Index of

Last updated : Thu May 18 02:15:23 JST 2017
Total : 2183 (2179) in this page
000450006.b3lyp_6-31g(d).inp

000450006.b3lyp_6-31g(d).qchem.inp (generated)

000450006.b3lyp_6-31g(d).gjf (generated)

000450006.b3lyp_6-31g(d).firefly.inp (generated)

000450006.b3lyp_6-31g(d).smash.inp (generated)

000450006.b3lyp_6-31g(d).nwchem.inp (generated) 000450006.b3lyp_6-31g(d).log.xz 000450006.td-b3lyp_6-31g+(d).inp 000450006.td-b3lyp_6-31g+(d).log.xz

000450006.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450006.td-b3lyp_6-31+g(d).gjf (generated)

000450006.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450006.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450006.mol 000450006.PUBCHEM 000450006.mol (via Jmol)
000450010.b3lyp_6-31g(d).inp

000450010.b3lyp_6-31g(d).qchem.inp (generated)

000450010.b3lyp_6-31g(d).gjf (generated)

000450010.b3lyp_6-31g(d).firefly.inp (generated)

000450010.b3lyp_6-31g(d).smash.inp (generated)

000450010.b3lyp_6-31g(d).nwchem.inp (generated) 000450010.b3lyp_6-31g(d).log.xz 000450010.td-b3lyp_6-31g+(d).inp 000450010.td-b3lyp_6-31g+(d).log.xz

000450010.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450010.td-b3lyp_6-31+g(d).gjf (generated)

000450010.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450010.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450010.mol 000450010.PUBCHEM 000450010.mol (via Jmol)
000450012.b3lyp_6-31g(d).inp

000450012.b3lyp_6-31g(d).qchem.inp (generated)

000450012.b3lyp_6-31g(d).gjf (generated)

000450012.b3lyp_6-31g(d).firefly.inp (generated)

000450012.b3lyp_6-31g(d).smash.inp (generated)

000450012.b3lyp_6-31g(d).nwchem.inp (generated) 000450012.b3lyp_6-31g(d).log.xz 000450012.td-b3lyp_6-31g+(d).inp 000450012.td-b3lyp_6-31g+(d).log.xz

000450012.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450012.td-b3lyp_6-31+g(d).gjf (generated)

000450012.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450012.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450012.mol 000450012.PUBCHEM 000450012.mol (via Jmol)
000450034.b3lyp_6-31g(d).inp

000450034.b3lyp_6-31g(d).qchem.inp (generated)

000450034.b3lyp_6-31g(d).gjf (generated)

000450034.b3lyp_6-31g(d).firefly.inp (generated)

000450034.b3lyp_6-31g(d).smash.inp (generated)

000450034.b3lyp_6-31g(d).nwchem.inp (generated) 000450034.b3lyp_6-31g(d).log.xz 000450034.td-b3lyp_6-31g+(d).inp 000450034.td-b3lyp_6-31g+(d).log.xz

000450034.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450034.td-b3lyp_6-31+g(d).gjf (generated)

000450034.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450034.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450034.mol 000450034.PUBCHEM 000450034.mol (via Jmol)
000450035.b3lyp_6-31g(d).inp

000450035.b3lyp_6-31g(d).qchem.inp (generated)

000450035.b3lyp_6-31g(d).gjf (generated)

000450035.b3lyp_6-31g(d).firefly.inp (generated)

000450035.b3lyp_6-31g(d).smash.inp (generated)

000450035.b3lyp_6-31g(d).nwchem.inp (generated) 000450035.b3lyp_6-31g(d).log.xz 000450035.td-b3lyp_6-31g+(d).inp 000450035.td-b3lyp_6-31g+(d).log.xz

000450035.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450035.td-b3lyp_6-31+g(d).gjf (generated)

000450035.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450035.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450035.mol 000450035.PUBCHEM 000450035.mol (via Jmol)
000450039.b3lyp_6-31g(d).inp

000450039.b3lyp_6-31g(d).qchem.inp (generated)

000450039.b3lyp_6-31g(d).gjf (generated)

000450039.b3lyp_6-31g(d).firefly.inp (generated)

000450039.b3lyp_6-31g(d).smash.inp (generated)

000450039.b3lyp_6-31g(d).nwchem.inp (generated) 000450039.b3lyp_6-31g(d).log.xz 000450039.td-b3lyp_6-31g+(d).inp 000450039.td-b3lyp_6-31g+(d).log.xz

000450039.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450039.td-b3lyp_6-31+g(d).gjf (generated)

000450039.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450039.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450039.mol 000450039.PUBCHEM 000450039.mol (via Jmol)
000450045.b3lyp_6-31g(d).inp

000450045.b3lyp_6-31g(d).qchem.inp (generated)

000450045.b3lyp_6-31g(d).gjf (generated)

000450045.b3lyp_6-31g(d).firefly.inp (generated)

000450045.b3lyp_6-31g(d).smash.inp (generated)

000450045.b3lyp_6-31g(d).nwchem.inp (generated) 000450045.b3lyp_6-31g(d).log.xz 000450045.td-b3lyp_6-31g+(d).inp 000450045.td-b3lyp_6-31g+(d).log.xz

000450045.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450045.td-b3lyp_6-31+g(d).gjf (generated)

000450045.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450045.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450045.mol 000450045.PUBCHEM 000450045.mol (via Jmol)
000450106.b3lyp_6-31g(d).inp

000450106.b3lyp_6-31g(d).qchem.inp (generated)

000450106.b3lyp_6-31g(d).gjf (generated)

000450106.b3lyp_6-31g(d).firefly.inp (generated)

000450106.b3lyp_6-31g(d).smash.inp (generated)

000450106.b3lyp_6-31g(d).nwchem.inp (generated) 000450106.b3lyp_6-31g(d).log.xz 000450106.td-b3lyp_6-31g+(d).inp 000450106.td-b3lyp_6-31g+(d).log.xz

000450106.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450106.td-b3lyp_6-31+g(d).gjf (generated)

000450106.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450106.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450106.mol 000450106.PUBCHEM 000450106.mol (via Jmol)
000450108.b3lyp_6-31g(d).inp

000450108.b3lyp_6-31g(d).qchem.inp (generated)

000450108.b3lyp_6-31g(d).gjf (generated)

000450108.b3lyp_6-31g(d).firefly.inp (generated)

000450108.b3lyp_6-31g(d).smash.inp (generated)

000450108.b3lyp_6-31g(d).nwchem.inp (generated) 000450108.b3lyp_6-31g(d).log.xz 000450108.td-b3lyp_6-31g+(d).inp 000450108.td-b3lyp_6-31g+(d).log.xz

000450108.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450108.td-b3lyp_6-31+g(d).gjf (generated)

000450108.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450108.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450108.mol 000450108.PUBCHEM 000450108.mol (via Jmol)
000450112.b3lyp_6-31g(d).inp

000450112.b3lyp_6-31g(d).qchem.inp (generated)

000450112.b3lyp_6-31g(d).gjf (generated)

000450112.b3lyp_6-31g(d).firefly.inp (generated)

000450112.b3lyp_6-31g(d).smash.inp (generated)

000450112.b3lyp_6-31g(d).nwchem.inp (generated) 000450112.b3lyp_6-31g(d).log.xz 000450112.td-b3lyp_6-31g+(d).inp 000450112.td-b3lyp_6-31g+(d).log.xz

000450112.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450112.td-b3lyp_6-31+g(d).gjf (generated)

000450112.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450112.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450112.mol 000450112.PUBCHEM 000450112.mol (via Jmol)
000450114.b3lyp_6-31g(d).inp

000450114.b3lyp_6-31g(d).qchem.inp (generated)

000450114.b3lyp_6-31g(d).gjf (generated)

000450114.b3lyp_6-31g(d).firefly.inp (generated)

000450114.b3lyp_6-31g(d).smash.inp (generated)

000450114.b3lyp_6-31g(d).nwchem.inp (generated) 000450114.b3lyp_6-31g(d).log.xz 000450114.td-b3lyp_6-31g+(d).inp 000450114.td-b3lyp_6-31g+(d).log.xz

000450114.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450114.td-b3lyp_6-31+g(d).gjf (generated)

000450114.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450114.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450114.mol 000450114.PUBCHEM 000450114.mol (via Jmol)
000450118.b3lyp_6-31g(d).inp

000450118.b3lyp_6-31g(d).qchem.inp (generated)

000450118.b3lyp_6-31g(d).gjf (generated)

000450118.b3lyp_6-31g(d).firefly.inp (generated)

000450118.b3lyp_6-31g(d).smash.inp (generated)

000450118.b3lyp_6-31g(d).nwchem.inp (generated) 000450118.b3lyp_6-31g(d).log.xz 000450118.td-b3lyp_6-31g+(d).inp 000450118.td-b3lyp_6-31g+(d).log.xz

000450118.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450118.td-b3lyp_6-31+g(d).gjf (generated)

000450118.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450118.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450118.mol 000450118.PUBCHEM 000450118.mol (via Jmol)
000450119.b3lyp_6-31g(d).inp

000450119.b3lyp_6-31g(d).qchem.inp (generated)

000450119.b3lyp_6-31g(d).gjf (generated)

000450119.b3lyp_6-31g(d).firefly.inp (generated)

000450119.b3lyp_6-31g(d).smash.inp (generated)

000450119.b3lyp_6-31g(d).nwchem.inp (generated) 000450119.b3lyp_6-31g(d).log.xz 000450119.td-b3lyp_6-31g+(d).inp 000450119.td-b3lyp_6-31g+(d).log.xz

000450119.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450119.td-b3lyp_6-31+g(d).gjf (generated)

000450119.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450119.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450119.mol 000450119.PUBCHEM 000450119.mol (via Jmol)
000450120.b3lyp_6-31g(d).inp

000450120.b3lyp_6-31g(d).qchem.inp (generated)

000450120.b3lyp_6-31g(d).gjf (generated)

000450120.b3lyp_6-31g(d).firefly.inp (generated)

000450120.b3lyp_6-31g(d).smash.inp (generated)

000450120.b3lyp_6-31g(d).nwchem.inp (generated) 000450120.b3lyp_6-31g(d).log.xz 000450120.td-b3lyp_6-31g+(d).inp 000450120.td-b3lyp_6-31g+(d).log.xz

000450120.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450120.td-b3lyp_6-31+g(d).gjf (generated)

000450120.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450120.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450120.mol 000450120.PUBCHEM 000450120.mol (via Jmol)
000450122.b3lyp_6-31g(d).inp

000450122.b3lyp_6-31g(d).qchem.inp (generated)

000450122.b3lyp_6-31g(d).gjf (generated)

000450122.b3lyp_6-31g(d).firefly.inp (generated)

000450122.b3lyp_6-31g(d).smash.inp (generated)

000450122.b3lyp_6-31g(d).nwchem.inp (generated) 000450122.b3lyp_6-31g(d).log.xz 000450122.td-b3lyp_6-31g+(d).inp 000450122.td-b3lyp_6-31g+(d).log.xz

000450122.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450122.td-b3lyp_6-31+g(d).gjf (generated)

000450122.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450122.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450122.mol 000450122.PUBCHEM 000450122.mol (via Jmol)
000450145.b3lyp_6-31g(d).inp

000450145.b3lyp_6-31g(d).qchem.inp (generated)

000450145.b3lyp_6-31g(d).gjf (generated)

000450145.b3lyp_6-31g(d).firefly.inp (generated)

000450145.b3lyp_6-31g(d).smash.inp (generated)

000450145.b3lyp_6-31g(d).nwchem.inp (generated) 000450145.b3lyp_6-31g(d).log.xz 000450145.td-b3lyp_6-31g+(d).inp 000450145.td-b3lyp_6-31g+(d).log.xz

000450145.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450145.td-b3lyp_6-31+g(d).gjf (generated)

000450145.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450145.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450145.mol 000450145.PUBCHEM 000450145.mol (via Jmol)
000450171.b3lyp_6-31g(d).inp

000450171.b3lyp_6-31g(d).qchem.inp (generated)

000450171.b3lyp_6-31g(d).gjf (generated)

000450171.b3lyp_6-31g(d).firefly.inp (generated)

000450171.b3lyp_6-31g(d).smash.inp (generated)

000450171.b3lyp_6-31g(d).nwchem.inp (generated) 000450171.b3lyp_6-31g(d).log.xz 000450171.td-b3lyp_6-31g+(d).inp 000450171.td-b3lyp_6-31g+(d).log.xz

000450171.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450171.td-b3lyp_6-31+g(d).gjf (generated)

000450171.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450171.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450171.mol 000450171.PUBCHEM 000450171.mol (via Jmol)
000450173.b3lyp_6-31g(d).inp

000450173.b3lyp_6-31g(d).qchem.inp (generated)

000450173.b3lyp_6-31g(d).gjf (generated)

000450173.b3lyp_6-31g(d).firefly.inp (generated)

000450173.b3lyp_6-31g(d).smash.inp (generated)

000450173.b3lyp_6-31g(d).nwchem.inp (generated) 000450173.b3lyp_6-31g(d).log.xz 000450173.td-b3lyp_6-31g+(d).inp 000450173.td-b3lyp_6-31g+(d).log.xz

000450173.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450173.td-b3lyp_6-31+g(d).gjf (generated)

000450173.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450173.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450173.mol 000450173.PUBCHEM 000450173.mol (via Jmol)
000450174.b3lyp_6-31g(d).inp

000450174.b3lyp_6-31g(d).qchem.inp (generated)

000450174.b3lyp_6-31g(d).gjf (generated)

000450174.b3lyp_6-31g(d).firefly.inp (generated)

000450174.b3lyp_6-31g(d).smash.inp (generated)

000450174.b3lyp_6-31g(d).nwchem.inp (generated) 000450174.b3lyp_6-31g(d).log.xz 000450174.td-b3lyp_6-31g+(d).inp 000450174.td-b3lyp_6-31g+(d).log.xz

000450174.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450174.td-b3lyp_6-31+g(d).gjf (generated)

000450174.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450174.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450174.mol 000450174.PUBCHEM 000450174.mol (via Jmol)
000450188.b3lyp_6-31g(d).inp

000450188.b3lyp_6-31g(d).qchem.inp (generated)

000450188.b3lyp_6-31g(d).gjf (generated)

000450188.b3lyp_6-31g(d).firefly.inp (generated)

000450188.b3lyp_6-31g(d).smash.inp (generated)

000450188.b3lyp_6-31g(d).nwchem.inp (generated) 000450188.b3lyp_6-31g(d).log.xz 000450188.td-b3lyp_6-31g+(d).inp 000450188.td-b3lyp_6-31g+(d).log.xz

000450188.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450188.td-b3lyp_6-31+g(d).gjf (generated)

000450188.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450188.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450188.mol 000450188.PUBCHEM 000450188.mol (via Jmol)
000450194.b3lyp_6-31g(d).inp

000450194.b3lyp_6-31g(d).qchem.inp (generated)

000450194.b3lyp_6-31g(d).gjf (generated)

000450194.b3lyp_6-31g(d).firefly.inp (generated)

000450194.b3lyp_6-31g(d).smash.inp (generated)

000450194.b3lyp_6-31g(d).nwchem.inp (generated) 000450194.b3lyp_6-31g(d).log.xz 000450194.td-b3lyp_6-31g+(d).inp 000450194.td-b3lyp_6-31g+(d).log.xz

000450194.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450194.td-b3lyp_6-31+g(d).gjf (generated)

000450194.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450194.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450194.mol 000450194.PUBCHEM 000450194.mol (via Jmol)
000450201.b3lyp_6-31g(d).inp

000450201.b3lyp_6-31g(d).qchem.inp (generated)

000450201.b3lyp_6-31g(d).gjf (generated)

000450201.b3lyp_6-31g(d).firefly.inp (generated)

000450201.b3lyp_6-31g(d).smash.inp (generated)

000450201.b3lyp_6-31g(d).nwchem.inp (generated) 000450201.b3lyp_6-31g(d).log.xz 000450201.td-b3lyp_6-31g+(d).inp 000450201.td-b3lyp_6-31g+(d).log.xz

000450201.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450201.td-b3lyp_6-31+g(d).gjf (generated)

000450201.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450201.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450201.mol 000450201.PUBCHEM 000450201.mol (via Jmol)
000450213.b3lyp_6-31g(d).inp

000450213.b3lyp_6-31g(d).qchem.inp (generated)

000450213.b3lyp_6-31g(d).gjf (generated)

000450213.b3lyp_6-31g(d).firefly.inp (generated)

000450213.b3lyp_6-31g(d).smash.inp (generated)

000450213.b3lyp_6-31g(d).nwchem.inp (generated) 000450213.b3lyp_6-31g(d).log.xz 000450213.td-b3lyp_6-31g+(d).inp 000450213.td-b3lyp_6-31g+(d).log.xz

000450213.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450213.td-b3lyp_6-31+g(d).gjf (generated)

000450213.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450213.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450213.mol 000450213.PUBCHEM 000450213.mol (via Jmol)
000450249.b3lyp_6-31g(d).inp

000450249.b3lyp_6-31g(d).qchem.inp (generated)

000450249.b3lyp_6-31g(d).gjf (generated)

000450249.b3lyp_6-31g(d).firefly.inp (generated)

000450249.b3lyp_6-31g(d).smash.inp (generated)

000450249.b3lyp_6-31g(d).nwchem.inp (generated) 000450249.b3lyp_6-31g(d).log.xz 000450249.td-b3lyp_6-31g+(d).inp 000450249.td-b3lyp_6-31g+(d).log.xz

000450249.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450249.td-b3lyp_6-31+g(d).gjf (generated)

000450249.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450249.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450249.mol 000450249.PUBCHEM 000450249.mol (via Jmol)
000450268.b3lyp_6-31g(d).inp

000450268.b3lyp_6-31g(d).qchem.inp (generated)

000450268.b3lyp_6-31g(d).gjf (generated)

000450268.b3lyp_6-31g(d).firefly.inp (generated)

000450268.b3lyp_6-31g(d).smash.inp (generated)

000450268.b3lyp_6-31g(d).nwchem.inp (generated) 000450268.b3lyp_6-31g(d).log.xz 000450268.td-b3lyp_6-31g+(d).inp 000450268.td-b3lyp_6-31g+(d).log.xz

000450268.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450268.td-b3lyp_6-31+g(d).gjf (generated)

000450268.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450268.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450268.mol 000450268.PUBCHEM 000450268.mol (via Jmol)
000450272.b3lyp_6-31g(d).inp

000450272.b3lyp_6-31g(d).qchem.inp (generated)

000450272.b3lyp_6-31g(d).gjf (generated)

000450272.b3lyp_6-31g(d).firefly.inp (generated)

000450272.b3lyp_6-31g(d).smash.inp (generated)

000450272.b3lyp_6-31g(d).nwchem.inp (generated) 000450272.b3lyp_6-31g(d).log.xz 000450272.td-b3lyp_6-31g+(d).inp 000450272.td-b3lyp_6-31g+(d).log.xz

000450272.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450272.td-b3lyp_6-31+g(d).gjf (generated)

000450272.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450272.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450272.mol 000450272.PUBCHEM 000450272.mol (via Jmol)
000450280.b3lyp_6-31g(d).inp

000450280.b3lyp_6-31g(d).qchem.inp (generated)

000450280.b3lyp_6-31g(d).gjf (generated)

000450280.b3lyp_6-31g(d).firefly.inp (generated)

000450280.b3lyp_6-31g(d).smash.inp (generated)

000450280.b3lyp_6-31g(d).nwchem.inp (generated) 000450280.b3lyp_6-31g(d).log.xz 000450280.td-b3lyp_6-31g+(d).inp 000450280.td-b3lyp_6-31g+(d).log.xz

000450280.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450280.td-b3lyp_6-31+g(d).gjf (generated)

000450280.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450280.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450280.mol 000450280.PUBCHEM 000450280.mol (via Jmol)
000450283.b3lyp_6-31g(d).inp

000450283.b3lyp_6-31g(d).qchem.inp (generated)

000450283.b3lyp_6-31g(d).gjf (generated)

000450283.b3lyp_6-31g(d).firefly.inp (generated)

000450283.b3lyp_6-31g(d).smash.inp (generated)

000450283.b3lyp_6-31g(d).nwchem.inp (generated) 000450283.b3lyp_6-31g(d).log.xz 000450283.td-b3lyp_6-31g+(d).inp 000450283.td-b3lyp_6-31g+(d).log.xz

000450283.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450283.td-b3lyp_6-31+g(d).gjf (generated)

000450283.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450283.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450283.mol 000450283.PUBCHEM 000450283.mol (via Jmol)
000450313.b3lyp_6-31g(d).inp

000450313.b3lyp_6-31g(d).qchem.inp (generated)

000450313.b3lyp_6-31g(d).gjf (generated)

000450313.b3lyp_6-31g(d).firefly.inp (generated)

000450313.b3lyp_6-31g(d).smash.inp (generated)

000450313.b3lyp_6-31g(d).nwchem.inp (generated) 000450313.b3lyp_6-31g(d).log.xz 000450313.td-b3lyp_6-31g+(d).inp 000450313.td-b3lyp_6-31g+(d).log.xz

000450313.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450313.td-b3lyp_6-31+g(d).gjf (generated)

000450313.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450313.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450313.mol 000450313.PUBCHEM 000450313.mol (via Jmol)
000450315.b3lyp_6-31g(d).inp

000450315.b3lyp_6-31g(d).qchem.inp (generated)

000450315.b3lyp_6-31g(d).gjf (generated)

000450315.b3lyp_6-31g(d).firefly.inp (generated)

000450315.b3lyp_6-31g(d).smash.inp (generated)

000450315.b3lyp_6-31g(d).nwchem.inp (generated) 000450315.b3lyp_6-31g(d).log.xz 000450315.td-b3lyp_6-31g+(d).inp 000450315.td-b3lyp_6-31g+(d).log.xz

000450315.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450315.td-b3lyp_6-31+g(d).gjf (generated)

000450315.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450315.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450315.mol 000450315.PUBCHEM 000450315.mol (via Jmol)
000450318.b3lyp_6-31g(d).inp

000450318.b3lyp_6-31g(d).qchem.inp (generated)

000450318.b3lyp_6-31g(d).gjf (generated)

000450318.b3lyp_6-31g(d).firefly.inp (generated)

000450318.b3lyp_6-31g(d).smash.inp (generated)

000450318.b3lyp_6-31g(d).nwchem.inp (generated) 000450318.b3lyp_6-31g(d).log.xz 000450318.td-b3lyp_6-31g+(d).inp 000450318.td-b3lyp_6-31g+(d).log.xz

000450318.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450318.td-b3lyp_6-31+g(d).gjf (generated)

000450318.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450318.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450318.mol 000450318.PUBCHEM 000450318.mol (via Jmol)
000450319.b3lyp_6-31g(d).inp

000450319.b3lyp_6-31g(d).qchem.inp (generated)

000450319.b3lyp_6-31g(d).gjf (generated)

000450319.b3lyp_6-31g(d).firefly.inp (generated)

000450319.b3lyp_6-31g(d).smash.inp (generated)

000450319.b3lyp_6-31g(d).nwchem.inp (generated) 000450319.b3lyp_6-31g(d).log.xz 000450319.td-b3lyp_6-31g+(d).inp 000450319.td-b3lyp_6-31g+(d).log.xz

000450319.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450319.td-b3lyp_6-31+g(d).gjf (generated)

000450319.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450319.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450319.mol 000450319.PUBCHEM 000450319.mol (via Jmol)
000450320.b3lyp_6-31g(d).inp

000450320.b3lyp_6-31g(d).qchem.inp (generated)

000450320.b3lyp_6-31g(d).gjf (generated)

000450320.b3lyp_6-31g(d).firefly.inp (generated)

000450320.b3lyp_6-31g(d).smash.inp (generated)

000450320.b3lyp_6-31g(d).nwchem.inp (generated) 000450320.b3lyp_6-31g(d).log.xz 000450320.td-b3lyp_6-31g+(d).inp 000450320.td-b3lyp_6-31g+(d).log.xz

000450320.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450320.td-b3lyp_6-31+g(d).gjf (generated)

000450320.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450320.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450320.mol 000450320.PUBCHEM 000450320.mol (via Jmol)
000450321.b3lyp_6-31g(d).inp

000450321.b3lyp_6-31g(d).qchem.inp (generated)

000450321.b3lyp_6-31g(d).gjf (generated)

000450321.b3lyp_6-31g(d).firefly.inp (generated)

000450321.b3lyp_6-31g(d).smash.inp (generated)

000450321.b3lyp_6-31g(d).nwchem.inp (generated) 000450321.b3lyp_6-31g(d).log.xz 000450321.td-b3lyp_6-31g+(d).inp 000450321.td-b3lyp_6-31g+(d).log.xz

000450321.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450321.td-b3lyp_6-31+g(d).gjf (generated)

000450321.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450321.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450321.mol 000450321.PUBCHEM 000450321.mol (via Jmol)
000450342.b3lyp_6-31g(d).inp

000450342.b3lyp_6-31g(d).qchem.inp (generated)

000450342.b3lyp_6-31g(d).gjf (generated)

000450342.b3lyp_6-31g(d).firefly.inp (generated)

000450342.b3lyp_6-31g(d).smash.inp (generated)

000450342.b3lyp_6-31g(d).nwchem.inp (generated) 000450342.b3lyp_6-31g(d).log.xz 000450342.td-b3lyp_6-31g+(d).inp 000450342.td-b3lyp_6-31g+(d).log.xz

000450342.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450342.td-b3lyp_6-31+g(d).gjf (generated)

000450342.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450342.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450342.mol 000450342.PUBCHEM 000450342.mol (via Jmol)
000450343.b3lyp_6-31g(d).inp

000450343.b3lyp_6-31g(d).qchem.inp (generated)

000450343.b3lyp_6-31g(d).gjf (generated)

000450343.b3lyp_6-31g(d).firefly.inp (generated)

000450343.b3lyp_6-31g(d).smash.inp (generated)

000450343.b3lyp_6-31g(d).nwchem.inp (generated) 000450343.b3lyp_6-31g(d).log.xz 000450343.td-b3lyp_6-31g+(d).inp 000450343.td-b3lyp_6-31g+(d).log.xz

000450343.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450343.td-b3lyp_6-31+g(d).gjf (generated)

000450343.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450343.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450343.mol 000450343.PUBCHEM 000450343.mol (via Jmol)
000450344.b3lyp_6-31g(d).inp

000450344.b3lyp_6-31g(d).qchem.inp (generated)

000450344.b3lyp_6-31g(d).gjf (generated)

000450344.b3lyp_6-31g(d).firefly.inp (generated)

000450344.b3lyp_6-31g(d).smash.inp (generated)

000450344.b3lyp_6-31g(d).nwchem.inp (generated) 000450344.b3lyp_6-31g(d).log.xz 000450344.td-b3lyp_6-31g+(d).inp 000450344.td-b3lyp_6-31g+(d).log.xz

000450344.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450344.td-b3lyp_6-31+g(d).gjf (generated)

000450344.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450344.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450344.mol 000450344.PUBCHEM 000450344.mol (via Jmol)
000450345.b3lyp_6-31g(d).inp

000450345.b3lyp_6-31g(d).qchem.inp (generated)

000450345.b3lyp_6-31g(d).gjf (generated)

000450345.b3lyp_6-31g(d).firefly.inp (generated)

000450345.b3lyp_6-31g(d).smash.inp (generated)

000450345.b3lyp_6-31g(d).nwchem.inp (generated) 000450345.b3lyp_6-31g(d).log.xz 000450345.td-b3lyp_6-31g+(d).inp 000450345.td-b3lyp_6-31g+(d).log.xz

000450345.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450345.td-b3lyp_6-31+g(d).gjf (generated)

000450345.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450345.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450345.mol 000450345.PUBCHEM 000450345.mol (via Jmol)
000450346.b3lyp_6-31g(d).inp

000450346.b3lyp_6-31g(d).qchem.inp (generated)

000450346.b3lyp_6-31g(d).gjf (generated)

000450346.b3lyp_6-31g(d).firefly.inp (generated)

000450346.b3lyp_6-31g(d).smash.inp (generated)

000450346.b3lyp_6-31g(d).nwchem.inp (generated) 000450346.b3lyp_6-31g(d).log.xz 000450346.td-b3lyp_6-31g+(d).inp 000450346.td-b3lyp_6-31g+(d).log.xz

000450346.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450346.td-b3lyp_6-31+g(d).gjf (generated)

000450346.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450346.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450346.mol 000450346.PUBCHEM 000450346.mol (via Jmol)
000450347.b3lyp_6-31g(d).inp

000450347.b3lyp_6-31g(d).qchem.inp (generated)

000450347.b3lyp_6-31g(d).gjf (generated)

000450347.b3lyp_6-31g(d).firefly.inp (generated)

000450347.b3lyp_6-31g(d).smash.inp (generated)

000450347.b3lyp_6-31g(d).nwchem.inp (generated) 000450347.b3lyp_6-31g(d).log.xz 000450347.td-b3lyp_6-31g+(d).inp 000450347.td-b3lyp_6-31g+(d).log.xz

000450347.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450347.td-b3lyp_6-31+g(d).gjf (generated)

000450347.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450347.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450347.mol 000450347.PUBCHEM 000450347.mol (via Jmol)
000450348.b3lyp_6-31g(d).inp

000450348.b3lyp_6-31g(d).qchem.inp (generated)

000450348.b3lyp_6-31g(d).gjf (generated)

000450348.b3lyp_6-31g(d).firefly.inp (generated)

000450348.b3lyp_6-31g(d).smash.inp (generated)

000450348.b3lyp_6-31g(d).nwchem.inp (generated) 000450348.b3lyp_6-31g(d).log.xz 000450348.td-b3lyp_6-31g+(d).inp 000450348.td-b3lyp_6-31g+(d).log.xz

000450348.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450348.td-b3lyp_6-31+g(d).gjf (generated)

000450348.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450348.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450348.mol 000450348.PUBCHEM 000450348.mol (via Jmol)
000450349.b3lyp_6-31g(d).inp

000450349.b3lyp_6-31g(d).qchem.inp (generated)

000450349.b3lyp_6-31g(d).gjf (generated)

000450349.b3lyp_6-31g(d).firefly.inp (generated)

000450349.b3lyp_6-31g(d).smash.inp (generated)

000450349.b3lyp_6-31g(d).nwchem.inp (generated) 000450349.b3lyp_6-31g(d).log.xz 000450349.td-b3lyp_6-31g+(d).inp 000450349.td-b3lyp_6-31g+(d).log.xz

000450349.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450349.td-b3lyp_6-31+g(d).gjf (generated)

000450349.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450349.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450349.mol 000450349.PUBCHEM 000450349.mol (via Jmol)
000450359.b3lyp_6-31g(d).inp

000450359.b3lyp_6-31g(d).qchem.inp (generated)

000450359.b3lyp_6-31g(d).gjf (generated)

000450359.b3lyp_6-31g(d).firefly.inp (generated)

000450359.b3lyp_6-31g(d).smash.inp (generated)

000450359.b3lyp_6-31g(d).nwchem.inp (generated) 000450359.b3lyp_6-31g(d).log.xz 000450359.td-b3lyp_6-31g+(d).inp 000450359.td-b3lyp_6-31g+(d).log.xz

000450359.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450359.td-b3lyp_6-31+g(d).gjf (generated)

000450359.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450359.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450359.mol 000450359.PUBCHEM 000450359.mol (via Jmol)
000450360.b3lyp_6-31g(d).inp

000450360.b3lyp_6-31g(d).qchem.inp (generated)

000450360.b3lyp_6-31g(d).gjf (generated)

000450360.b3lyp_6-31g(d).firefly.inp (generated)

000450360.b3lyp_6-31g(d).smash.inp (generated)

000450360.b3lyp_6-31g(d).nwchem.inp (generated) 000450360.b3lyp_6-31g(d).log.xz 000450360.td-b3lyp_6-31g+(d).inp 000450360.td-b3lyp_6-31g+(d).log.xz

000450360.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450360.td-b3lyp_6-31+g(d).gjf (generated)

000450360.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450360.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450360.mol 000450360.PUBCHEM 000450360.mol (via Jmol)
000450361.b3lyp_6-31g(d).inp

000450361.b3lyp_6-31g(d).qchem.inp (generated)

000450361.b3lyp_6-31g(d).gjf (generated)

000450361.b3lyp_6-31g(d).firefly.inp (generated)

000450361.b3lyp_6-31g(d).smash.inp (generated)

000450361.b3lyp_6-31g(d).nwchem.inp (generated) 000450361.b3lyp_6-31g(d).log.xz 000450361.td-b3lyp_6-31g+(d).inp 000450361.td-b3lyp_6-31g+(d).log.xz

000450361.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450361.td-b3lyp_6-31+g(d).gjf (generated)

000450361.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450361.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450361.mol 000450361.PUBCHEM 000450361.mol (via Jmol)
000450407.b3lyp_6-31g(d).inp

000450407.b3lyp_6-31g(d).qchem.inp (generated)

000450407.b3lyp_6-31g(d).gjf (generated)

000450407.b3lyp_6-31g(d).firefly.inp (generated)

000450407.b3lyp_6-31g(d).smash.inp (generated)

000450407.b3lyp_6-31g(d).nwchem.inp (generated) 000450407.b3lyp_6-31g(d).log.xz 000450407.td-b3lyp_6-31g+(d).inp 000450407.td-b3lyp_6-31g+(d).log.xz

000450407.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450407.td-b3lyp_6-31+g(d).gjf (generated)

000450407.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450407.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450407.mol 000450407.PUBCHEM 000450407.mol (via Jmol)
000450408.b3lyp_6-31g(d).inp

000450408.b3lyp_6-31g(d).qchem.inp (generated)

000450408.b3lyp_6-31g(d).gjf (generated)

000450408.b3lyp_6-31g(d).firefly.inp (generated)

000450408.b3lyp_6-31g(d).smash.inp (generated)

000450408.b3lyp_6-31g(d).nwchem.inp (generated) 000450408.b3lyp_6-31g(d).log.xz 000450408.td-b3lyp_6-31g+(d).inp 000450408.td-b3lyp_6-31g+(d).log.xz

000450408.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450408.td-b3lyp_6-31+g(d).gjf (generated)

000450408.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450408.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450408.mol 000450408.PUBCHEM 000450408.mol (via Jmol)
000450409.b3lyp_6-31g(d).inp

000450409.b3lyp_6-31g(d).qchem.inp (generated)

000450409.b3lyp_6-31g(d).gjf (generated)

000450409.b3lyp_6-31g(d).firefly.inp (generated)

000450409.b3lyp_6-31g(d).smash.inp (generated)

000450409.b3lyp_6-31g(d).nwchem.inp (generated) 000450409.b3lyp_6-31g(d).log.xz 000450409.td-b3lyp_6-31g+(d).inp 000450409.td-b3lyp_6-31g+(d).log.xz

000450409.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450409.td-b3lyp_6-31+g(d).gjf (generated)

000450409.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450409.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450409.mol 000450409.PUBCHEM 000450409.mol (via Jmol)
000450413.b3lyp_6-31g(d).inp

000450413.b3lyp_6-31g(d).qchem.inp (generated)

000450413.b3lyp_6-31g(d).gjf (generated)

000450413.b3lyp_6-31g(d).firefly.inp (generated)

000450413.b3lyp_6-31g(d).smash.inp (generated)

000450413.b3lyp_6-31g(d).nwchem.inp (generated) 000450413.b3lyp_6-31g(d).log.xz 000450413.td-b3lyp_6-31g+(d).inp 000450413.td-b3lyp_6-31g+(d).log.xz

000450413.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450413.td-b3lyp_6-31+g(d).gjf (generated)

000450413.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450413.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450413.mol 000450413.PUBCHEM 000450413.mol (via Jmol)
000450416.b3lyp_6-31g(d).inp

000450416.b3lyp_6-31g(d).qchem.inp (generated)

000450416.b3lyp_6-31g(d).gjf (generated)

000450416.b3lyp_6-31g(d).firefly.inp (generated)

000450416.b3lyp_6-31g(d).smash.inp (generated)

000450416.b3lyp_6-31g(d).nwchem.inp (generated) 000450416.b3lyp_6-31g(d).log.xz 000450416.td-b3lyp_6-31g+(d).inp 000450416.td-b3lyp_6-31g+(d).log.xz

000450416.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450416.td-b3lyp_6-31+g(d).gjf (generated)

000450416.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450416.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450416.mol 000450416.PUBCHEM 000450416.mol (via Jmol)
000450430.b3lyp_6-31g(d).inp

000450430.b3lyp_6-31g(d).qchem.inp (generated)

000450430.b3lyp_6-31g(d).gjf (generated)

000450430.b3lyp_6-31g(d).firefly.inp (generated)

000450430.b3lyp_6-31g(d).smash.inp (generated)

000450430.b3lyp_6-31g(d).nwchem.inp (generated) 000450430.b3lyp_6-31g(d).log.xz 000450430.td-b3lyp_6-31g+(d).inp 000450430.td-b3lyp_6-31g+(d).log.xz

000450430.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450430.td-b3lyp_6-31+g(d).gjf (generated)

000450430.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450430.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450430.mol 000450430.PUBCHEM 000450430.mol (via Jmol)
000450446.b3lyp_6-31g(d).inp

000450446.b3lyp_6-31g(d).qchem.inp (generated)

000450446.b3lyp_6-31g(d).gjf (generated)

000450446.b3lyp_6-31g(d).firefly.inp (generated)

000450446.b3lyp_6-31g(d).smash.inp (generated)

000450446.b3lyp_6-31g(d).nwchem.inp (generated) 000450446.b3lyp_6-31g(d).log.xz 000450446.td-b3lyp_6-31g+(d).inp 000450446.td-b3lyp_6-31g+(d).log.xz

000450446.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450446.td-b3lyp_6-31+g(d).gjf (generated)

000450446.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450446.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450446.mol 000450446.PUBCHEM 000450446.mol (via Jmol)
000450462.b3lyp_6-31g(d).inp

000450462.b3lyp_6-31g(d).qchem.inp (generated)

000450462.b3lyp_6-31g(d).gjf (generated)

000450462.b3lyp_6-31g(d).firefly.inp (generated)

000450462.b3lyp_6-31g(d).smash.inp (generated)

000450462.b3lyp_6-31g(d).nwchem.inp (generated) 000450462.b3lyp_6-31g(d).log.xz 000450462.td-b3lyp_6-31g+(d).inp 000450462.td-b3lyp_6-31g+(d).log.xz

000450462.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450462.td-b3lyp_6-31+g(d).gjf (generated)

000450462.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450462.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450462.mol 000450462.PUBCHEM 000450462.mol (via Jmol)
000450463.b3lyp_6-31g(d).inp

000450463.b3lyp_6-31g(d).qchem.inp (generated)

000450463.b3lyp_6-31g(d).gjf (generated)

000450463.b3lyp_6-31g(d).firefly.inp (generated)

000450463.b3lyp_6-31g(d).smash.inp (generated)

000450463.b3lyp_6-31g(d).nwchem.inp (generated) 000450463.b3lyp_6-31g(d).log.xz 000450463.td-b3lyp_6-31g+(d).inp 000450463.td-b3lyp_6-31g+(d).log.xz

000450463.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450463.td-b3lyp_6-31+g(d).gjf (generated)

000450463.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450463.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450463.mol 000450463.PUBCHEM 000450463.mol (via Jmol)
000450464.b3lyp_6-31g(d).inp

000450464.b3lyp_6-31g(d).qchem.inp (generated)

000450464.b3lyp_6-31g(d).gjf (generated)

000450464.b3lyp_6-31g(d).firefly.inp (generated)

000450464.b3lyp_6-31g(d).smash.inp (generated)

000450464.b3lyp_6-31g(d).nwchem.inp (generated) 000450464.b3lyp_6-31g(d).log.xz 000450464.td-b3lyp_6-31g+(d).inp 000450464.td-b3lyp_6-31g+(d).log.xz

000450464.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450464.td-b3lyp_6-31+g(d).gjf (generated)

000450464.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450464.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450464.mol 000450464.PUBCHEM 000450464.mol (via Jmol)
000450465.b3lyp_6-31g(d).inp

000450465.b3lyp_6-31g(d).qchem.inp (generated)

000450465.b3lyp_6-31g(d).gjf (generated)

000450465.b3lyp_6-31g(d).firefly.inp (generated)

000450465.b3lyp_6-31g(d).smash.inp (generated)

000450465.b3lyp_6-31g(d).nwchem.inp (generated) 000450465.b3lyp_6-31g(d).log.xz 000450465.td-b3lyp_6-31g+(d).inp 000450465.td-b3lyp_6-31g+(d).log.xz

000450465.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450465.td-b3lyp_6-31+g(d).gjf (generated)

000450465.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450465.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450465.mol 000450465.PUBCHEM 000450465.mol (via Jmol)
000450473.b3lyp_6-31g(d).inp

000450473.b3lyp_6-31g(d).qchem.inp (generated)

000450473.b3lyp_6-31g(d).gjf (generated)

000450473.b3lyp_6-31g(d).firefly.inp (generated)

000450473.b3lyp_6-31g(d).smash.inp (generated)

000450473.b3lyp_6-31g(d).nwchem.inp (generated) 000450473.b3lyp_6-31g(d).log.xz 000450473.td-b3lyp_6-31g+(d).inp 000450473.td-b3lyp_6-31g+(d).log.xz

000450473.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450473.td-b3lyp_6-31+g(d).gjf (generated)

000450473.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450473.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450473.mol 000450473.PUBCHEM 000450473.mol (via Jmol)
000450496.b3lyp_6-31g(d).inp

000450496.b3lyp_6-31g(d).qchem.inp (generated)

000450496.b3lyp_6-31g(d).gjf (generated)

000450496.b3lyp_6-31g(d).firefly.inp (generated)

000450496.b3lyp_6-31g(d).smash.inp (generated)

000450496.b3lyp_6-31g(d).nwchem.inp (generated) 000450496.b3lyp_6-31g(d).log.xz 000450496.td-b3lyp_6-31g+(d).inp 000450496.td-b3lyp_6-31g+(d).log.xz

000450496.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450496.td-b3lyp_6-31+g(d).gjf (generated)

000450496.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450496.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450496.mol 000450496.PUBCHEM 000450496.mol (via Jmol)
000450497.b3lyp_6-31g(d).inp

000450497.b3lyp_6-31g(d).qchem.inp (generated)

000450497.b3lyp_6-31g(d).gjf (generated)

000450497.b3lyp_6-31g(d).firefly.inp (generated)

000450497.b3lyp_6-31g(d).smash.inp (generated)

000450497.b3lyp_6-31g(d).nwchem.inp (generated) 000450497.b3lyp_6-31g(d).log.xz 000450497.td-b3lyp_6-31g+(d).inp 000450497.td-b3lyp_6-31g+(d).log.xz

000450497.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450497.td-b3lyp_6-31+g(d).gjf (generated)

000450497.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450497.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450497.mol 000450497.PUBCHEM 000450497.mol (via Jmol)
000450503.b3lyp_6-31g(d).inp

000450503.b3lyp_6-31g(d).qchem.inp (generated)

000450503.b3lyp_6-31g(d).gjf (generated)

000450503.b3lyp_6-31g(d).firefly.inp (generated)

000450503.b3lyp_6-31g(d).smash.inp (generated)

000450503.b3lyp_6-31g(d).nwchem.inp (generated) 000450503.b3lyp_6-31g(d).log.xz 000450503.td-b3lyp_6-31g+(d).inp 000450503.td-b3lyp_6-31g+(d).log.xz

000450503.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450503.td-b3lyp_6-31+g(d).gjf (generated)

000450503.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450503.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450503.mol 000450503.PUBCHEM 000450503.mol (via Jmol)
000450515.b3lyp_6-31g(d).inp

000450515.b3lyp_6-31g(d).qchem.inp (generated)

000450515.b3lyp_6-31g(d).gjf (generated)

000450515.b3lyp_6-31g(d).firefly.inp (generated)

000450515.b3lyp_6-31g(d).smash.inp (generated)

000450515.b3lyp_6-31g(d).nwchem.inp (generated) 000450515.b3lyp_6-31g(d).log.xz 000450515.td-b3lyp_6-31g+(d).inp 000450515.td-b3lyp_6-31g+(d).log.xz

000450515.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450515.td-b3lyp_6-31+g(d).gjf (generated)

000450515.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450515.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450515.mol 000450515.PUBCHEM 000450515.mol (via Jmol)
000450528.b3lyp_6-31g(d).inp

000450528.b3lyp_6-31g(d).qchem.inp (generated)

000450528.b3lyp_6-31g(d).gjf (generated)

000450528.b3lyp_6-31g(d).firefly.inp (generated)

000450528.b3lyp_6-31g(d).smash.inp (generated)

000450528.b3lyp_6-31g(d).nwchem.inp (generated) 000450528.b3lyp_6-31g(d).log.xz 000450528.td-b3lyp_6-31g+(d).inp 000450528.td-b3lyp_6-31g+(d).log.xz

000450528.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450528.td-b3lyp_6-31+g(d).gjf (generated)

000450528.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450528.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450528.mol 000450528.PUBCHEM 000450528.mol (via Jmol)
000450529.b3lyp_6-31g(d).inp

000450529.b3lyp_6-31g(d).qchem.inp (generated)

000450529.b3lyp_6-31g(d).gjf (generated)

000450529.b3lyp_6-31g(d).firefly.inp (generated)

000450529.b3lyp_6-31g(d).smash.inp (generated)

000450529.b3lyp_6-31g(d).nwchem.inp (generated) 000450529.b3lyp_6-31g(d).log.xz 000450529.td-b3lyp_6-31g+(d).inp 000450529.td-b3lyp_6-31g+(d).log.xz

000450529.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450529.td-b3lyp_6-31+g(d).gjf (generated)

000450529.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450529.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450529.mol 000450529.PUBCHEM 000450529.mol (via Jmol)
000450530.b3lyp_6-31g(d).inp

000450530.b3lyp_6-31g(d).qchem.inp (generated)

000450530.b3lyp_6-31g(d).gjf (generated)

000450530.b3lyp_6-31g(d).firefly.inp (generated)

000450530.b3lyp_6-31g(d).smash.inp (generated)

000450530.b3lyp_6-31g(d).nwchem.inp (generated) 000450530.b3lyp_6-31g(d).log.xz 000450530.td-b3lyp_6-31g+(d).inp 000450530.td-b3lyp_6-31g+(d).log.xz

000450530.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450530.td-b3lyp_6-31+g(d).gjf (generated)

000450530.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450530.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450530.mol 000450530.PUBCHEM 000450530.mol (via Jmol)
000450531.b3lyp_6-31g(d).inp

000450531.b3lyp_6-31g(d).qchem.inp (generated)

000450531.b3lyp_6-31g(d).gjf (generated)

000450531.b3lyp_6-31g(d).firefly.inp (generated)

000450531.b3lyp_6-31g(d).smash.inp (generated)

000450531.b3lyp_6-31g(d).nwchem.inp (generated) 000450531.b3lyp_6-31g(d).log.xz 000450531.td-b3lyp_6-31g+(d).inp 000450531.td-b3lyp_6-31g+(d).log.xz

000450531.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450531.td-b3lyp_6-31+g(d).gjf (generated)

000450531.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450531.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450531.mol 000450531.PUBCHEM 000450531.mol (via Jmol)
000450532.b3lyp_6-31g(d).inp

000450532.b3lyp_6-31g(d).qchem.inp (generated)

000450532.b3lyp_6-31g(d).gjf (generated)

000450532.b3lyp_6-31g(d).firefly.inp (generated)

000450532.b3lyp_6-31g(d).smash.inp (generated)

000450532.b3lyp_6-31g(d).nwchem.inp (generated) 000450532.b3lyp_6-31g(d).log.xz 000450532.td-b3lyp_6-31g+(d).inp 000450532.td-b3lyp_6-31g+(d).log.xz

000450532.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450532.td-b3lyp_6-31+g(d).gjf (generated)

000450532.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450532.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450532.mol 000450532.PUBCHEM 000450532.mol (via Jmol)
000450533.b3lyp_6-31g(d).inp

000450533.b3lyp_6-31g(d).qchem.inp (generated)

000450533.b3lyp_6-31g(d).gjf (generated)

000450533.b3lyp_6-31g(d).firefly.inp (generated)

000450533.b3lyp_6-31g(d).smash.inp (generated)

000450533.b3lyp_6-31g(d).nwchem.inp (generated) 000450533.b3lyp_6-31g(d).log.xz 000450533.td-b3lyp_6-31g+(d).inp 000450533.td-b3lyp_6-31g+(d).log.xz

000450533.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450533.td-b3lyp_6-31+g(d).gjf (generated)

000450533.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450533.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450533.mol 000450533.PUBCHEM 000450533.mol (via Jmol)
000450534.b3lyp_6-31g(d).inp

000450534.b3lyp_6-31g(d).qchem.inp (generated)

000450534.b3lyp_6-31g(d).gjf (generated)

000450534.b3lyp_6-31g(d).firefly.inp (generated)

000450534.b3lyp_6-31g(d).smash.inp (generated)

000450534.b3lyp_6-31g(d).nwchem.inp (generated) 000450534.b3lyp_6-31g(d).log.xz 000450534.td-b3lyp_6-31g+(d).inp 000450534.td-b3lyp_6-31g+(d).log.xz

000450534.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450534.td-b3lyp_6-31+g(d).gjf (generated)

000450534.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450534.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450534.mol 000450534.PUBCHEM 000450534.mol (via Jmol)
000450535.b3lyp_6-31g(d).inp

000450535.b3lyp_6-31g(d).qchem.inp (generated)

000450535.b3lyp_6-31g(d).gjf (generated)

000450535.b3lyp_6-31g(d).firefly.inp (generated)

000450535.b3lyp_6-31g(d).smash.inp (generated)

000450535.b3lyp_6-31g(d).nwchem.inp (generated) 000450535.b3lyp_6-31g(d).log.xz 000450535.td-b3lyp_6-31g+(d).inp 000450535.td-b3lyp_6-31g+(d).log.xz

000450535.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450535.td-b3lyp_6-31+g(d).gjf (generated)

000450535.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450535.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450535.mol 000450535.PUBCHEM 000450535.mol (via Jmol)
000450536.b3lyp_6-31g(d).inp

000450536.b3lyp_6-31g(d).qchem.inp (generated)

000450536.b3lyp_6-31g(d).gjf (generated)

000450536.b3lyp_6-31g(d).firefly.inp (generated)

000450536.b3lyp_6-31g(d).smash.inp (generated)

000450536.b3lyp_6-31g(d).nwchem.inp (generated) 000450536.b3lyp_6-31g(d).log.xz 000450536.td-b3lyp_6-31g+(d).inp 000450536.td-b3lyp_6-31g+(d).log.xz

000450536.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450536.td-b3lyp_6-31+g(d).gjf (generated)

000450536.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450536.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450536.mol 000450536.PUBCHEM 000450536.mol (via Jmol)
000450537.b3lyp_6-31g(d).inp

000450537.b3lyp_6-31g(d).qchem.inp (generated)

000450537.b3lyp_6-31g(d).gjf (generated)

000450537.b3lyp_6-31g(d).firefly.inp (generated)

000450537.b3lyp_6-31g(d).smash.inp (generated)

000450537.b3lyp_6-31g(d).nwchem.inp (generated) 000450537.b3lyp_6-31g(d).log.xz 000450537.td-b3lyp_6-31g+(d).inp 000450537.td-b3lyp_6-31g+(d).log.xz

000450537.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450537.td-b3lyp_6-31+g(d).gjf (generated)

000450537.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450537.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450537.mol 000450537.PUBCHEM 000450537.mol (via Jmol)
000450538.b3lyp_6-31g(d).inp

000450538.b3lyp_6-31g(d).qchem.inp (generated)

000450538.b3lyp_6-31g(d).gjf (generated)

000450538.b3lyp_6-31g(d).firefly.inp (generated)

000450538.b3lyp_6-31g(d).smash.inp (generated)

000450538.b3lyp_6-31g(d).nwchem.inp (generated) 000450538.b3lyp_6-31g(d).log.xz 000450538.td-b3lyp_6-31g+(d).inp 000450538.td-b3lyp_6-31g+(d).log.xz

000450538.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450538.td-b3lyp_6-31+g(d).gjf (generated)

000450538.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450538.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450538.mol 000450538.PUBCHEM 000450538.mol (via Jmol)
000450540.b3lyp_6-31g(d).inp

000450540.b3lyp_6-31g(d).qchem.inp (generated)

000450540.b3lyp_6-31g(d).gjf (generated)

000450540.b3lyp_6-31g(d).firefly.inp (generated)

000450540.b3lyp_6-31g(d).smash.inp (generated)

000450540.b3lyp_6-31g(d).nwchem.inp (generated) 000450540.b3lyp_6-31g(d).log.xz 000450540.td-b3lyp_6-31g+(d).inp 000450540.td-b3lyp_6-31g+(d).log.xz

000450540.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450540.td-b3lyp_6-31+g(d).gjf (generated)

000450540.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450540.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450540.mol 000450540.PUBCHEM 000450540.mol (via Jmol)
000450541.b3lyp_6-31g(d).inp

000450541.b3lyp_6-31g(d).qchem.inp (generated)

000450541.b3lyp_6-31g(d).gjf (generated)

000450541.b3lyp_6-31g(d).firefly.inp (generated)

000450541.b3lyp_6-31g(d).smash.inp (generated)

000450541.b3lyp_6-31g(d).nwchem.inp (generated) 000450541.b3lyp_6-31g(d).log.xz 000450541.td-b3lyp_6-31g+(d).inp 000450541.td-b3lyp_6-31g+(d).log.xz

000450541.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450541.td-b3lyp_6-31+g(d).gjf (generated)

000450541.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450541.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450541.mol 000450541.PUBCHEM 000450541.mol (via Jmol)
000450542.b3lyp_6-31g(d).inp

000450542.b3lyp_6-31g(d).qchem.inp (generated)

000450542.b3lyp_6-31g(d).gjf (generated)

000450542.b3lyp_6-31g(d).firefly.inp (generated)

000450542.b3lyp_6-31g(d).smash.inp (generated)

000450542.b3lyp_6-31g(d).nwchem.inp (generated) 000450542.b3lyp_6-31g(d).log.xz 000450542.td-b3lyp_6-31g+(d).inp 000450542.td-b3lyp_6-31g+(d).log.xz

000450542.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450542.td-b3lyp_6-31+g(d).gjf (generated)

000450542.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450542.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450542.mol 000450542.PUBCHEM 000450542.mol (via Jmol)
000450543.b3lyp_6-31g(d).inp

000450543.b3lyp_6-31g(d).qchem.inp (generated)

000450543.b3lyp_6-31g(d).gjf (generated)

000450543.b3lyp_6-31g(d).firefly.inp (generated)

000450543.b3lyp_6-31g(d).smash.inp (generated)

000450543.b3lyp_6-31g(d).nwchem.inp (generated) 000450543.b3lyp_6-31g(d).log.xz 000450543.td-b3lyp_6-31g+(d).inp 000450543.td-b3lyp_6-31g+(d).log.xz

000450543.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450543.td-b3lyp_6-31+g(d).gjf (generated)

000450543.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450543.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450543.mol 000450543.PUBCHEM 000450543.mol (via Jmol)
000450544.b3lyp_6-31g(d).inp

000450544.b3lyp_6-31g(d).qchem.inp (generated)

000450544.b3lyp_6-31g(d).gjf (generated)

000450544.b3lyp_6-31g(d).firefly.inp (generated)

000450544.b3lyp_6-31g(d).smash.inp (generated)

000450544.b3lyp_6-31g(d).nwchem.inp (generated) 000450544.b3lyp_6-31g(d).log.xz 000450544.td-b3lyp_6-31g+(d).inp 000450544.td-b3lyp_6-31g+(d).log.xz

000450544.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450544.td-b3lyp_6-31+g(d).gjf (generated)

000450544.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450544.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450544.mol 000450544.PUBCHEM 000450544.mol (via Jmol)
000450545.b3lyp_6-31g(d).inp

000450545.b3lyp_6-31g(d).qchem.inp (generated)

000450545.b3lyp_6-31g(d).gjf (generated)

000450545.b3lyp_6-31g(d).firefly.inp (generated)

000450545.b3lyp_6-31g(d).smash.inp (generated)

000450545.b3lyp_6-31g(d).nwchem.inp (generated) 000450545.b3lyp_6-31g(d).log.xz 000450545.td-b3lyp_6-31g+(d).inp 000450545.td-b3lyp_6-31g+(d).log.xz

000450545.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450545.td-b3lyp_6-31+g(d).gjf (generated)

000450545.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450545.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450545.mol 000450545.PUBCHEM 000450545.mol (via Jmol)
000450546.b3lyp_6-31g(d).inp

000450546.b3lyp_6-31g(d).qchem.inp (generated)

000450546.b3lyp_6-31g(d).gjf (generated)

000450546.b3lyp_6-31g(d).firefly.inp (generated)

000450546.b3lyp_6-31g(d).smash.inp (generated)

000450546.b3lyp_6-31g(d).nwchem.inp (generated) 000450546.b3lyp_6-31g(d).log.xz 000450546.td-b3lyp_6-31g+(d).inp 000450546.td-b3lyp_6-31g+(d).log.xz

000450546.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450546.td-b3lyp_6-31+g(d).gjf (generated)

000450546.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450546.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450546.mol 000450546.PUBCHEM 000450546.mol (via Jmol)
000450547.b3lyp_6-31g(d).inp

000450547.b3lyp_6-31g(d).qchem.inp (generated)

000450547.b3lyp_6-31g(d).gjf (generated)

000450547.b3lyp_6-31g(d).firefly.inp (generated)

000450547.b3lyp_6-31g(d).smash.inp (generated)

000450547.b3lyp_6-31g(d).nwchem.inp (generated) 000450547.b3lyp_6-31g(d).log.xz 000450547.td-b3lyp_6-31g+(d).inp 000450547.td-b3lyp_6-31g+(d).log.xz

000450547.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450547.td-b3lyp_6-31+g(d).gjf (generated)

000450547.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450547.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450547.mol 000450547.PUBCHEM 000450547.mol (via Jmol)
000450548.b3lyp_6-31g(d).inp

000450548.b3lyp_6-31g(d).qchem.inp (generated)

000450548.b3lyp_6-31g(d).gjf (generated)

000450548.b3lyp_6-31g(d).firefly.inp (generated)

000450548.b3lyp_6-31g(d).smash.inp (generated)

000450548.b3lyp_6-31g(d).nwchem.inp (generated) 000450548.b3lyp_6-31g(d).log.xz 000450548.td-b3lyp_6-31g+(d).inp 000450548.td-b3lyp_6-31g+(d).log.xz

000450548.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450548.td-b3lyp_6-31+g(d).gjf (generated)

000450548.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450548.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450548.mol 000450548.PUBCHEM 000450548.mol (via Jmol)
000450549.b3lyp_6-31g(d).inp

000450549.b3lyp_6-31g(d).qchem.inp (generated)

000450549.b3lyp_6-31g(d).gjf (generated)

000450549.b3lyp_6-31g(d).firefly.inp (generated)

000450549.b3lyp_6-31g(d).smash.inp (generated)

000450549.b3lyp_6-31g(d).nwchem.inp (generated) 000450549.b3lyp_6-31g(d).log.xz 000450549.td-b3lyp_6-31g+(d).inp 000450549.td-b3lyp_6-31g+(d).log.xz

000450549.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450549.td-b3lyp_6-31+g(d).gjf (generated)

000450549.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450549.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450549.mol 000450549.PUBCHEM 000450549.mol (via Jmol)
000450550.b3lyp_6-31g(d).inp

000450550.b3lyp_6-31g(d).qchem.inp (generated)

000450550.b3lyp_6-31g(d).gjf (generated)

000450550.b3lyp_6-31g(d).firefly.inp (generated)

000450550.b3lyp_6-31g(d).smash.inp (generated)

000450550.b3lyp_6-31g(d).nwchem.inp (generated) 000450550.b3lyp_6-31g(d).log.xz 000450550.td-b3lyp_6-31g+(d).inp 000450550.td-b3lyp_6-31g+(d).log.xz

000450550.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450550.td-b3lyp_6-31+g(d).gjf (generated)

000450550.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450550.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450550.mol 000450550.PUBCHEM 000450550.mol (via Jmol)
000450551.b3lyp_6-31g(d).inp

000450551.b3lyp_6-31g(d).qchem.inp (generated)

000450551.b3lyp_6-31g(d).gjf (generated)

000450551.b3lyp_6-31g(d).firefly.inp (generated)

000450551.b3lyp_6-31g(d).smash.inp (generated)

000450551.b3lyp_6-31g(d).nwchem.inp (generated) 000450551.b3lyp_6-31g(d).log.xz 000450551.td-b3lyp_6-31g+(d).inp 000450551.td-b3lyp_6-31g+(d).log.xz

000450551.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450551.td-b3lyp_6-31+g(d).gjf (generated)

000450551.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450551.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450551.mol 000450551.PUBCHEM 000450551.mol (via Jmol)
000450552.b3lyp_6-31g(d).inp

000450552.b3lyp_6-31g(d).qchem.inp (generated)

000450552.b3lyp_6-31g(d).gjf (generated)

000450552.b3lyp_6-31g(d).firefly.inp (generated)

000450552.b3lyp_6-31g(d).smash.inp (generated)

000450552.b3lyp_6-31g(d).nwchem.inp (generated) 000450552.b3lyp_6-31g(d).log.xz 000450552.td-b3lyp_6-31g+(d).inp 000450552.td-b3lyp_6-31g+(d).log.xz

000450552.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450552.td-b3lyp_6-31+g(d).gjf (generated)

000450552.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450552.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450552.mol 000450552.PUBCHEM 000450552.mol (via Jmol)
000450553.b3lyp_6-31g(d).inp

000450553.b3lyp_6-31g(d).qchem.inp (generated)

000450553.b3lyp_6-31g(d).gjf (generated)

000450553.b3lyp_6-31g(d).firefly.inp (generated)

000450553.b3lyp_6-31g(d).smash.inp (generated)

000450553.b3lyp_6-31g(d).nwchem.inp (generated) 000450553.b3lyp_6-31g(d).log.xz 000450553.td-b3lyp_6-31g+(d).inp 000450553.td-b3lyp_6-31g+(d).log.xz

000450553.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450553.td-b3lyp_6-31+g(d).gjf (generated)

000450553.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450553.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450553.mol 000450553.PUBCHEM 000450553.mol (via Jmol)
000450554.b3lyp_6-31g(d).inp

000450554.b3lyp_6-31g(d).qchem.inp (generated)

000450554.b3lyp_6-31g(d).gjf (generated)

000450554.b3lyp_6-31g(d).firefly.inp (generated)

000450554.b3lyp_6-31g(d).smash.inp (generated)

000450554.b3lyp_6-31g(d).nwchem.inp (generated) 000450554.b3lyp_6-31g(d).log.xz 000450554.td-b3lyp_6-31g+(d).inp 000450554.td-b3lyp_6-31g+(d).log.xz

000450554.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450554.td-b3lyp_6-31+g(d).gjf (generated)

000450554.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450554.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450554.mol 000450554.PUBCHEM 000450554.mol (via Jmol)
000450555.b3lyp_6-31g(d).inp

000450555.b3lyp_6-31g(d).qchem.inp (generated)

000450555.b3lyp_6-31g(d).gjf (generated)

000450555.b3lyp_6-31g(d).firefly.inp (generated)

000450555.b3lyp_6-31g(d).smash.inp (generated)

000450555.b3lyp_6-31g(d).nwchem.inp (generated) 000450555.b3lyp_6-31g(d).log.xz 000450555.td-b3lyp_6-31g+(d).inp 000450555.td-b3lyp_6-31g+(d).log.xz

000450555.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450555.td-b3lyp_6-31+g(d).gjf (generated)

000450555.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450555.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450555.mol 000450555.PUBCHEM 000450555.mol (via Jmol)
000450556.b3lyp_6-31g(d).inp

000450556.b3lyp_6-31g(d).qchem.inp (generated)

000450556.b3lyp_6-31g(d).gjf (generated)

000450556.b3lyp_6-31g(d).firefly.inp (generated)

000450556.b3lyp_6-31g(d).smash.inp (generated)

000450556.b3lyp_6-31g(d).nwchem.inp (generated) 000450556.b3lyp_6-31g(d).log.xz 000450556.td-b3lyp_6-31g+(d).inp 000450556.td-b3lyp_6-31g+(d).log.xz

000450556.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450556.td-b3lyp_6-31+g(d).gjf (generated)

000450556.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450556.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450556.mol 000450556.PUBCHEM 000450556.mol (via Jmol)
000450557.b3lyp_6-31g(d).inp

000450557.b3lyp_6-31g(d).qchem.inp (generated)

000450557.b3lyp_6-31g(d).gjf (generated)

000450557.b3lyp_6-31g(d).firefly.inp (generated)

000450557.b3lyp_6-31g(d).smash.inp (generated)

000450557.b3lyp_6-31g(d).nwchem.inp (generated) 000450557.b3lyp_6-31g(d).log.xz 000450557.td-b3lyp_6-31g+(d).inp 000450557.td-b3lyp_6-31g+(d).log.xz

000450557.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450557.td-b3lyp_6-31+g(d).gjf (generated)

000450557.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450557.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450557.mol 000450557.PUBCHEM 000450557.mol (via Jmol)
000450558.b3lyp_6-31g(d).inp

000450558.b3lyp_6-31g(d).qchem.inp (generated)

000450558.b3lyp_6-31g(d).gjf (generated)

000450558.b3lyp_6-31g(d).firefly.inp (generated)

000450558.b3lyp_6-31g(d).smash.inp (generated)

000450558.b3lyp_6-31g(d).nwchem.inp (generated) 000450558.b3lyp_6-31g(d).log.xz 000450558.td-b3lyp_6-31g+(d).inp 000450558.td-b3lyp_6-31g+(d).log.xz

000450558.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450558.td-b3lyp_6-31+g(d).gjf (generated)

000450558.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450558.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450558.mol 000450558.PUBCHEM 000450558.mol (via Jmol)
000450559.b3lyp_6-31g(d).inp

000450559.b3lyp_6-31g(d).qchem.inp (generated)

000450559.b3lyp_6-31g(d).gjf (generated)

000450559.b3lyp_6-31g(d).firefly.inp (generated)

000450559.b3lyp_6-31g(d).smash.inp (generated)

000450559.b3lyp_6-31g(d).nwchem.inp (generated) 000450559.b3lyp_6-31g(d).log.xz 000450559.td-b3lyp_6-31g+(d).inp 000450559.td-b3lyp_6-31g+(d).log.xz

000450559.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450559.td-b3lyp_6-31+g(d).gjf (generated)

000450559.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450559.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450559.mol 000450559.PUBCHEM 000450559.mol (via Jmol)
000450560.b3lyp_6-31g(d).inp

000450560.b3lyp_6-31g(d).qchem.inp (generated)

000450560.b3lyp_6-31g(d).gjf (generated)

000450560.b3lyp_6-31g(d).firefly.inp (generated)

000450560.b3lyp_6-31g(d).smash.inp (generated)

000450560.b3lyp_6-31g(d).nwchem.inp (generated) 000450560.b3lyp_6-31g(d).log.xz 000450560.td-b3lyp_6-31g+(d).inp 000450560.td-b3lyp_6-31g+(d).log.xz

000450560.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450560.td-b3lyp_6-31+g(d).gjf (generated)

000450560.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450560.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450560.mol 000450560.PUBCHEM 000450560.mol (via Jmol)
000450561.b3lyp_6-31g(d).inp

000450561.b3lyp_6-31g(d).qchem.inp (generated)

000450561.b3lyp_6-31g(d).gjf (generated)

000450561.b3lyp_6-31g(d).firefly.inp (generated)

000450561.b3lyp_6-31g(d).smash.inp (generated)

000450561.b3lyp_6-31g(d).nwchem.inp (generated) 000450561.b3lyp_6-31g(d).log.xz 000450561.td-b3lyp_6-31g+(d).inp 000450561.td-b3lyp_6-31g+(d).log.xz

000450561.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450561.td-b3lyp_6-31+g(d).gjf (generated)

000450561.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450561.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450561.mol 000450561.PUBCHEM 000450561.mol (via Jmol)
000450562.b3lyp_6-31g(d).inp

000450562.b3lyp_6-31g(d).qchem.inp (generated)

000450562.b3lyp_6-31g(d).gjf (generated)

000450562.b3lyp_6-31g(d).firefly.inp (generated)

000450562.b3lyp_6-31g(d).smash.inp (generated)

000450562.b3lyp_6-31g(d).nwchem.inp (generated) 000450562.b3lyp_6-31g(d).log.xz 000450562.td-b3lyp_6-31g+(d).inp 000450562.td-b3lyp_6-31g+(d).log.xz

000450562.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450562.td-b3lyp_6-31+g(d).gjf (generated)

000450562.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450562.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450562.mol 000450562.PUBCHEM 000450562.mol (via Jmol)
000450563.b3lyp_6-31g(d).inp

000450563.b3lyp_6-31g(d).qchem.inp (generated)

000450563.b3lyp_6-31g(d).gjf (generated)

000450563.b3lyp_6-31g(d).firefly.inp (generated)

000450563.b3lyp_6-31g(d).smash.inp (generated)

000450563.b3lyp_6-31g(d).nwchem.inp (generated) 000450563.b3lyp_6-31g(d).log.xz 000450563.td-b3lyp_6-31g+(d).inp 000450563.td-b3lyp_6-31g+(d).log.xz

000450563.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450563.td-b3lyp_6-31+g(d).gjf (generated)

000450563.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450563.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450563.mol 000450563.PUBCHEM 000450563.mol (via Jmol)
000450564.b3lyp_6-31g(d).inp

000450564.b3lyp_6-31g(d).qchem.inp (generated)

000450564.b3lyp_6-31g(d).gjf (generated)

000450564.b3lyp_6-31g(d).firefly.inp (generated)

000450564.b3lyp_6-31g(d).smash.inp (generated)

000450564.b3lyp_6-31g(d).nwchem.inp (generated) 000450564.b3lyp_6-31g(d).log.xz 000450564.td-b3lyp_6-31g+(d).inp 000450564.td-b3lyp_6-31g+(d).log.xz

000450564.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450564.td-b3lyp_6-31+g(d).gjf (generated)

000450564.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450564.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450564.mol 000450564.PUBCHEM 000450564.mol (via Jmol)
000450565.b3lyp_6-31g(d).inp

000450565.b3lyp_6-31g(d).qchem.inp (generated)

000450565.b3lyp_6-31g(d).gjf (generated)

000450565.b3lyp_6-31g(d).firefly.inp (generated)

000450565.b3lyp_6-31g(d).smash.inp (generated)

000450565.b3lyp_6-31g(d).nwchem.inp (generated) 000450565.b3lyp_6-31g(d).log.xz 000450565.td-b3lyp_6-31g+(d).inp 000450565.td-b3lyp_6-31g+(d).log.xz

000450565.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450565.td-b3lyp_6-31+g(d).gjf (generated)

000450565.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450565.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450565.mol 000450565.PUBCHEM 000450565.mol (via Jmol)
000450566.b3lyp_6-31g(d).inp

000450566.b3lyp_6-31g(d).qchem.inp (generated)

000450566.b3lyp_6-31g(d).gjf (generated)

000450566.b3lyp_6-31g(d).firefly.inp (generated)

000450566.b3lyp_6-31g(d).smash.inp (generated)

000450566.b3lyp_6-31g(d).nwchem.inp (generated) 000450566.b3lyp_6-31g(d).log.xz 000450566.td-b3lyp_6-31g+(d).inp 000450566.td-b3lyp_6-31g+(d).log.xz

000450566.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450566.td-b3lyp_6-31+g(d).gjf (generated)

000450566.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450566.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450566.mol 000450566.PUBCHEM 000450566.mol (via Jmol)
000450567.b3lyp_6-31g(d).inp

000450567.b3lyp_6-31g(d).qchem.inp (generated)

000450567.b3lyp_6-31g(d).gjf (generated)

000450567.b3lyp_6-31g(d).firefly.inp (generated)

000450567.b3lyp_6-31g(d).smash.inp (generated)

000450567.b3lyp_6-31g(d).nwchem.inp (generated) 000450567.b3lyp_6-31g(d).log.xz 000450567.td-b3lyp_6-31g+(d).inp 000450567.td-b3lyp_6-31g+(d).log.xz

000450567.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450567.td-b3lyp_6-31+g(d).gjf (generated)

000450567.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450567.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450567.mol 000450567.PUBCHEM 000450567.mol (via Jmol)
000450568.b3lyp_6-31g(d).inp

000450568.b3lyp_6-31g(d).qchem.inp (generated)

000450568.b3lyp_6-31g(d).gjf (generated)

000450568.b3lyp_6-31g(d).firefly.inp (generated)

000450568.b3lyp_6-31g(d).smash.inp (generated)

000450568.b3lyp_6-31g(d).nwchem.inp (generated) 000450568.b3lyp_6-31g(d).log.xz 000450568.td-b3lyp_6-31g+(d).inp 000450568.td-b3lyp_6-31g+(d).log.xz

000450568.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450568.td-b3lyp_6-31+g(d).gjf (generated)

000450568.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450568.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450568.mol 000450568.PUBCHEM 000450568.mol (via Jmol)
000450569.b3lyp_6-31g(d).inp

000450569.b3lyp_6-31g(d).qchem.inp (generated)

000450569.b3lyp_6-31g(d).gjf (generated)

000450569.b3lyp_6-31g(d).firefly.inp (generated)

000450569.b3lyp_6-31g(d).smash.inp (generated)

000450569.b3lyp_6-31g(d).nwchem.inp (generated) 000450569.b3lyp_6-31g(d).log.xz 000450569.td-b3lyp_6-31g+(d).inp 000450569.td-b3lyp_6-31g+(d).log.xz

000450569.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450569.td-b3lyp_6-31+g(d).gjf (generated)

000450569.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450569.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450569.mol 000450569.PUBCHEM 000450569.mol (via Jmol)
000450570.b3lyp_6-31g(d).inp

000450570.b3lyp_6-31g(d).qchem.inp (generated)

000450570.b3lyp_6-31g(d).gjf (generated)

000450570.b3lyp_6-31g(d).firefly.inp (generated)

000450570.b3lyp_6-31g(d).smash.inp (generated)

000450570.b3lyp_6-31g(d).nwchem.inp (generated) 000450570.b3lyp_6-31g(d).log.xz 000450570.td-b3lyp_6-31g+(d).inp 000450570.td-b3lyp_6-31g+(d).log.xz

000450570.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450570.td-b3lyp_6-31+g(d).gjf (generated)

000450570.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450570.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450570.mol 000450570.PUBCHEM 000450570.mol (via Jmol)
000450571.b3lyp_6-31g(d).inp

000450571.b3lyp_6-31g(d).qchem.inp (generated)

000450571.b3lyp_6-31g(d).gjf (generated)

000450571.b3lyp_6-31g(d).firefly.inp (generated)

000450571.b3lyp_6-31g(d).smash.inp (generated)

000450571.b3lyp_6-31g(d).nwchem.inp (generated) 000450571.b3lyp_6-31g(d).log.xz 000450571.td-b3lyp_6-31g+(d).inp 000450571.td-b3lyp_6-31g+(d).log.xz

000450571.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450571.td-b3lyp_6-31+g(d).gjf (generated)

000450571.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450571.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450571.mol 000450571.PUBCHEM 000450571.mol (via Jmol)
000450574.b3lyp_6-31g(d).inp

000450574.b3lyp_6-31g(d).qchem.inp (generated)

000450574.b3lyp_6-31g(d).gjf (generated)

000450574.b3lyp_6-31g(d).firefly.inp (generated)

000450574.b3lyp_6-31g(d).smash.inp (generated)

000450574.b3lyp_6-31g(d).nwchem.inp (generated) 000450574.b3lyp_6-31g(d).log.xz 000450574.td-b3lyp_6-31g+(d).inp 000450574.td-b3lyp_6-31g+(d).log.xz

000450574.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450574.td-b3lyp_6-31+g(d).gjf (generated)

000450574.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450574.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450574.mol 000450574.PUBCHEM 000450574.mol (via Jmol)
000450575.b3lyp_6-31g(d).inp

000450575.b3lyp_6-31g(d).qchem.inp (generated)

000450575.b3lyp_6-31g(d).gjf (generated)

000450575.b3lyp_6-31g(d).firefly.inp (generated)

000450575.b3lyp_6-31g(d).smash.inp (generated)

000450575.b3lyp_6-31g(d).nwchem.inp (generated) 000450575.b3lyp_6-31g(d).log.xz 000450575.td-b3lyp_6-31g+(d).inp 000450575.td-b3lyp_6-31g+(d).log.xz

000450575.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450575.td-b3lyp_6-31+g(d).gjf (generated)

000450575.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450575.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450575.mol 000450575.PUBCHEM 000450575.mol (via Jmol)
000450576.b3lyp_6-31g(d).inp

000450576.b3lyp_6-31g(d).qchem.inp (generated)

000450576.b3lyp_6-31g(d).gjf (generated)

000450576.b3lyp_6-31g(d).firefly.inp (generated)

000450576.b3lyp_6-31g(d).smash.inp (generated)

000450576.b3lyp_6-31g(d).nwchem.inp (generated) 000450576.b3lyp_6-31g(d).log.xz 000450576.td-b3lyp_6-31g+(d).inp 000450576.td-b3lyp_6-31g+(d).log.xz

000450576.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450576.td-b3lyp_6-31+g(d).gjf (generated)

000450576.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450576.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450576.mol 000450576.PUBCHEM 000450576.mol (via Jmol)
000450577.b3lyp_6-31g(d).inp

000450577.b3lyp_6-31g(d).qchem.inp (generated)

000450577.b3lyp_6-31g(d).gjf (generated)

000450577.b3lyp_6-31g(d).firefly.inp (generated)

000450577.b3lyp_6-31g(d).smash.inp (generated)

000450577.b3lyp_6-31g(d).nwchem.inp (generated) 000450577.b3lyp_6-31g(d).log.xz 000450577.td-b3lyp_6-31g+(d).inp 000450577.td-b3lyp_6-31g+(d).log.xz

000450577.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450577.td-b3lyp_6-31+g(d).gjf (generated)

000450577.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450577.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450577.mol 000450577.PUBCHEM 000450577.mol (via Jmol)
000450578.b3lyp_6-31g(d).inp

000450578.b3lyp_6-31g(d).qchem.inp (generated)

000450578.b3lyp_6-31g(d).gjf (generated)

000450578.b3lyp_6-31g(d).firefly.inp (generated)

000450578.b3lyp_6-31g(d).smash.inp (generated)

000450578.b3lyp_6-31g(d).nwchem.inp (generated) 000450578.b3lyp_6-31g(d).log.xz 000450578.td-b3lyp_6-31g+(d).inp 000450578.td-b3lyp_6-31g+(d).log.xz

000450578.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450578.td-b3lyp_6-31+g(d).gjf (generated)

000450578.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450578.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450578.mol 000450578.PUBCHEM 000450578.mol (via Jmol)
000450579.b3lyp_6-31g(d).inp

000450579.b3lyp_6-31g(d).qchem.inp (generated)

000450579.b3lyp_6-31g(d).gjf (generated)

000450579.b3lyp_6-31g(d).firefly.inp (generated)

000450579.b3lyp_6-31g(d).smash.inp (generated)

000450579.b3lyp_6-31g(d).nwchem.inp (generated) 000450579.b3lyp_6-31g(d).log.xz 000450579.td-b3lyp_6-31g+(d).inp 000450579.td-b3lyp_6-31g+(d).log.xz

000450579.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450579.td-b3lyp_6-31+g(d).gjf (generated)

000450579.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450579.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450579.mol 000450579.PUBCHEM 000450579.mol (via Jmol)
000450580.b3lyp_6-31g(d).inp

000450580.b3lyp_6-31g(d).qchem.inp (generated)

000450580.b3lyp_6-31g(d).gjf (generated)

000450580.b3lyp_6-31g(d).firefly.inp (generated)

000450580.b3lyp_6-31g(d).smash.inp (generated)

000450580.b3lyp_6-31g(d).nwchem.inp (generated) 000450580.b3lyp_6-31g(d).log.xz 000450580.td-b3lyp_6-31g+(d).inp 000450580.td-b3lyp_6-31g+(d).log.xz

000450580.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450580.td-b3lyp_6-31+g(d).gjf (generated)

000450580.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450580.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450580.mol 000450580.PUBCHEM 000450580.mol (via Jmol)
000450581.b3lyp_6-31g(d).inp

000450581.b3lyp_6-31g(d).qchem.inp (generated)

000450581.b3lyp_6-31g(d).gjf (generated)

000450581.b3lyp_6-31g(d).firefly.inp (generated)

000450581.b3lyp_6-31g(d).smash.inp (generated)

000450581.b3lyp_6-31g(d).nwchem.inp (generated) 000450581.b3lyp_6-31g(d).log.xz 000450581.td-b3lyp_6-31g+(d).inp 000450581.td-b3lyp_6-31g+(d).log.xz

000450581.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450581.td-b3lyp_6-31+g(d).gjf (generated)

000450581.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450581.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450581.mol 000450581.PUBCHEM 000450581.mol (via Jmol)
000450582.b3lyp_6-31g(d).inp

000450582.b3lyp_6-31g(d).qchem.inp (generated)

000450582.b3lyp_6-31g(d).gjf (generated)

000450582.b3lyp_6-31g(d).firefly.inp (generated)

000450582.b3lyp_6-31g(d).smash.inp (generated)

000450582.b3lyp_6-31g(d).nwchem.inp (generated) 000450582.b3lyp_6-31g(d).log.xz 000450582.td-b3lyp_6-31g+(d).inp 000450582.td-b3lyp_6-31g+(d).log.xz

000450582.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450582.td-b3lyp_6-31+g(d).gjf (generated)

000450582.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450582.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450582.mol 000450582.PUBCHEM 000450582.mol (via Jmol)
000450583.b3lyp_6-31g(d).inp

000450583.b3lyp_6-31g(d).qchem.inp (generated)

000450583.b3lyp_6-31g(d).gjf (generated)

000450583.b3lyp_6-31g(d).firefly.inp (generated)

000450583.b3lyp_6-31g(d).smash.inp (generated)

000450583.b3lyp_6-31g(d).nwchem.inp (generated) 000450583.b3lyp_6-31g(d).log.xz 000450583.td-b3lyp_6-31g+(d).inp 000450583.td-b3lyp_6-31g+(d).log.xz

000450583.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450583.td-b3lyp_6-31+g(d).gjf (generated)

000450583.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450583.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450583.mol 000450583.PUBCHEM 000450583.mol (via Jmol)
000450585.b3lyp_6-31g(d).inp

000450585.b3lyp_6-31g(d).qchem.inp (generated)

000450585.b3lyp_6-31g(d).gjf (generated)

000450585.b3lyp_6-31g(d).firefly.inp (generated)

000450585.b3lyp_6-31g(d).smash.inp (generated)

000450585.b3lyp_6-31g(d).nwchem.inp (generated) 000450585.b3lyp_6-31g(d).log.xz 000450585.td-b3lyp_6-31g+(d).inp 000450585.td-b3lyp_6-31g+(d).log.xz

000450585.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450585.td-b3lyp_6-31+g(d).gjf (generated)

000450585.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450585.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450585.mol 000450585.PUBCHEM 000450585.mol (via Jmol)
000450586.b3lyp_6-31g(d).inp

000450586.b3lyp_6-31g(d).qchem.inp (generated)

000450586.b3lyp_6-31g(d).gjf (generated)

000450586.b3lyp_6-31g(d).firefly.inp (generated)

000450586.b3lyp_6-31g(d).smash.inp (generated)

000450586.b3lyp_6-31g(d).nwchem.inp (generated) 000450586.b3lyp_6-31g(d).log.xz 000450586.td-b3lyp_6-31g+(d).inp 000450586.td-b3lyp_6-31g+(d).log.xz

000450586.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450586.td-b3lyp_6-31+g(d).gjf (generated)

000450586.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450586.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450586.mol 000450586.PUBCHEM 000450586.mol (via Jmol)
000450587.b3lyp_6-31g(d).inp

000450587.b3lyp_6-31g(d).qchem.inp (generated)

000450587.b3lyp_6-31g(d).gjf (generated)

000450587.b3lyp_6-31g(d).firefly.inp (generated)

000450587.b3lyp_6-31g(d).smash.inp (generated)

000450587.b3lyp_6-31g(d).nwchem.inp (generated) 000450587.b3lyp_6-31g(d).log.xz 000450587.td-b3lyp_6-31g+(d).inp 000450587.td-b3lyp_6-31g+(d).log.xz

000450587.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450587.td-b3lyp_6-31+g(d).gjf (generated)

000450587.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450587.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450587.mol 000450587.PUBCHEM 000450587.mol (via Jmol)
000450588.b3lyp_6-31g(d).inp

000450588.b3lyp_6-31g(d).qchem.inp (generated)

000450588.b3lyp_6-31g(d).gjf (generated)

000450588.b3lyp_6-31g(d).firefly.inp (generated)

000450588.b3lyp_6-31g(d).smash.inp (generated)

000450588.b3lyp_6-31g(d).nwchem.inp (generated) 000450588.b3lyp_6-31g(d).log.xz 000450588.td-b3lyp_6-31g+(d).inp 000450588.td-b3lyp_6-31g+(d).log.xz

000450588.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450588.td-b3lyp_6-31+g(d).gjf (generated)

000450588.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450588.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450588.mol 000450588.PUBCHEM 000450588.mol (via Jmol)
000450590.b3lyp_6-31g(d).inp

000450590.b3lyp_6-31g(d).qchem.inp (generated)

000450590.b3lyp_6-31g(d).gjf (generated)

000450590.b3lyp_6-31g(d).firefly.inp (generated)

000450590.b3lyp_6-31g(d).smash.inp (generated)

000450590.b3lyp_6-31g(d).nwchem.inp (generated) 000450590.b3lyp_6-31g(d).log.xz 000450590.td-b3lyp_6-31g+(d).inp 000450590.td-b3lyp_6-31g+(d).log.xz

000450590.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450590.td-b3lyp_6-31+g(d).gjf (generated)

000450590.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450590.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450590.mol 000450590.PUBCHEM 000450590.mol (via Jmol)
000450591.b3lyp_6-31g(d).inp

000450591.b3lyp_6-31g(d).qchem.inp (generated)

000450591.b3lyp_6-31g(d).gjf (generated)

000450591.b3lyp_6-31g(d).firefly.inp (generated)

000450591.b3lyp_6-31g(d).smash.inp (generated)

000450591.b3lyp_6-31g(d).nwchem.inp (generated) 000450591.b3lyp_6-31g(d).log.xz 000450591.td-b3lyp_6-31g+(d).inp 000450591.td-b3lyp_6-31g+(d).log.xz

000450591.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450591.td-b3lyp_6-31+g(d).gjf (generated)

000450591.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450591.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450591.mol 000450591.PUBCHEM 000450591.mol (via Jmol)
000450592.b3lyp_6-31g(d).inp

000450592.b3lyp_6-31g(d).qchem.inp (generated)

000450592.b3lyp_6-31g(d).gjf (generated)

000450592.b3lyp_6-31g(d).firefly.inp (generated)

000450592.b3lyp_6-31g(d).smash.inp (generated)

000450592.b3lyp_6-31g(d).nwchem.inp (generated) 000450592.b3lyp_6-31g(d).log.xz 000450592.td-b3lyp_6-31g+(d).inp 000450592.td-b3lyp_6-31g+(d).log.xz

000450592.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450592.td-b3lyp_6-31+g(d).gjf (generated)

000450592.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450592.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450592.mol 000450592.PUBCHEM 000450592.mol (via Jmol)
000450593.b3lyp_6-31g(d).inp

000450593.b3lyp_6-31g(d).qchem.inp (generated)

000450593.b3lyp_6-31g(d).gjf (generated)

000450593.b3lyp_6-31g(d).firefly.inp (generated)

000450593.b3lyp_6-31g(d).smash.inp (generated)

000450593.b3lyp_6-31g(d).nwchem.inp (generated) 000450593.b3lyp_6-31g(d).log.xz 000450593.td-b3lyp_6-31g+(d).inp 000450593.td-b3lyp_6-31g+(d).log.xz

000450593.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450593.td-b3lyp_6-31+g(d).gjf (generated)

000450593.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450593.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450593.mol 000450593.PUBCHEM 000450593.mol (via Jmol)
000450594.b3lyp_6-31g(d).inp

000450594.b3lyp_6-31g(d).qchem.inp (generated)

000450594.b3lyp_6-31g(d).gjf (generated)

000450594.b3lyp_6-31g(d).firefly.inp (generated)

000450594.b3lyp_6-31g(d).smash.inp (generated)

000450594.b3lyp_6-31g(d).nwchem.inp (generated) 000450594.b3lyp_6-31g(d).log.xz 000450594.td-b3lyp_6-31g+(d).inp 000450594.td-b3lyp_6-31g+(d).log.xz

000450594.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450594.td-b3lyp_6-31+g(d).gjf (generated)

000450594.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450594.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450594.mol 000450594.PUBCHEM 000450594.mol (via Jmol)
000450595.b3lyp_6-31g(d).inp

000450595.b3lyp_6-31g(d).qchem.inp (generated)

000450595.b3lyp_6-31g(d).gjf (generated)

000450595.b3lyp_6-31g(d).firefly.inp (generated)

000450595.b3lyp_6-31g(d).smash.inp (generated)

000450595.b3lyp_6-31g(d).nwchem.inp (generated) 000450595.b3lyp_6-31g(d).log.xz 000450595.td-b3lyp_6-31g+(d).inp 000450595.td-b3lyp_6-31g+(d).log.xz

000450595.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450595.td-b3lyp_6-31+g(d).gjf (generated)

000450595.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450595.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450595.mol 000450595.PUBCHEM 000450595.mol (via Jmol)
000450596.b3lyp_6-31g(d).inp

000450596.b3lyp_6-31g(d).qchem.inp (generated)

000450596.b3lyp_6-31g(d).gjf (generated)

000450596.b3lyp_6-31g(d).firefly.inp (generated)

000450596.b3lyp_6-31g(d).smash.inp (generated)

000450596.b3lyp_6-31g(d).nwchem.inp (generated) 000450596.b3lyp_6-31g(d).log.xz 000450596.td-b3lyp_6-31g+(d).inp 000450596.td-b3lyp_6-31g+(d).log.xz

000450596.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450596.td-b3lyp_6-31+g(d).gjf (generated)

000450596.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450596.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450596.mol 000450596.PUBCHEM 000450596.mol (via Jmol)
000450597.b3lyp_6-31g(d).inp

000450597.b3lyp_6-31g(d).qchem.inp (generated)

000450597.b3lyp_6-31g(d).gjf (generated)

000450597.b3lyp_6-31g(d).firefly.inp (generated)

000450597.b3lyp_6-31g(d).smash.inp (generated)

000450597.b3lyp_6-31g(d).nwchem.inp (generated) 000450597.b3lyp_6-31g(d).log.xz 000450597.td-b3lyp_6-31g+(d).inp 000450597.td-b3lyp_6-31g+(d).log.xz

000450597.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450597.td-b3lyp_6-31+g(d).gjf (generated)

000450597.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450597.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450597.mol 000450597.PUBCHEM 000450597.mol (via Jmol)
000450598.b3lyp_6-31g(d).inp

000450598.b3lyp_6-31g(d).qchem.inp (generated)

000450598.b3lyp_6-31g(d).gjf (generated)

000450598.b3lyp_6-31g(d).firefly.inp (generated)

000450598.b3lyp_6-31g(d).smash.inp (generated)

000450598.b3lyp_6-31g(d).nwchem.inp (generated) 000450598.b3lyp_6-31g(d).log.xz 000450598.td-b3lyp_6-31g+(d).inp 000450598.td-b3lyp_6-31g+(d).log.xz

000450598.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450598.td-b3lyp_6-31+g(d).gjf (generated)

000450598.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450598.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450598.mol 000450598.PUBCHEM 000450598.mol (via Jmol)
000450599.b3lyp_6-31g(d).inp

000450599.b3lyp_6-31g(d).qchem.inp (generated)

000450599.b3lyp_6-31g(d).gjf (generated)

000450599.b3lyp_6-31g(d).firefly.inp (generated)

000450599.b3lyp_6-31g(d).smash.inp (generated)

000450599.b3lyp_6-31g(d).nwchem.inp (generated) 000450599.b3lyp_6-31g(d).log.xz 000450599.td-b3lyp_6-31g+(d).inp 000450599.td-b3lyp_6-31g+(d).log.xz

000450599.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450599.td-b3lyp_6-31+g(d).gjf (generated)

000450599.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450599.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450599.mol 000450599.PUBCHEM 000450599.mol (via Jmol)
000450600.b3lyp_6-31g(d).inp

000450600.b3lyp_6-31g(d).qchem.inp (generated)

000450600.b3lyp_6-31g(d).gjf (generated)

000450600.b3lyp_6-31g(d).firefly.inp (generated)

000450600.b3lyp_6-31g(d).smash.inp (generated)

000450600.b3lyp_6-31g(d).nwchem.inp (generated) 000450600.b3lyp_6-31g(d).log.xz 000450600.td-b3lyp_6-31g+(d).inp 000450600.td-b3lyp_6-31g+(d).log.xz

000450600.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450600.td-b3lyp_6-31+g(d).gjf (generated)

000450600.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450600.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450600.mol 000450600.PUBCHEM 000450600.mol (via Jmol)
000450601.b3lyp_6-31g(d).inp

000450601.b3lyp_6-31g(d).qchem.inp (generated)

000450601.b3lyp_6-31g(d).gjf (generated)

000450601.b3lyp_6-31g(d).firefly.inp (generated)

000450601.b3lyp_6-31g(d).smash.inp (generated)

000450601.b3lyp_6-31g(d).nwchem.inp (generated) 000450601.b3lyp_6-31g(d).log.xz 000450601.td-b3lyp_6-31g+(d).inp 000450601.td-b3lyp_6-31g+(d).log.xz

000450601.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450601.td-b3lyp_6-31+g(d).gjf (generated)

000450601.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450601.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450601.mol 000450601.PUBCHEM 000450601.mol (via Jmol)
000450602.b3lyp_6-31g(d).inp

000450602.b3lyp_6-31g(d).qchem.inp (generated)

000450602.b3lyp_6-31g(d).gjf (generated)

000450602.b3lyp_6-31g(d).firefly.inp (generated)

000450602.b3lyp_6-31g(d).smash.inp (generated)

000450602.b3lyp_6-31g(d).nwchem.inp (generated) 000450602.b3lyp_6-31g(d).log.xz 000450602.td-b3lyp_6-31g+(d).inp 000450602.td-b3lyp_6-31g+(d).log.xz

000450602.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450602.td-b3lyp_6-31+g(d).gjf (generated)

000450602.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450602.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450602.mol 000450602.PUBCHEM 000450602.mol (via Jmol)
000450603.b3lyp_6-31g(d).inp

000450603.b3lyp_6-31g(d).qchem.inp (generated)

000450603.b3lyp_6-31g(d).gjf (generated)

000450603.b3lyp_6-31g(d).firefly.inp (generated)

000450603.b3lyp_6-31g(d).smash.inp (generated)

000450603.b3lyp_6-31g(d).nwchem.inp (generated) 000450603.b3lyp_6-31g(d).log.xz 000450603.td-b3lyp_6-31g+(d).inp 000450603.td-b3lyp_6-31g+(d).log.xz

000450603.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450603.td-b3lyp_6-31+g(d).gjf (generated)

000450603.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450603.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450603.mol 000450603.PUBCHEM 000450603.mol (via Jmol)
000450604.b3lyp_6-31g(d).inp

000450604.b3lyp_6-31g(d).qchem.inp (generated)

000450604.b3lyp_6-31g(d).gjf (generated)

000450604.b3lyp_6-31g(d).firefly.inp (generated)

000450604.b3lyp_6-31g(d).smash.inp (generated)

000450604.b3lyp_6-31g(d).nwchem.inp (generated) 000450604.b3lyp_6-31g(d).log.xz 000450604.td-b3lyp_6-31g+(d).inp 000450604.td-b3lyp_6-31g+(d).log.xz

000450604.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450604.td-b3lyp_6-31+g(d).gjf (generated)

000450604.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450604.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450604.mol 000450604.PUBCHEM 000450604.mol (via Jmol)
000450605.b3lyp_6-31g(d).inp

000450605.b3lyp_6-31g(d).qchem.inp (generated)

000450605.b3lyp_6-31g(d).gjf (generated)

000450605.b3lyp_6-31g(d).firefly.inp (generated)

000450605.b3lyp_6-31g(d).smash.inp (generated)

000450605.b3lyp_6-31g(d).nwchem.inp (generated) 000450605.b3lyp_6-31g(d).log.xz 000450605.td-b3lyp_6-31g+(d).inp 000450605.td-b3lyp_6-31g+(d).log.xz

000450605.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450605.td-b3lyp_6-31+g(d).gjf (generated)

000450605.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450605.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450605.mol 000450605.PUBCHEM 000450605.mol (via Jmol)
000450606.b3lyp_6-31g(d).inp

000450606.b3lyp_6-31g(d).qchem.inp (generated)

000450606.b3lyp_6-31g(d).gjf (generated)

000450606.b3lyp_6-31g(d).firefly.inp (generated)

000450606.b3lyp_6-31g(d).smash.inp (generated)

000450606.b3lyp_6-31g(d).nwchem.inp (generated) 000450606.b3lyp_6-31g(d).log.xz 000450606.td-b3lyp_6-31g+(d).inp 000450606.td-b3lyp_6-31g+(d).log.xz

000450606.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450606.td-b3lyp_6-31+g(d).gjf (generated)

000450606.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450606.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450606.mol 000450606.PUBCHEM 000450606.mol (via Jmol)
000450607.b3lyp_6-31g(d).inp

000450607.b3lyp_6-31g(d).qchem.inp (generated)

000450607.b3lyp_6-31g(d).gjf (generated)

000450607.b3lyp_6-31g(d).firefly.inp (generated)

000450607.b3lyp_6-31g(d).smash.inp (generated)

000450607.b3lyp_6-31g(d).nwchem.inp (generated) 000450607.b3lyp_6-31g(d).log.xz 000450607.td-b3lyp_6-31g+(d).inp 000450607.td-b3lyp_6-31g+(d).log.xz

000450607.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450607.td-b3lyp_6-31+g(d).gjf (generated)

000450607.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450607.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450607.mol 000450607.PUBCHEM 000450607.mol (via Jmol)
000450608.b3lyp_6-31g(d).inp

000450608.b3lyp_6-31g(d).qchem.inp (generated)

000450608.b3lyp_6-31g(d).gjf (generated)

000450608.b3lyp_6-31g(d).firefly.inp (generated)

000450608.b3lyp_6-31g(d).smash.inp (generated)

000450608.b3lyp_6-31g(d).nwchem.inp (generated) 000450608.b3lyp_6-31g(d).log.xz 000450608.td-b3lyp_6-31g+(d).inp 000450608.td-b3lyp_6-31g+(d).log.xz

000450608.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450608.td-b3lyp_6-31+g(d).gjf (generated)

000450608.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450608.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450608.mol 000450608.PUBCHEM 000450608.mol (via Jmol)
000450609.b3lyp_6-31g(d).inp

000450609.b3lyp_6-31g(d).qchem.inp (generated)

000450609.b3lyp_6-31g(d).gjf (generated)

000450609.b3lyp_6-31g(d).firefly.inp (generated)

000450609.b3lyp_6-31g(d).smash.inp (generated)

000450609.b3lyp_6-31g(d).nwchem.inp (generated) 000450609.b3lyp_6-31g(d).log.xz 000450609.td-b3lyp_6-31g+(d).inp 000450609.td-b3lyp_6-31g+(d).log.xz

000450609.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450609.td-b3lyp_6-31+g(d).gjf (generated)

000450609.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450609.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450609.mol 000450609.PUBCHEM 000450609.mol (via Jmol)
000450610.b3lyp_6-31g(d).inp

000450610.b3lyp_6-31g(d).qchem.inp (generated)

000450610.b3lyp_6-31g(d).gjf (generated)

000450610.b3lyp_6-31g(d).firefly.inp (generated)

000450610.b3lyp_6-31g(d).smash.inp (generated)

000450610.b3lyp_6-31g(d).nwchem.inp (generated) 000450610.b3lyp_6-31g(d).log.xz 000450610.td-b3lyp_6-31g+(d).inp 000450610.td-b3lyp_6-31g+(d).log.xz

000450610.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450610.td-b3lyp_6-31+g(d).gjf (generated)

000450610.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450610.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450610.mol 000450610.PUBCHEM 000450610.mol (via Jmol)
000450614.b3lyp_6-31g(d).inp

000450614.b3lyp_6-31g(d).qchem.inp (generated)

000450614.b3lyp_6-31g(d).gjf (generated)

000450614.b3lyp_6-31g(d).firefly.inp (generated)

000450614.b3lyp_6-31g(d).smash.inp (generated)

000450614.b3lyp_6-31g(d).nwchem.inp (generated) 000450614.b3lyp_6-31g(d).log.xz 000450614.td-b3lyp_6-31g+(d).inp 000450614.td-b3lyp_6-31g+(d).log.xz

000450614.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450614.td-b3lyp_6-31+g(d).gjf (generated)

000450614.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450614.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450614.mol 000450614.PUBCHEM 000450614.mol (via Jmol)
000450618.b3lyp_6-31g(d).inp

000450618.b3lyp_6-31g(d).qchem.inp (generated)

000450618.b3lyp_6-31g(d).gjf (generated)

000450618.b3lyp_6-31g(d).firefly.inp (generated)

000450618.b3lyp_6-31g(d).smash.inp (generated)

000450618.b3lyp_6-31g(d).nwchem.inp (generated) 000450618.b3lyp_6-31g(d).log.xz 000450618.td-b3lyp_6-31g+(d).inp 000450618.td-b3lyp_6-31g+(d).log.xz

000450618.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450618.td-b3lyp_6-31+g(d).gjf (generated)

000450618.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450618.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450618.mol 000450618.PUBCHEM 000450618.mol (via Jmol)
000450621.b3lyp_6-31g(d).inp

000450621.b3lyp_6-31g(d).qchem.inp (generated)

000450621.b3lyp_6-31g(d).gjf (generated)

000450621.b3lyp_6-31g(d).firefly.inp (generated)

000450621.b3lyp_6-31g(d).smash.inp (generated)

000450621.b3lyp_6-31g(d).nwchem.inp (generated) 000450621.b3lyp_6-31g(d).log.xz 000450621.td-b3lyp_6-31g+(d).inp 000450621.td-b3lyp_6-31g+(d).log.xz

000450621.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450621.td-b3lyp_6-31+g(d).gjf (generated)

000450621.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450621.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450621.mol 000450621.PUBCHEM 000450621.mol (via Jmol)
000450622.b3lyp_6-31g(d).inp

000450622.b3lyp_6-31g(d).qchem.inp (generated)

000450622.b3lyp_6-31g(d).gjf (generated)

000450622.b3lyp_6-31g(d).firefly.inp (generated)

000450622.b3lyp_6-31g(d).smash.inp (generated)

000450622.b3lyp_6-31g(d).nwchem.inp (generated) 000450622.b3lyp_6-31g(d).log.xz 000450622.td-b3lyp_6-31g+(d).inp 000450622.td-b3lyp_6-31g+(d).log.xz

000450622.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450622.td-b3lyp_6-31+g(d).gjf (generated)

000450622.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450622.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450622.mol 000450622.PUBCHEM 000450622.mol (via Jmol)
000450623.b3lyp_6-31g(d).inp

000450623.b3lyp_6-31g(d).qchem.inp (generated)

000450623.b3lyp_6-31g(d).gjf (generated)

000450623.b3lyp_6-31g(d).firefly.inp (generated)

000450623.b3lyp_6-31g(d).smash.inp (generated)

000450623.b3lyp_6-31g(d).nwchem.inp (generated) 000450623.b3lyp_6-31g(d).log.xz 000450623.td-b3lyp_6-31g+(d).inp 000450623.td-b3lyp_6-31g+(d).log.xz

000450623.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450623.td-b3lyp_6-31+g(d).gjf (generated)

000450623.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450623.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450623.mol 000450623.PUBCHEM 000450623.mol (via Jmol)
000450624.b3lyp_6-31g(d).inp

000450624.b3lyp_6-31g(d).qchem.inp (generated)

000450624.b3lyp_6-31g(d).gjf (generated)

000450624.b3lyp_6-31g(d).firefly.inp (generated)

000450624.b3lyp_6-31g(d).smash.inp (generated)

000450624.b3lyp_6-31g(d).nwchem.inp (generated) 000450624.b3lyp_6-31g(d).log.xz 000450624.td-b3lyp_6-31g+(d).inp 000450624.td-b3lyp_6-31g+(d).log.xz

000450624.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450624.td-b3lyp_6-31+g(d).gjf (generated)

000450624.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450624.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450624.mol 000450624.PUBCHEM 000450624.mol (via Jmol)
000450625.b3lyp_6-31g(d).inp

000450625.b3lyp_6-31g(d).qchem.inp (generated)

000450625.b3lyp_6-31g(d).gjf (generated)

000450625.b3lyp_6-31g(d).firefly.inp (generated)

000450625.b3lyp_6-31g(d).smash.inp (generated)

000450625.b3lyp_6-31g(d).nwchem.inp (generated) 000450625.b3lyp_6-31g(d).log.xz 000450625.td-b3lyp_6-31g+(d).inp 000450625.td-b3lyp_6-31g+(d).log.xz

000450625.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450625.td-b3lyp_6-31+g(d).gjf (generated)

000450625.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450625.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450625.mol 000450625.PUBCHEM 000450625.mol (via Jmol)
000450626.b3lyp_6-31g(d).inp

000450626.b3lyp_6-31g(d).qchem.inp (generated)

000450626.b3lyp_6-31g(d).gjf (generated)

000450626.b3lyp_6-31g(d).firefly.inp (generated)

000450626.b3lyp_6-31g(d).smash.inp (generated)

000450626.b3lyp_6-31g(d).nwchem.inp (generated) 000450626.b3lyp_6-31g(d).log.xz 000450626.td-b3lyp_6-31g+(d).inp 000450626.td-b3lyp_6-31g+(d).log.xz

000450626.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450626.td-b3lyp_6-31+g(d).gjf (generated)

000450626.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450626.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450626.mol 000450626.PUBCHEM 000450626.mol (via Jmol)
000450629.b3lyp_6-31g(d).inp

000450629.b3lyp_6-31g(d).qchem.inp (generated)

000450629.b3lyp_6-31g(d).gjf (generated)

000450629.b3lyp_6-31g(d).firefly.inp (generated)

000450629.b3lyp_6-31g(d).smash.inp (generated)

000450629.b3lyp_6-31g(d).nwchem.inp (generated) 000450629.b3lyp_6-31g(d).log.xz 000450629.td-b3lyp_6-31g+(d).inp 000450629.td-b3lyp_6-31g+(d).log.xz

000450629.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450629.td-b3lyp_6-31+g(d).gjf (generated)

000450629.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450629.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450629.mol 000450629.PUBCHEM 000450629.mol (via Jmol)
000450630.b3lyp_6-31g(d).inp

000450630.b3lyp_6-31g(d).qchem.inp (generated)

000450630.b3lyp_6-31g(d).gjf (generated)

000450630.b3lyp_6-31g(d).firefly.inp (generated)

000450630.b3lyp_6-31g(d).smash.inp (generated)

000450630.b3lyp_6-31g(d).nwchem.inp (generated) 000450630.b3lyp_6-31g(d).log.xz 000450630.td-b3lyp_6-31g+(d).inp 000450630.td-b3lyp_6-31g+(d).log.xz

000450630.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450630.td-b3lyp_6-31+g(d).gjf (generated)

000450630.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450630.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450630.mol 000450630.PUBCHEM 000450630.mol (via Jmol)
000450631.b3lyp_6-31g(d).inp

000450631.b3lyp_6-31g(d).qchem.inp (generated)

000450631.b3lyp_6-31g(d).gjf (generated)

000450631.b3lyp_6-31g(d).firefly.inp (generated)

000450631.b3lyp_6-31g(d).smash.inp (generated)

000450631.b3lyp_6-31g(d).nwchem.inp (generated) 000450631.b3lyp_6-31g(d).log.xz 000450631.td-b3lyp_6-31g+(d).inp 000450631.td-b3lyp_6-31g+(d).log.xz

000450631.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450631.td-b3lyp_6-31+g(d).gjf (generated)

000450631.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450631.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450631.mol 000450631.PUBCHEM 000450631.mol (via Jmol)
000450632.b3lyp_6-31g(d).inp

000450632.b3lyp_6-31g(d).qchem.inp (generated)

000450632.b3lyp_6-31g(d).gjf (generated)

000450632.b3lyp_6-31g(d).firefly.inp (generated)

000450632.b3lyp_6-31g(d).smash.inp (generated)

000450632.b3lyp_6-31g(d).nwchem.inp (generated) 000450632.b3lyp_6-31g(d).log.xz 000450632.td-b3lyp_6-31g+(d).inp 000450632.td-b3lyp_6-31g+(d).log.xz

000450632.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450632.td-b3lyp_6-31+g(d).gjf (generated)

000450632.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450632.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450632.mol 000450632.PUBCHEM 000450632.mol (via Jmol)
000450633.b3lyp_6-31g(d).inp

000450633.b3lyp_6-31g(d).qchem.inp (generated)

000450633.b3lyp_6-31g(d).gjf (generated)

000450633.b3lyp_6-31g(d).firefly.inp (generated)

000450633.b3lyp_6-31g(d).smash.inp (generated)

000450633.b3lyp_6-31g(d).nwchem.inp (generated) 000450633.b3lyp_6-31g(d).log.xz 000450633.td-b3lyp_6-31g+(d).inp 000450633.td-b3lyp_6-31g+(d).log.xz

000450633.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450633.td-b3lyp_6-31+g(d).gjf (generated)

000450633.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450633.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450633.mol 000450633.PUBCHEM 000450633.mol (via Jmol)
000450638.b3lyp_6-31g(d).inp

000450638.b3lyp_6-31g(d).qchem.inp (generated)

000450638.b3lyp_6-31g(d).gjf (generated)

000450638.b3lyp_6-31g(d).firefly.inp (generated)

000450638.b3lyp_6-31g(d).smash.inp (generated)

000450638.b3lyp_6-31g(d).nwchem.inp (generated) 000450638.b3lyp_6-31g(d).log.xz 000450638.td-b3lyp_6-31g+(d).inp 000450638.td-b3lyp_6-31g+(d).log.xz

000450638.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450638.td-b3lyp_6-31+g(d).gjf (generated)

000450638.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450638.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450638.mol 000450638.PUBCHEM 000450638.mol (via Jmol)
000450639.b3lyp_6-31g(d).inp

000450639.b3lyp_6-31g(d).qchem.inp (generated)

000450639.b3lyp_6-31g(d).gjf (generated)

000450639.b3lyp_6-31g(d).firefly.inp (generated)

000450639.b3lyp_6-31g(d).smash.inp (generated)

000450639.b3lyp_6-31g(d).nwchem.inp (generated) 000450639.b3lyp_6-31g(d).log.xz 000450639.td-b3lyp_6-31g+(d).inp 000450639.td-b3lyp_6-31g+(d).log.xz

000450639.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450639.td-b3lyp_6-31+g(d).gjf (generated)

000450639.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450639.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450639.mol 000450639.PUBCHEM 000450639.mol (via Jmol)
000450642.b3lyp_6-31g(d).inp

000450642.b3lyp_6-31g(d).qchem.inp (generated)

000450642.b3lyp_6-31g(d).gjf (generated)

000450642.b3lyp_6-31g(d).firefly.inp (generated)

000450642.b3lyp_6-31g(d).smash.inp (generated)

000450642.b3lyp_6-31g(d).nwchem.inp (generated) 000450642.b3lyp_6-31g(d).log.xz 000450642.td-b3lyp_6-31g+(d).inp 000450642.td-b3lyp_6-31g+(d).log.xz

000450642.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450642.td-b3lyp_6-31+g(d).gjf (generated)

000450642.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450642.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450642.mol 000450642.PUBCHEM 000450642.mol (via Jmol)
000450643.b3lyp_6-31g(d).inp

000450643.b3lyp_6-31g(d).qchem.inp (generated)

000450643.b3lyp_6-31g(d).gjf (generated)

000450643.b3lyp_6-31g(d).firefly.inp (generated)

000450643.b3lyp_6-31g(d).smash.inp (generated)

000450643.b3lyp_6-31g(d).nwchem.inp (generated) 000450643.b3lyp_6-31g(d).log.xz 000450643.td-b3lyp_6-31g+(d).inp 000450643.td-b3lyp_6-31g+(d).log.xz

000450643.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450643.td-b3lyp_6-31+g(d).gjf (generated)

000450643.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450643.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450643.mol 000450643.PUBCHEM 000450643.mol (via Jmol)
000450644.b3lyp_6-31g(d).inp

000450644.b3lyp_6-31g(d).qchem.inp (generated)

000450644.b3lyp_6-31g(d).gjf (generated)

000450644.b3lyp_6-31g(d).firefly.inp (generated)

000450644.b3lyp_6-31g(d).smash.inp (generated)

000450644.b3lyp_6-31g(d).nwchem.inp (generated) 000450644.b3lyp_6-31g(d).log.xz 000450644.td-b3lyp_6-31g+(d).inp 000450644.td-b3lyp_6-31g+(d).log.xz

000450644.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450644.td-b3lyp_6-31+g(d).gjf (generated)

000450644.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450644.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450644.mol 000450644.PUBCHEM 000450644.mol (via Jmol)
000450645.b3lyp_6-31g(d).inp

000450645.b3lyp_6-31g(d).qchem.inp (generated)

000450645.b3lyp_6-31g(d).gjf (generated)

000450645.b3lyp_6-31g(d).firefly.inp (generated)

000450645.b3lyp_6-31g(d).smash.inp (generated)

000450645.b3lyp_6-31g(d).nwchem.inp (generated) 000450645.b3lyp_6-31g(d).log.xz 000450645.td-b3lyp_6-31g+(d).inp 000450645.td-b3lyp_6-31g+(d).log.xz

000450645.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450645.td-b3lyp_6-31+g(d).gjf (generated)

000450645.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450645.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450645.mol 000450645.PUBCHEM 000450645.mol (via Jmol)
000450646.b3lyp_6-31g(d).inp

000450646.b3lyp_6-31g(d).qchem.inp (generated)

000450646.b3lyp_6-31g(d).gjf (generated)

000450646.b3lyp_6-31g(d).firefly.inp (generated)

000450646.b3lyp_6-31g(d).smash.inp (generated)

000450646.b3lyp_6-31g(d).nwchem.inp (generated) 000450646.b3lyp_6-31g(d).log.xz 000450646.td-b3lyp_6-31g+(d).inp 000450646.td-b3lyp_6-31g+(d).log.xz

000450646.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450646.td-b3lyp_6-31+g(d).gjf (generated)

000450646.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450646.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450646.mol 000450646.PUBCHEM 000450646.mol (via Jmol)
000450648.b3lyp_6-31g(d).inp

000450648.b3lyp_6-31g(d).qchem.inp (generated)

000450648.b3lyp_6-31g(d).gjf (generated)

000450648.b3lyp_6-31g(d).firefly.inp (generated)

000450648.b3lyp_6-31g(d).smash.inp (generated)

000450648.b3lyp_6-31g(d).nwchem.inp (generated) 000450648.b3lyp_6-31g(d).log.xz 000450648.td-b3lyp_6-31g+(d).inp 000450648.td-b3lyp_6-31g+(d).log.xz

000450648.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450648.td-b3lyp_6-31+g(d).gjf (generated)

000450648.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450648.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450648.mol 000450648.PUBCHEM 000450648.mol (via Jmol)
000450649.b3lyp_6-31g(d).inp

000450649.b3lyp_6-31g(d).qchem.inp (generated)

000450649.b3lyp_6-31g(d).gjf (generated)

000450649.b3lyp_6-31g(d).firefly.inp (generated)

000450649.b3lyp_6-31g(d).smash.inp (generated)

000450649.b3lyp_6-31g(d).nwchem.inp (generated) 000450649.b3lyp_6-31g(d).log.xz 000450649.td-b3lyp_6-31g+(d).inp 000450649.td-b3lyp_6-31g+(d).log.xz

000450649.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450649.td-b3lyp_6-31+g(d).gjf (generated)

000450649.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450649.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450649.mol 000450649.PUBCHEM 000450649.mol (via Jmol)
000450650.b3lyp_6-31g(d).inp

000450650.b3lyp_6-31g(d).qchem.inp (generated)

000450650.b3lyp_6-31g(d).gjf (generated)

000450650.b3lyp_6-31g(d).firefly.inp (generated)

000450650.b3lyp_6-31g(d).smash.inp (generated)

000450650.b3lyp_6-31g(d).nwchem.inp (generated) 000450650.b3lyp_6-31g(d).log.xz 000450650.td-b3lyp_6-31g+(d).inp 000450650.td-b3lyp_6-31g+(d).log.xz

000450650.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450650.td-b3lyp_6-31+g(d).gjf (generated)

000450650.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450650.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450650.mol 000450650.PUBCHEM 000450650.mol (via Jmol)
000450653.b3lyp_6-31g(d).inp

000450653.b3lyp_6-31g(d).qchem.inp (generated)

000450653.b3lyp_6-31g(d).gjf (generated)

000450653.b3lyp_6-31g(d).firefly.inp (generated)

000450653.b3lyp_6-31g(d).smash.inp (generated)

000450653.b3lyp_6-31g(d).nwchem.inp (generated) 000450653.b3lyp_6-31g(d).log.xz 000450653.td-b3lyp_6-31g+(d).inp 000450653.td-b3lyp_6-31g+(d).log.xz

000450653.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450653.td-b3lyp_6-31+g(d).gjf (generated)

000450653.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450653.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450653.mol 000450653.PUBCHEM 000450653.mol (via Jmol)
000450655.b3lyp_6-31g(d).inp

000450655.b3lyp_6-31g(d).qchem.inp (generated)

000450655.b3lyp_6-31g(d).gjf (generated)

000450655.b3lyp_6-31g(d).firefly.inp (generated)

000450655.b3lyp_6-31g(d).smash.inp (generated)

000450655.b3lyp_6-31g(d).nwchem.inp (generated) 000450655.b3lyp_6-31g(d).log.xz 000450655.td-b3lyp_6-31g+(d).inp 000450655.td-b3lyp_6-31g+(d).log.xz

000450655.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450655.td-b3lyp_6-31+g(d).gjf (generated)

000450655.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450655.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450655.mol 000450655.PUBCHEM 000450655.mol (via Jmol)
000450656.b3lyp_6-31g(d).inp

000450656.b3lyp_6-31g(d).qchem.inp (generated)

000450656.b3lyp_6-31g(d).gjf (generated)

000450656.b3lyp_6-31g(d).firefly.inp (generated)

000450656.b3lyp_6-31g(d).smash.inp (generated)

000450656.b3lyp_6-31g(d).nwchem.inp (generated) 000450656.b3lyp_6-31g(d).log.xz 000450656.td-b3lyp_6-31g+(d).inp 000450656.td-b3lyp_6-31g+(d).log.xz

000450656.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450656.td-b3lyp_6-31+g(d).gjf (generated)

000450656.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450656.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450656.mol 000450656.PUBCHEM 000450656.mol (via Jmol)
000450657.b3lyp_6-31g(d).inp

000450657.b3lyp_6-31g(d).qchem.inp (generated)

000450657.b3lyp_6-31g(d).gjf (generated)

000450657.b3lyp_6-31g(d).firefly.inp (generated)

000450657.b3lyp_6-31g(d).smash.inp (generated)

000450657.b3lyp_6-31g(d).nwchem.inp (generated) 000450657.b3lyp_6-31g(d).log.xz 000450657.td-b3lyp_6-31g+(d).inp 000450657.td-b3lyp_6-31g+(d).log.xz

000450657.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450657.td-b3lyp_6-31+g(d).gjf (generated)

000450657.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450657.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450657.mol 000450657.PUBCHEM 000450657.mol (via Jmol)
000450659.b3lyp_6-31g(d).inp

000450659.b3lyp_6-31g(d).qchem.inp (generated)

000450659.b3lyp_6-31g(d).gjf (generated)

000450659.b3lyp_6-31g(d).firefly.inp (generated)

000450659.b3lyp_6-31g(d).smash.inp (generated)

000450659.b3lyp_6-31g(d).nwchem.inp (generated) 000450659.b3lyp_6-31g(d).log.xz 000450659.td-b3lyp_6-31g+(d).inp 000450659.td-b3lyp_6-31g+(d).log.xz

000450659.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450659.td-b3lyp_6-31+g(d).gjf (generated)

000450659.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450659.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450659.mol 000450659.PUBCHEM 000450659.mol (via Jmol)
000450660.b3lyp_6-31g(d).inp

000450660.b3lyp_6-31g(d).qchem.inp (generated)

000450660.b3lyp_6-31g(d).gjf (generated)

000450660.b3lyp_6-31g(d).firefly.inp (generated)

000450660.b3lyp_6-31g(d).smash.inp (generated)

000450660.b3lyp_6-31g(d).nwchem.inp (generated) 000450660.b3lyp_6-31g(d).log.xz 000450660.td-b3lyp_6-31g+(d).inp 000450660.td-b3lyp_6-31g+(d).log.xz

000450660.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450660.td-b3lyp_6-31+g(d).gjf (generated)

000450660.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450660.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450660.mol 000450660.PUBCHEM 000450660.mol (via Jmol)
000450661.b3lyp_6-31g(d).inp

000450661.b3lyp_6-31g(d).qchem.inp (generated)

000450661.b3lyp_6-31g(d).gjf (generated)

000450661.b3lyp_6-31g(d).firefly.inp (generated)

000450661.b3lyp_6-31g(d).smash.inp (generated)

000450661.b3lyp_6-31g(d).nwchem.inp (generated) 000450661.b3lyp_6-31g(d).log.xz 000450661.td-b3lyp_6-31g+(d).inp 000450661.td-b3lyp_6-31g+(d).log.xz

000450661.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450661.td-b3lyp_6-31+g(d).gjf (generated)

000450661.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450661.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450661.mol 000450661.PUBCHEM 000450661.mol (via Jmol)
000450662.b3lyp_6-31g(d).inp

000450662.b3lyp_6-31g(d).qchem.inp (generated)

000450662.b3lyp_6-31g(d).gjf (generated)

000450662.b3lyp_6-31g(d).firefly.inp (generated)

000450662.b3lyp_6-31g(d).smash.inp (generated)

000450662.b3lyp_6-31g(d).nwchem.inp (generated) 000450662.b3lyp_6-31g(d).log.xz 000450662.td-b3lyp_6-31g+(d).inp 000450662.td-b3lyp_6-31g+(d).log.xz

000450662.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450662.td-b3lyp_6-31+g(d).gjf (generated)

000450662.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450662.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450662.mol 000450662.PUBCHEM 000450662.mol (via Jmol)
000450665.b3lyp_6-31g(d).inp

000450665.b3lyp_6-31g(d).qchem.inp (generated)

000450665.b3lyp_6-31g(d).gjf (generated)

000450665.b3lyp_6-31g(d).firefly.inp (generated)

000450665.b3lyp_6-31g(d).smash.inp (generated)

000450665.b3lyp_6-31g(d).nwchem.inp (generated) 000450665.b3lyp_6-31g(d).log.xz 000450665.td-b3lyp_6-31g+(d).inp 000450665.td-b3lyp_6-31g+(d).log.xz

000450665.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450665.td-b3lyp_6-31+g(d).gjf (generated)

000450665.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450665.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450665.mol 000450665.PUBCHEM 000450665.mol (via Jmol)
000450666.b3lyp_6-31g(d).inp

000450666.b3lyp_6-31g(d).qchem.inp (generated)

000450666.b3lyp_6-31g(d).gjf (generated)

000450666.b3lyp_6-31g(d).firefly.inp (generated)

000450666.b3lyp_6-31g(d).smash.inp (generated)

000450666.b3lyp_6-31g(d).nwchem.inp (generated) 000450666.b3lyp_6-31g(d).log.xz 000450666.td-b3lyp_6-31g+(d).inp 000450666.td-b3lyp_6-31g+(d).log.xz

000450666.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450666.td-b3lyp_6-31+g(d).gjf (generated)

000450666.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450666.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450666.mol 000450666.PUBCHEM 000450666.mol (via Jmol)
000450671.b3lyp_6-31g(d).inp

000450671.b3lyp_6-31g(d).qchem.inp (generated)

000450671.b3lyp_6-31g(d).gjf (generated)

000450671.b3lyp_6-31g(d).firefly.inp (generated)

000450671.b3lyp_6-31g(d).smash.inp (generated)

000450671.b3lyp_6-31g(d).nwchem.inp (generated) 000450671.b3lyp_6-31g(d).log.xz 000450671.td-b3lyp_6-31g+(d).inp 000450671.td-b3lyp_6-31g+(d).log.xz

000450671.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450671.td-b3lyp_6-31+g(d).gjf (generated)

000450671.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450671.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450671.mol 000450671.PUBCHEM 000450671.mol (via Jmol)
000450676.b3lyp_6-31g(d).inp

000450676.b3lyp_6-31g(d).qchem.inp (generated)

000450676.b3lyp_6-31g(d).gjf (generated)

000450676.b3lyp_6-31g(d).firefly.inp (generated)

000450676.b3lyp_6-31g(d).smash.inp (generated)

000450676.b3lyp_6-31g(d).nwchem.inp (generated) 000450676.b3lyp_6-31g(d).log.xz 000450676.td-b3lyp_6-31g+(d).inp 000450676.td-b3lyp_6-31g+(d).log.xz

000450676.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450676.td-b3lyp_6-31+g(d).gjf (generated)

000450676.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450676.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450676.mol 000450676.PUBCHEM 000450676.mol (via Jmol)
000450677.b3lyp_6-31g(d).inp

000450677.b3lyp_6-31g(d).qchem.inp (generated)

000450677.b3lyp_6-31g(d).gjf (generated)

000450677.b3lyp_6-31g(d).firefly.inp (generated)

000450677.b3lyp_6-31g(d).smash.inp (generated)

000450677.b3lyp_6-31g(d).nwchem.inp (generated) 000450677.b3lyp_6-31g(d).log.xz 000450677.td-b3lyp_6-31g+(d).inp 000450677.td-b3lyp_6-31g+(d).log.xz

000450677.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450677.td-b3lyp_6-31+g(d).gjf (generated)

000450677.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450677.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450677.mol 000450677.PUBCHEM 000450677.mol (via Jmol)
000450680.b3lyp_6-31g(d).inp

000450680.b3lyp_6-31g(d).qchem.inp (generated)

000450680.b3lyp_6-31g(d).gjf (generated)

000450680.b3lyp_6-31g(d).firefly.inp (generated)

000450680.b3lyp_6-31g(d).smash.inp (generated)

000450680.b3lyp_6-31g(d).nwchem.inp (generated) 000450680.b3lyp_6-31g(d).log.xz 000450680.td-b3lyp_6-31g+(d).inp 000450680.td-b3lyp_6-31g+(d).log.xz

000450680.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450680.td-b3lyp_6-31+g(d).gjf (generated)

000450680.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450680.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450680.mol 000450680.PUBCHEM 000450680.mol (via Jmol)
000450681.b3lyp_6-31g(d).inp

000450681.b3lyp_6-31g(d).qchem.inp (generated)

000450681.b3lyp_6-31g(d).gjf (generated)

000450681.b3lyp_6-31g(d).firefly.inp (generated)

000450681.b3lyp_6-31g(d).smash.inp (generated)

000450681.b3lyp_6-31g(d).nwchem.inp (generated) 000450681.b3lyp_6-31g(d).log.xz 000450681.td-b3lyp_6-31g+(d).inp 000450681.td-b3lyp_6-31g+(d).log.xz

000450681.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450681.td-b3lyp_6-31+g(d).gjf (generated)

000450681.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450681.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450681.mol 000450681.PUBCHEM 000450681.mol (via Jmol)
000450682.b3lyp_6-31g(d).inp

000450682.b3lyp_6-31g(d).qchem.inp (generated)

000450682.b3lyp_6-31g(d).gjf (generated)

000450682.b3lyp_6-31g(d).firefly.inp (generated)

000450682.b3lyp_6-31g(d).smash.inp (generated)

000450682.b3lyp_6-31g(d).nwchem.inp (generated) 000450682.b3lyp_6-31g(d).log.xz 000450682.td-b3lyp_6-31g+(d).inp 000450682.td-b3lyp_6-31g+(d).log.xz

000450682.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450682.td-b3lyp_6-31+g(d).gjf (generated)

000450682.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450682.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450682.mol 000450682.PUBCHEM 000450682.mol (via Jmol)
000450683.b3lyp_6-31g(d).inp

000450683.b3lyp_6-31g(d).qchem.inp (generated)

000450683.b3lyp_6-31g(d).gjf (generated)

000450683.b3lyp_6-31g(d).firefly.inp (generated)

000450683.b3lyp_6-31g(d).smash.inp (generated)

000450683.b3lyp_6-31g(d).nwchem.inp (generated) 000450683.b3lyp_6-31g(d).log.xz 000450683.td-b3lyp_6-31g+(d).inp 000450683.td-b3lyp_6-31g+(d).log.xz

000450683.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450683.td-b3lyp_6-31+g(d).gjf (generated)

000450683.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450683.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450683.mol 000450683.PUBCHEM 000450683.mol (via Jmol)
000450684.b3lyp_6-31g(d).inp

000450684.b3lyp_6-31g(d).qchem.inp (generated)

000450684.b3lyp_6-31g(d).gjf (generated)

000450684.b3lyp_6-31g(d).firefly.inp (generated)

000450684.b3lyp_6-31g(d).smash.inp (generated)

000450684.b3lyp_6-31g(d).nwchem.inp (generated) 000450684.b3lyp_6-31g(d).log.xz 000450684.td-b3lyp_6-31g+(d).inp 000450684.td-b3lyp_6-31g+(d).log.xz

000450684.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450684.td-b3lyp_6-31+g(d).gjf (generated)

000450684.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450684.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450684.mol 000450684.PUBCHEM 000450684.mol (via Jmol)
000450687.b3lyp_6-31g(d).inp

000450687.b3lyp_6-31g(d).qchem.inp (generated)

000450687.b3lyp_6-31g(d).gjf (generated)

000450687.b3lyp_6-31g(d).firefly.inp (generated)

000450687.b3lyp_6-31g(d).smash.inp (generated)

000450687.b3lyp_6-31g(d).nwchem.inp (generated) 000450687.b3lyp_6-31g(d).log.xz 000450687.td-b3lyp_6-31g+(d).inp 000450687.td-b3lyp_6-31g+(d).log.xz

000450687.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450687.td-b3lyp_6-31+g(d).gjf (generated)

000450687.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450687.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450687.mol 000450687.PUBCHEM 000450687.mol (via Jmol)
000450688.b3lyp_6-31g(d).inp

000450688.b3lyp_6-31g(d).qchem.inp (generated)

000450688.b3lyp_6-31g(d).gjf (generated)

000450688.b3lyp_6-31g(d).firefly.inp (generated)

000450688.b3lyp_6-31g(d).smash.inp (generated)

000450688.b3lyp_6-31g(d).nwchem.inp (generated) 000450688.b3lyp_6-31g(d).log.xz 000450688.td-b3lyp_6-31g+(d).inp 000450688.td-b3lyp_6-31g+(d).log.xz

000450688.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450688.td-b3lyp_6-31+g(d).gjf (generated)

000450688.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450688.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450688.mol 000450688.PUBCHEM 000450688.mol (via Jmol)
000450689.b3lyp_6-31g(d).inp

000450689.b3lyp_6-31g(d).qchem.inp (generated)

000450689.b3lyp_6-31g(d).gjf (generated)

000450689.b3lyp_6-31g(d).firefly.inp (generated)

000450689.b3lyp_6-31g(d).smash.inp (generated)

000450689.b3lyp_6-31g(d).nwchem.inp (generated) 000450689.b3lyp_6-31g(d).log.xz 000450689.td-b3lyp_6-31g+(d).inp 000450689.td-b3lyp_6-31g+(d).log.xz

000450689.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450689.td-b3lyp_6-31+g(d).gjf (generated)

000450689.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450689.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450689.mol 000450689.PUBCHEM 000450689.mol (via Jmol)
000450697.b3lyp_6-31g(d).inp

000450697.b3lyp_6-31g(d).qchem.inp (generated)

000450697.b3lyp_6-31g(d).gjf (generated)

000450697.b3lyp_6-31g(d).firefly.inp (generated)

000450697.b3lyp_6-31g(d).smash.inp (generated)

000450697.b3lyp_6-31g(d).nwchem.inp (generated) 000450697.b3lyp_6-31g(d).log.xz 000450697.td-b3lyp_6-31g+(d).inp 000450697.td-b3lyp_6-31g+(d).log.xz

000450697.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450697.td-b3lyp_6-31+g(d).gjf (generated)

000450697.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450697.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450697.mol 000450697.PUBCHEM 000450697.mol (via Jmol)
000450698.b3lyp_6-31g(d).inp

000450698.b3lyp_6-31g(d).qchem.inp (generated)

000450698.b3lyp_6-31g(d).gjf (generated)

000450698.b3lyp_6-31g(d).firefly.inp (generated)

000450698.b3lyp_6-31g(d).smash.inp (generated)

000450698.b3lyp_6-31g(d).nwchem.inp (generated) 000450698.b3lyp_6-31g(d).log.xz 000450698.td-b3lyp_6-31g+(d).inp 000450698.td-b3lyp_6-31g+(d).log.xz

000450698.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450698.td-b3lyp_6-31+g(d).gjf (generated)

000450698.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450698.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450698.mol 000450698.PUBCHEM 000450698.mol (via Jmol)
000450699.b3lyp_6-31g(d).inp

000450699.b3lyp_6-31g(d).qchem.inp (generated)

000450699.b3lyp_6-31g(d).gjf (generated)

000450699.b3lyp_6-31g(d).firefly.inp (generated)

000450699.b3lyp_6-31g(d).smash.inp (generated)

000450699.b3lyp_6-31g(d).nwchem.inp (generated) 000450699.b3lyp_6-31g(d).log.xz 000450699.td-b3lyp_6-31g+(d).inp 000450699.td-b3lyp_6-31g+(d).log.xz

000450699.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450699.td-b3lyp_6-31+g(d).gjf (generated)

000450699.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450699.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450699.mol 000450699.PUBCHEM 000450699.mol (via Jmol)
000450700.b3lyp_6-31g(d).inp

000450700.b3lyp_6-31g(d).qchem.inp (generated)

000450700.b3lyp_6-31g(d).gjf (generated)

000450700.b3lyp_6-31g(d).firefly.inp (generated)

000450700.b3lyp_6-31g(d).smash.inp (generated)

000450700.b3lyp_6-31g(d).nwchem.inp (generated) 000450700.b3lyp_6-31g(d).log.xz 000450700.td-b3lyp_6-31g+(d).inp 000450700.td-b3lyp_6-31g+(d).log.xz

000450700.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450700.td-b3lyp_6-31+g(d).gjf (generated)

000450700.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450700.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450700.mol 000450700.PUBCHEM 000450700.mol (via Jmol)
000450701.b3lyp_6-31g(d).inp

000450701.b3lyp_6-31g(d).qchem.inp (generated)

000450701.b3lyp_6-31g(d).gjf (generated)

000450701.b3lyp_6-31g(d).firefly.inp (generated)

000450701.b3lyp_6-31g(d).smash.inp (generated)

000450701.b3lyp_6-31g(d).nwchem.inp (generated) 000450701.b3lyp_6-31g(d).log.xz 000450701.td-b3lyp_6-31g+(d).inp 000450701.td-b3lyp_6-31g+(d).log.xz

000450701.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450701.td-b3lyp_6-31+g(d).gjf (generated)

000450701.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450701.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450701.mol 000450701.PUBCHEM 000450701.mol (via Jmol)
000450702.b3lyp_6-31g(d).inp

000450702.b3lyp_6-31g(d).qchem.inp (generated)

000450702.b3lyp_6-31g(d).gjf (generated)

000450702.b3lyp_6-31g(d).firefly.inp (generated)

000450702.b3lyp_6-31g(d).smash.inp (generated)

000450702.b3lyp_6-31g(d).nwchem.inp (generated) 000450702.b3lyp_6-31g(d).log.xz 000450702.td-b3lyp_6-31g+(d).inp 000450702.td-b3lyp_6-31g+(d).log.xz

000450702.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450702.td-b3lyp_6-31+g(d).gjf (generated)

000450702.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450702.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450702.mol 000450702.PUBCHEM 000450702.mol (via Jmol)
000450704.b3lyp_6-31g(d).inp

000450704.b3lyp_6-31g(d).qchem.inp (generated)

000450704.b3lyp_6-31g(d).gjf (generated)

000450704.b3lyp_6-31g(d).firefly.inp (generated)

000450704.b3lyp_6-31g(d).smash.inp (generated)

000450704.b3lyp_6-31g(d).nwchem.inp (generated) 000450704.b3lyp_6-31g(d).log.xz 000450704.td-b3lyp_6-31g+(d).inp 000450704.td-b3lyp_6-31g+(d).log.xz

000450704.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450704.td-b3lyp_6-31+g(d).gjf (generated)

000450704.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450704.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450704.mol 000450704.PUBCHEM 000450704.mol (via Jmol)
000450705.b3lyp_6-31g(d).inp

000450705.b3lyp_6-31g(d).qchem.inp (generated)

000450705.b3lyp_6-31g(d).gjf (generated)

000450705.b3lyp_6-31g(d).firefly.inp (generated)

000450705.b3lyp_6-31g(d).smash.inp (generated)

000450705.b3lyp_6-31g(d).nwchem.inp (generated) 000450705.b3lyp_6-31g(d).log.xz 000450705.td-b3lyp_6-31g+(d).inp 000450705.td-b3lyp_6-31g+(d).log.xz

000450705.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450705.td-b3lyp_6-31+g(d).gjf (generated)

000450705.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450705.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450705.mol 000450705.PUBCHEM 000450705.mol (via Jmol)
000450706.b3lyp_6-31g(d).inp

000450706.b3lyp_6-31g(d).qchem.inp (generated)

000450706.b3lyp_6-31g(d).gjf (generated)

000450706.b3lyp_6-31g(d).firefly.inp (generated)

000450706.b3lyp_6-31g(d).smash.inp (generated)

000450706.b3lyp_6-31g(d).nwchem.inp (generated) 000450706.b3lyp_6-31g(d).log.xz 000450706.td-b3lyp_6-31g+(d).inp 000450706.td-b3lyp_6-31g+(d).log.xz

000450706.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450706.td-b3lyp_6-31+g(d).gjf (generated)

000450706.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450706.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450706.mol 000450706.PUBCHEM 000450706.mol (via Jmol)
000450707.b3lyp_6-31g(d).inp

000450707.b3lyp_6-31g(d).qchem.inp (generated)

000450707.b3lyp_6-31g(d).gjf (generated)

000450707.b3lyp_6-31g(d).firefly.inp (generated)

000450707.b3lyp_6-31g(d).smash.inp (generated)

000450707.b3lyp_6-31g(d).nwchem.inp (generated) 000450707.b3lyp_6-31g(d).log.xz 000450707.td-b3lyp_6-31g+(d).inp 000450707.td-b3lyp_6-31g+(d).log.xz

000450707.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450707.td-b3lyp_6-31+g(d).gjf (generated)

000450707.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450707.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450707.mol 000450707.PUBCHEM 000450707.mol (via Jmol)
000450708.b3lyp_6-31g(d).inp

000450708.b3lyp_6-31g(d).qchem.inp (generated)

000450708.b3lyp_6-31g(d).gjf (generated)

000450708.b3lyp_6-31g(d).firefly.inp (generated)

000450708.b3lyp_6-31g(d).smash.inp (generated)

000450708.b3lyp_6-31g(d).nwchem.inp (generated) 000450708.b3lyp_6-31g(d).log.xz 000450708.td-b3lyp_6-31g+(d).inp 000450708.td-b3lyp_6-31g+(d).log.xz

000450708.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450708.td-b3lyp_6-31+g(d).gjf (generated)

000450708.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450708.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450708.mol 000450708.PUBCHEM 000450708.mol (via Jmol)
000450709.b3lyp_6-31g(d).inp

000450709.b3lyp_6-31g(d).qchem.inp (generated)

000450709.b3lyp_6-31g(d).gjf (generated)

000450709.b3lyp_6-31g(d).firefly.inp (generated)

000450709.b3lyp_6-31g(d).smash.inp (generated)

000450709.b3lyp_6-31g(d).nwchem.inp (generated) 000450709.b3lyp_6-31g(d).log.xz 000450709.td-b3lyp_6-31g+(d).inp 000450709.td-b3lyp_6-31g+(d).log.xz

000450709.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450709.td-b3lyp_6-31+g(d).gjf (generated)

000450709.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450709.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450709.mol 000450709.PUBCHEM 000450709.mol (via Jmol)
000450710.b3lyp_6-31g(d).inp

000450710.b3lyp_6-31g(d).qchem.inp (generated)

000450710.b3lyp_6-31g(d).gjf (generated)

000450710.b3lyp_6-31g(d).firefly.inp (generated)

000450710.b3lyp_6-31g(d).smash.inp (generated)

000450710.b3lyp_6-31g(d).nwchem.inp (generated) 000450710.b3lyp_6-31g(d).log.xz 000450710.td-b3lyp_6-31g+(d).inp 000450710.td-b3lyp_6-31g+(d).log.xz

000450710.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450710.td-b3lyp_6-31+g(d).gjf (generated)

000450710.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450710.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450710.mol 000450710.PUBCHEM 000450710.mol (via Jmol)
000450711.b3lyp_6-31g(d).inp

000450711.b3lyp_6-31g(d).qchem.inp (generated)

000450711.b3lyp_6-31g(d).gjf (generated)

000450711.b3lyp_6-31g(d).firefly.inp (generated)

000450711.b3lyp_6-31g(d).smash.inp (generated)

000450711.b3lyp_6-31g(d).nwchem.inp (generated) 000450711.b3lyp_6-31g(d).log.xz 000450711.td-b3lyp_6-31g+(d).inp 000450711.td-b3lyp_6-31g+(d).log.xz

000450711.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450711.td-b3lyp_6-31+g(d).gjf (generated)

000450711.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450711.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450711.mol 000450711.PUBCHEM 000450711.mol (via Jmol)
000450713.b3lyp_6-31g(d).inp

000450713.b3lyp_6-31g(d).qchem.inp (generated)

000450713.b3lyp_6-31g(d).gjf (generated)

000450713.b3lyp_6-31g(d).firefly.inp (generated)

000450713.b3lyp_6-31g(d).smash.inp (generated)

000450713.b3lyp_6-31g(d).nwchem.inp (generated) 000450713.b3lyp_6-31g(d).log.xz 000450713.td-b3lyp_6-31g+(d).inp 000450713.td-b3lyp_6-31g+(d).log.xz

000450713.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450713.td-b3lyp_6-31+g(d).gjf (generated)

000450713.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450713.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450713.mol 000450713.PUBCHEM 000450713.mol (via Jmol)
000450714.b3lyp_6-31g(d).inp

000450714.b3lyp_6-31g(d).qchem.inp (generated)

000450714.b3lyp_6-31g(d).gjf (generated)

000450714.b3lyp_6-31g(d).firefly.inp (generated)

000450714.b3lyp_6-31g(d).smash.inp (generated)

000450714.b3lyp_6-31g(d).nwchem.inp (generated) 000450714.b3lyp_6-31g(d).log.xz 000450714.td-b3lyp_6-31g+(d).inp 000450714.td-b3lyp_6-31g+(d).log.xz

000450714.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450714.td-b3lyp_6-31+g(d).gjf (generated)

000450714.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450714.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450714.mol 000450714.PUBCHEM 000450714.mol (via Jmol)
000450715.b3lyp_6-31g(d).inp

000450715.b3lyp_6-31g(d).qchem.inp (generated)

000450715.b3lyp_6-31g(d).gjf (generated)

000450715.b3lyp_6-31g(d).firefly.inp (generated)

000450715.b3lyp_6-31g(d).smash.inp (generated)

000450715.b3lyp_6-31g(d).nwchem.inp (generated) 000450715.b3lyp_6-31g(d).log.xz 000450715.td-b3lyp_6-31g+(d).inp 000450715.td-b3lyp_6-31g+(d).log.xz

000450715.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450715.td-b3lyp_6-31+g(d).gjf (generated)

000450715.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450715.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450715.mol 000450715.PUBCHEM 000450715.mol (via Jmol)
000450716.b3lyp_6-31g(d).inp

000450716.b3lyp_6-31g(d).qchem.inp (generated)

000450716.b3lyp_6-31g(d).gjf (generated)

000450716.b3lyp_6-31g(d).firefly.inp (generated)

000450716.b3lyp_6-31g(d).smash.inp (generated)

000450716.b3lyp_6-31g(d).nwchem.inp (generated) 000450716.b3lyp_6-31g(d).log.xz 000450716.td-b3lyp_6-31g+(d).inp 000450716.td-b3lyp_6-31g+(d).log.xz

000450716.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450716.td-b3lyp_6-31+g(d).gjf (generated)

000450716.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450716.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450716.mol 000450716.PUBCHEM 000450716.mol (via Jmol)
000450717.b3lyp_6-31g(d).inp

000450717.b3lyp_6-31g(d).qchem.inp (generated)

000450717.b3lyp_6-31g(d).gjf (generated)

000450717.b3lyp_6-31g(d).firefly.inp (generated)

000450717.b3lyp_6-31g(d).smash.inp (generated)

000450717.b3lyp_6-31g(d).nwchem.inp (generated) 000450717.b3lyp_6-31g(d).log.xz 000450717.td-b3lyp_6-31g+(d).inp 000450717.td-b3lyp_6-31g+(d).log.xz

000450717.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450717.td-b3lyp_6-31+g(d).gjf (generated)

000450717.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450717.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450717.mol 000450717.PUBCHEM 000450717.mol (via Jmol)
000450718.b3lyp_6-31g(d).inp

000450718.b3lyp_6-31g(d).qchem.inp (generated)

000450718.b3lyp_6-31g(d).gjf (generated)

000450718.b3lyp_6-31g(d).firefly.inp (generated)

000450718.b3lyp_6-31g(d).smash.inp (generated)

000450718.b3lyp_6-31g(d).nwchem.inp (generated) 000450718.b3lyp_6-31g(d).log.xz 000450718.td-b3lyp_6-31g+(d).inp 000450718.td-b3lyp_6-31g+(d).log.xz

000450718.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450718.td-b3lyp_6-31+g(d).gjf (generated)

000450718.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450718.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450718.mol 000450718.PUBCHEM 000450718.mol (via Jmol)
000450719.b3lyp_6-31g(d).inp

000450719.b3lyp_6-31g(d).qchem.inp (generated)

000450719.b3lyp_6-31g(d).gjf (generated)

000450719.b3lyp_6-31g(d).firefly.inp (generated)

000450719.b3lyp_6-31g(d).smash.inp (generated)

000450719.b3lyp_6-31g(d).nwchem.inp (generated) 000450719.b3lyp_6-31g(d).log.xz 000450719.td-b3lyp_6-31g+(d).inp 000450719.td-b3lyp_6-31g+(d).log.xz

000450719.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450719.td-b3lyp_6-31+g(d).gjf (generated)

000450719.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450719.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450719.mol 000450719.PUBCHEM 000450719.mol (via Jmol)
000450720.b3lyp_6-31g(d).inp

000450720.b3lyp_6-31g(d).qchem.inp (generated)

000450720.b3lyp_6-31g(d).gjf (generated)

000450720.b3lyp_6-31g(d).firefly.inp (generated)

000450720.b3lyp_6-31g(d).smash.inp (generated)

000450720.b3lyp_6-31g(d).nwchem.inp (generated) 000450720.b3lyp_6-31g(d).log.xz 000450720.td-b3lyp_6-31g+(d).inp 000450720.td-b3lyp_6-31g+(d).log.xz

000450720.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450720.td-b3lyp_6-31+g(d).gjf (generated)

000450720.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450720.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450720.mol 000450720.PUBCHEM 000450720.mol (via Jmol)
000450721.b3lyp_6-31g(d).inp

000450721.b3lyp_6-31g(d).qchem.inp (generated)

000450721.b3lyp_6-31g(d).gjf (generated)

000450721.b3lyp_6-31g(d).firefly.inp (generated)

000450721.b3lyp_6-31g(d).smash.inp (generated)

000450721.b3lyp_6-31g(d).nwchem.inp (generated) 000450721.b3lyp_6-31g(d).log.xz 000450721.td-b3lyp_6-31g+(d).inp 000450721.td-b3lyp_6-31g+(d).log.xz

000450721.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450721.td-b3lyp_6-31+g(d).gjf (generated)

000450721.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450721.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450721.mol 000450721.PUBCHEM 000450721.mol (via Jmol)
000450722.b3lyp_6-31g(d).inp

000450722.b3lyp_6-31g(d).qchem.inp (generated)

000450722.b3lyp_6-31g(d).gjf (generated)

000450722.b3lyp_6-31g(d).firefly.inp (generated)

000450722.b3lyp_6-31g(d).smash.inp (generated)

000450722.b3lyp_6-31g(d).nwchem.inp (generated) 000450722.b3lyp_6-31g(d).log.xz 000450722.td-b3lyp_6-31g+(d).inp 000450722.td-b3lyp_6-31g+(d).log.xz

000450722.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450722.td-b3lyp_6-31+g(d).gjf (generated)

000450722.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450722.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450722.mol 000450722.PUBCHEM 000450722.mol (via Jmol)
000450723.b3lyp_6-31g(d).inp

000450723.b3lyp_6-31g(d).qchem.inp (generated)

000450723.b3lyp_6-31g(d).gjf (generated)

000450723.b3lyp_6-31g(d).firefly.inp (generated)

000450723.b3lyp_6-31g(d).smash.inp (generated)

000450723.b3lyp_6-31g(d).nwchem.inp (generated) 000450723.b3lyp_6-31g(d).log.xz 000450723.td-b3lyp_6-31g+(d).inp 000450723.td-b3lyp_6-31g+(d).log.xz

000450723.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450723.td-b3lyp_6-31+g(d).gjf (generated)

000450723.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450723.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450723.mol 000450723.PUBCHEM 000450723.mol (via Jmol)
000450724.b3lyp_6-31g(d).inp

000450724.b3lyp_6-31g(d).qchem.inp (generated)

000450724.b3lyp_6-31g(d).gjf (generated)

000450724.b3lyp_6-31g(d).firefly.inp (generated)

000450724.b3lyp_6-31g(d).smash.inp (generated)

000450724.b3lyp_6-31g(d).nwchem.inp (generated) 000450724.b3lyp_6-31g(d).log.xz 000450724.td-b3lyp_6-31g+(d).inp 000450724.td-b3lyp_6-31g+(d).log.xz

000450724.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450724.td-b3lyp_6-31+g(d).gjf (generated)

000450724.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450724.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450724.mol 000450724.PUBCHEM 000450724.mol (via Jmol)
000450725.b3lyp_6-31g(d).inp

000450725.b3lyp_6-31g(d).qchem.inp (generated)

000450725.b3lyp_6-31g(d).gjf (generated)

000450725.b3lyp_6-31g(d).firefly.inp (generated)

000450725.b3lyp_6-31g(d).smash.inp (generated)

000450725.b3lyp_6-31g(d).nwchem.inp (generated) 000450725.b3lyp_6-31g(d).log.xz 000450725.td-b3lyp_6-31g+(d).inp 000450725.td-b3lyp_6-31g+(d).log.xz

000450725.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450725.td-b3lyp_6-31+g(d).gjf (generated)

000450725.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450725.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450725.mol 000450725.PUBCHEM 000450725.mol (via Jmol)
000450726.b3lyp_6-31g(d).inp

000450726.b3lyp_6-31g(d).qchem.inp (generated)

000450726.b3lyp_6-31g(d).gjf (generated)

000450726.b3lyp_6-31g(d).firefly.inp (generated)

000450726.b3lyp_6-31g(d).smash.inp (generated)

000450726.b3lyp_6-31g(d).nwchem.inp (generated) 000450726.b3lyp_6-31g(d).log.xz 000450726.td-b3lyp_6-31g+(d).inp 000450726.td-b3lyp_6-31g+(d).log.xz

000450726.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450726.td-b3lyp_6-31+g(d).gjf (generated)

000450726.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450726.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450726.mol 000450726.PUBCHEM 000450726.mol (via Jmol)
000450727.b3lyp_6-31g(d).inp

000450727.b3lyp_6-31g(d).qchem.inp (generated)

000450727.b3lyp_6-31g(d).gjf (generated)

000450727.b3lyp_6-31g(d).firefly.inp (generated)

000450727.b3lyp_6-31g(d).smash.inp (generated)

000450727.b3lyp_6-31g(d).nwchem.inp (generated) 000450727.b3lyp_6-31g(d).log.xz 000450727.td-b3lyp_6-31g+(d).inp 000450727.td-b3lyp_6-31g+(d).log.xz

000450727.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450727.td-b3lyp_6-31+g(d).gjf (generated)

000450727.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450727.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450727.mol 000450727.PUBCHEM 000450727.mol (via Jmol)
000450728.b3lyp_6-31g(d).inp

000450728.b3lyp_6-31g(d).qchem.inp (generated)

000450728.b3lyp_6-31g(d).gjf (generated)

000450728.b3lyp_6-31g(d).firefly.inp (generated)

000450728.b3lyp_6-31g(d).smash.inp (generated)

000450728.b3lyp_6-31g(d).nwchem.inp (generated) 000450728.b3lyp_6-31g(d).log.xz 000450728.td-b3lyp_6-31g+(d).inp 000450728.td-b3lyp_6-31g+(d).log.xz

000450728.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450728.td-b3lyp_6-31+g(d).gjf (generated)

000450728.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450728.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450728.mol 000450728.PUBCHEM 000450728.mol (via Jmol)
000450729.b3lyp_6-31g(d).inp

000450729.b3lyp_6-31g(d).qchem.inp (generated)

000450729.b3lyp_6-31g(d).gjf (generated)

000450729.b3lyp_6-31g(d).firefly.inp (generated)

000450729.b3lyp_6-31g(d).smash.inp (generated)

000450729.b3lyp_6-31g(d).nwchem.inp (generated) 000450729.b3lyp_6-31g(d).log.xz 000450729.td-b3lyp_6-31g+(d).inp 000450729.td-b3lyp_6-31g+(d).log.xz

000450729.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450729.td-b3lyp_6-31+g(d).gjf (generated)

000450729.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450729.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450729.mol 000450729.PUBCHEM 000450729.mol (via Jmol)
000450730.b3lyp_6-31g(d).inp

000450730.b3lyp_6-31g(d).qchem.inp (generated)

000450730.b3lyp_6-31g(d).gjf (generated)

000450730.b3lyp_6-31g(d).firefly.inp (generated)

000450730.b3lyp_6-31g(d).smash.inp (generated)

000450730.b3lyp_6-31g(d).nwchem.inp (generated) 000450730.b3lyp_6-31g(d).log.xz 000450730.td-b3lyp_6-31g+(d).inp 000450730.td-b3lyp_6-31g+(d).log.xz

000450730.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450730.td-b3lyp_6-31+g(d).gjf (generated)

000450730.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450730.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450730.mol 000450730.PUBCHEM 000450730.mol (via Jmol)
000450731.b3lyp_6-31g(d).inp

000450731.b3lyp_6-31g(d).qchem.inp (generated)

000450731.b3lyp_6-31g(d).gjf (generated)

000450731.b3lyp_6-31g(d).firefly.inp (generated)

000450731.b3lyp_6-31g(d).smash.inp (generated)

000450731.b3lyp_6-31g(d).nwchem.inp (generated) 000450731.b3lyp_6-31g(d).log.xz 000450731.td-b3lyp_6-31g+(d).inp 000450731.td-b3lyp_6-31g+(d).log.xz

000450731.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450731.td-b3lyp_6-31+g(d).gjf (generated)

000450731.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450731.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450731.mol 000450731.PUBCHEM 000450731.mol (via Jmol)
000450732.b3lyp_6-31g(d).inp

000450732.b3lyp_6-31g(d).qchem.inp (generated)

000450732.b3lyp_6-31g(d).gjf (generated)

000450732.b3lyp_6-31g(d).firefly.inp (generated)

000450732.b3lyp_6-31g(d).smash.inp (generated)

000450732.b3lyp_6-31g(d).nwchem.inp (generated) 000450732.b3lyp_6-31g(d).log.xz 000450732.td-b3lyp_6-31g+(d).inp 000450732.td-b3lyp_6-31g+(d).log.xz

000450732.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450732.td-b3lyp_6-31+g(d).gjf (generated)

000450732.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450732.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450732.mol 000450732.PUBCHEM 000450732.mol (via Jmol)
000450733.b3lyp_6-31g(d).inp

000450733.b3lyp_6-31g(d).qchem.inp (generated)

000450733.b3lyp_6-31g(d).gjf (generated)

000450733.b3lyp_6-31g(d).firefly.inp (generated)

000450733.b3lyp_6-31g(d).smash.inp (generated)

000450733.b3lyp_6-31g(d).nwchem.inp (generated) 000450733.b3lyp_6-31g(d).log.xz 000450733.td-b3lyp_6-31g+(d).inp 000450733.td-b3lyp_6-31g+(d).log.xz

000450733.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450733.td-b3lyp_6-31+g(d).gjf (generated)

000450733.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450733.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450733.mol 000450733.PUBCHEM 000450733.mol (via Jmol)
000450734.b3lyp_6-31g(d).inp

000450734.b3lyp_6-31g(d).qchem.inp (generated)

000450734.b3lyp_6-31g(d).gjf (generated)

000450734.b3lyp_6-31g(d).firefly.inp (generated)

000450734.b3lyp_6-31g(d).smash.inp (generated)

000450734.b3lyp_6-31g(d).nwchem.inp (generated) 000450734.b3lyp_6-31g(d).log.xz 000450734.td-b3lyp_6-31g+(d).inp 000450734.td-b3lyp_6-31g+(d).log.xz

000450734.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450734.td-b3lyp_6-31+g(d).gjf (generated)

000450734.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450734.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450734.mol 000450734.PUBCHEM 000450734.mol (via Jmol)
000450735.b3lyp_6-31g(d).inp

000450735.b3lyp_6-31g(d).qchem.inp (generated)

000450735.b3lyp_6-31g(d).gjf (generated)

000450735.b3lyp_6-31g(d).firefly.inp (generated)

000450735.b3lyp_6-31g(d).smash.inp (generated)

000450735.b3lyp_6-31g(d).nwchem.inp (generated) 000450735.b3lyp_6-31g(d).log.xz 000450735.td-b3lyp_6-31g+(d).inp 000450735.td-b3lyp_6-31g+(d).log.xz

000450735.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450735.td-b3lyp_6-31+g(d).gjf (generated)

000450735.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450735.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450735.mol 000450735.PUBCHEM 000450735.mol (via Jmol)
000450736.b3lyp_6-31g(d).inp

000450736.b3lyp_6-31g(d).qchem.inp (generated)

000450736.b3lyp_6-31g(d).gjf (generated)

000450736.b3lyp_6-31g(d).firefly.inp (generated)

000450736.b3lyp_6-31g(d).smash.inp (generated)

000450736.b3lyp_6-31g(d).nwchem.inp (generated) 000450736.b3lyp_6-31g(d).log.xz 000450736.td-b3lyp_6-31g+(d).inp 000450736.td-b3lyp_6-31g+(d).log.xz

000450736.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450736.td-b3lyp_6-31+g(d).gjf (generated)

000450736.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450736.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450736.mol 000450736.PUBCHEM 000450736.mol (via Jmol)
000450737.b3lyp_6-31g(d).inp

000450737.b3lyp_6-31g(d).qchem.inp (generated)

000450737.b3lyp_6-31g(d).gjf (generated)

000450737.b3lyp_6-31g(d).firefly.inp (generated)

000450737.b3lyp_6-31g(d).smash.inp (generated)

000450737.b3lyp_6-31g(d).nwchem.inp (generated) 000450737.b3lyp_6-31g(d).log.xz 000450737.td-b3lyp_6-31g+(d).inp 000450737.td-b3lyp_6-31g+(d).log.xz

000450737.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450737.td-b3lyp_6-31+g(d).gjf (generated)

000450737.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450737.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450737.mol 000450737.PUBCHEM 000450737.mol (via Jmol)
000450738.b3lyp_6-31g(d).inp

000450738.b3lyp_6-31g(d).qchem.inp (generated)

000450738.b3lyp_6-31g(d).gjf (generated)

000450738.b3lyp_6-31g(d).firefly.inp (generated)

000450738.b3lyp_6-31g(d).smash.inp (generated)

000450738.b3lyp_6-31g(d).nwchem.inp (generated) 000450738.b3lyp_6-31g(d).log.xz 000450738.td-b3lyp_6-31g+(d).inp 000450738.td-b3lyp_6-31g+(d).log.xz

000450738.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450738.td-b3lyp_6-31+g(d).gjf (generated)

000450738.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450738.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450738.mol 000450738.PUBCHEM 000450738.mol (via Jmol)
000450739.b3lyp_6-31g(d).inp

000450739.b3lyp_6-31g(d).qchem.inp (generated)

000450739.b3lyp_6-31g(d).gjf (generated)

000450739.b3lyp_6-31g(d).firefly.inp (generated)

000450739.b3lyp_6-31g(d).smash.inp (generated)

000450739.b3lyp_6-31g(d).nwchem.inp (generated) 000450739.b3lyp_6-31g(d).log.xz 000450739.td-b3lyp_6-31g+(d).inp 000450739.td-b3lyp_6-31g+(d).log.xz

000450739.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450739.td-b3lyp_6-31+g(d).gjf (generated)

000450739.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450739.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450739.mol 000450739.PUBCHEM 000450739.mol (via Jmol)
000450741.b3lyp_6-31g(d).inp

000450741.b3lyp_6-31g(d).qchem.inp (generated)

000450741.b3lyp_6-31g(d).gjf (generated)

000450741.b3lyp_6-31g(d).firefly.inp (generated)

000450741.b3lyp_6-31g(d).smash.inp (generated)

000450741.b3lyp_6-31g(d).nwchem.inp (generated) 000450741.b3lyp_6-31g(d).log.xz 000450741.td-b3lyp_6-31g+(d).inp 000450741.td-b3lyp_6-31g+(d).log.xz

000450741.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450741.td-b3lyp_6-31+g(d).gjf (generated)

000450741.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450741.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450741.mol 000450741.PUBCHEM 000450741.mol (via Jmol)
000450742.b3lyp_6-31g(d).inp

000450742.b3lyp_6-31g(d).qchem.inp (generated)

000450742.b3lyp_6-31g(d).gjf (generated)

000450742.b3lyp_6-31g(d).firefly.inp (generated)

000450742.b3lyp_6-31g(d).smash.inp (generated)

000450742.b3lyp_6-31g(d).nwchem.inp (generated) 000450742.b3lyp_6-31g(d).log.xz 000450742.td-b3lyp_6-31g+(d).inp 000450742.td-b3lyp_6-31g+(d).log.xz

000450742.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450742.td-b3lyp_6-31+g(d).gjf (generated)

000450742.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450742.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450742.mol 000450742.PUBCHEM 000450742.mol (via Jmol)
000450743.b3lyp_6-31g(d).inp

000450743.b3lyp_6-31g(d).qchem.inp (generated)

000450743.b3lyp_6-31g(d).gjf (generated)

000450743.b3lyp_6-31g(d).firefly.inp (generated)

000450743.b3lyp_6-31g(d).smash.inp (generated)

000450743.b3lyp_6-31g(d).nwchem.inp (generated) 000450743.b3lyp_6-31g(d).log.xz 000450743.td-b3lyp_6-31g+(d).inp 000450743.td-b3lyp_6-31g+(d).log.xz

000450743.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450743.td-b3lyp_6-31+g(d).gjf (generated)

000450743.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450743.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450743.mol 000450743.PUBCHEM 000450743.mol (via Jmol)
000450744.b3lyp_6-31g(d).inp

000450744.b3lyp_6-31g(d).qchem.inp (generated)

000450744.b3lyp_6-31g(d).gjf (generated)

000450744.b3lyp_6-31g(d).firefly.inp (generated)

000450744.b3lyp_6-31g(d).smash.inp (generated)

000450744.b3lyp_6-31g(d).nwchem.inp (generated) 000450744.b3lyp_6-31g(d).log.xz 000450744.td-b3lyp_6-31g+(d).inp 000450744.td-b3lyp_6-31g+(d).log.xz

000450744.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450744.td-b3lyp_6-31+g(d).gjf (generated)

000450744.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450744.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450744.mol 000450744.PUBCHEM 000450744.mol (via Jmol)
000450746.b3lyp_6-31g(d).inp

000450746.b3lyp_6-31g(d).qchem.inp (generated)

000450746.b3lyp_6-31g(d).gjf (generated)

000450746.b3lyp_6-31g(d).firefly.inp (generated)

000450746.b3lyp_6-31g(d).smash.inp (generated)

000450746.b3lyp_6-31g(d).nwchem.inp (generated) 000450746.b3lyp_6-31g(d).log.xz 000450746.td-b3lyp_6-31g+(d).inp 000450746.td-b3lyp_6-31g+(d).log.xz

000450746.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450746.td-b3lyp_6-31+g(d).gjf (generated)

000450746.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450746.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450746.mol 000450746.PUBCHEM 000450746.mol (via Jmol)
000450747.b3lyp_6-31g(d).inp

000450747.b3lyp_6-31g(d).qchem.inp (generated)

000450747.b3lyp_6-31g(d).gjf (generated)

000450747.b3lyp_6-31g(d).firefly.inp (generated)

000450747.b3lyp_6-31g(d).smash.inp (generated)

000450747.b3lyp_6-31g(d).nwchem.inp (generated) 000450747.b3lyp_6-31g(d).log.xz 000450747.td-b3lyp_6-31g+(d).inp 000450747.td-b3lyp_6-31g+(d).log.xz

000450747.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450747.td-b3lyp_6-31+g(d).gjf (generated)

000450747.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450747.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450747.mol 000450747.PUBCHEM 000450747.mol (via Jmol)
000450748.b3lyp_6-31g(d).inp

000450748.b3lyp_6-31g(d).qchem.inp (generated)

000450748.b3lyp_6-31g(d).gjf (generated)

000450748.b3lyp_6-31g(d).firefly.inp (generated)

000450748.b3lyp_6-31g(d).smash.inp (generated)

000450748.b3lyp_6-31g(d).nwchem.inp (generated) 000450748.b3lyp_6-31g(d).log.xz 000450748.td-b3lyp_6-31g+(d).inp 000450748.td-b3lyp_6-31g+(d).log.xz

000450748.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450748.td-b3lyp_6-31+g(d).gjf (generated)

000450748.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450748.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450748.mol 000450748.PUBCHEM 000450748.mol (via Jmol)
000450749.b3lyp_6-31g(d).inp

000450749.b3lyp_6-31g(d).qchem.inp (generated)

000450749.b3lyp_6-31g(d).gjf (generated)

000450749.b3lyp_6-31g(d).firefly.inp (generated)

000450749.b3lyp_6-31g(d).smash.inp (generated)

000450749.b3lyp_6-31g(d).nwchem.inp (generated) 000450749.b3lyp_6-31g(d).log.xz 000450749.td-b3lyp_6-31g+(d).inp 000450749.td-b3lyp_6-31g+(d).log.xz

000450749.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450749.td-b3lyp_6-31+g(d).gjf (generated)

000450749.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450749.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450749.mol 000450749.PUBCHEM 000450749.mol (via Jmol)
000450750.b3lyp_6-31g(d).inp

000450750.b3lyp_6-31g(d).qchem.inp (generated)

000450750.b3lyp_6-31g(d).gjf (generated)

000450750.b3lyp_6-31g(d).firefly.inp (generated)

000450750.b3lyp_6-31g(d).smash.inp (generated)

000450750.b3lyp_6-31g(d).nwchem.inp (generated) 000450750.b3lyp_6-31g(d).log.xz 000450750.td-b3lyp_6-31g+(d).inp 000450750.td-b3lyp_6-31g+(d).log.xz

000450750.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450750.td-b3lyp_6-31+g(d).gjf (generated)

000450750.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450750.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450750.mol 000450750.PUBCHEM 000450750.mol (via Jmol)
000450751.b3lyp_6-31g(d).inp

000450751.b3lyp_6-31g(d).qchem.inp (generated)

000450751.b3lyp_6-31g(d).gjf (generated)

000450751.b3lyp_6-31g(d).firefly.inp (generated)

000450751.b3lyp_6-31g(d).smash.inp (generated)

000450751.b3lyp_6-31g(d).nwchem.inp (generated) 000450751.b3lyp_6-31g(d).log.xz 000450751.td-b3lyp_6-31g+(d).inp 000450751.td-b3lyp_6-31g+(d).log.xz

000450751.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450751.td-b3lyp_6-31+g(d).gjf (generated)

000450751.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450751.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450751.mol 000450751.PUBCHEM 000450751.mol (via Jmol)
000450752.b3lyp_6-31g(d).inp

000450752.b3lyp_6-31g(d).qchem.inp (generated)

000450752.b3lyp_6-31g(d).gjf (generated)

000450752.b3lyp_6-31g(d).firefly.inp (generated)

000450752.b3lyp_6-31g(d).smash.inp (generated)

000450752.b3lyp_6-31g(d).nwchem.inp (generated) 000450752.b3lyp_6-31g(d).log.xz 000450752.td-b3lyp_6-31g+(d).inp 000450752.td-b3lyp_6-31g+(d).log.xz

000450752.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450752.td-b3lyp_6-31+g(d).gjf (generated)

000450752.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450752.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450752.mol 000450752.PUBCHEM 000450752.mol (via Jmol)
000450754.b3lyp_6-31g(d).inp

000450754.b3lyp_6-31g(d).qchem.inp (generated)

000450754.b3lyp_6-31g(d).gjf (generated)

000450754.b3lyp_6-31g(d).firefly.inp (generated)

000450754.b3lyp_6-31g(d).smash.inp (generated)

000450754.b3lyp_6-31g(d).nwchem.inp (generated) 000450754.b3lyp_6-31g(d).log.xz 000450754.td-b3lyp_6-31g+(d).inp 000450754.td-b3lyp_6-31g+(d).log.xz

000450754.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450754.td-b3lyp_6-31+g(d).gjf (generated)

000450754.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450754.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450754.mol 000450754.PUBCHEM 000450754.mol (via Jmol)
000450755.b3lyp_6-31g(d).inp

000450755.b3lyp_6-31g(d).qchem.inp (generated)

000450755.b3lyp_6-31g(d).gjf (generated)

000450755.b3lyp_6-31g(d).firefly.inp (generated)

000450755.b3lyp_6-31g(d).smash.inp (generated)

000450755.b3lyp_6-31g(d).nwchem.inp (generated) 000450755.b3lyp_6-31g(d).log.xz 000450755.td-b3lyp_6-31g+(d).inp 000450755.td-b3lyp_6-31g+(d).log.xz

000450755.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450755.td-b3lyp_6-31+g(d).gjf (generated)

000450755.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450755.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450755.mol 000450755.PUBCHEM 000450755.mol (via Jmol)
000450756.b3lyp_6-31g(d).inp

000450756.b3lyp_6-31g(d).qchem.inp (generated)

000450756.b3lyp_6-31g(d).gjf (generated)

000450756.b3lyp_6-31g(d).firefly.inp (generated)

000450756.b3lyp_6-31g(d).smash.inp (generated)

000450756.b3lyp_6-31g(d).nwchem.inp (generated) 000450756.b3lyp_6-31g(d).log.xz 000450756.td-b3lyp_6-31g+(d).inp 000450756.td-b3lyp_6-31g+(d).log.xz

000450756.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450756.td-b3lyp_6-31+g(d).gjf (generated)

000450756.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450756.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450756.mol 000450756.PUBCHEM 000450756.mol (via Jmol)
000450757.b3lyp_6-31g(d).inp

000450757.b3lyp_6-31g(d).qchem.inp (generated)

000450757.b3lyp_6-31g(d).gjf (generated)

000450757.b3lyp_6-31g(d).firefly.inp (generated)

000450757.b3lyp_6-31g(d).smash.inp (generated)

000450757.b3lyp_6-31g(d).nwchem.inp (generated) 000450757.b3lyp_6-31g(d).log.xz 000450757.td-b3lyp_6-31g+(d).inp 000450757.td-b3lyp_6-31g+(d).log.xz

000450757.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450757.td-b3lyp_6-31+g(d).gjf (generated)

000450757.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450757.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450757.mol 000450757.PUBCHEM 000450757.mol (via Jmol)
000450758.b3lyp_6-31g(d).inp

000450758.b3lyp_6-31g(d).qchem.inp (generated)

000450758.b3lyp_6-31g(d).gjf (generated)

000450758.b3lyp_6-31g(d).firefly.inp (generated)

000450758.b3lyp_6-31g(d).smash.inp (generated)

000450758.b3lyp_6-31g(d).nwchem.inp (generated) 000450758.b3lyp_6-31g(d).log.xz 000450758.td-b3lyp_6-31g+(d).inp 000450758.td-b3lyp_6-31g+(d).log.xz

000450758.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450758.td-b3lyp_6-31+g(d).gjf (generated)

000450758.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450758.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450758.mol 000450758.PUBCHEM 000450758.mol (via Jmol)
000450761.b3lyp_6-31g(d).inp

000450761.b3lyp_6-31g(d).qchem.inp (generated)

000450761.b3lyp_6-31g(d).gjf (generated)

000450761.b3lyp_6-31g(d).firefly.inp (generated)

000450761.b3lyp_6-31g(d).smash.inp (generated)

000450761.b3lyp_6-31g(d).nwchem.inp (generated) 000450761.b3lyp_6-31g(d).log.xz 000450761.td-b3lyp_6-31g+(d).inp 000450761.td-b3lyp_6-31g+(d).log.xz

000450761.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450761.td-b3lyp_6-31+g(d).gjf (generated)

000450761.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450761.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450761.mol 000450761.PUBCHEM 000450761.mol (via Jmol)
000450762.b3lyp_6-31g(d).inp

000450762.b3lyp_6-31g(d).qchem.inp (generated)

000450762.b3lyp_6-31g(d).gjf (generated)

000450762.b3lyp_6-31g(d).firefly.inp (generated)

000450762.b3lyp_6-31g(d).smash.inp (generated)

000450762.b3lyp_6-31g(d).nwchem.inp (generated) 000450762.b3lyp_6-31g(d).log.xz 000450762.td-b3lyp_6-31g+(d).inp 000450762.td-b3lyp_6-31g+(d).log.xz

000450762.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450762.td-b3lyp_6-31+g(d).gjf (generated)

000450762.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450762.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450762.mol 000450762.PUBCHEM 000450762.mol (via Jmol)
000450763.b3lyp_6-31g(d).inp

000450763.b3lyp_6-31g(d).qchem.inp (generated)

000450763.b3lyp_6-31g(d).gjf (generated)

000450763.b3lyp_6-31g(d).firefly.inp (generated)

000450763.b3lyp_6-31g(d).smash.inp (generated)

000450763.b3lyp_6-31g(d).nwchem.inp (generated) 000450763.b3lyp_6-31g(d).log.xz 000450763.td-b3lyp_6-31g+(d).inp 000450763.td-b3lyp_6-31g+(d).log.xz

000450763.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450763.td-b3lyp_6-31+g(d).gjf (generated)

000450763.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450763.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450763.mol 000450763.PUBCHEM 000450763.mol (via Jmol)
000450771.b3lyp_6-31g(d).inp

000450771.b3lyp_6-31g(d).qchem.inp (generated)

000450771.b3lyp_6-31g(d).gjf (generated)

000450771.b3lyp_6-31g(d).firefly.inp (generated)

000450771.b3lyp_6-31g(d).smash.inp (generated)

000450771.b3lyp_6-31g(d).nwchem.inp (generated) 000450771.b3lyp_6-31g(d).log.xz 000450771.td-b3lyp_6-31g+(d).inp 000450771.td-b3lyp_6-31g+(d).log.xz

000450771.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450771.td-b3lyp_6-31+g(d).gjf (generated)

000450771.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450771.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450771.mol 000450771.PUBCHEM 000450771.mol (via Jmol)
000450781.b3lyp_6-31g(d).inp

000450781.b3lyp_6-31g(d).qchem.inp (generated)

000450781.b3lyp_6-31g(d).gjf (generated)

000450781.b3lyp_6-31g(d).firefly.inp (generated)

000450781.b3lyp_6-31g(d).smash.inp (generated)

000450781.b3lyp_6-31g(d).nwchem.inp (generated) 000450781.b3lyp_6-31g(d).log.xz 000450781.td-b3lyp_6-31g+(d).inp 000450781.td-b3lyp_6-31g+(d).log.xz

000450781.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450781.td-b3lyp_6-31+g(d).gjf (generated)

000450781.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450781.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450781.mol 000450781.PUBCHEM 000450781.mol (via Jmol)
000450783.b3lyp_6-31g(d).inp

000450783.b3lyp_6-31g(d).qchem.inp (generated)

000450783.b3lyp_6-31g(d).gjf (generated)

000450783.b3lyp_6-31g(d).firefly.inp (generated)

000450783.b3lyp_6-31g(d).smash.inp (generated)

000450783.b3lyp_6-31g(d).nwchem.inp (generated) 000450783.b3lyp_6-31g(d).log.xz 000450783.td-b3lyp_6-31g+(d).inp 000450783.td-b3lyp_6-31g+(d).log.xz

000450783.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450783.td-b3lyp_6-31+g(d).gjf (generated)

000450783.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450783.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450783.mol 000450783.PUBCHEM 000450783.mol (via Jmol)
000450784.b3lyp_6-31g(d).inp

000450784.b3lyp_6-31g(d).qchem.inp (generated)

000450784.b3lyp_6-31g(d).gjf (generated)

000450784.b3lyp_6-31g(d).firefly.inp (generated)

000450784.b3lyp_6-31g(d).smash.inp (generated)

000450784.b3lyp_6-31g(d).nwchem.inp (generated) 000450784.b3lyp_6-31g(d).log.xz 000450784.td-b3lyp_6-31g+(d).inp 000450784.td-b3lyp_6-31g+(d).log.xz

000450784.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450784.td-b3lyp_6-31+g(d).gjf (generated)

000450784.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450784.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450784.mol 000450784.PUBCHEM 000450784.mol (via Jmol)
000450785.b3lyp_6-31g(d).inp

000450785.b3lyp_6-31g(d).qchem.inp (generated)

000450785.b3lyp_6-31g(d).gjf (generated)

000450785.b3lyp_6-31g(d).firefly.inp (generated)

000450785.b3lyp_6-31g(d).smash.inp (generated)

000450785.b3lyp_6-31g(d).nwchem.inp (generated) 000450785.b3lyp_6-31g(d).log.xz 000450785.td-b3lyp_6-31g+(d).inp 000450785.td-b3lyp_6-31g+(d).log.xz

000450785.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450785.td-b3lyp_6-31+g(d).gjf (generated)

000450785.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450785.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450785.mol 000450785.PUBCHEM 000450785.mol (via Jmol)
000450786.b3lyp_6-31g(d).inp

000450786.b3lyp_6-31g(d).qchem.inp (generated)

000450786.b3lyp_6-31g(d).gjf (generated)

000450786.b3lyp_6-31g(d).firefly.inp (generated)

000450786.b3lyp_6-31g(d).smash.inp (generated)

000450786.b3lyp_6-31g(d).nwchem.inp (generated) 000450786.b3lyp_6-31g(d).log.xz 000450786.td-b3lyp_6-31g+(d).inp 000450786.td-b3lyp_6-31g+(d).log.xz

000450786.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450786.td-b3lyp_6-31+g(d).gjf (generated)

000450786.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450786.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450786.mol 000450786.PUBCHEM 000450786.mol (via Jmol)
000450787.b3lyp_6-31g(d).inp

000450787.b3lyp_6-31g(d).qchem.inp (generated)

000450787.b3lyp_6-31g(d).gjf (generated)

000450787.b3lyp_6-31g(d).firefly.inp (generated)

000450787.b3lyp_6-31g(d).smash.inp (generated)

000450787.b3lyp_6-31g(d).nwchem.inp (generated) 000450787.b3lyp_6-31g(d).log.xz 000450787.td-b3lyp_6-31g+(d).inp 000450787.td-b3lyp_6-31g+(d).log.xz

000450787.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450787.td-b3lyp_6-31+g(d).gjf (generated)

000450787.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450787.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450787.mol 000450787.PUBCHEM 000450787.mol (via Jmol)
000450788.b3lyp_6-31g(d).inp

000450788.b3lyp_6-31g(d).qchem.inp (generated)

000450788.b3lyp_6-31g(d).gjf (generated)

000450788.b3lyp_6-31g(d).firefly.inp (generated)

000450788.b3lyp_6-31g(d).smash.inp (generated)

000450788.b3lyp_6-31g(d).nwchem.inp (generated) 000450788.b3lyp_6-31g(d).log.xz 000450788.td-b3lyp_6-31g+(d).inp 000450788.td-b3lyp_6-31g+(d).log.xz

000450788.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450788.td-b3lyp_6-31+g(d).gjf (generated)

000450788.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450788.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450788.mol 000450788.PUBCHEM 000450788.mol (via Jmol)
000450790.b3lyp_6-31g(d).inp

000450790.b3lyp_6-31g(d).qchem.inp (generated)

000450790.b3lyp_6-31g(d).gjf (generated)

000450790.b3lyp_6-31g(d).firefly.inp (generated)

000450790.b3lyp_6-31g(d).smash.inp (generated)

000450790.b3lyp_6-31g(d).nwchem.inp (generated) 000450790.b3lyp_6-31g(d).log.xz 000450790.td-b3lyp_6-31g+(d).inp 000450790.td-b3lyp_6-31g+(d).log.xz

000450790.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450790.td-b3lyp_6-31+g(d).gjf (generated)

000450790.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450790.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450790.mol 000450790.PUBCHEM 000450790.mol (via Jmol)
000450792.b3lyp_6-31g(d).inp

000450792.b3lyp_6-31g(d).qchem.inp (generated)

000450792.b3lyp_6-31g(d).gjf (generated)

000450792.b3lyp_6-31g(d).firefly.inp (generated)

000450792.b3lyp_6-31g(d).smash.inp (generated)

000450792.b3lyp_6-31g(d).nwchem.inp (generated) 000450792.b3lyp_6-31g(d).log.xz 000450792.td-b3lyp_6-31g+(d).inp 000450792.td-b3lyp_6-31g+(d).log.xz

000450792.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450792.td-b3lyp_6-31+g(d).gjf (generated)

000450792.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450792.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450792.mol 000450792.PUBCHEM 000450792.mol (via Jmol)
000450793.b3lyp_6-31g(d).inp

000450793.b3lyp_6-31g(d).qchem.inp (generated)

000450793.b3lyp_6-31g(d).gjf (generated)

000450793.b3lyp_6-31g(d).firefly.inp (generated)

000450793.b3lyp_6-31g(d).smash.inp (generated)

000450793.b3lyp_6-31g(d).nwchem.inp (generated) 000450793.b3lyp_6-31g(d).log.xz 000450793.td-b3lyp_6-31g+(d).inp 000450793.td-b3lyp_6-31g+(d).log.xz

000450793.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450793.td-b3lyp_6-31+g(d).gjf (generated)

000450793.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450793.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450793.mol 000450793.PUBCHEM 000450793.mol (via Jmol)
000450804.b3lyp_6-31g(d).inp

000450804.b3lyp_6-31g(d).qchem.inp (generated)

000450804.b3lyp_6-31g(d).gjf (generated)

000450804.b3lyp_6-31g(d).firefly.inp (generated)

000450804.b3lyp_6-31g(d).smash.inp (generated)

000450804.b3lyp_6-31g(d).nwchem.inp (generated) 000450804.b3lyp_6-31g(d).log.xz 000450804.td-b3lyp_6-31g+(d).inp 000450804.td-b3lyp_6-31g+(d).log.xz

000450804.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450804.td-b3lyp_6-31+g(d).gjf (generated)

000450804.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450804.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450804.mol 000450804.PUBCHEM 000450804.mol (via Jmol)
000450806.b3lyp_6-31g(d).inp

000450806.b3lyp_6-31g(d).qchem.inp (generated)

000450806.b3lyp_6-31g(d).gjf (generated)

000450806.b3lyp_6-31g(d).firefly.inp (generated)

000450806.b3lyp_6-31g(d).smash.inp (generated)

000450806.b3lyp_6-31g(d).nwchem.inp (generated) 000450806.b3lyp_6-31g(d).log.xz 000450806.td-b3lyp_6-31g+(d).inp 000450806.td-b3lyp_6-31g+(d).log.xz

000450806.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450806.td-b3lyp_6-31+g(d).gjf (generated)

000450806.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450806.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450806.mol 000450806.PUBCHEM 000450806.mol (via Jmol)
000450807.b3lyp_6-31g(d).inp

000450807.b3lyp_6-31g(d).qchem.inp (generated)

000450807.b3lyp_6-31g(d).gjf (generated)

000450807.b3lyp_6-31g(d).firefly.inp (generated)

000450807.b3lyp_6-31g(d).smash.inp (generated)

000450807.b3lyp_6-31g(d).nwchem.inp (generated) 000450807.b3lyp_6-31g(d).log.xz 000450807.td-b3lyp_6-31g+(d).inp 000450807.td-b3lyp_6-31g+(d).log.xz

000450807.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450807.td-b3lyp_6-31+g(d).gjf (generated)

000450807.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450807.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450807.mol 000450807.PUBCHEM 000450807.mol (via Jmol)
000450808.b3lyp_6-31g(d).inp

000450808.b3lyp_6-31g(d).qchem.inp (generated)

000450808.b3lyp_6-31g(d).gjf (generated)

000450808.b3lyp_6-31g(d).firefly.inp (generated)

000450808.b3lyp_6-31g(d).smash.inp (generated)

000450808.b3lyp_6-31g(d).nwchem.inp (generated) 000450808.b3lyp_6-31g(d).log.xz 000450808.td-b3lyp_6-31g+(d).inp 000450808.td-b3lyp_6-31g+(d).log.xz

000450808.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450808.td-b3lyp_6-31+g(d).gjf (generated)

000450808.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450808.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450808.mol 000450808.PUBCHEM 000450808.mol (via Jmol)
000450809.b3lyp_6-31g(d).inp

000450809.b3lyp_6-31g(d).qchem.inp (generated)

000450809.b3lyp_6-31g(d).gjf (generated)

000450809.b3lyp_6-31g(d).firefly.inp (generated)

000450809.b3lyp_6-31g(d).smash.inp (generated)

000450809.b3lyp_6-31g(d).nwchem.inp (generated) 000450809.b3lyp_6-31g(d).log.xz 000450809.td-b3lyp_6-31g+(d).inp 000450809.td-b3lyp_6-31g+(d).log.xz

000450809.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450809.td-b3lyp_6-31+g(d).gjf (generated)

000450809.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450809.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450809.mol 000450809.PUBCHEM 000450809.mol (via Jmol)
000450810.b3lyp_6-31g(d).inp

000450810.b3lyp_6-31g(d).qchem.inp (generated)

000450810.b3lyp_6-31g(d).gjf (generated)

000450810.b3lyp_6-31g(d).firefly.inp (generated)

000450810.b3lyp_6-31g(d).smash.inp (generated)

000450810.b3lyp_6-31g(d).nwchem.inp (generated) 000450810.b3lyp_6-31g(d).log.xz 000450810.td-b3lyp_6-31g+(d).inp 000450810.td-b3lyp_6-31g+(d).log.xz

000450810.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450810.td-b3lyp_6-31+g(d).gjf (generated)

000450810.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450810.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450810.mol 000450810.PUBCHEM 000450810.mol (via Jmol)
000450811.b3lyp_6-31g(d).inp

000450811.b3lyp_6-31g(d).qchem.inp (generated)

000450811.b3lyp_6-31g(d).gjf (generated)

000450811.b3lyp_6-31g(d).firefly.inp (generated)

000450811.b3lyp_6-31g(d).smash.inp (generated)

000450811.b3lyp_6-31g(d).nwchem.inp (generated) 000450811.b3lyp_6-31g(d).log.xz 000450811.td-b3lyp_6-31g+(d).inp 000450811.td-b3lyp_6-31g+(d).log.xz

000450811.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450811.td-b3lyp_6-31+g(d).gjf (generated)

000450811.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450811.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450811.mol 000450811.PUBCHEM 000450811.mol (via Jmol)
000450812.b3lyp_6-31g(d).inp

000450812.b3lyp_6-31g(d).qchem.inp (generated)

000450812.b3lyp_6-31g(d).gjf (generated)

000450812.b3lyp_6-31g(d).firefly.inp (generated)

000450812.b3lyp_6-31g(d).smash.inp (generated)

000450812.b3lyp_6-31g(d).nwchem.inp (generated) 000450812.b3lyp_6-31g(d).log.xz 000450812.td-b3lyp_6-31g+(d).inp 000450812.td-b3lyp_6-31g+(d).log.xz

000450812.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450812.td-b3lyp_6-31+g(d).gjf (generated)

000450812.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450812.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450812.mol 000450812.PUBCHEM 000450812.mol (via Jmol)
000450813.b3lyp_6-31g(d).inp

000450813.b3lyp_6-31g(d).qchem.inp (generated)

000450813.b3lyp_6-31g(d).gjf (generated)

000450813.b3lyp_6-31g(d).firefly.inp (generated)

000450813.b3lyp_6-31g(d).smash.inp (generated)

000450813.b3lyp_6-31g(d).nwchem.inp (generated) 000450813.b3lyp_6-31g(d).log.xz 000450813.td-b3lyp_6-31g+(d).inp 000450813.td-b3lyp_6-31g+(d).log.xz

000450813.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450813.td-b3lyp_6-31+g(d).gjf (generated)

000450813.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450813.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450813.mol 000450813.PUBCHEM 000450813.mol (via Jmol)
000450843.b3lyp_6-31g(d).inp

000450843.b3lyp_6-31g(d).qchem.inp (generated)

000450843.b3lyp_6-31g(d).gjf (generated)

000450843.b3lyp_6-31g(d).firefly.inp (generated)

000450843.b3lyp_6-31g(d).smash.inp (generated)

000450843.b3lyp_6-31g(d).nwchem.inp (generated) 000450843.b3lyp_6-31g(d).log.xz 000450843.td-b3lyp_6-31g+(d).inp 000450843.td-b3lyp_6-31g+(d).log.xz

000450843.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450843.td-b3lyp_6-31+g(d).gjf (generated)

000450843.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450843.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450843.mol 000450843.PUBCHEM 000450843.mol (via Jmol)
000450844.b3lyp_6-31g(d).inp

000450844.b3lyp_6-31g(d).qchem.inp (generated)

000450844.b3lyp_6-31g(d).gjf (generated)

000450844.b3lyp_6-31g(d).firefly.inp (generated)

000450844.b3lyp_6-31g(d).smash.inp (generated)

000450844.b3lyp_6-31g(d).nwchem.inp (generated) 000450844.b3lyp_6-31g(d).log.xz 000450844.td-b3lyp_6-31g+(d).inp 000450844.td-b3lyp_6-31g+(d).log.xz

000450844.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450844.td-b3lyp_6-31+g(d).gjf (generated)

000450844.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450844.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450844.mol 000450844.PUBCHEM 000450844.mol (via Jmol)
000450846.b3lyp_6-31g(d).inp

000450846.b3lyp_6-31g(d).qchem.inp (generated)

000450846.b3lyp_6-31g(d).gjf (generated)

000450846.b3lyp_6-31g(d).firefly.inp (generated)

000450846.b3lyp_6-31g(d).smash.inp (generated)

000450846.b3lyp_6-31g(d).nwchem.inp (generated) 000450846.b3lyp_6-31g(d).log.xz 000450846.td-b3lyp_6-31g+(d).inp 000450846.td-b3lyp_6-31g+(d).log.xz

000450846.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450846.td-b3lyp_6-31+g(d).gjf (generated)

000450846.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450846.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450846.mol 000450846.PUBCHEM 000450846.mol (via Jmol)
000450847.b3lyp_6-31g(d).inp

000450847.b3lyp_6-31g(d).qchem.inp (generated)

000450847.b3lyp_6-31g(d).gjf (generated)

000450847.b3lyp_6-31g(d).firefly.inp (generated)

000450847.b3lyp_6-31g(d).smash.inp (generated)

000450847.b3lyp_6-31g(d).nwchem.inp (generated) 000450847.b3lyp_6-31g(d).log.xz 000450847.td-b3lyp_6-31g+(d).inp 000450847.td-b3lyp_6-31g+(d).log.xz

000450847.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450847.td-b3lyp_6-31+g(d).gjf (generated)

000450847.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450847.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450847.mol 000450847.PUBCHEM 000450847.mol (via Jmol)
000450849.b3lyp_6-31g(d).inp

000450849.b3lyp_6-31g(d).qchem.inp (generated)

000450849.b3lyp_6-31g(d).gjf (generated)

000450849.b3lyp_6-31g(d).firefly.inp (generated)

000450849.b3lyp_6-31g(d).smash.inp (generated)

000450849.b3lyp_6-31g(d).nwchem.inp (generated) 000450849.b3lyp_6-31g(d).log.xz 000450849.td-b3lyp_6-31g+(d).inp 000450849.td-b3lyp_6-31g+(d).log.xz

000450849.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450849.td-b3lyp_6-31+g(d).gjf (generated)

000450849.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450849.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450849.mol 000450849.PUBCHEM 000450849.mol (via Jmol)
000450851.b3lyp_6-31g(d).inp

000450851.b3lyp_6-31g(d).qchem.inp (generated)

000450851.b3lyp_6-31g(d).gjf (generated)

000450851.b3lyp_6-31g(d).firefly.inp (generated)

000450851.b3lyp_6-31g(d).smash.inp (generated)

000450851.b3lyp_6-31g(d).nwchem.inp (generated) 000450851.b3lyp_6-31g(d).log.xz 000450851.td-b3lyp_6-31g+(d).inp 000450851.td-b3lyp_6-31g+(d).log.xz

000450851.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450851.td-b3lyp_6-31+g(d).gjf (generated)

000450851.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450851.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450851.mol 000450851.PUBCHEM 000450851.mol (via Jmol)
000450852.b3lyp_6-31g(d).inp

000450852.b3lyp_6-31g(d).qchem.inp (generated)

000450852.b3lyp_6-31g(d).gjf (generated)

000450852.b3lyp_6-31g(d).firefly.inp (generated)

000450852.b3lyp_6-31g(d).smash.inp (generated)

000450852.b3lyp_6-31g(d).nwchem.inp (generated) 000450852.b3lyp_6-31g(d).log.xz 000450852.td-b3lyp_6-31g+(d).inp 000450852.td-b3lyp_6-31g+(d).log.xz

000450852.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450852.td-b3lyp_6-31+g(d).gjf (generated)

000450852.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450852.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450852.mol 000450852.PUBCHEM 000450852.mol (via Jmol)
000450855.b3lyp_6-31g(d).inp

000450855.b3lyp_6-31g(d).qchem.inp (generated)

000450855.b3lyp_6-31g(d).gjf (generated)

000450855.b3lyp_6-31g(d).firefly.inp (generated)

000450855.b3lyp_6-31g(d).smash.inp (generated)

000450855.b3lyp_6-31g(d).nwchem.inp (generated) 000450855.b3lyp_6-31g(d).log.xz 000450855.td-b3lyp_6-31g+(d).inp 000450855.td-b3lyp_6-31g+(d).log.xz

000450855.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450855.td-b3lyp_6-31+g(d).gjf (generated)

000450855.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450855.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450855.mol 000450855.PUBCHEM 000450855.mol (via Jmol)
000450860.b3lyp_6-31g(d).inp

000450860.b3lyp_6-31g(d).qchem.inp (generated)

000450860.b3lyp_6-31g(d).gjf (generated)

000450860.b3lyp_6-31g(d).firefly.inp (generated)

000450860.b3lyp_6-31g(d).smash.inp (generated)

000450860.b3lyp_6-31g(d).nwchem.inp (generated) 000450860.b3lyp_6-31g(d).log.xz 000450860.td-b3lyp_6-31g+(d).inp 000450860.td-b3lyp_6-31g+(d).log.xz

000450860.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450860.td-b3lyp_6-31+g(d).gjf (generated)

000450860.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450860.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450860.mol 000450860.PUBCHEM 000450860.mol (via Jmol)
000450864.b3lyp_6-31g(d).inp

000450864.b3lyp_6-31g(d).qchem.inp (generated)

000450864.b3lyp_6-31g(d).gjf (generated)

000450864.b3lyp_6-31g(d).firefly.inp (generated)

000450864.b3lyp_6-31g(d).smash.inp (generated)

000450864.b3lyp_6-31g(d).nwchem.inp (generated) 000450864.b3lyp_6-31g(d).log.xz 000450864.td-b3lyp_6-31g+(d).inp 000450864.td-b3lyp_6-31g+(d).log.xz

000450864.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450864.td-b3lyp_6-31+g(d).gjf (generated)

000450864.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450864.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450864.mol 000450864.PUBCHEM 000450864.mol (via Jmol)
000450881.b3lyp_6-31g(d).inp

000450881.b3lyp_6-31g(d).qchem.inp (generated)

000450881.b3lyp_6-31g(d).gjf (generated)

000450881.b3lyp_6-31g(d).firefly.inp (generated)

000450881.b3lyp_6-31g(d).smash.inp (generated)

000450881.b3lyp_6-31g(d).nwchem.inp (generated) 000450881.b3lyp_6-31g(d).log.xz 000450881.td-b3lyp_6-31g+(d).inp 000450881.td-b3lyp_6-31g+(d).log.xz

000450881.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450881.td-b3lyp_6-31+g(d).gjf (generated)

000450881.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450881.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450881.mol 000450881.PUBCHEM 000450881.mol (via Jmol)
000450884.b3lyp_6-31g(d).inp

000450884.b3lyp_6-31g(d).qchem.inp (generated)

000450884.b3lyp_6-31g(d).gjf (generated)

000450884.b3lyp_6-31g(d).firefly.inp (generated)

000450884.b3lyp_6-31g(d).smash.inp (generated)

000450884.b3lyp_6-31g(d).nwchem.inp (generated) 000450884.b3lyp_6-31g(d).log.xz 000450884.td-b3lyp_6-31g+(d).inp 000450884.td-b3lyp_6-31g+(d).log.xz

000450884.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450884.td-b3lyp_6-31+g(d).gjf (generated)

000450884.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450884.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450884.mol 000450884.PUBCHEM 000450884.mol (via Jmol)
000450885.b3lyp_6-31g(d).inp

000450885.b3lyp_6-31g(d).qchem.inp (generated)

000450885.b3lyp_6-31g(d).gjf (generated)

000450885.b3lyp_6-31g(d).firefly.inp (generated)

000450885.b3lyp_6-31g(d).smash.inp (generated)

000450885.b3lyp_6-31g(d).nwchem.inp (generated) 000450885.b3lyp_6-31g(d).log.xz 000450885.td-b3lyp_6-31g+(d).inp 000450885.td-b3lyp_6-31g+(d).log.xz

000450885.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450885.td-b3lyp_6-31+g(d).gjf (generated)

000450885.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450885.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450885.mol 000450885.PUBCHEM 000450885.mol (via Jmol)
000450891.b3lyp_6-31g(d).inp

000450891.b3lyp_6-31g(d).qchem.inp (generated)

000450891.b3lyp_6-31g(d).gjf (generated)

000450891.b3lyp_6-31g(d).firefly.inp (generated)

000450891.b3lyp_6-31g(d).smash.inp (generated)

000450891.b3lyp_6-31g(d).nwchem.inp (generated) 000450891.b3lyp_6-31g(d).log.xz 000450891.td-b3lyp_6-31g+(d).inp 000450891.td-b3lyp_6-31g+(d).log.xz

000450891.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450891.td-b3lyp_6-31+g(d).gjf (generated)

000450891.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450891.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450891.mol 000450891.PUBCHEM 000450891.mol (via Jmol)
000450893.b3lyp_6-31g(d).inp

000450893.b3lyp_6-31g(d).qchem.inp (generated)

000450893.b3lyp_6-31g(d).gjf (generated)

000450893.b3lyp_6-31g(d).firefly.inp (generated)

000450893.b3lyp_6-31g(d).smash.inp (generated)

000450893.b3lyp_6-31g(d).nwchem.inp (generated) 000450893.b3lyp_6-31g(d).log.xz 000450893.td-b3lyp_6-31g+(d).inp 000450893.td-b3lyp_6-31g+(d).log.xz

000450893.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450893.td-b3lyp_6-31+g(d).gjf (generated)

000450893.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450893.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450893.mol 000450893.PUBCHEM 000450893.mol (via Jmol)
000450915.b3lyp_6-31g(d).inp

000450915.b3lyp_6-31g(d).qchem.inp (generated)

000450915.b3lyp_6-31g(d).gjf (generated)

000450915.b3lyp_6-31g(d).firefly.inp (generated)

000450915.b3lyp_6-31g(d).smash.inp (generated)

000450915.b3lyp_6-31g(d).nwchem.inp (generated) 000450915.b3lyp_6-31g(d).log.xz 000450915.td-b3lyp_6-31g+(d).inp 000450915.td-b3lyp_6-31g+(d).log.xz

000450915.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450915.td-b3lyp_6-31+g(d).gjf (generated)

000450915.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450915.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450915.mol 000450915.PUBCHEM 000450915.mol (via Jmol)
000450916.b3lyp_6-31g(d).inp

000450916.b3lyp_6-31g(d).qchem.inp (generated)

000450916.b3lyp_6-31g(d).gjf (generated)

000450916.b3lyp_6-31g(d).firefly.inp (generated)

000450916.b3lyp_6-31g(d).smash.inp (generated)

000450916.b3lyp_6-31g(d).nwchem.inp (generated) 000450916.b3lyp_6-31g(d).log.xz 000450916.td-b3lyp_6-31g+(d).inp 000450916.td-b3lyp_6-31g+(d).log.xz

000450916.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450916.td-b3lyp_6-31+g(d).gjf (generated)

000450916.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450916.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450916.mol 000450916.PUBCHEM 000450916.mol (via Jmol)
000450917.b3lyp_6-31g(d).inp

000450917.b3lyp_6-31g(d).qchem.inp (generated)

000450917.b3lyp_6-31g(d).gjf (generated)

000450917.b3lyp_6-31g(d).firefly.inp (generated)

000450917.b3lyp_6-31g(d).smash.inp (generated)

000450917.b3lyp_6-31g(d).nwchem.inp (generated) 000450917.b3lyp_6-31g(d).log.xz 000450917.td-b3lyp_6-31g+(d).inp 000450917.td-b3lyp_6-31g+(d).log.xz

000450917.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450917.td-b3lyp_6-31+g(d).gjf (generated)

000450917.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450917.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450917.mol 000450917.PUBCHEM 000450917.mol (via Jmol)
000450918.b3lyp_6-31g(d).inp

000450918.b3lyp_6-31g(d).qchem.inp (generated)

000450918.b3lyp_6-31g(d).gjf (generated)

000450918.b3lyp_6-31g(d).firefly.inp (generated)

000450918.b3lyp_6-31g(d).smash.inp (generated)

000450918.b3lyp_6-31g(d).nwchem.inp (generated) 000450918.b3lyp_6-31g(d).log.xz 000450918.td-b3lyp_6-31g+(d).inp 000450918.td-b3lyp_6-31g+(d).log.xz

000450918.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450918.td-b3lyp_6-31+g(d).gjf (generated)

000450918.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450918.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450918.mol 000450918.PUBCHEM 000450918.mol (via Jmol)
000450919.b3lyp_6-31g(d).inp

000450919.b3lyp_6-31g(d).qchem.inp (generated)

000450919.b3lyp_6-31g(d).gjf (generated)

000450919.b3lyp_6-31g(d).firefly.inp (generated)

000450919.b3lyp_6-31g(d).smash.inp (generated)

000450919.b3lyp_6-31g(d).nwchem.inp (generated) 000450919.b3lyp_6-31g(d).log.xz 000450919.td-b3lyp_6-31g+(d).inp 000450919.td-b3lyp_6-31g+(d).log.xz

000450919.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450919.td-b3lyp_6-31+g(d).gjf (generated)

000450919.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450919.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450919.mol 000450919.PUBCHEM 000450919.mol (via Jmol)
000450920.b3lyp_6-31g(d).inp

000450920.b3lyp_6-31g(d).qchem.inp (generated)

000450920.b3lyp_6-31g(d).gjf (generated)

000450920.b3lyp_6-31g(d).firefly.inp (generated)

000450920.b3lyp_6-31g(d).smash.inp (generated)

000450920.b3lyp_6-31g(d).nwchem.inp (generated) 000450920.b3lyp_6-31g(d).log.xz 000450920.td-b3lyp_6-31g+(d).inp 000450920.td-b3lyp_6-31g+(d).log.xz

000450920.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450920.td-b3lyp_6-31+g(d).gjf (generated)

000450920.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450920.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450920.mol 000450920.PUBCHEM 000450920.mol (via Jmol)
000450921.b3lyp_6-31g(d).inp

000450921.b3lyp_6-31g(d).qchem.inp (generated)

000450921.b3lyp_6-31g(d).gjf (generated)

000450921.b3lyp_6-31g(d).firefly.inp (generated)

000450921.b3lyp_6-31g(d).smash.inp (generated)

000450921.b3lyp_6-31g(d).nwchem.inp (generated) 000450921.b3lyp_6-31g(d).log.xz 000450921.td-b3lyp_6-31g+(d).inp 000450921.td-b3lyp_6-31g+(d).log.xz

000450921.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450921.td-b3lyp_6-31+g(d).gjf (generated)

000450921.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450921.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450921.mol 000450921.PUBCHEM 000450921.mol (via Jmol)
000450922.b3lyp_6-31g(d).inp

000450922.b3lyp_6-31g(d).qchem.inp (generated)

000450922.b3lyp_6-31g(d).gjf (generated)

000450922.b3lyp_6-31g(d).firefly.inp (generated)

000450922.b3lyp_6-31g(d).smash.inp (generated)

000450922.b3lyp_6-31g(d).nwchem.inp (generated) 000450922.b3lyp_6-31g(d).log.xz 000450922.td-b3lyp_6-31g+(d).inp 000450922.td-b3lyp_6-31g+(d).log.xz

000450922.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450922.td-b3lyp_6-31+g(d).gjf (generated)

000450922.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450922.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450922.mol 000450922.PUBCHEM 000450922.mol (via Jmol)
000450923.b3lyp_6-31g(d).inp

000450923.b3lyp_6-31g(d).qchem.inp (generated)

000450923.b3lyp_6-31g(d).gjf (generated)

000450923.b3lyp_6-31g(d).firefly.inp (generated)

000450923.b3lyp_6-31g(d).smash.inp (generated)

000450923.b3lyp_6-31g(d).nwchem.inp (generated) 000450923.b3lyp_6-31g(d).log.xz 000450923.td-b3lyp_6-31g+(d).inp 000450923.td-b3lyp_6-31g+(d).log.xz

000450923.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450923.td-b3lyp_6-31+g(d).gjf (generated)

000450923.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450923.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450923.mol 000450923.PUBCHEM 000450923.mol (via Jmol)
000450954.b3lyp_6-31g(d).inp

000450954.b3lyp_6-31g(d).qchem.inp (generated)

000450954.b3lyp_6-31g(d).gjf (generated)

000450954.b3lyp_6-31g(d).firefly.inp (generated)

000450954.b3lyp_6-31g(d).smash.inp (generated)

000450954.b3lyp_6-31g(d).nwchem.inp (generated) 000450954.b3lyp_6-31g(d).log.xz 000450954.td-b3lyp_6-31g+(d).inp 000450954.td-b3lyp_6-31g+(d).log.xz

000450954.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450954.td-b3lyp_6-31+g(d).gjf (generated)

000450954.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450954.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450954.mol 000450954.PUBCHEM 000450954.mol (via Jmol)
000450961.b3lyp_6-31g(d).inp

000450961.b3lyp_6-31g(d).qchem.inp (generated)

000450961.b3lyp_6-31g(d).gjf (generated)

000450961.b3lyp_6-31g(d).firefly.inp (generated)

000450961.b3lyp_6-31g(d).smash.inp (generated)

000450961.b3lyp_6-31g(d).nwchem.inp (generated) 000450961.b3lyp_6-31g(d).log.xz 000450961.td-b3lyp_6-31g+(d).inp 000450961.td-b3lyp_6-31g+(d).log.xz

000450961.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450961.td-b3lyp_6-31+g(d).gjf (generated)

000450961.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450961.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450961.mol 000450961.PUBCHEM 000450961.mol (via Jmol)
000450968.b3lyp_6-31g(d).inp

000450968.b3lyp_6-31g(d).qchem.inp (generated)

000450968.b3lyp_6-31g(d).gjf (generated)

000450968.b3lyp_6-31g(d).firefly.inp (generated)

000450968.b3lyp_6-31g(d).smash.inp (generated)

000450968.b3lyp_6-31g(d).nwchem.inp (generated) 000450968.b3lyp_6-31g(d).log.xz 000450968.td-b3lyp_6-31g+(d).inp 000450968.td-b3lyp_6-31g+(d).log.xz

000450968.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450968.td-b3lyp_6-31+g(d).gjf (generated)

000450968.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450968.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450968.mol 000450968.PUBCHEM 000450968.mol (via Jmol)
000450969.b3lyp_6-31g(d).inp

000450969.b3lyp_6-31g(d).qchem.inp (generated)

000450969.b3lyp_6-31g(d).gjf (generated)

000450969.b3lyp_6-31g(d).firefly.inp (generated)

000450969.b3lyp_6-31g(d).smash.inp (generated)

000450969.b3lyp_6-31g(d).nwchem.inp (generated) 000450969.b3lyp_6-31g(d).log.xz 000450969.td-b3lyp_6-31g+(d).inp 000450969.td-b3lyp_6-31g+(d).log.xz

000450969.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450969.td-b3lyp_6-31+g(d).gjf (generated)

000450969.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450969.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450969.mol 000450969.PUBCHEM 000450969.mol (via Jmol)
000450970.b3lyp_6-31g(d).inp

000450970.b3lyp_6-31g(d).qchem.inp (generated)

000450970.b3lyp_6-31g(d).gjf (generated)

000450970.b3lyp_6-31g(d).firefly.inp (generated)

000450970.b3lyp_6-31g(d).smash.inp (generated)

000450970.b3lyp_6-31g(d).nwchem.inp (generated) 000450970.b3lyp_6-31g(d).log.xz 000450970.td-b3lyp_6-31g+(d).inp 000450970.td-b3lyp_6-31g+(d).log.xz

000450970.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450970.td-b3lyp_6-31+g(d).gjf (generated)

000450970.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450970.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450970.mol 000450970.PUBCHEM 000450970.mol (via Jmol)
000450971.b3lyp_6-31g(d).inp

000450971.b3lyp_6-31g(d).qchem.inp (generated)

000450971.b3lyp_6-31g(d).gjf (generated)

000450971.b3lyp_6-31g(d).firefly.inp (generated)

000450971.b3lyp_6-31g(d).smash.inp (generated)

000450971.b3lyp_6-31g(d).nwchem.inp (generated) 000450971.b3lyp_6-31g(d).log.xz 000450971.td-b3lyp_6-31g+(d).inp 000450971.td-b3lyp_6-31g+(d).log.xz

000450971.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450971.td-b3lyp_6-31+g(d).gjf (generated)

000450971.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450971.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450971.mol 000450971.PUBCHEM 000450971.mol (via Jmol)
000450972.b3lyp_6-31g(d).inp

000450972.b3lyp_6-31g(d).qchem.inp (generated)

000450972.b3lyp_6-31g(d).gjf (generated)

000450972.b3lyp_6-31g(d).firefly.inp (generated)

000450972.b3lyp_6-31g(d).smash.inp (generated)

000450972.b3lyp_6-31g(d).nwchem.inp (generated) 000450972.b3lyp_6-31g(d).log.xz 000450972.td-b3lyp_6-31g+(d).inp 000450972.td-b3lyp_6-31g+(d).log.xz

000450972.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450972.td-b3lyp_6-31+g(d).gjf (generated)

000450972.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450972.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450972.mol 000450972.PUBCHEM 000450972.mol (via Jmol)
000450974.b3lyp_6-31g(d).inp

000450974.b3lyp_6-31g(d).qchem.inp (generated)

000450974.b3lyp_6-31g(d).gjf (generated)

000450974.b3lyp_6-31g(d).firefly.inp (generated)

000450974.b3lyp_6-31g(d).smash.inp (generated)

000450974.b3lyp_6-31g(d).nwchem.inp (generated) 000450974.b3lyp_6-31g(d).log.xz 000450974.td-b3lyp_6-31g+(d).inp 000450974.td-b3lyp_6-31g+(d).log.xz

000450974.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450974.td-b3lyp_6-31+g(d).gjf (generated)

000450974.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450974.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450974.mol 000450974.PUBCHEM 000450974.mol (via Jmol)
000450978.b3lyp_6-31g(d).inp

000450978.b3lyp_6-31g(d).qchem.inp (generated)

000450978.b3lyp_6-31g(d).gjf (generated)

000450978.b3lyp_6-31g(d).firefly.inp (generated)

000450978.b3lyp_6-31g(d).smash.inp (generated)

000450978.b3lyp_6-31g(d).nwchem.inp (generated) 000450978.b3lyp_6-31g(d).log.xz 000450978.td-b3lyp_6-31g+(d).inp 000450978.td-b3lyp_6-31g+(d).log.xz

000450978.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450978.td-b3lyp_6-31+g(d).gjf (generated)

000450978.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450978.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450978.mol 000450978.PUBCHEM 000450978.mol (via Jmol)
000450979.b3lyp_6-31g(d).inp

000450979.b3lyp_6-31g(d).qchem.inp (generated)

000450979.b3lyp_6-31g(d).gjf (generated)

000450979.b3lyp_6-31g(d).firefly.inp (generated)

000450979.b3lyp_6-31g(d).smash.inp (generated)

000450979.b3lyp_6-31g(d).nwchem.inp (generated) 000450979.b3lyp_6-31g(d).log.xz 000450979.td-b3lyp_6-31g+(d).inp 000450979.td-b3lyp_6-31g+(d).log.xz

000450979.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450979.td-b3lyp_6-31+g(d).gjf (generated)

000450979.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450979.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450979.mol 000450979.PUBCHEM 000450979.mol (via Jmol)
000450981.b3lyp_6-31g(d).inp

000450981.b3lyp_6-31g(d).qchem.inp (generated)

000450981.b3lyp_6-31g(d).gjf (generated)

000450981.b3lyp_6-31g(d).firefly.inp (generated)

000450981.b3lyp_6-31g(d).smash.inp (generated)

000450981.b3lyp_6-31g(d).nwchem.inp (generated) 000450981.b3lyp_6-31g(d).log.xz 000450981.td-b3lyp_6-31g+(d).inp 000450981.td-b3lyp_6-31g+(d).log.xz

000450981.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450981.td-b3lyp_6-31+g(d).gjf (generated)

000450981.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450981.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450981.mol 000450981.PUBCHEM 000450981.mol (via Jmol)
000450982.b3lyp_6-31g(d).inp

000450982.b3lyp_6-31g(d).qchem.inp (generated)

000450982.b3lyp_6-31g(d).gjf (generated)

000450982.b3lyp_6-31g(d).firefly.inp (generated)

000450982.b3lyp_6-31g(d).smash.inp (generated)

000450982.b3lyp_6-31g(d).nwchem.inp (generated) 000450982.b3lyp_6-31g(d).log.xz 000450982.td-b3lyp_6-31g+(d).inp 000450982.td-b3lyp_6-31g+(d).log.xz

000450982.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450982.td-b3lyp_6-31+g(d).gjf (generated)

000450982.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450982.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450982.mol 000450982.PUBCHEM 000450982.mol (via Jmol)
000450983.b3lyp_6-31g(d).inp

000450983.b3lyp_6-31g(d).qchem.inp (generated)

000450983.b3lyp_6-31g(d).gjf (generated)

000450983.b3lyp_6-31g(d).firefly.inp (generated)

000450983.b3lyp_6-31g(d).smash.inp (generated)

000450983.b3lyp_6-31g(d).nwchem.inp (generated) 000450983.b3lyp_6-31g(d).log.xz 000450983.td-b3lyp_6-31g+(d).inp 000450983.td-b3lyp_6-31g+(d).log.xz

000450983.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450983.td-b3lyp_6-31+g(d).gjf (generated)

000450983.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450983.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450983.mol 000450983.PUBCHEM 000450983.mol (via Jmol)
000450984.b3lyp_6-31g(d).inp

000450984.b3lyp_6-31g(d).qchem.inp (generated)

000450984.b3lyp_6-31g(d).gjf (generated)

000450984.b3lyp_6-31g(d).firefly.inp (generated)

000450984.b3lyp_6-31g(d).smash.inp (generated)

000450984.b3lyp_6-31g(d).nwchem.inp (generated) 000450984.b3lyp_6-31g(d).log.xz 000450984.td-b3lyp_6-31g+(d).inp 000450984.td-b3lyp_6-31g+(d).log.xz

000450984.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450984.td-b3lyp_6-31+g(d).gjf (generated)

000450984.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450984.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450984.mol 000450984.PUBCHEM 000450984.mol (via Jmol)
000450990.b3lyp_6-31g(d).inp

000450990.b3lyp_6-31g(d).qchem.inp (generated)

000450990.b3lyp_6-31g(d).gjf (generated)

000450990.b3lyp_6-31g(d).firefly.inp (generated)

000450990.b3lyp_6-31g(d).smash.inp (generated)

000450990.b3lyp_6-31g(d).nwchem.inp (generated) 000450990.b3lyp_6-31g(d).log.xz 000450990.td-b3lyp_6-31g+(d).inp 000450990.td-b3lyp_6-31g+(d).log.xz

000450990.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450990.td-b3lyp_6-31+g(d).gjf (generated)

000450990.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450990.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450990.mol 000450990.PUBCHEM 000450990.mol (via Jmol)
000450995.b3lyp_6-31g(d).inp

000450995.b3lyp_6-31g(d).qchem.inp (generated)

000450995.b3lyp_6-31g(d).gjf (generated)

000450995.b3lyp_6-31g(d).firefly.inp (generated)

000450995.b3lyp_6-31g(d).smash.inp (generated)

000450995.b3lyp_6-31g(d).nwchem.inp (generated) 000450995.b3lyp_6-31g(d).log.xz 000450995.td-b3lyp_6-31g+(d).inp 000450995.td-b3lyp_6-31g+(d).log.xz

000450995.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450995.td-b3lyp_6-31+g(d).gjf (generated)

000450995.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450995.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450995.mol 000450995.PUBCHEM 000450995.mol (via Jmol)
000450996.b3lyp_6-31g(d).inp

000450996.b3lyp_6-31g(d).qchem.inp (generated)

000450996.b3lyp_6-31g(d).gjf (generated)

000450996.b3lyp_6-31g(d).firefly.inp (generated)

000450996.b3lyp_6-31g(d).smash.inp (generated)

000450996.b3lyp_6-31g(d).nwchem.inp (generated) 000450996.b3lyp_6-31g(d).log.xz 000450996.td-b3lyp_6-31g+(d).inp 000450996.td-b3lyp_6-31g+(d).log.xz

000450996.td-b3lyp_6-31+g(d).qchem.inp (generated)

000450996.td-b3lyp_6-31+g(d).gjf (generated)

000450996.td-b3lyp_6-31+g(d).firefly.inp (generated)

000450996.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000450996.mol 000450996.PUBCHEM 000450996.mol (via Jmol)
000451005.b3lyp_6-31g(d).inp

000451005.b3lyp_6-31g(d).qchem.inp (generated)

000451005.b3lyp_6-31g(d).gjf (generated)

000451005.b3lyp_6-31g(d).firefly.inp (generated)

000451005.b3lyp_6-31g(d).smash.inp (generated)

000451005.b3lyp_6-31g(d).nwchem.inp (generated) 000451005.b3lyp_6-31g(d).log.xz 000451005.td-b3lyp_6-31g+(d).inp 000451005.td-b3lyp_6-31g+(d).log.xz

000451005.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451005.td-b3lyp_6-31+g(d).gjf (generated)

000451005.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451005.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451005.mol 000451005.PUBCHEM 000451005.mol (via Jmol)
000451012.b3lyp_6-31g(d).inp

000451012.b3lyp_6-31g(d).qchem.inp (generated)

000451012.b3lyp_6-31g(d).gjf (generated)

000451012.b3lyp_6-31g(d).firefly.inp (generated)

000451012.b3lyp_6-31g(d).smash.inp (generated)

000451012.b3lyp_6-31g(d).nwchem.inp (generated) 000451012.b3lyp_6-31g(d).log.xz 000451012.td-b3lyp_6-31g+(d).inp 000451012.td-b3lyp_6-31g+(d).log.xz

000451012.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451012.td-b3lyp_6-31+g(d).gjf (generated)

000451012.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451012.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451012.mol 000451012.PUBCHEM 000451012.mol (via Jmol)
000451016.b3lyp_6-31g(d).inp

000451016.b3lyp_6-31g(d).qchem.inp (generated)

000451016.b3lyp_6-31g(d).gjf (generated)

000451016.b3lyp_6-31g(d).firefly.inp (generated)

000451016.b3lyp_6-31g(d).smash.inp (generated)

000451016.b3lyp_6-31g(d).nwchem.inp (generated) 000451016.b3lyp_6-31g(d).log.xz 000451016.td-b3lyp_6-31g+(d).inp 000451016.td-b3lyp_6-31g+(d).log.xz

000451016.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451016.td-b3lyp_6-31+g(d).gjf (generated)

000451016.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451016.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451016.mol 000451016.PUBCHEM 000451016.mol (via Jmol)
000451022.b3lyp_6-31g(d).inp

000451022.b3lyp_6-31g(d).qchem.inp (generated)

000451022.b3lyp_6-31g(d).gjf (generated)

000451022.b3lyp_6-31g(d).firefly.inp (generated)

000451022.b3lyp_6-31g(d).smash.inp (generated)

000451022.b3lyp_6-31g(d).nwchem.inp (generated) 000451022.b3lyp_6-31g(d).log.xz 000451022.td-b3lyp_6-31g+(d).inp 000451022.td-b3lyp_6-31g+(d).log.xz

000451022.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451022.td-b3lyp_6-31+g(d).gjf (generated)

000451022.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451022.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451022.mol 000451022.PUBCHEM 000451022.mol (via Jmol)
000451031.b3lyp_6-31g(d).inp

000451031.b3lyp_6-31g(d).qchem.inp (generated)

000451031.b3lyp_6-31g(d).gjf (generated)

000451031.b3lyp_6-31g(d).firefly.inp (generated)

000451031.b3lyp_6-31g(d).smash.inp (generated)

000451031.b3lyp_6-31g(d).nwchem.inp (generated) 000451031.b3lyp_6-31g(d).log.xz 000451031.td-b3lyp_6-31g+(d).inp 000451031.td-b3lyp_6-31g+(d).log.xz

000451031.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451031.td-b3lyp_6-31+g(d).gjf (generated)

000451031.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451031.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451031.mol 000451031.PUBCHEM 000451031.mol (via Jmol)
000451037.b3lyp_6-31g(d).inp

000451037.b3lyp_6-31g(d).qchem.inp (generated)

000451037.b3lyp_6-31g(d).gjf (generated)

000451037.b3lyp_6-31g(d).firefly.inp (generated)

000451037.b3lyp_6-31g(d).smash.inp (generated)

000451037.b3lyp_6-31g(d).nwchem.inp (generated) 000451037.b3lyp_6-31g(d).log.xz 000451037.td-b3lyp_6-31g+(d).inp 000451037.td-b3lyp_6-31g+(d).log.xz

000451037.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451037.td-b3lyp_6-31+g(d).gjf (generated)

000451037.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451037.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451037.mol 000451037.PUBCHEM 000451037.mol (via Jmol)
000451038.b3lyp_6-31g(d).inp

000451038.b3lyp_6-31g(d).qchem.inp (generated)

000451038.b3lyp_6-31g(d).gjf (generated)

000451038.b3lyp_6-31g(d).firefly.inp (generated)

000451038.b3lyp_6-31g(d).smash.inp (generated)

000451038.b3lyp_6-31g(d).nwchem.inp (generated) 000451038.b3lyp_6-31g(d).log.xz 000451038.td-b3lyp_6-31g+(d).inp 000451038.td-b3lyp_6-31g+(d).log.xz

000451038.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451038.td-b3lyp_6-31+g(d).gjf (generated)

000451038.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451038.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451038.mol 000451038.PUBCHEM 000451038.mol (via Jmol)
000451039.b3lyp_6-31g(d).inp

000451039.b3lyp_6-31g(d).qchem.inp (generated)

000451039.b3lyp_6-31g(d).gjf (generated)

000451039.b3lyp_6-31g(d).firefly.inp (generated)

000451039.b3lyp_6-31g(d).smash.inp (generated)

000451039.b3lyp_6-31g(d).nwchem.inp (generated) 000451039.b3lyp_6-31g(d).log.xz 000451039.td-b3lyp_6-31g+(d).inp 000451039.td-b3lyp_6-31g+(d).log.xz

000451039.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451039.td-b3lyp_6-31+g(d).gjf (generated)

000451039.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451039.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451039.mol 000451039.PUBCHEM 000451039.mol (via Jmol)
000451050.b3lyp_6-31g(d).inp

000451050.b3lyp_6-31g(d).qchem.inp (generated)

000451050.b3lyp_6-31g(d).gjf (generated)

000451050.b3lyp_6-31g(d).firefly.inp (generated)

000451050.b3lyp_6-31g(d).smash.inp (generated)

000451050.b3lyp_6-31g(d).nwchem.inp (generated) 000451050.b3lyp_6-31g(d).log.xz 000451050.td-b3lyp_6-31g+(d).inp 000451050.td-b3lyp_6-31g+(d).log.xz

000451050.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451050.td-b3lyp_6-31+g(d).gjf (generated)

000451050.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451050.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451050.mol 000451050.PUBCHEM 000451050.mol (via Jmol)
000451061.b3lyp_6-31g(d).inp

000451061.b3lyp_6-31g(d).qchem.inp (generated)

000451061.b3lyp_6-31g(d).gjf (generated)

000451061.b3lyp_6-31g(d).firefly.inp (generated)

000451061.b3lyp_6-31g(d).smash.inp (generated)

000451061.b3lyp_6-31g(d).nwchem.inp (generated) 000451061.b3lyp_6-31g(d).log.xz 000451061.td-b3lyp_6-31g+(d).inp 000451061.td-b3lyp_6-31g+(d).log.xz

000451061.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451061.td-b3lyp_6-31+g(d).gjf (generated)

000451061.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451061.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451061.mol 000451061.PUBCHEM 000451061.mol (via Jmol)
000451062.b3lyp_6-31g(d).inp

000451062.b3lyp_6-31g(d).qchem.inp (generated)

000451062.b3lyp_6-31g(d).gjf (generated)

000451062.b3lyp_6-31g(d).firefly.inp (generated)

000451062.b3lyp_6-31g(d).smash.inp (generated)

000451062.b3lyp_6-31g(d).nwchem.inp (generated) 000451062.b3lyp_6-31g(d).log.xz 000451062.td-b3lyp_6-31g+(d).inp 000451062.td-b3lyp_6-31g+(d).log.xz

000451062.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451062.td-b3lyp_6-31+g(d).gjf (generated)

000451062.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451062.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451062.mol 000451062.PUBCHEM 000451062.mol (via Jmol)
000451064.b3lyp_6-31g(d).inp

000451064.b3lyp_6-31g(d).qchem.inp (generated)

000451064.b3lyp_6-31g(d).gjf (generated)

000451064.b3lyp_6-31g(d).firefly.inp (generated)

000451064.b3lyp_6-31g(d).smash.inp (generated)

000451064.b3lyp_6-31g(d).nwchem.inp (generated) 000451064.b3lyp_6-31g(d).log.xz 000451064.td-b3lyp_6-31g+(d).inp 000451064.td-b3lyp_6-31g+(d).log.xz

000451064.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451064.td-b3lyp_6-31+g(d).gjf (generated)

000451064.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451064.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451064.mol 000451064.PUBCHEM 000451064.mol (via Jmol)
000451085.b3lyp_6-31g(d).inp

000451085.b3lyp_6-31g(d).qchem.inp (generated)

000451085.b3lyp_6-31g(d).gjf (generated)

000451085.b3lyp_6-31g(d).firefly.inp (generated)

000451085.b3lyp_6-31g(d).smash.inp (generated)

000451085.b3lyp_6-31g(d).nwchem.inp (generated) 000451085.b3lyp_6-31g(d).log.xz 000451085.td-b3lyp_6-31g+(d).inp 000451085.td-b3lyp_6-31g+(d).log.xz

000451085.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451085.td-b3lyp_6-31+g(d).gjf (generated)

000451085.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451085.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451085.mol 000451085.PUBCHEM 000451085.mol (via Jmol)
000451088.b3lyp_6-31g(d).inp

000451088.b3lyp_6-31g(d).qchem.inp (generated)

000451088.b3lyp_6-31g(d).gjf (generated)

000451088.b3lyp_6-31g(d).firefly.inp (generated)

000451088.b3lyp_6-31g(d).smash.inp (generated)

000451088.b3lyp_6-31g(d).nwchem.inp (generated) 000451088.b3lyp_6-31g(d).log.xz 000451088.td-b3lyp_6-31g+(d).inp 000451088.td-b3lyp_6-31g+(d).log.xz

000451088.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451088.td-b3lyp_6-31+g(d).gjf (generated)

000451088.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451088.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451088.mol 000451088.PUBCHEM 000451088.mol (via Jmol)
000451090.b3lyp_6-31g(d).inp

000451090.b3lyp_6-31g(d).qchem.inp (generated)

000451090.b3lyp_6-31g(d).gjf (generated)

000451090.b3lyp_6-31g(d).firefly.inp (generated)

000451090.b3lyp_6-31g(d).smash.inp (generated)

000451090.b3lyp_6-31g(d).nwchem.inp (generated) 000451090.b3lyp_6-31g(d).log.xz 000451090.td-b3lyp_6-31g+(d).inp 000451090.td-b3lyp_6-31g+(d).log.xz

000451090.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451090.td-b3lyp_6-31+g(d).gjf (generated)

000451090.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451090.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451090.mol 000451090.PUBCHEM 000451090.mol (via Jmol)
000451093.b3lyp_6-31g(d).inp

000451093.b3lyp_6-31g(d).qchem.inp (generated)

000451093.b3lyp_6-31g(d).gjf (generated)

000451093.b3lyp_6-31g(d).firefly.inp (generated)

000451093.b3lyp_6-31g(d).smash.inp (generated)

000451093.b3lyp_6-31g(d).nwchem.inp (generated) 000451093.b3lyp_6-31g(d).log.xz 000451093.td-b3lyp_6-31g+(d).inp 000451093.td-b3lyp_6-31g+(d).log.xz

000451093.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451093.td-b3lyp_6-31+g(d).gjf (generated)

000451093.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451093.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451093.mol 000451093.PUBCHEM 000451093.mol (via Jmol)
000451106.b3lyp_6-31g(d).inp

000451106.b3lyp_6-31g(d).qchem.inp (generated)

000451106.b3lyp_6-31g(d).gjf (generated)

000451106.b3lyp_6-31g(d).firefly.inp (generated)

000451106.b3lyp_6-31g(d).smash.inp (generated)

000451106.b3lyp_6-31g(d).nwchem.inp (generated) 000451106.b3lyp_6-31g(d).log.xz 000451106.td-b3lyp_6-31g+(d).inp 000451106.td-b3lyp_6-31g+(d).log.xz

000451106.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451106.td-b3lyp_6-31+g(d).gjf (generated)

000451106.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451106.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451106.mol 000451106.PUBCHEM 000451106.mol (via Jmol)
000451124.b3lyp_6-31g(d).inp

000451124.b3lyp_6-31g(d).qchem.inp (generated)

000451124.b3lyp_6-31g(d).gjf (generated)

000451124.b3lyp_6-31g(d).firefly.inp (generated)

000451124.b3lyp_6-31g(d).smash.inp (generated)

000451124.b3lyp_6-31g(d).nwchem.inp (generated) 000451124.b3lyp_6-31g(d).log.xz 000451124.td-b3lyp_6-31g+(d).inp 000451124.td-b3lyp_6-31g+(d).log.xz

000451124.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451124.td-b3lyp_6-31+g(d).gjf (generated)

000451124.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451124.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451124.mol 000451124.PUBCHEM 000451124.mol (via Jmol)
000451129.b3lyp_6-31g(d).inp

000451129.b3lyp_6-31g(d).qchem.inp (generated)

000451129.b3lyp_6-31g(d).gjf (generated)

000451129.b3lyp_6-31g(d).firefly.inp (generated)

000451129.b3lyp_6-31g(d).smash.inp (generated)

000451129.b3lyp_6-31g(d).nwchem.inp (generated) 000451129.b3lyp_6-31g(d).log.xz 000451129.td-b3lyp_6-31g+(d).inp 000451129.td-b3lyp_6-31g+(d).log.xz

000451129.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451129.td-b3lyp_6-31+g(d).gjf (generated)

000451129.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451129.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451129.mol 000451129.PUBCHEM 000451129.mol (via Jmol)
000451130.b3lyp_6-31g(d).inp

000451130.b3lyp_6-31g(d).qchem.inp (generated)

000451130.b3lyp_6-31g(d).gjf (generated)

000451130.b3lyp_6-31g(d).firefly.inp (generated)

000451130.b3lyp_6-31g(d).smash.inp (generated)

000451130.b3lyp_6-31g(d).nwchem.inp (generated) 000451130.b3lyp_6-31g(d).log.xz 000451130.td-b3lyp_6-31g+(d).inp 000451130.td-b3lyp_6-31g+(d).log.xz

000451130.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451130.td-b3lyp_6-31+g(d).gjf (generated)

000451130.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451130.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451130.mol 000451130.PUBCHEM 000451130.mol (via Jmol)
000451131.b3lyp_6-31g(d).inp

000451131.b3lyp_6-31g(d).qchem.inp (generated)

000451131.b3lyp_6-31g(d).gjf (generated)

000451131.b3lyp_6-31g(d).firefly.inp (generated)

000451131.b3lyp_6-31g(d).smash.inp (generated)

000451131.b3lyp_6-31g(d).nwchem.inp (generated) 000451131.b3lyp_6-31g(d).log.xz 000451131.td-b3lyp_6-31g+(d).inp 000451131.td-b3lyp_6-31g+(d).log.xz

000451131.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451131.td-b3lyp_6-31+g(d).gjf (generated)

000451131.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451131.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451131.mol 000451131.PUBCHEM 000451131.mol (via Jmol)
000451132.b3lyp_6-31g(d).inp

000451132.b3lyp_6-31g(d).qchem.inp (generated)

000451132.b3lyp_6-31g(d).gjf (generated)

000451132.b3lyp_6-31g(d).firefly.inp (generated)

000451132.b3lyp_6-31g(d).smash.inp (generated)

000451132.b3lyp_6-31g(d).nwchem.inp (generated) 000451132.b3lyp_6-31g(d).log.xz 000451132.td-b3lyp_6-31g+(d).inp 000451132.td-b3lyp_6-31g+(d).log.xz

000451132.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451132.td-b3lyp_6-31+g(d).gjf (generated)

000451132.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451132.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451132.mol 000451132.PUBCHEM 000451132.mol (via Jmol)
000451133.b3lyp_6-31g(d).inp

000451133.b3lyp_6-31g(d).qchem.inp (generated)

000451133.b3lyp_6-31g(d).gjf (generated)

000451133.b3lyp_6-31g(d).firefly.inp (generated)

000451133.b3lyp_6-31g(d).smash.inp (generated)

000451133.b3lyp_6-31g(d).nwchem.inp (generated) 000451133.b3lyp_6-31g(d).log.xz 000451133.td-b3lyp_6-31g+(d).inp 000451133.td-b3lyp_6-31g+(d).log.xz

000451133.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451133.td-b3lyp_6-31+g(d).gjf (generated)

000451133.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451133.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451133.mol 000451133.PUBCHEM 000451133.mol (via Jmol)
000451187.b3lyp_6-31g(d).inp

000451187.b3lyp_6-31g(d).qchem.inp (generated)

000451187.b3lyp_6-31g(d).gjf (generated)

000451187.b3lyp_6-31g(d).firefly.inp (generated)

000451187.b3lyp_6-31g(d).smash.inp (generated)

000451187.b3lyp_6-31g(d).nwchem.inp (generated) 000451187.b3lyp_6-31g(d).log.xz 000451187.td-b3lyp_6-31g+(d).inp 000451187.td-b3lyp_6-31g+(d).log.xz

000451187.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451187.td-b3lyp_6-31+g(d).gjf (generated)

000451187.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451187.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451187.mol 000451187.PUBCHEM 000451187.mol (via Jmol)
000451188.b3lyp_6-31g(d).inp

000451188.b3lyp_6-31g(d).qchem.inp (generated)

000451188.b3lyp_6-31g(d).gjf (generated)

000451188.b3lyp_6-31g(d).firefly.inp (generated)

000451188.b3lyp_6-31g(d).smash.inp (generated)

000451188.b3lyp_6-31g(d).nwchem.inp (generated) 000451188.b3lyp_6-31g(d).log.xz 000451188.td-b3lyp_6-31g+(d).inp 000451188.td-b3lyp_6-31g+(d).log.xz

000451188.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451188.td-b3lyp_6-31+g(d).gjf (generated)

000451188.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451188.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451188.mol 000451188.PUBCHEM 000451188.mol (via Jmol)
000451189.b3lyp_6-31g(d).inp

000451189.b3lyp_6-31g(d).qchem.inp (generated)

000451189.b3lyp_6-31g(d).gjf (generated)

000451189.b3lyp_6-31g(d).firefly.inp (generated)

000451189.b3lyp_6-31g(d).smash.inp (generated)

000451189.b3lyp_6-31g(d).nwchem.inp (generated) 000451189.b3lyp_6-31g(d).log.xz 000451189.td-b3lyp_6-31g+(d).inp 000451189.td-b3lyp_6-31g+(d).log.xz

000451189.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451189.td-b3lyp_6-31+g(d).gjf (generated)

000451189.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451189.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451189.mol 000451189.PUBCHEM 000451189.mol (via Jmol)
000451190.b3lyp_6-31g(d).inp

000451190.b3lyp_6-31g(d).qchem.inp (generated)

000451190.b3lyp_6-31g(d).gjf (generated)

000451190.b3lyp_6-31g(d).firefly.inp (generated)

000451190.b3lyp_6-31g(d).smash.inp (generated)

000451190.b3lyp_6-31g(d).nwchem.inp (generated) 000451190.b3lyp_6-31g(d).log.xz 000451190.td-b3lyp_6-31g+(d).inp 000451190.td-b3lyp_6-31g+(d).log.xz

000451190.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451190.td-b3lyp_6-31+g(d).gjf (generated)

000451190.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451190.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451190.mol 000451190.PUBCHEM 000451190.mol (via Jmol)
000451191.b3lyp_6-31g(d).inp

000451191.b3lyp_6-31g(d).qchem.inp (generated)

000451191.b3lyp_6-31g(d).gjf (generated)

000451191.b3lyp_6-31g(d).firefly.inp (generated)

000451191.b3lyp_6-31g(d).smash.inp (generated)

000451191.b3lyp_6-31g(d).nwchem.inp (generated) 000451191.b3lyp_6-31g(d).log.xz 000451191.td-b3lyp_6-31g+(d).inp 000451191.td-b3lyp_6-31g+(d).log.xz

000451191.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451191.td-b3lyp_6-31+g(d).gjf (generated)

000451191.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451191.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451191.mol 000451191.PUBCHEM 000451191.mol (via Jmol)
000451192.b3lyp_6-31g(d).inp

000451192.b3lyp_6-31g(d).qchem.inp (generated)

000451192.b3lyp_6-31g(d).gjf (generated)

000451192.b3lyp_6-31g(d).firefly.inp (generated)

000451192.b3lyp_6-31g(d).smash.inp (generated)

000451192.b3lyp_6-31g(d).nwchem.inp (generated) 000451192.b3lyp_6-31g(d).log.xz 000451192.td-b3lyp_6-31g+(d).inp 000451192.td-b3lyp_6-31g+(d).log.xz

000451192.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451192.td-b3lyp_6-31+g(d).gjf (generated)

000451192.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451192.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451192.mol 000451192.PUBCHEM 000451192.mol (via Jmol)
000451193.b3lyp_6-31g(d).inp

000451193.b3lyp_6-31g(d).qchem.inp (generated)

000451193.b3lyp_6-31g(d).gjf (generated)

000451193.b3lyp_6-31g(d).firefly.inp (generated)

000451193.b3lyp_6-31g(d).smash.inp (generated)

000451193.b3lyp_6-31g(d).nwchem.inp (generated) 000451193.b3lyp_6-31g(d).log.xz 000451193.td-b3lyp_6-31g+(d).inp 000451193.td-b3lyp_6-31g+(d).log.xz

000451193.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451193.td-b3lyp_6-31+g(d).gjf (generated)

000451193.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451193.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451193.mol 000451193.PUBCHEM 000451193.mol (via Jmol)
000451194.b3lyp_6-31g(d).inp

000451194.b3lyp_6-31g(d).qchem.inp (generated)

000451194.b3lyp_6-31g(d).gjf (generated)

000451194.b3lyp_6-31g(d).firefly.inp (generated)

000451194.b3lyp_6-31g(d).smash.inp (generated)

000451194.b3lyp_6-31g(d).nwchem.inp (generated) 000451194.b3lyp_6-31g(d).log.xz 000451194.td-b3lyp_6-31g+(d).inp 000451194.td-b3lyp_6-31g+(d).log.xz

000451194.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451194.td-b3lyp_6-31+g(d).gjf (generated)

000451194.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451194.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451194.mol 000451194.PUBCHEM 000451194.mol (via Jmol)
000451195.b3lyp_6-31g(d).inp

000451195.b3lyp_6-31g(d).qchem.inp (generated)

000451195.b3lyp_6-31g(d).gjf (generated)

000451195.b3lyp_6-31g(d).firefly.inp (generated)

000451195.b3lyp_6-31g(d).smash.inp (generated)

000451195.b3lyp_6-31g(d).nwchem.inp (generated) 000451195.b3lyp_6-31g(d).log.xz 000451195.td-b3lyp_6-31g+(d).inp 000451195.td-b3lyp_6-31g+(d).log.xz

000451195.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451195.td-b3lyp_6-31+g(d).gjf (generated)

000451195.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451195.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451195.mol 000451195.PUBCHEM 000451195.mol (via Jmol)
000451196.b3lyp_6-31g(d).inp

000451196.b3lyp_6-31g(d).qchem.inp (generated)

000451196.b3lyp_6-31g(d).gjf (generated)

000451196.b3lyp_6-31g(d).firefly.inp (generated)

000451196.b3lyp_6-31g(d).smash.inp (generated)

000451196.b3lyp_6-31g(d).nwchem.inp (generated) 000451196.b3lyp_6-31g(d).log.xz 000451196.td-b3lyp_6-31g+(d).inp 000451196.td-b3lyp_6-31g+(d).log.xz

000451196.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451196.td-b3lyp_6-31+g(d).gjf (generated)

000451196.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451196.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451196.mol 000451196.PUBCHEM 000451196.mol (via Jmol)
000451197.b3lyp_6-31g(d).inp

000451197.b3lyp_6-31g(d).qchem.inp (generated)

000451197.b3lyp_6-31g(d).gjf (generated)

000451197.b3lyp_6-31g(d).firefly.inp (generated)

000451197.b3lyp_6-31g(d).smash.inp (generated)

000451197.b3lyp_6-31g(d).nwchem.inp (generated) 000451197.b3lyp_6-31g(d).log.xz 000451197.td-b3lyp_6-31g+(d).inp 000451197.td-b3lyp_6-31g+(d).log.xz

000451197.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451197.td-b3lyp_6-31+g(d).gjf (generated)

000451197.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451197.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451197.mol 000451197.PUBCHEM 000451197.mol (via Jmol)
000451198.b3lyp_6-31g(d).inp

000451198.b3lyp_6-31g(d).qchem.inp (generated)

000451198.b3lyp_6-31g(d).gjf (generated)

000451198.b3lyp_6-31g(d).firefly.inp (generated)

000451198.b3lyp_6-31g(d).smash.inp (generated)

000451198.b3lyp_6-31g(d).nwchem.inp (generated) 000451198.b3lyp_6-31g(d).log.xz 000451198.td-b3lyp_6-31g+(d).inp 000451198.td-b3lyp_6-31g+(d).log.xz

000451198.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451198.td-b3lyp_6-31+g(d).gjf (generated)

000451198.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451198.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451198.mol 000451198.PUBCHEM 000451198.mol (via Jmol)
000451199.b3lyp_6-31g(d).inp

000451199.b3lyp_6-31g(d).qchem.inp (generated)

000451199.b3lyp_6-31g(d).gjf (generated)

000451199.b3lyp_6-31g(d).firefly.inp (generated)

000451199.b3lyp_6-31g(d).smash.inp (generated)

000451199.b3lyp_6-31g(d).nwchem.inp (generated) 000451199.b3lyp_6-31g(d).log.xz 000451199.td-b3lyp_6-31g+(d).inp 000451199.td-b3lyp_6-31g+(d).log.xz

000451199.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451199.td-b3lyp_6-31+g(d).gjf (generated)

000451199.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451199.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451199.mol 000451199.PUBCHEM 000451199.mol (via Jmol)
000451200.b3lyp_6-31g(d).inp

000451200.b3lyp_6-31g(d).qchem.inp (generated)

000451200.b3lyp_6-31g(d).gjf (generated)

000451200.b3lyp_6-31g(d).firefly.inp (generated)

000451200.b3lyp_6-31g(d).smash.inp (generated)

000451200.b3lyp_6-31g(d).nwchem.inp (generated) 000451200.b3lyp_6-31g(d).log.xz 000451200.td-b3lyp_6-31g+(d).inp 000451200.td-b3lyp_6-31g+(d).log.xz

000451200.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451200.td-b3lyp_6-31+g(d).gjf (generated)

000451200.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451200.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451200.mol 000451200.PUBCHEM 000451200.mol (via Jmol)
000451201.b3lyp_6-31g(d).inp

000451201.b3lyp_6-31g(d).qchem.inp (generated)

000451201.b3lyp_6-31g(d).gjf (generated)

000451201.b3lyp_6-31g(d).firefly.inp (generated)

000451201.b3lyp_6-31g(d).smash.inp (generated)

000451201.b3lyp_6-31g(d).nwchem.inp (generated) 000451201.b3lyp_6-31g(d).log.xz 000451201.td-b3lyp_6-31g+(d).inp 000451201.td-b3lyp_6-31g+(d).log.xz

000451201.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451201.td-b3lyp_6-31+g(d).gjf (generated)

000451201.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451201.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451201.mol 000451201.PUBCHEM 000451201.mol (via Jmol)
000451202.b3lyp_6-31g(d).inp

000451202.b3lyp_6-31g(d).qchem.inp (generated)

000451202.b3lyp_6-31g(d).gjf (generated)

000451202.b3lyp_6-31g(d).firefly.inp (generated)

000451202.b3lyp_6-31g(d).smash.inp (generated)

000451202.b3lyp_6-31g(d).nwchem.inp (generated) 000451202.b3lyp_6-31g(d).log.xz 000451202.td-b3lyp_6-31g+(d).inp 000451202.td-b3lyp_6-31g+(d).log.xz

000451202.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451202.td-b3lyp_6-31+g(d).gjf (generated)

000451202.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451202.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451202.mol 000451202.PUBCHEM 000451202.mol (via Jmol)
000451203.b3lyp_6-31g(d).inp

000451203.b3lyp_6-31g(d).qchem.inp (generated)

000451203.b3lyp_6-31g(d).gjf (generated)

000451203.b3lyp_6-31g(d).firefly.inp (generated)

000451203.b3lyp_6-31g(d).smash.inp (generated)

000451203.b3lyp_6-31g(d).nwchem.inp (generated) 000451203.b3lyp_6-31g(d).log.xz 000451203.td-b3lyp_6-31g+(d).inp 000451203.td-b3lyp_6-31g+(d).log.xz

000451203.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451203.td-b3lyp_6-31+g(d).gjf (generated)

000451203.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451203.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451203.mol 000451203.PUBCHEM 000451203.mol (via Jmol)
000451204.b3lyp_6-31g(d).inp

000451204.b3lyp_6-31g(d).qchem.inp (generated)

000451204.b3lyp_6-31g(d).gjf (generated)

000451204.b3lyp_6-31g(d).firefly.inp (generated)

000451204.b3lyp_6-31g(d).smash.inp (generated)

000451204.b3lyp_6-31g(d).nwchem.inp (generated) 000451204.b3lyp_6-31g(d).log.xz 000451204.td-b3lyp_6-31g+(d).inp 000451204.td-b3lyp_6-31g+(d).log.xz

000451204.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451204.td-b3lyp_6-31+g(d).gjf (generated)

000451204.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451204.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451204.mol 000451204.PUBCHEM 000451204.mol (via Jmol)
000451205.b3lyp_6-31g(d).inp

000451205.b3lyp_6-31g(d).qchem.inp (generated)

000451205.b3lyp_6-31g(d).gjf (generated)

000451205.b3lyp_6-31g(d).firefly.inp (generated)

000451205.b3lyp_6-31g(d).smash.inp (generated)

000451205.b3lyp_6-31g(d).nwchem.inp (generated) 000451205.b3lyp_6-31g(d).log.xz 000451205.td-b3lyp_6-31g+(d).inp 000451205.td-b3lyp_6-31g+(d).log.xz

000451205.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451205.td-b3lyp_6-31+g(d).gjf (generated)

000451205.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451205.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451205.mol 000451205.PUBCHEM 000451205.mol (via Jmol)
000451207.b3lyp_6-31g(d).inp

000451207.b3lyp_6-31g(d).qchem.inp (generated)

000451207.b3lyp_6-31g(d).gjf (generated)

000451207.b3lyp_6-31g(d).firefly.inp (generated)

000451207.b3lyp_6-31g(d).smash.inp (generated)

000451207.b3lyp_6-31g(d).nwchem.inp (generated) 000451207.b3lyp_6-31g(d).log.xz 000451207.td-b3lyp_6-31g+(d).inp 000451207.td-b3lyp_6-31g+(d).log.xz

000451207.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451207.td-b3lyp_6-31+g(d).gjf (generated)

000451207.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451207.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451207.mol 000451207.PUBCHEM 000451207.mol (via Jmol)
000451209.b3lyp_6-31g(d).inp

000451209.b3lyp_6-31g(d).qchem.inp (generated)

000451209.b3lyp_6-31g(d).gjf (generated)

000451209.b3lyp_6-31g(d).firefly.inp (generated)

000451209.b3lyp_6-31g(d).smash.inp (generated)

000451209.b3lyp_6-31g(d).nwchem.inp (generated) 000451209.b3lyp_6-31g(d).log.xz 000451209.td-b3lyp_6-31g+(d).inp 000451209.td-b3lyp_6-31g+(d).log.xz

000451209.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451209.td-b3lyp_6-31+g(d).gjf (generated)

000451209.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451209.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451209.mol 000451209.PUBCHEM 000451209.mol (via Jmol)
000451210.b3lyp_6-31g(d).inp

000451210.b3lyp_6-31g(d).qchem.inp (generated)

000451210.b3lyp_6-31g(d).gjf (generated)

000451210.b3lyp_6-31g(d).firefly.inp (generated)

000451210.b3lyp_6-31g(d).smash.inp (generated)

000451210.b3lyp_6-31g(d).nwchem.inp (generated) 000451210.b3lyp_6-31g(d).log.xz 000451210.td-b3lyp_6-31g+(d).inp 000451210.td-b3lyp_6-31g+(d).log.xz

000451210.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451210.td-b3lyp_6-31+g(d).gjf (generated)

000451210.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451210.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451210.mol 000451210.PUBCHEM 000451210.mol (via Jmol)
000451211.b3lyp_6-31g(d).inp

000451211.b3lyp_6-31g(d).qchem.inp (generated)

000451211.b3lyp_6-31g(d).gjf (generated)

000451211.b3lyp_6-31g(d).firefly.inp (generated)

000451211.b3lyp_6-31g(d).smash.inp (generated)

000451211.b3lyp_6-31g(d).nwchem.inp (generated) 000451211.b3lyp_6-31g(d).log.xz 000451211.td-b3lyp_6-31g+(d).inp 000451211.td-b3lyp_6-31g+(d).log.xz

000451211.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451211.td-b3lyp_6-31+g(d).gjf (generated)

000451211.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451211.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451211.mol 000451211.PUBCHEM 000451211.mol (via Jmol)
000451212.b3lyp_6-31g(d).inp

000451212.b3lyp_6-31g(d).qchem.inp (generated)

000451212.b3lyp_6-31g(d).gjf (generated)

000451212.b3lyp_6-31g(d).firefly.inp (generated)

000451212.b3lyp_6-31g(d).smash.inp (generated)

000451212.b3lyp_6-31g(d).nwchem.inp (generated) 000451212.b3lyp_6-31g(d).log.xz 000451212.td-b3lyp_6-31g+(d).inp 000451212.td-b3lyp_6-31g+(d).log.xz

000451212.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451212.td-b3lyp_6-31+g(d).gjf (generated)

000451212.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451212.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451212.mol 000451212.PUBCHEM 000451212.mol (via Jmol)
000451213.b3lyp_6-31g(d).inp

000451213.b3lyp_6-31g(d).qchem.inp (generated)

000451213.b3lyp_6-31g(d).gjf (generated)

000451213.b3lyp_6-31g(d).firefly.inp (generated)

000451213.b3lyp_6-31g(d).smash.inp (generated)

000451213.b3lyp_6-31g(d).nwchem.inp (generated) 000451213.b3lyp_6-31g(d).log.xz 000451213.td-b3lyp_6-31g+(d).inp 000451213.td-b3lyp_6-31g+(d).log.xz

000451213.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451213.td-b3lyp_6-31+g(d).gjf (generated)

000451213.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451213.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451213.mol 000451213.PUBCHEM 000451213.mol (via Jmol)
000451214.b3lyp_6-31g(d).inp

000451214.b3lyp_6-31g(d).qchem.inp (generated)

000451214.b3lyp_6-31g(d).gjf (generated)

000451214.b3lyp_6-31g(d).firefly.inp (generated)

000451214.b3lyp_6-31g(d).smash.inp (generated)

000451214.b3lyp_6-31g(d).nwchem.inp (generated) 000451214.b3lyp_6-31g(d).log.xz 000451214.td-b3lyp_6-31g+(d).inp 000451214.td-b3lyp_6-31g+(d).log.xz

000451214.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451214.td-b3lyp_6-31+g(d).gjf (generated)

000451214.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451214.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451214.mol 000451214.PUBCHEM 000451214.mol (via Jmol)
000451215.b3lyp_6-31g(d).inp

000451215.b3lyp_6-31g(d).qchem.inp (generated)

000451215.b3lyp_6-31g(d).gjf (generated)

000451215.b3lyp_6-31g(d).firefly.inp (generated)

000451215.b3lyp_6-31g(d).smash.inp (generated)

000451215.b3lyp_6-31g(d).nwchem.inp (generated) 000451215.b3lyp_6-31g(d).log.xz 000451215.td-b3lyp_6-31g+(d).inp 000451215.td-b3lyp_6-31g+(d).log.xz

000451215.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451215.td-b3lyp_6-31+g(d).gjf (generated)

000451215.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451215.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451215.mol 000451215.PUBCHEM 000451215.mol (via Jmol)
000451216.b3lyp_6-31g(d).inp

000451216.b3lyp_6-31g(d).qchem.inp (generated)

000451216.b3lyp_6-31g(d).gjf (generated)

000451216.b3lyp_6-31g(d).firefly.inp (generated)

000451216.b3lyp_6-31g(d).smash.inp (generated)

000451216.b3lyp_6-31g(d).nwchem.inp (generated) 000451216.b3lyp_6-31g(d).log.xz 000451216.td-b3lyp_6-31g+(d).inp 000451216.td-b3lyp_6-31g+(d).log.xz

000451216.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451216.td-b3lyp_6-31+g(d).gjf (generated)

000451216.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451216.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451216.mol 000451216.PUBCHEM 000451216.mol (via Jmol)
000451217.b3lyp_6-31g(d).inp

000451217.b3lyp_6-31g(d).qchem.inp (generated)

000451217.b3lyp_6-31g(d).gjf (generated)

000451217.b3lyp_6-31g(d).firefly.inp (generated)

000451217.b3lyp_6-31g(d).smash.inp (generated)

000451217.b3lyp_6-31g(d).nwchem.inp (generated) 000451217.b3lyp_6-31g(d).log.xz 000451217.td-b3lyp_6-31g+(d).inp 000451217.td-b3lyp_6-31g+(d).log.xz

000451217.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451217.td-b3lyp_6-31+g(d).gjf (generated)

000451217.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451217.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451217.mol 000451217.PUBCHEM 000451217.mol (via Jmol)
000451220.b3lyp_6-31g(d).inp

000451220.b3lyp_6-31g(d).qchem.inp (generated)

000451220.b3lyp_6-31g(d).gjf (generated)

000451220.b3lyp_6-31g(d).firefly.inp (generated)

000451220.b3lyp_6-31g(d).smash.inp (generated)

000451220.b3lyp_6-31g(d).nwchem.inp (generated) 000451220.b3lyp_6-31g(d).log.xz 000451220.td-b3lyp_6-31g+(d).inp 000451220.td-b3lyp_6-31g+(d).log.xz

000451220.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451220.td-b3lyp_6-31+g(d).gjf (generated)

000451220.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451220.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451220.mol 000451220.PUBCHEM 000451220.mol (via Jmol)
000451221.b3lyp_6-31g(d).inp

000451221.b3lyp_6-31g(d).qchem.inp (generated)

000451221.b3lyp_6-31g(d).gjf (generated)

000451221.b3lyp_6-31g(d).firefly.inp (generated)

000451221.b3lyp_6-31g(d).smash.inp (generated)

000451221.b3lyp_6-31g(d).nwchem.inp (generated) 000451221.b3lyp_6-31g(d).log.xz 000451221.td-b3lyp_6-31g+(d).inp 000451221.td-b3lyp_6-31g+(d).log.xz

000451221.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451221.td-b3lyp_6-31+g(d).gjf (generated)

000451221.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451221.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451221.mol 000451221.PUBCHEM 000451221.mol (via Jmol)
000451224.b3lyp_6-31g(d).inp

000451224.b3lyp_6-31g(d).qchem.inp (generated)

000451224.b3lyp_6-31g(d).gjf (generated)

000451224.b3lyp_6-31g(d).firefly.inp (generated)

000451224.b3lyp_6-31g(d).smash.inp (generated)

000451224.b3lyp_6-31g(d).nwchem.inp (generated) 000451224.b3lyp_6-31g(d).log.xz 000451224.td-b3lyp_6-31g+(d).inp 000451224.td-b3lyp_6-31g+(d).log.xz

000451224.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451224.td-b3lyp_6-31+g(d).gjf (generated)

000451224.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451224.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451224.mol 000451224.PUBCHEM 000451224.mol (via Jmol)
000451225.b3lyp_6-31g(d).inp

000451225.b3lyp_6-31g(d).qchem.inp (generated)

000451225.b3lyp_6-31g(d).gjf (generated)

000451225.b3lyp_6-31g(d).firefly.inp (generated)

000451225.b3lyp_6-31g(d).smash.inp (generated)

000451225.b3lyp_6-31g(d).nwchem.inp (generated) 000451225.b3lyp_6-31g(d).log.xz 000451225.td-b3lyp_6-31g+(d).inp 000451225.td-b3lyp_6-31g+(d).log.xz

000451225.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451225.td-b3lyp_6-31+g(d).gjf (generated)

000451225.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451225.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451225.mol 000451225.PUBCHEM 000451225.mol (via Jmol)
000451226.b3lyp_6-31g(d).inp

000451226.b3lyp_6-31g(d).qchem.inp (generated)

000451226.b3lyp_6-31g(d).gjf (generated)

000451226.b3lyp_6-31g(d).firefly.inp (generated)

000451226.b3lyp_6-31g(d).smash.inp (generated)

000451226.b3lyp_6-31g(d).nwchem.inp (generated) 000451226.b3lyp_6-31g(d).log.xz 000451226.td-b3lyp_6-31g+(d).inp 000451226.td-b3lyp_6-31g+(d).log.xz

000451226.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451226.td-b3lyp_6-31+g(d).gjf (generated)

000451226.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451226.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451226.mol 000451226.PUBCHEM 000451226.mol (via Jmol)
000451227.b3lyp_6-31g(d).inp

000451227.b3lyp_6-31g(d).qchem.inp (generated)

000451227.b3lyp_6-31g(d).gjf (generated)

000451227.b3lyp_6-31g(d).firefly.inp (generated)

000451227.b3lyp_6-31g(d).smash.inp (generated)

000451227.b3lyp_6-31g(d).nwchem.inp (generated) 000451227.b3lyp_6-31g(d).log.xz 000451227.td-b3lyp_6-31g+(d).inp 000451227.td-b3lyp_6-31g+(d).log.xz

000451227.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451227.td-b3lyp_6-31+g(d).gjf (generated)

000451227.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451227.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451227.mol 000451227.PUBCHEM 000451227.mol (via Jmol)
000451229.b3lyp_6-31g(d).inp

000451229.b3lyp_6-31g(d).qchem.inp (generated)

000451229.b3lyp_6-31g(d).gjf (generated)

000451229.b3lyp_6-31g(d).firefly.inp (generated)

000451229.b3lyp_6-31g(d).smash.inp (generated)

000451229.b3lyp_6-31g(d).nwchem.inp (generated) 000451229.b3lyp_6-31g(d).log.xz 000451229.td-b3lyp_6-31g+(d).inp 000451229.td-b3lyp_6-31g+(d).log.xz

000451229.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451229.td-b3lyp_6-31+g(d).gjf (generated)

000451229.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451229.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451229.mol 000451229.PUBCHEM 000451229.mol (via Jmol)
000451230.b3lyp_6-31g(d).inp

000451230.b3lyp_6-31g(d).qchem.inp (generated)

000451230.b3lyp_6-31g(d).gjf (generated)

000451230.b3lyp_6-31g(d).firefly.inp (generated)

000451230.b3lyp_6-31g(d).smash.inp (generated)

000451230.b3lyp_6-31g(d).nwchem.inp (generated) 000451230.b3lyp_6-31g(d).log.xz 000451230.td-b3lyp_6-31g+(d).inp 000451230.td-b3lyp_6-31g+(d).log.xz

000451230.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451230.td-b3lyp_6-31+g(d).gjf (generated)

000451230.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451230.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451230.mol 000451230.PUBCHEM 000451230.mol (via Jmol)
000451231.b3lyp_6-31g(d).inp

000451231.b3lyp_6-31g(d).qchem.inp (generated)

000451231.b3lyp_6-31g(d).gjf (generated)

000451231.b3lyp_6-31g(d).firefly.inp (generated)

000451231.b3lyp_6-31g(d).smash.inp (generated)

000451231.b3lyp_6-31g(d).nwchem.inp (generated) 000451231.b3lyp_6-31g(d).log.xz 000451231.td-b3lyp_6-31g+(d).inp 000451231.td-b3lyp_6-31g+(d).log.xz

000451231.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451231.td-b3lyp_6-31+g(d).gjf (generated)

000451231.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451231.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451231.mol 000451231.PUBCHEM 000451231.mol (via Jmol)
000451235.b3lyp_6-31g(d).inp

000451235.b3lyp_6-31g(d).qchem.inp (generated)

000451235.b3lyp_6-31g(d).gjf (generated)

000451235.b3lyp_6-31g(d).firefly.inp (generated)

000451235.b3lyp_6-31g(d).smash.inp (generated)

000451235.b3lyp_6-31g(d).nwchem.inp (generated) 000451235.b3lyp_6-31g(d).log.xz 000451235.td-b3lyp_6-31g+(d).inp 000451235.td-b3lyp_6-31g+(d).log.xz

000451235.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451235.td-b3lyp_6-31+g(d).gjf (generated)

000451235.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451235.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451235.mol 000451235.PUBCHEM 000451235.mol (via Jmol)
000451244.b3lyp_6-31g(d).inp

000451244.b3lyp_6-31g(d).qchem.inp (generated)

000451244.b3lyp_6-31g(d).gjf (generated)

000451244.b3lyp_6-31g(d).firefly.inp (generated)

000451244.b3lyp_6-31g(d).smash.inp (generated)

000451244.b3lyp_6-31g(d).nwchem.inp (generated) 000451244.b3lyp_6-31g(d).log.xz 000451244.td-b3lyp_6-31g+(d).inp 000451244.td-b3lyp_6-31g+(d).log.xz

000451244.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451244.td-b3lyp_6-31+g(d).gjf (generated)

000451244.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451244.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451244.mol 000451244.PUBCHEM 000451244.mol (via Jmol)
000451245.b3lyp_6-31g(d).inp

000451245.b3lyp_6-31g(d).qchem.inp (generated)

000451245.b3lyp_6-31g(d).gjf (generated)

000451245.b3lyp_6-31g(d).firefly.inp (generated)

000451245.b3lyp_6-31g(d).smash.inp (generated)

000451245.b3lyp_6-31g(d).nwchem.inp (generated) 000451245.b3lyp_6-31g(d).log.xz 000451245.td-b3lyp_6-31g+(d).inp 000451245.td-b3lyp_6-31g+(d).log.xz

000451245.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451245.td-b3lyp_6-31+g(d).gjf (generated)

000451245.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451245.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451245.mol 000451245.PUBCHEM 000451245.mol (via Jmol)
000451246.b3lyp_6-31g(d).inp

000451246.b3lyp_6-31g(d).qchem.inp (generated)

000451246.b3lyp_6-31g(d).gjf (generated)

000451246.b3lyp_6-31g(d).firefly.inp (generated)

000451246.b3lyp_6-31g(d).smash.inp (generated)

000451246.b3lyp_6-31g(d).nwchem.inp (generated) 000451246.b3lyp_6-31g(d).log.xz 000451246.td-b3lyp_6-31g+(d).inp 000451246.td-b3lyp_6-31g+(d).log.xz

000451246.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451246.td-b3lyp_6-31+g(d).gjf (generated)

000451246.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451246.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451246.mol 000451246.PUBCHEM 000451246.mol (via Jmol)
000451247.b3lyp_6-31g(d).inp

000451247.b3lyp_6-31g(d).qchem.inp (generated)

000451247.b3lyp_6-31g(d).gjf (generated)

000451247.b3lyp_6-31g(d).firefly.inp (generated)

000451247.b3lyp_6-31g(d).smash.inp (generated)

000451247.b3lyp_6-31g(d).nwchem.inp (generated) 000451247.b3lyp_6-31g(d).log.xz 000451247.td-b3lyp_6-31g+(d).inp 000451247.td-b3lyp_6-31g+(d).log.xz

000451247.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451247.td-b3lyp_6-31+g(d).gjf (generated)

000451247.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451247.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451247.mol 000451247.PUBCHEM 000451247.mol (via Jmol)
000451248.b3lyp_6-31g(d).inp

000451248.b3lyp_6-31g(d).qchem.inp (generated)

000451248.b3lyp_6-31g(d).gjf (generated)

000451248.b3lyp_6-31g(d).firefly.inp (generated)

000451248.b3lyp_6-31g(d).smash.inp (generated)

000451248.b3lyp_6-31g(d).nwchem.inp (generated) 000451248.b3lyp_6-31g(d).log.xz 000451248.td-b3lyp_6-31g+(d).inp 000451248.td-b3lyp_6-31g+(d).log.xz

000451248.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451248.td-b3lyp_6-31+g(d).gjf (generated)

000451248.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451248.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451248.mol 000451248.PUBCHEM 000451248.mol (via Jmol)
000451253.b3lyp_6-31g(d).inp

000451253.b3lyp_6-31g(d).qchem.inp (generated)

000451253.b3lyp_6-31g(d).gjf (generated)

000451253.b3lyp_6-31g(d).firefly.inp (generated)

000451253.b3lyp_6-31g(d).smash.inp (generated)

000451253.b3lyp_6-31g(d).nwchem.inp (generated) 000451253.b3lyp_6-31g(d).log.xz 000451253.td-b3lyp_6-31g+(d).inp 000451253.td-b3lyp_6-31g+(d).log.xz

000451253.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451253.td-b3lyp_6-31+g(d).gjf (generated)

000451253.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451253.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451253.mol 000451253.PUBCHEM 000451253.mol (via Jmol)
000451254.b3lyp_6-31g(d).inp

000451254.b3lyp_6-31g(d).qchem.inp (generated)

000451254.b3lyp_6-31g(d).gjf (generated)

000451254.b3lyp_6-31g(d).firefly.inp (generated)

000451254.b3lyp_6-31g(d).smash.inp (generated)

000451254.b3lyp_6-31g(d).nwchem.inp (generated) 000451254.b3lyp_6-31g(d).log.xz 000451254.td-b3lyp_6-31g+(d).inp 000451254.td-b3lyp_6-31g+(d).log.xz

000451254.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451254.td-b3lyp_6-31+g(d).gjf (generated)

000451254.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451254.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451254.mol 000451254.PUBCHEM 000451254.mol (via Jmol)
000451255.b3lyp_6-31g(d).inp

000451255.b3lyp_6-31g(d).qchem.inp (generated)

000451255.b3lyp_6-31g(d).gjf (generated)

000451255.b3lyp_6-31g(d).firefly.inp (generated)

000451255.b3lyp_6-31g(d).smash.inp (generated)

000451255.b3lyp_6-31g(d).nwchem.inp (generated) 000451255.b3lyp_6-31g(d).log.xz 000451255.td-b3lyp_6-31g+(d).inp 000451255.td-b3lyp_6-31g+(d).log.xz

000451255.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451255.td-b3lyp_6-31+g(d).gjf (generated)

000451255.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451255.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451255.mol 000451255.PUBCHEM 000451255.mol (via Jmol)
000451257.b3lyp_6-31g(d).inp

000451257.b3lyp_6-31g(d).qchem.inp (generated)

000451257.b3lyp_6-31g(d).gjf (generated)

000451257.b3lyp_6-31g(d).firefly.inp (generated)

000451257.b3lyp_6-31g(d).smash.inp (generated)

000451257.b3lyp_6-31g(d).nwchem.inp (generated) 000451257.b3lyp_6-31g(d).log.xz 000451257.td-b3lyp_6-31g+(d).inp 000451257.td-b3lyp_6-31g+(d).log.xz

000451257.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451257.td-b3lyp_6-31+g(d).gjf (generated)

000451257.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451257.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451257.mol 000451257.PUBCHEM 000451257.mol (via Jmol)
000451258.b3lyp_6-31g(d).inp

000451258.b3lyp_6-31g(d).qchem.inp (generated)

000451258.b3lyp_6-31g(d).gjf (generated)

000451258.b3lyp_6-31g(d).firefly.inp (generated)

000451258.b3lyp_6-31g(d).smash.inp (generated)

000451258.b3lyp_6-31g(d).nwchem.inp (generated) 000451258.b3lyp_6-31g(d).log.xz 000451258.td-b3lyp_6-31g+(d).inp 000451258.td-b3lyp_6-31g+(d).log.xz

000451258.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451258.td-b3lyp_6-31+g(d).gjf (generated)

000451258.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451258.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451258.mol 000451258.PUBCHEM 000451258.mol (via Jmol)
000451259.b3lyp_6-31g(d).inp

000451259.b3lyp_6-31g(d).qchem.inp (generated)

000451259.b3lyp_6-31g(d).gjf (generated)

000451259.b3lyp_6-31g(d).firefly.inp (generated)

000451259.b3lyp_6-31g(d).smash.inp (generated)

000451259.b3lyp_6-31g(d).nwchem.inp (generated) 000451259.b3lyp_6-31g(d).log.xz 000451259.td-b3lyp_6-31g+(d).inp 000451259.td-b3lyp_6-31g+(d).log.xz

000451259.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451259.td-b3lyp_6-31+g(d).gjf (generated)

000451259.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451259.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451259.mol 000451259.PUBCHEM 000451259.mol (via Jmol)
000451260.b3lyp_6-31g(d).inp

000451260.b3lyp_6-31g(d).qchem.inp (generated)

000451260.b3lyp_6-31g(d).gjf (generated)

000451260.b3lyp_6-31g(d).firefly.inp (generated)

000451260.b3lyp_6-31g(d).smash.inp (generated)

000451260.b3lyp_6-31g(d).nwchem.inp (generated) 000451260.b3lyp_6-31g(d).log.xz 000451260.td-b3lyp_6-31g+(d).inp 000451260.td-b3lyp_6-31g+(d).log.xz

000451260.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451260.td-b3lyp_6-31+g(d).gjf (generated)

000451260.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451260.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451260.mol 000451260.PUBCHEM 000451260.mol (via Jmol)
000451261.b3lyp_6-31g(d).inp

000451261.b3lyp_6-31g(d).qchem.inp (generated)

000451261.b3lyp_6-31g(d).gjf (generated)

000451261.b3lyp_6-31g(d).firefly.inp (generated)

000451261.b3lyp_6-31g(d).smash.inp (generated)

000451261.b3lyp_6-31g(d).nwchem.inp (generated) 000451261.b3lyp_6-31g(d).log.xz 000451261.td-b3lyp_6-31g+(d).inp 000451261.td-b3lyp_6-31g+(d).log.xz

000451261.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451261.td-b3lyp_6-31+g(d).gjf (generated)

000451261.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451261.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451261.mol 000451261.PUBCHEM 000451261.mol (via Jmol)
000451262.b3lyp_6-31g(d).inp

000451262.b3lyp_6-31g(d).qchem.inp (generated)

000451262.b3lyp_6-31g(d).gjf (generated)

000451262.b3lyp_6-31g(d).firefly.inp (generated)

000451262.b3lyp_6-31g(d).smash.inp (generated)

000451262.b3lyp_6-31g(d).nwchem.inp (generated) 000451262.b3lyp_6-31g(d).log.xz 000451262.td-b3lyp_6-31g+(d).inp 000451262.td-b3lyp_6-31g+(d).log.xz

000451262.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451262.td-b3lyp_6-31+g(d).gjf (generated)

000451262.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451262.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451262.mol 000451262.PUBCHEM 000451262.mol (via Jmol)
000451263.b3lyp_6-31g(d).inp

000451263.b3lyp_6-31g(d).qchem.inp (generated)

000451263.b3lyp_6-31g(d).gjf (generated)

000451263.b3lyp_6-31g(d).firefly.inp (generated)

000451263.b3lyp_6-31g(d).smash.inp (generated)

000451263.b3lyp_6-31g(d).nwchem.inp (generated) 000451263.b3lyp_6-31g(d).log.xz 000451263.td-b3lyp_6-31g+(d).inp 000451263.td-b3lyp_6-31g+(d).log.xz

000451263.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451263.td-b3lyp_6-31+g(d).gjf (generated)

000451263.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451263.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451263.mol 000451263.PUBCHEM 000451263.mol (via Jmol)
000451265.b3lyp_6-31g(d).inp

000451265.b3lyp_6-31g(d).qchem.inp (generated)

000451265.b3lyp_6-31g(d).gjf (generated)

000451265.b3lyp_6-31g(d).firefly.inp (generated)

000451265.b3lyp_6-31g(d).smash.inp (generated)

000451265.b3lyp_6-31g(d).nwchem.inp (generated) 000451265.b3lyp_6-31g(d).log.xz 000451265.td-b3lyp_6-31g+(d).inp 000451265.td-b3lyp_6-31g+(d).log.xz

000451265.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451265.td-b3lyp_6-31+g(d).gjf (generated)

000451265.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451265.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451265.mol 000451265.PUBCHEM 000451265.mol (via Jmol)
000451266.b3lyp_6-31g(d).inp

000451266.b3lyp_6-31g(d).qchem.inp (generated)

000451266.b3lyp_6-31g(d).gjf (generated)

000451266.b3lyp_6-31g(d).firefly.inp (generated)

000451266.b3lyp_6-31g(d).smash.inp (generated)

000451266.b3lyp_6-31g(d).nwchem.inp (generated) 000451266.b3lyp_6-31g(d).log.xz 000451266.td-b3lyp_6-31g+(d).inp 000451266.td-b3lyp_6-31g+(d).log.xz

000451266.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451266.td-b3lyp_6-31+g(d).gjf (generated)

000451266.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451266.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451266.mol 000451266.PUBCHEM 000451266.mol (via Jmol)
000451267.b3lyp_6-31g(d).inp

000451267.b3lyp_6-31g(d).qchem.inp (generated)

000451267.b3lyp_6-31g(d).gjf (generated)

000451267.b3lyp_6-31g(d).firefly.inp (generated)

000451267.b3lyp_6-31g(d).smash.inp (generated)

000451267.b3lyp_6-31g(d).nwchem.inp (generated) 000451267.b3lyp_6-31g(d).log.xz 000451267.td-b3lyp_6-31g+(d).inp 000451267.td-b3lyp_6-31g+(d).log.xz

000451267.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451267.td-b3lyp_6-31+g(d).gjf (generated)

000451267.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451267.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451267.mol 000451267.PUBCHEM 000451267.mol (via Jmol)
000451269.b3lyp_6-31g(d).inp

000451269.b3lyp_6-31g(d).qchem.inp (generated)

000451269.b3lyp_6-31g(d).gjf (generated)

000451269.b3lyp_6-31g(d).firefly.inp (generated)

000451269.b3lyp_6-31g(d).smash.inp (generated)

000451269.b3lyp_6-31g(d).nwchem.inp (generated) 000451269.b3lyp_6-31g(d).log.xz 000451269.td-b3lyp_6-31g+(d).inp 000451269.td-b3lyp_6-31g+(d).log.xz

000451269.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451269.td-b3lyp_6-31+g(d).gjf (generated)

000451269.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451269.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451269.mol 000451269.PUBCHEM 000451269.mol (via Jmol)
000451270.b3lyp_6-31g(d).inp

000451270.b3lyp_6-31g(d).qchem.inp (generated)

000451270.b3lyp_6-31g(d).gjf (generated)

000451270.b3lyp_6-31g(d).firefly.inp (generated)

000451270.b3lyp_6-31g(d).smash.inp (generated)

000451270.b3lyp_6-31g(d).nwchem.inp (generated) 000451270.b3lyp_6-31g(d).log.xz 000451270.td-b3lyp_6-31g+(d).inp 000451270.td-b3lyp_6-31g+(d).log.xz

000451270.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451270.td-b3lyp_6-31+g(d).gjf (generated)

000451270.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451270.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451270.mol 000451270.PUBCHEM 000451270.mol (via Jmol)
000451287.b3lyp_6-31g(d).inp

000451287.b3lyp_6-31g(d).qchem.inp (generated)

000451287.b3lyp_6-31g(d).gjf (generated)

000451287.b3lyp_6-31g(d).firefly.inp (generated)

000451287.b3lyp_6-31g(d).smash.inp (generated)

000451287.b3lyp_6-31g(d).nwchem.inp (generated) 000451287.b3lyp_6-31g(d).log.xz 000451287.td-b3lyp_6-31g+(d).inp 000451287.td-b3lyp_6-31g+(d).log.xz

000451287.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451287.td-b3lyp_6-31+g(d).gjf (generated)

000451287.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451287.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451287.mol 000451287.PUBCHEM 000451287.mol (via Jmol)
000451288.b3lyp_6-31g(d).inp

000451288.b3lyp_6-31g(d).qchem.inp (generated)

000451288.b3lyp_6-31g(d).gjf (generated)

000451288.b3lyp_6-31g(d).firefly.inp (generated)

000451288.b3lyp_6-31g(d).smash.inp (generated)

000451288.b3lyp_6-31g(d).nwchem.inp (generated) 000451288.b3lyp_6-31g(d).log.xz 000451288.td-b3lyp_6-31g+(d).inp 000451288.td-b3lyp_6-31g+(d).log.xz

000451288.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451288.td-b3lyp_6-31+g(d).gjf (generated)

000451288.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451288.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451288.mol 000451288.PUBCHEM 000451288.mol (via Jmol)
000451289.b3lyp_6-31g(d).inp

000451289.b3lyp_6-31g(d).qchem.inp (generated)

000451289.b3lyp_6-31g(d).gjf (generated)

000451289.b3lyp_6-31g(d).firefly.inp (generated)

000451289.b3lyp_6-31g(d).smash.inp (generated)

000451289.b3lyp_6-31g(d).nwchem.inp (generated) 000451289.b3lyp_6-31g(d).log.xz 000451289.td-b3lyp_6-31g+(d).inp 000451289.td-b3lyp_6-31g+(d).log.xz

000451289.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451289.td-b3lyp_6-31+g(d).gjf (generated)

000451289.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451289.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451289.mol 000451289.PUBCHEM 000451289.mol (via Jmol)
000451290.b3lyp_6-31g(d).inp

000451290.b3lyp_6-31g(d).qchem.inp (generated)

000451290.b3lyp_6-31g(d).gjf (generated)

000451290.b3lyp_6-31g(d).firefly.inp (generated)

000451290.b3lyp_6-31g(d).smash.inp (generated)

000451290.b3lyp_6-31g(d).nwchem.inp (generated) 000451290.b3lyp_6-31g(d).log.xz 000451290.td-b3lyp_6-31g+(d).inp 000451290.td-b3lyp_6-31g+(d).log.xz

000451290.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451290.td-b3lyp_6-31+g(d).gjf (generated)

000451290.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451290.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451290.mol 000451290.PUBCHEM 000451290.mol (via Jmol)
000451293.b3lyp_6-31g(d).inp

000451293.b3lyp_6-31g(d).qchem.inp (generated)

000451293.b3lyp_6-31g(d).gjf (generated)

000451293.b3lyp_6-31g(d).firefly.inp (generated)

000451293.b3lyp_6-31g(d).smash.inp (generated)

000451293.b3lyp_6-31g(d).nwchem.inp (generated) 000451293.b3lyp_6-31g(d).log.xz 000451293.td-b3lyp_6-31g+(d).inp 000451293.td-b3lyp_6-31g+(d).log.xz

000451293.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451293.td-b3lyp_6-31+g(d).gjf (generated)

000451293.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451293.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451293.mol 000451293.PUBCHEM 000451293.mol (via Jmol)
000451294.b3lyp_6-31g(d).inp

000451294.b3lyp_6-31g(d).qchem.inp (generated)

000451294.b3lyp_6-31g(d).gjf (generated)

000451294.b3lyp_6-31g(d).firefly.inp (generated)

000451294.b3lyp_6-31g(d).smash.inp (generated)

000451294.b3lyp_6-31g(d).nwchem.inp (generated) 000451294.b3lyp_6-31g(d).log.xz 000451294.td-b3lyp_6-31g+(d).inp 000451294.td-b3lyp_6-31g+(d).log.xz

000451294.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451294.td-b3lyp_6-31+g(d).gjf (generated)

000451294.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451294.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451294.mol 000451294.PUBCHEM 000451294.mol (via Jmol)
000451295.b3lyp_6-31g(d).inp

000451295.b3lyp_6-31g(d).qchem.inp (generated)

000451295.b3lyp_6-31g(d).gjf (generated)

000451295.b3lyp_6-31g(d).firefly.inp (generated)

000451295.b3lyp_6-31g(d).smash.inp (generated)

000451295.b3lyp_6-31g(d).nwchem.inp (generated) 000451295.b3lyp_6-31g(d).log.xz 000451295.td-b3lyp_6-31g+(d).inp 000451295.td-b3lyp_6-31g+(d).log.xz

000451295.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451295.td-b3lyp_6-31+g(d).gjf (generated)

000451295.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451295.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451295.mol 000451295.PUBCHEM 000451295.mol (via Jmol)
000451296.b3lyp_6-31g(d).inp

000451296.b3lyp_6-31g(d).qchem.inp (generated)

000451296.b3lyp_6-31g(d).gjf (generated)

000451296.b3lyp_6-31g(d).firefly.inp (generated)

000451296.b3lyp_6-31g(d).smash.inp (generated)

000451296.b3lyp_6-31g(d).nwchem.inp (generated) 000451296.b3lyp_6-31g(d).log.xz 000451296.td-b3lyp_6-31g+(d).inp 000451296.td-b3lyp_6-31g+(d).log.xz

000451296.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451296.td-b3lyp_6-31+g(d).gjf (generated)

000451296.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451296.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451296.mol 000451296.PUBCHEM 000451296.mol (via Jmol)
000451297.b3lyp_6-31g(d).inp

000451297.b3lyp_6-31g(d).qchem.inp (generated)

000451297.b3lyp_6-31g(d).gjf (generated)

000451297.b3lyp_6-31g(d).firefly.inp (generated)

000451297.b3lyp_6-31g(d).smash.inp (generated)

000451297.b3lyp_6-31g(d).nwchem.inp (generated) 000451297.b3lyp_6-31g(d).log.xz 000451297.td-b3lyp_6-31g+(d).inp 000451297.td-b3lyp_6-31g+(d).log.xz

000451297.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451297.td-b3lyp_6-31+g(d).gjf (generated)

000451297.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451297.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451297.mol 000451297.PUBCHEM 000451297.mol (via Jmol)
000451298.b3lyp_6-31g(d).inp

000451298.b3lyp_6-31g(d).qchem.inp (generated)

000451298.b3lyp_6-31g(d).gjf (generated)

000451298.b3lyp_6-31g(d).firefly.inp (generated)

000451298.b3lyp_6-31g(d).smash.inp (generated)

000451298.b3lyp_6-31g(d).nwchem.inp (generated) 000451298.b3lyp_6-31g(d).log.xz 000451298.td-b3lyp_6-31g+(d).inp 000451298.td-b3lyp_6-31g+(d).log.xz

000451298.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451298.td-b3lyp_6-31+g(d).gjf (generated)

000451298.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451298.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451298.mol 000451298.PUBCHEM 000451298.mol (via Jmol)
000451299.b3lyp_6-31g(d).inp

000451299.b3lyp_6-31g(d).qchem.inp (generated)

000451299.b3lyp_6-31g(d).gjf (generated)

000451299.b3lyp_6-31g(d).firefly.inp (generated)

000451299.b3lyp_6-31g(d).smash.inp (generated)

000451299.b3lyp_6-31g(d).nwchem.inp (generated) 000451299.b3lyp_6-31g(d).log.xz 000451299.td-b3lyp_6-31g+(d).inp 000451299.td-b3lyp_6-31g+(d).log.xz

000451299.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451299.td-b3lyp_6-31+g(d).gjf (generated)

000451299.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451299.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451299.mol 000451299.PUBCHEM 000451299.mol (via Jmol)
000451301.b3lyp_6-31g(d).inp

000451301.b3lyp_6-31g(d).qchem.inp (generated)

000451301.b3lyp_6-31g(d).gjf (generated)

000451301.b3lyp_6-31g(d).firefly.inp (generated)

000451301.b3lyp_6-31g(d).smash.inp (generated)

000451301.b3lyp_6-31g(d).nwchem.inp (generated) 000451301.b3lyp_6-31g(d).log.xz 000451301.td-b3lyp_6-31g+(d).inp 000451301.td-b3lyp_6-31g+(d).log.xz

000451301.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451301.td-b3lyp_6-31+g(d).gjf (generated)

000451301.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451301.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451301.mol 000451301.PUBCHEM 000451301.mol (via Jmol)
000451303.b3lyp_6-31g(d).inp

000451303.b3lyp_6-31g(d).qchem.inp (generated)

000451303.b3lyp_6-31g(d).gjf (generated)

000451303.b3lyp_6-31g(d).firefly.inp (generated)

000451303.b3lyp_6-31g(d).smash.inp (generated)

000451303.b3lyp_6-31g(d).nwchem.inp (generated) 000451303.b3lyp_6-31g(d).log.xz 000451303.td-b3lyp_6-31g+(d).inp 000451303.td-b3lyp_6-31g+(d).log.xz

000451303.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451303.td-b3lyp_6-31+g(d).gjf (generated)

000451303.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451303.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451303.mol 000451303.PUBCHEM 000451303.mol (via Jmol)
000451305.b3lyp_6-31g(d).inp

000451305.b3lyp_6-31g(d).qchem.inp (generated)

000451305.b3lyp_6-31g(d).gjf (generated)

000451305.b3lyp_6-31g(d).firefly.inp (generated)

000451305.b3lyp_6-31g(d).smash.inp (generated)

000451305.b3lyp_6-31g(d).nwchem.inp (generated) 000451305.b3lyp_6-31g(d).log.xz 000451305.td-b3lyp_6-31g+(d).inp 000451305.td-b3lyp_6-31g+(d).log.xz

000451305.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451305.td-b3lyp_6-31+g(d).gjf (generated)

000451305.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451305.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451305.mol 000451305.PUBCHEM 000451305.mol (via Jmol)
000451306.b3lyp_6-31g(d).inp

000451306.b3lyp_6-31g(d).qchem.inp (generated)

000451306.b3lyp_6-31g(d).gjf (generated)

000451306.b3lyp_6-31g(d).firefly.inp (generated)

000451306.b3lyp_6-31g(d).smash.inp (generated)

000451306.b3lyp_6-31g(d).nwchem.inp (generated) 000451306.b3lyp_6-31g(d).log.xz 000451306.td-b3lyp_6-31g+(d).inp 000451306.td-b3lyp_6-31g+(d).log.xz

000451306.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451306.td-b3lyp_6-31+g(d).gjf (generated)

000451306.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451306.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451306.mol 000451306.PUBCHEM 000451306.mol (via Jmol)
000451307.b3lyp_6-31g(d).inp

000451307.b3lyp_6-31g(d).qchem.inp (generated)

000451307.b3lyp_6-31g(d).gjf (generated)

000451307.b3lyp_6-31g(d).firefly.inp (generated)

000451307.b3lyp_6-31g(d).smash.inp (generated)

000451307.b3lyp_6-31g(d).nwchem.inp (generated) 000451307.b3lyp_6-31g(d).log.xz 000451307.td-b3lyp_6-31g+(d).inp 000451307.td-b3lyp_6-31g+(d).log.xz

000451307.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451307.td-b3lyp_6-31+g(d).gjf (generated)

000451307.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451307.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451307.mol 000451307.PUBCHEM 000451307.mol (via Jmol)
000451309.b3lyp_6-31g(d).inp

000451309.b3lyp_6-31g(d).qchem.inp (generated)

000451309.b3lyp_6-31g(d).gjf (generated)

000451309.b3lyp_6-31g(d).firefly.inp (generated)

000451309.b3lyp_6-31g(d).smash.inp (generated)

000451309.b3lyp_6-31g(d).nwchem.inp (generated) 000451309.b3lyp_6-31g(d).log.xz 000451309.td-b3lyp_6-31g+(d).inp 000451309.td-b3lyp_6-31g+(d).log.xz

000451309.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451309.td-b3lyp_6-31+g(d).gjf (generated)

000451309.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451309.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451309.mol 000451309.PUBCHEM 000451309.mol (via Jmol)
000451310.b3lyp_6-31g(d).inp

000451310.b3lyp_6-31g(d).qchem.inp (generated)

000451310.b3lyp_6-31g(d).gjf (generated)

000451310.b3lyp_6-31g(d).firefly.inp (generated)

000451310.b3lyp_6-31g(d).smash.inp (generated)

000451310.b3lyp_6-31g(d).nwchem.inp (generated) 000451310.b3lyp_6-31g(d).log.xz 000451310.td-b3lyp_6-31g+(d).inp 000451310.td-b3lyp_6-31g+(d).log.xz

000451310.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451310.td-b3lyp_6-31+g(d).gjf (generated)

000451310.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451310.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451310.mol 000451310.PUBCHEM 000451310.mol (via Jmol)
000451312.b3lyp_6-31g(d).inp

000451312.b3lyp_6-31g(d).qchem.inp (generated)

000451312.b3lyp_6-31g(d).gjf (generated)

000451312.b3lyp_6-31g(d).firefly.inp (generated)

000451312.b3lyp_6-31g(d).smash.inp (generated)

000451312.b3lyp_6-31g(d).nwchem.inp (generated) 000451312.b3lyp_6-31g(d).log.xz 000451312.td-b3lyp_6-31g+(d).inp 000451312.td-b3lyp_6-31g+(d).log.xz

000451312.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451312.td-b3lyp_6-31+g(d).gjf (generated)

000451312.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451312.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451312.mol 000451312.PUBCHEM 000451312.mol (via Jmol)
000451314.b3lyp_6-31g(d).inp

000451314.b3lyp_6-31g(d).qchem.inp (generated)

000451314.b3lyp_6-31g(d).gjf (generated)

000451314.b3lyp_6-31g(d).firefly.inp (generated)

000451314.b3lyp_6-31g(d).smash.inp (generated)

000451314.b3lyp_6-31g(d).nwchem.inp (generated) 000451314.b3lyp_6-31g(d).log.xz 000451314.td-b3lyp_6-31g+(d).inp 000451314.td-b3lyp_6-31g+(d).log.xz

000451314.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451314.td-b3lyp_6-31+g(d).gjf (generated)

000451314.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451314.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451314.mol 000451314.PUBCHEM 000451314.mol (via Jmol)
000451316.b3lyp_6-31g(d).inp

000451316.b3lyp_6-31g(d).qchem.inp (generated)

000451316.b3lyp_6-31g(d).gjf (generated)

000451316.b3lyp_6-31g(d).firefly.inp (generated)

000451316.b3lyp_6-31g(d).smash.inp (generated)

000451316.b3lyp_6-31g(d).nwchem.inp (generated) 000451316.b3lyp_6-31g(d).log.xz 000451316.td-b3lyp_6-31g+(d).inp 000451316.td-b3lyp_6-31g+(d).log.xz

000451316.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451316.td-b3lyp_6-31+g(d).gjf (generated)

000451316.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451316.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451316.mol 000451316.PUBCHEM 000451316.mol (via Jmol)
000451317.b3lyp_6-31g(d).inp

000451317.b3lyp_6-31g(d).qchem.inp (generated)

000451317.b3lyp_6-31g(d).gjf (generated)

000451317.b3lyp_6-31g(d).firefly.inp (generated)

000451317.b3lyp_6-31g(d).smash.inp (generated)

000451317.b3lyp_6-31g(d).nwchem.inp (generated) 000451317.b3lyp_6-31g(d).log.xz 000451317.td-b3lyp_6-31g+(d).inp 000451317.td-b3lyp_6-31g+(d).log.xz

000451317.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451317.td-b3lyp_6-31+g(d).gjf (generated)

000451317.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451317.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451317.mol 000451317.PUBCHEM 000451317.mol (via Jmol)
000451318.b3lyp_6-31g(d).inp

000451318.b3lyp_6-31g(d).qchem.inp (generated)

000451318.b3lyp_6-31g(d).gjf (generated)

000451318.b3lyp_6-31g(d).firefly.inp (generated)

000451318.b3lyp_6-31g(d).smash.inp (generated)

000451318.b3lyp_6-31g(d).nwchem.inp (generated) 000451318.b3lyp_6-31g(d).log.xz 000451318.td-b3lyp_6-31g+(d).inp 000451318.td-b3lyp_6-31g+(d).log.xz

000451318.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451318.td-b3lyp_6-31+g(d).gjf (generated)

000451318.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451318.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451318.mol 000451318.PUBCHEM 000451318.mol (via Jmol)
000451319.b3lyp_6-31g(d).inp

000451319.b3lyp_6-31g(d).qchem.inp (generated)

000451319.b3lyp_6-31g(d).gjf (generated)

000451319.b3lyp_6-31g(d).firefly.inp (generated)

000451319.b3lyp_6-31g(d).smash.inp (generated)

000451319.b3lyp_6-31g(d).nwchem.inp (generated) 000451319.b3lyp_6-31g(d).log.xz 000451319.td-b3lyp_6-31g+(d).inp 000451319.td-b3lyp_6-31g+(d).log.xz

000451319.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451319.td-b3lyp_6-31+g(d).gjf (generated)

000451319.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451319.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451319.mol 000451319.PUBCHEM 000451319.mol (via Jmol)
000451320.b3lyp_6-31g(d).inp

000451320.b3lyp_6-31g(d).qchem.inp (generated)

000451320.b3lyp_6-31g(d).gjf (generated)

000451320.b3lyp_6-31g(d).firefly.inp (generated)

000451320.b3lyp_6-31g(d).smash.inp (generated)

000451320.b3lyp_6-31g(d).nwchem.inp (generated) 000451320.b3lyp_6-31g(d).log.xz 000451320.td-b3lyp_6-31g+(d).inp 000451320.td-b3lyp_6-31g+(d).log.xz

000451320.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451320.td-b3lyp_6-31+g(d).gjf (generated)

000451320.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451320.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451320.mol 000451320.PUBCHEM 000451320.mol (via Jmol)
000451321.b3lyp_6-31g(d).inp

000451321.b3lyp_6-31g(d).qchem.inp (generated)

000451321.b3lyp_6-31g(d).gjf (generated)

000451321.b3lyp_6-31g(d).firefly.inp (generated)

000451321.b3lyp_6-31g(d).smash.inp (generated)

000451321.b3lyp_6-31g(d).nwchem.inp (generated) 000451321.b3lyp_6-31g(d).log.xz 000451321.td-b3lyp_6-31g+(d).inp 000451321.td-b3lyp_6-31g+(d).log.xz

000451321.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451321.td-b3lyp_6-31+g(d).gjf (generated)

000451321.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451321.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451321.mol 000451321.PUBCHEM 000451321.mol (via Jmol)
000451322.b3lyp_6-31g(d).inp

000451322.b3lyp_6-31g(d).qchem.inp (generated)

000451322.b3lyp_6-31g(d).gjf (generated)

000451322.b3lyp_6-31g(d).firefly.inp (generated)

000451322.b3lyp_6-31g(d).smash.inp (generated)

000451322.b3lyp_6-31g(d).nwchem.inp (generated) 000451322.b3lyp_6-31g(d).log.xz 000451322.td-b3lyp_6-31g+(d).inp 000451322.td-b3lyp_6-31g+(d).log.xz

000451322.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451322.td-b3lyp_6-31+g(d).gjf (generated)

000451322.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451322.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451322.mol 000451322.PUBCHEM 000451322.mol (via Jmol)
000451323.b3lyp_6-31g(d).inp

000451323.b3lyp_6-31g(d).qchem.inp (generated)

000451323.b3lyp_6-31g(d).gjf (generated)

000451323.b3lyp_6-31g(d).firefly.inp (generated)

000451323.b3lyp_6-31g(d).smash.inp (generated)

000451323.b3lyp_6-31g(d).nwchem.inp (generated) 000451323.b3lyp_6-31g(d).log.xz 000451323.td-b3lyp_6-31g+(d).inp 000451323.td-b3lyp_6-31g+(d).log.xz

000451323.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451323.td-b3lyp_6-31+g(d).gjf (generated)

000451323.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451323.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451323.mol 000451323.PUBCHEM 000451323.mol (via Jmol)
000451324.b3lyp_6-31g(d).inp

000451324.b3lyp_6-31g(d).qchem.inp (generated)

000451324.b3lyp_6-31g(d).gjf (generated)

000451324.b3lyp_6-31g(d).firefly.inp (generated)

000451324.b3lyp_6-31g(d).smash.inp (generated)

000451324.b3lyp_6-31g(d).nwchem.inp (generated) 000451324.b3lyp_6-31g(d).log.xz 000451324.td-b3lyp_6-31g+(d).inp 000451324.td-b3lyp_6-31g+(d).log.xz

000451324.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451324.td-b3lyp_6-31+g(d).gjf (generated)

000451324.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451324.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451324.mol 000451324.PUBCHEM 000451324.mol (via Jmol)
000451326.b3lyp_6-31g(d).inp

000451326.b3lyp_6-31g(d).qchem.inp (generated)

000451326.b3lyp_6-31g(d).gjf (generated)

000451326.b3lyp_6-31g(d).firefly.inp (generated)

000451326.b3lyp_6-31g(d).smash.inp (generated)

000451326.b3lyp_6-31g(d).nwchem.inp (generated) 000451326.b3lyp_6-31g(d).log.xz 000451326.td-b3lyp_6-31g+(d).inp 000451326.td-b3lyp_6-31g+(d).log.xz

000451326.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451326.td-b3lyp_6-31+g(d).gjf (generated)

000451326.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451326.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451326.mol 000451326.PUBCHEM 000451326.mol (via Jmol)
000451327.b3lyp_6-31g(d).inp

000451327.b3lyp_6-31g(d).qchem.inp (generated)

000451327.b3lyp_6-31g(d).gjf (generated)

000451327.b3lyp_6-31g(d).firefly.inp (generated)

000451327.b3lyp_6-31g(d).smash.inp (generated)

000451327.b3lyp_6-31g(d).nwchem.inp (generated) 000451327.b3lyp_6-31g(d).log.xz 000451327.td-b3lyp_6-31g+(d).inp 000451327.td-b3lyp_6-31g+(d).log.xz

000451327.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451327.td-b3lyp_6-31+g(d).gjf (generated)

000451327.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451327.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451327.mol 000451327.PUBCHEM 000451327.mol (via Jmol)
000451330.b3lyp_6-31g(d).inp

000451330.b3lyp_6-31g(d).qchem.inp (generated)

000451330.b3lyp_6-31g(d).gjf (generated)

000451330.b3lyp_6-31g(d).firefly.inp (generated)

000451330.b3lyp_6-31g(d).smash.inp (generated)

000451330.b3lyp_6-31g(d).nwchem.inp (generated) 000451330.b3lyp_6-31g(d).log.xz 000451330.td-b3lyp_6-31g+(d).inp 000451330.td-b3lyp_6-31g+(d).log.xz

000451330.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451330.td-b3lyp_6-31+g(d).gjf (generated)

000451330.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451330.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451330.mol 000451330.PUBCHEM 000451330.mol (via Jmol)
000451331.b3lyp_6-31g(d).inp

000451331.b3lyp_6-31g(d).qchem.inp (generated)

000451331.b3lyp_6-31g(d).gjf (generated)

000451331.b3lyp_6-31g(d).firefly.inp (generated)

000451331.b3lyp_6-31g(d).smash.inp (generated)

000451331.b3lyp_6-31g(d).nwchem.inp (generated) 000451331.b3lyp_6-31g(d).log.xz 000451331.td-b3lyp_6-31g+(d).inp 000451331.td-b3lyp_6-31g+(d).log.xz

000451331.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451331.td-b3lyp_6-31+g(d).gjf (generated)

000451331.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451331.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451331.mol 000451331.PUBCHEM 000451331.mol (via Jmol)
000451332.b3lyp_6-31g(d).inp

000451332.b3lyp_6-31g(d).qchem.inp (generated)

000451332.b3lyp_6-31g(d).gjf (generated)

000451332.b3lyp_6-31g(d).firefly.inp (generated)

000451332.b3lyp_6-31g(d).smash.inp (generated)

000451332.b3lyp_6-31g(d).nwchem.inp (generated) 000451332.b3lyp_6-31g(d).log.xz 000451332.td-b3lyp_6-31g+(d).inp 000451332.td-b3lyp_6-31g+(d).log.xz

000451332.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451332.td-b3lyp_6-31+g(d).gjf (generated)

000451332.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451332.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451332.mol 000451332.PUBCHEM 000451332.mol (via Jmol)
000451333.b3lyp_6-31g(d).inp

000451333.b3lyp_6-31g(d).qchem.inp (generated)

000451333.b3lyp_6-31g(d).gjf (generated)

000451333.b3lyp_6-31g(d).firefly.inp (generated)

000451333.b3lyp_6-31g(d).smash.inp (generated)

000451333.b3lyp_6-31g(d).nwchem.inp (generated) 000451333.b3lyp_6-31g(d).log.xz 000451333.td-b3lyp_6-31g+(d).inp 000451333.td-b3lyp_6-31g+(d).log.xz

000451333.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451333.td-b3lyp_6-31+g(d).gjf (generated)

000451333.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451333.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451333.mol 000451333.PUBCHEM 000451333.mol (via Jmol)
000451334.b3lyp_6-31g(d).inp

000451334.b3lyp_6-31g(d).qchem.inp (generated)

000451334.b3lyp_6-31g(d).gjf (generated)

000451334.b3lyp_6-31g(d).firefly.inp (generated)

000451334.b3lyp_6-31g(d).smash.inp (generated)

000451334.b3lyp_6-31g(d).nwchem.inp (generated) 000451334.b3lyp_6-31g(d).log.xz 000451334.td-b3lyp_6-31g+(d).inp 000451334.td-b3lyp_6-31g+(d).log.xz

000451334.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451334.td-b3lyp_6-31+g(d).gjf (generated)

000451334.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451334.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451334.mol 000451334.PUBCHEM 000451334.mol (via Jmol)
000451335.b3lyp_6-31g(d).inp

000451335.b3lyp_6-31g(d).qchem.inp (generated)

000451335.b3lyp_6-31g(d).gjf (generated)

000451335.b3lyp_6-31g(d).firefly.inp (generated)

000451335.b3lyp_6-31g(d).smash.inp (generated)

000451335.b3lyp_6-31g(d).nwchem.inp (generated) 000451335.b3lyp_6-31g(d).log.xz 000451335.td-b3lyp_6-31g+(d).inp 000451335.td-b3lyp_6-31g+(d).log.xz

000451335.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451335.td-b3lyp_6-31+g(d).gjf (generated)

000451335.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451335.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451335.mol 000451335.PUBCHEM 000451335.mol (via Jmol)
000451336.b3lyp_6-31g(d).inp

000451336.b3lyp_6-31g(d).qchem.inp (generated)

000451336.b3lyp_6-31g(d).gjf (generated)

000451336.b3lyp_6-31g(d).firefly.inp (generated)

000451336.b3lyp_6-31g(d).smash.inp (generated)

000451336.b3lyp_6-31g(d).nwchem.inp (generated) 000451336.b3lyp_6-31g(d).log.xz 000451336.td-b3lyp_6-31g+(d).inp 000451336.td-b3lyp_6-31g+(d).log.xz

000451336.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451336.td-b3lyp_6-31+g(d).gjf (generated)

000451336.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451336.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451336.mol 000451336.PUBCHEM 000451336.mol (via Jmol)
000451337.b3lyp_6-31g(d).inp

000451337.b3lyp_6-31g(d).qchem.inp (generated)

000451337.b3lyp_6-31g(d).gjf (generated)

000451337.b3lyp_6-31g(d).firefly.inp (generated)

000451337.b3lyp_6-31g(d).smash.inp (generated)

000451337.b3lyp_6-31g(d).nwchem.inp (generated) 000451337.b3lyp_6-31g(d).log.xz 000451337.td-b3lyp_6-31g+(d).inp 000451337.td-b3lyp_6-31g+(d).log.xz

000451337.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451337.td-b3lyp_6-31+g(d).gjf (generated)

000451337.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451337.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451337.mol 000451337.PUBCHEM 000451337.mol (via Jmol)
000451338.b3lyp_6-31g(d).inp

000451338.b3lyp_6-31g(d).qchem.inp (generated)

000451338.b3lyp_6-31g(d).gjf (generated)

000451338.b3lyp_6-31g(d).firefly.inp (generated)

000451338.b3lyp_6-31g(d).smash.inp (generated)

000451338.b3lyp_6-31g(d).nwchem.inp (generated) 000451338.b3lyp_6-31g(d).log.xz 000451338.td-b3lyp_6-31g+(d).inp 000451338.td-b3lyp_6-31g+(d).log.xz

000451338.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451338.td-b3lyp_6-31+g(d).gjf (generated)

000451338.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451338.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451338.mol 000451338.PUBCHEM 000451338.mol (via Jmol)
000451339.b3lyp_6-31g(d).inp

000451339.b3lyp_6-31g(d).qchem.inp (generated)

000451339.b3lyp_6-31g(d).gjf (generated)

000451339.b3lyp_6-31g(d).firefly.inp (generated)

000451339.b3lyp_6-31g(d).smash.inp (generated)

000451339.b3lyp_6-31g(d).nwchem.inp (generated) 000451339.b3lyp_6-31g(d).log.xz 000451339.td-b3lyp_6-31g+(d).inp 000451339.td-b3lyp_6-31g+(d).log.xz

000451339.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451339.td-b3lyp_6-31+g(d).gjf (generated)

000451339.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451339.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451339.mol 000451339.PUBCHEM 000451339.mol (via Jmol)
000451340.b3lyp_6-31g(d).inp

000451340.b3lyp_6-31g(d).qchem.inp (generated)

000451340.b3lyp_6-31g(d).gjf (generated)

000451340.b3lyp_6-31g(d).firefly.inp (generated)

000451340.b3lyp_6-31g(d).smash.inp (generated)

000451340.b3lyp_6-31g(d).nwchem.inp (generated) 000451340.b3lyp_6-31g(d).log.xz 000451340.td-b3lyp_6-31g+(d).inp 000451340.td-b3lyp_6-31g+(d).log.xz

000451340.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451340.td-b3lyp_6-31+g(d).gjf (generated)

000451340.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451340.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451340.mol 000451340.PUBCHEM 000451340.mol (via Jmol)
000451341.b3lyp_6-31g(d).inp

000451341.b3lyp_6-31g(d).qchem.inp (generated)

000451341.b3lyp_6-31g(d).gjf (generated)

000451341.b3lyp_6-31g(d).firefly.inp (generated)

000451341.b3lyp_6-31g(d).smash.inp (generated)

000451341.b3lyp_6-31g(d).nwchem.inp (generated) 000451341.b3lyp_6-31g(d).log.xz 000451341.td-b3lyp_6-31g+(d).inp 000451341.td-b3lyp_6-31g+(d).log.xz

000451341.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451341.td-b3lyp_6-31+g(d).gjf (generated)

000451341.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451341.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451341.mol 000451341.PUBCHEM 000451341.mol (via Jmol)
000451342.b3lyp_6-31g(d).inp

000451342.b3lyp_6-31g(d).qchem.inp (generated)

000451342.b3lyp_6-31g(d).gjf (generated)

000451342.b3lyp_6-31g(d).firefly.inp (generated)

000451342.b3lyp_6-31g(d).smash.inp (generated)

000451342.b3lyp_6-31g(d).nwchem.inp (generated) 000451342.b3lyp_6-31g(d).log.xz 000451342.td-b3lyp_6-31g+(d).inp 000451342.td-b3lyp_6-31g+(d).log.xz

000451342.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451342.td-b3lyp_6-31+g(d).gjf (generated)

000451342.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451342.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451342.mol 000451342.PUBCHEM 000451342.mol (via Jmol)
000451343.b3lyp_6-31g(d).inp

000451343.b3lyp_6-31g(d).qchem.inp (generated)

000451343.b3lyp_6-31g(d).gjf (generated)

000451343.b3lyp_6-31g(d).firefly.inp (generated)

000451343.b3lyp_6-31g(d).smash.inp (generated)

000451343.b3lyp_6-31g(d).nwchem.inp (generated) 000451343.b3lyp_6-31g(d).log.xz 000451343.td-b3lyp_6-31g+(d).inp 000451343.td-b3lyp_6-31g+(d).log.xz

000451343.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451343.td-b3lyp_6-31+g(d).gjf (generated)

000451343.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451343.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451343.mol 000451343.PUBCHEM 000451343.mol (via Jmol)
000451344.b3lyp_6-31g(d).inp

000451344.b3lyp_6-31g(d).qchem.inp (generated)

000451344.b3lyp_6-31g(d).gjf (generated)

000451344.b3lyp_6-31g(d).firefly.inp (generated)

000451344.b3lyp_6-31g(d).smash.inp (generated)

000451344.b3lyp_6-31g(d).nwchem.inp (generated) 000451344.b3lyp_6-31g(d).log.xz 000451344.td-b3lyp_6-31g+(d).inp 000451344.td-b3lyp_6-31g+(d).log.xz

000451344.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451344.td-b3lyp_6-31+g(d).gjf (generated)

000451344.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451344.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451344.mol 000451344.PUBCHEM 000451344.mol (via Jmol)
000451345.b3lyp_6-31g(d).inp

000451345.b3lyp_6-31g(d).qchem.inp (generated)

000451345.b3lyp_6-31g(d).gjf (generated)

000451345.b3lyp_6-31g(d).firefly.inp (generated)

000451345.b3lyp_6-31g(d).smash.inp (generated)

000451345.b3lyp_6-31g(d).nwchem.inp (generated) 000451345.b3lyp_6-31g(d).log.xz 000451345.td-b3lyp_6-31g+(d).inp 000451345.td-b3lyp_6-31g+(d).log.xz

000451345.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451345.td-b3lyp_6-31+g(d).gjf (generated)

000451345.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451345.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451345.mol 000451345.PUBCHEM 000451345.mol (via Jmol)
000451346.b3lyp_6-31g(d).inp

000451346.b3lyp_6-31g(d).qchem.inp (generated)

000451346.b3lyp_6-31g(d).gjf (generated)

000451346.b3lyp_6-31g(d).firefly.inp (generated)

000451346.b3lyp_6-31g(d).smash.inp (generated)

000451346.b3lyp_6-31g(d).nwchem.inp (generated) 000451346.b3lyp_6-31g(d).log.xz 000451346.td-b3lyp_6-31g+(d).inp 000451346.td-b3lyp_6-31g+(d).log.xz

000451346.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451346.td-b3lyp_6-31+g(d).gjf (generated)

000451346.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451346.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451346.mol 000451346.PUBCHEM 000451346.mol (via Jmol)
000451347.b3lyp_6-31g(d).inp

000451347.b3lyp_6-31g(d).qchem.inp (generated)

000451347.b3lyp_6-31g(d).gjf (generated)

000451347.b3lyp_6-31g(d).firefly.inp (generated)

000451347.b3lyp_6-31g(d).smash.inp (generated)

000451347.b3lyp_6-31g(d).nwchem.inp (generated) 000451347.b3lyp_6-31g(d).log.xz 000451347.td-b3lyp_6-31g+(d).inp 000451347.td-b3lyp_6-31g+(d).log.xz

000451347.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451347.td-b3lyp_6-31+g(d).gjf (generated)

000451347.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451347.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451347.mol 000451347.PUBCHEM 000451347.mol (via Jmol)
000451348.b3lyp_6-31g(d).inp

000451348.b3lyp_6-31g(d).qchem.inp (generated)

000451348.b3lyp_6-31g(d).gjf (generated)

000451348.b3lyp_6-31g(d).firefly.inp (generated)

000451348.b3lyp_6-31g(d).smash.inp (generated)

000451348.b3lyp_6-31g(d).nwchem.inp (generated) 000451348.b3lyp_6-31g(d).log.xz 000451348.td-b3lyp_6-31g+(d).inp 000451348.td-b3lyp_6-31g+(d).log.xz

000451348.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451348.td-b3lyp_6-31+g(d).gjf (generated)

000451348.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451348.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451348.mol 000451348.PUBCHEM 000451348.mol (via Jmol)
000451351.b3lyp_6-31g(d).inp

000451351.b3lyp_6-31g(d).qchem.inp (generated)

000451351.b3lyp_6-31g(d).gjf (generated)

000451351.b3lyp_6-31g(d).firefly.inp (generated)

000451351.b3lyp_6-31g(d).smash.inp (generated)

000451351.b3lyp_6-31g(d).nwchem.inp (generated) 000451351.b3lyp_6-31g(d).log.xz 000451351.td-b3lyp_6-31g+(d).inp 000451351.td-b3lyp_6-31g+(d).log.xz

000451351.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451351.td-b3lyp_6-31+g(d).gjf (generated)

000451351.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451351.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451351.mol 000451351.PUBCHEM 000451351.mol (via Jmol)
000451353.b3lyp_6-31g(d).inp

000451353.b3lyp_6-31g(d).qchem.inp (generated)

000451353.b3lyp_6-31g(d).gjf (generated)

000451353.b3lyp_6-31g(d).firefly.inp (generated)

000451353.b3lyp_6-31g(d).smash.inp (generated)

000451353.b3lyp_6-31g(d).nwchem.inp (generated) 000451353.b3lyp_6-31g(d).log.xz 000451353.td-b3lyp_6-31g+(d).inp 000451353.td-b3lyp_6-31g+(d).log.xz

000451353.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451353.td-b3lyp_6-31+g(d).gjf (generated)

000451353.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451353.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451353.mol 000451353.PUBCHEM 000451353.mol (via Jmol)
000451354.b3lyp_6-31g(d).inp

000451354.b3lyp_6-31g(d).qchem.inp (generated)

000451354.b3lyp_6-31g(d).gjf (generated)

000451354.b3lyp_6-31g(d).firefly.inp (generated)

000451354.b3lyp_6-31g(d).smash.inp (generated)

000451354.b3lyp_6-31g(d).nwchem.inp (generated) 000451354.b3lyp_6-31g(d).log.xz 000451354.td-b3lyp_6-31g+(d).inp 000451354.td-b3lyp_6-31g+(d).log.xz

000451354.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451354.td-b3lyp_6-31+g(d).gjf (generated)

000451354.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451354.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451354.mol 000451354.PUBCHEM 000451354.mol (via Jmol)
000451356.b3lyp_6-31g(d).inp

000451356.b3lyp_6-31g(d).qchem.inp (generated)

000451356.b3lyp_6-31g(d).gjf (generated)

000451356.b3lyp_6-31g(d).firefly.inp (generated)

000451356.b3lyp_6-31g(d).smash.inp (generated)

000451356.b3lyp_6-31g(d).nwchem.inp (generated) 000451356.b3lyp_6-31g(d).log.xz 000451356.td-b3lyp_6-31g+(d).inp 000451356.td-b3lyp_6-31g+(d).log.xz

000451356.td-b3lyp_6-31+g(d).qchem.inp (generated)

000451356.td-b3lyp_6-31+g(d).gjf (generated)

000451356.td-b3lyp_6-31+g(d).firefly.inp (generated)

000451356.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000451356.mol 000451356.PUBCHEM 000451356.mol (via Jmol)