Index of

Last updated : Thu Jun 22 02:29:55 JST 2017
Total : 2439 (1963) in this page
000675028.b3lyp_6-31g(d).inp

000675028.b3lyp_6-31g(d).qchem.inp (generated)

000675028.b3lyp_6-31g(d).gjf (generated)

000675028.b3lyp_6-31g(d).firefly.inp (generated)

000675028.b3lyp_6-31g(d).smash.inp (generated)

000675028.b3lyp_6-31g(d).nwchem.inp (generated) 000675028.b3lyp_6-31g(d).log.xz 000675028.td-b3lyp_6-31g+(d).inp 000675028.td-b3lyp_6-31g+(d).log.xz

000675028.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675028.td-b3lyp_6-31+g(d).gjf (generated)

000675028.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675028.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675028.mol 000675028.PUBCHEM 000675028.mol (via Jmol)
000675042.b3lyp_6-31g(d).inp

000675042.b3lyp_6-31g(d).qchem.inp (generated)

000675042.b3lyp_6-31g(d).gjf (generated)

000675042.b3lyp_6-31g(d).firefly.inp (generated)

000675042.b3lyp_6-31g(d).smash.inp (generated)

000675042.b3lyp_6-31g(d).nwchem.inp (generated) 000675042.b3lyp_6-31g(d).log.xz 000675042.mol 000675042.PUBCHEM 000675042.mol (via Jmol)
000675052.b3lyp_6-31g(d).inp

000675052.b3lyp_6-31g(d).qchem.inp (generated)

000675052.b3lyp_6-31g(d).gjf (generated)

000675052.b3lyp_6-31g(d).firefly.inp (generated)

000675052.b3lyp_6-31g(d).smash.inp (generated)

000675052.b3lyp_6-31g(d).nwchem.inp (generated) 000675052.b3lyp_6-31g(d).log.xz 000675052.td-b3lyp_6-31g+(d).inp 000675052.td-b3lyp_6-31g+(d).log.xz

000675052.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675052.td-b3lyp_6-31+g(d).gjf (generated)

000675052.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675052.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675052.mol 000675052.PUBCHEM 000675052.mol (via Jmol)
000675061.b3lyp_6-31g(d).inp

000675061.b3lyp_6-31g(d).qchem.inp (generated)

000675061.b3lyp_6-31g(d).gjf (generated)

000675061.b3lyp_6-31g(d).firefly.inp (generated)

000675061.b3lyp_6-31g(d).smash.inp (generated)

000675061.b3lyp_6-31g(d).nwchem.inp (generated) 000675061.b3lyp_6-31g(d).log.xz 000675061.mol 000675061.PUBCHEM 000675061.mol (via Jmol)
000675062.b3lyp_6-31g(d).inp

000675062.b3lyp_6-31g(d).qchem.inp (generated)

000675062.b3lyp_6-31g(d).gjf (generated)

000675062.b3lyp_6-31g(d).firefly.inp (generated)

000675062.b3lyp_6-31g(d).smash.inp (generated)

000675062.b3lyp_6-31g(d).nwchem.inp (generated) 000675062.b3lyp_6-31g(d).log.xz 000675062.td-b3lyp_6-31g+(d).inp 000675062.td-b3lyp_6-31g+(d).log.xz

000675062.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675062.td-b3lyp_6-31+g(d).gjf (generated)

000675062.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675062.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675062.mol 000675062.PUBCHEM 000675062.mol (via Jmol)
000675064.b3lyp_6-31g(d).inp

000675064.b3lyp_6-31g(d).qchem.inp (generated)

000675064.b3lyp_6-31g(d).gjf (generated)

000675064.b3lyp_6-31g(d).firefly.inp (generated)

000675064.b3lyp_6-31g(d).smash.inp (generated)

000675064.b3lyp_6-31g(d).nwchem.inp (generated) 000675064.b3lyp_6-31g(d).log.xz 000675064.td-b3lyp_6-31g+(d).inp 000675064.td-b3lyp_6-31g+(d).log.xz

000675064.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675064.td-b3lyp_6-31+g(d).gjf (generated)

000675064.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675064.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675064.mol 000675064.PUBCHEM 000675064.mol (via Jmol)
000675080.b3lyp_6-31g(d).inp

000675080.b3lyp_6-31g(d).qchem.inp (generated)

000675080.b3lyp_6-31g(d).gjf (generated)

000675080.b3lyp_6-31g(d).firefly.inp (generated)

000675080.b3lyp_6-31g(d).smash.inp (generated)

000675080.b3lyp_6-31g(d).nwchem.inp (generated) 000675080.b3lyp_6-31g(d).log.xz 000675080.td-b3lyp_6-31g+(d).inp 000675080.td-b3lyp_6-31g+(d).log.xz

000675080.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675080.td-b3lyp_6-31+g(d).gjf (generated)

000675080.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675080.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675080.mol 000675080.PUBCHEM 000675080.mol (via Jmol)
000675082.b3lyp_6-31g(d).inp

000675082.b3lyp_6-31g(d).qchem.inp (generated)

000675082.b3lyp_6-31g(d).gjf (generated)

000675082.b3lyp_6-31g(d).firefly.inp (generated)

000675082.b3lyp_6-31g(d).smash.inp (generated)

000675082.b3lyp_6-31g(d).nwchem.inp (generated) 000675082.b3lyp_6-31g(d).log.xz 000675082.td-b3lyp_6-31g+(d).inp 000675082.td-b3lyp_6-31g+(d).log.xz

000675082.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675082.td-b3lyp_6-31+g(d).gjf (generated)

000675082.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675082.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675082.mol 000675082.PUBCHEM 000675082.mol (via Jmol)
000675087.b3lyp_6-31g(d).inp

000675087.b3lyp_6-31g(d).qchem.inp (generated)

000675087.b3lyp_6-31g(d).gjf (generated)

000675087.b3lyp_6-31g(d).firefly.inp (generated)

000675087.b3lyp_6-31g(d).smash.inp (generated)

000675087.b3lyp_6-31g(d).nwchem.inp (generated) 000675087.b3lyp_6-31g(d).log.xz 000675087.td-b3lyp_6-31g+(d).inp 000675087.td-b3lyp_6-31g+(d).log.xz

000675087.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675087.td-b3lyp_6-31+g(d).gjf (generated)

000675087.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675087.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675087.mol 000675087.PUBCHEM 000675087.mol (via Jmol)
000675088.b3lyp_6-31g(d).inp

000675088.b3lyp_6-31g(d).qchem.inp (generated)

000675088.b3lyp_6-31g(d).gjf (generated)

000675088.b3lyp_6-31g(d).firefly.inp (generated)

000675088.b3lyp_6-31g(d).smash.inp (generated)

000675088.b3lyp_6-31g(d).nwchem.inp (generated) 000675088.b3lyp_6-31g(d).log.xz 000675088.td-b3lyp_6-31g+(d).inp 000675088.td-b3lyp_6-31g+(d).log.xz

000675088.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675088.td-b3lyp_6-31+g(d).gjf (generated)

000675088.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675088.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675088.mol 000675088.PUBCHEM 000675088.mol (via Jmol)
000675093.b3lyp_6-31g(d).inp

000675093.b3lyp_6-31g(d).qchem.inp (generated)

000675093.b3lyp_6-31g(d).gjf (generated)

000675093.b3lyp_6-31g(d).firefly.inp (generated)

000675093.b3lyp_6-31g(d).smash.inp (generated)

000675093.b3lyp_6-31g(d).nwchem.inp (generated) 000675093.b3lyp_6-31g(d).log.xz 000675093.td-b3lyp_6-31g+(d).inp 000675093.td-b3lyp_6-31g+(d).log.xz

000675093.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675093.td-b3lyp_6-31+g(d).gjf (generated)

000675093.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675093.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675093.mol 000675093.PUBCHEM 000675093.mol (via Jmol)
000675099.b3lyp_6-31g(d).inp

000675099.b3lyp_6-31g(d).qchem.inp (generated)

000675099.b3lyp_6-31g(d).gjf (generated)

000675099.b3lyp_6-31g(d).firefly.inp (generated)

000675099.b3lyp_6-31g(d).smash.inp (generated)

000675099.b3lyp_6-31g(d).nwchem.inp (generated) 000675099.b3lyp_6-31g(d).log.xz 000675099.td-b3lyp_6-31g+(d).inp 000675099.td-b3lyp_6-31g+(d).log.xz

000675099.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675099.td-b3lyp_6-31+g(d).gjf (generated)

000675099.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675099.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675099.mol 000675099.PUBCHEM 000675099.mol (via Jmol)
000675102.b3lyp_6-31g(d).inp

000675102.b3lyp_6-31g(d).qchem.inp (generated)

000675102.b3lyp_6-31g(d).gjf (generated)

000675102.b3lyp_6-31g(d).firefly.inp (generated)

000675102.b3lyp_6-31g(d).smash.inp (generated)

000675102.b3lyp_6-31g(d).nwchem.inp (generated) 000675102.b3lyp_6-31g(d).log.xz 000675102.td-b3lyp_6-31g+(d).inp 000675102.td-b3lyp_6-31g+(d).log.xz

000675102.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675102.td-b3lyp_6-31+g(d).gjf (generated)

000675102.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675102.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675102.mol 000675102.PUBCHEM 000675102.mol (via Jmol)
000675107.b3lyp_6-31g(d).inp

000675107.b3lyp_6-31g(d).qchem.inp (generated)

000675107.b3lyp_6-31g(d).gjf (generated)

000675107.b3lyp_6-31g(d).firefly.inp (generated)

000675107.b3lyp_6-31g(d).smash.inp (generated)

000675107.b3lyp_6-31g(d).nwchem.inp (generated) 000675107.b3lyp_6-31g(d).log.xz 000675107.td-b3lyp_6-31g+(d).inp 000675107.td-b3lyp_6-31g+(d).log.xz

000675107.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675107.td-b3lyp_6-31+g(d).gjf (generated)

000675107.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675107.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675107.mol 000675107.PUBCHEM 000675107.mol (via Jmol)
000675115.b3lyp_6-31g(d).inp

000675115.b3lyp_6-31g(d).qchem.inp (generated)

000675115.b3lyp_6-31g(d).gjf (generated)

000675115.b3lyp_6-31g(d).firefly.inp (generated)

000675115.b3lyp_6-31g(d).smash.inp (generated)

000675115.b3lyp_6-31g(d).nwchem.inp (generated) 000675115.b3lyp_6-31g(d).log.xz 000675115.td-b3lyp_6-31g+(d).inp 000675115.td-b3lyp_6-31g+(d).log.xz

000675115.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675115.td-b3lyp_6-31+g(d).gjf (generated)

000675115.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675115.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675115.mol 000675115.PUBCHEM 000675115.mol (via Jmol)
000675130.b3lyp_6-31g(d).inp

000675130.b3lyp_6-31g(d).qchem.inp (generated)

000675130.b3lyp_6-31g(d).gjf (generated)

000675130.b3lyp_6-31g(d).firefly.inp (generated)

000675130.b3lyp_6-31g(d).smash.inp (generated)

000675130.b3lyp_6-31g(d).nwchem.inp (generated) 000675130.b3lyp_6-31g(d).log.xz 000675130.td-b3lyp_6-31g+(d).inp 000675130.td-b3lyp_6-31g+(d).log.xz

000675130.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675130.td-b3lyp_6-31+g(d).gjf (generated)

000675130.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675130.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675130.mol 000675130.PUBCHEM 000675130.mol (via Jmol)
000675131.b3lyp_6-31g(d).inp

000675131.b3lyp_6-31g(d).qchem.inp (generated)

000675131.b3lyp_6-31g(d).gjf (generated)

000675131.b3lyp_6-31g(d).firefly.inp (generated)

000675131.b3lyp_6-31g(d).smash.inp (generated)

000675131.b3lyp_6-31g(d).nwchem.inp (generated) 000675131.b3lyp_6-31g(d).log.xz 000675131.td-b3lyp_6-31g+(d).inp 000675131.td-b3lyp_6-31g+(d).log.xz

000675131.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675131.td-b3lyp_6-31+g(d).gjf (generated)

000675131.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675131.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675131.mol 000675131.PUBCHEM 000675131.mol (via Jmol)
000675147.b3lyp_6-31g(d).inp

000675147.b3lyp_6-31g(d).qchem.inp (generated)

000675147.b3lyp_6-31g(d).gjf (generated)

000675147.b3lyp_6-31g(d).firefly.inp (generated)

000675147.b3lyp_6-31g(d).smash.inp (generated)

000675147.b3lyp_6-31g(d).nwchem.inp (generated) 000675147.b3lyp_6-31g(d).log.xz 000675147.td-b3lyp_6-31g+(d).inp 000675147.td-b3lyp_6-31g+(d).log.xz

000675147.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675147.td-b3lyp_6-31+g(d).gjf (generated)

000675147.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675147.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675147.mol 000675147.PUBCHEM 000675147.mol (via Jmol)
000675151.b3lyp_6-31g(d).inp

000675151.b3lyp_6-31g(d).qchem.inp (generated)

000675151.b3lyp_6-31g(d).gjf (generated)

000675151.b3lyp_6-31g(d).firefly.inp (generated)

000675151.b3lyp_6-31g(d).smash.inp (generated)

000675151.b3lyp_6-31g(d).nwchem.inp (generated) 000675151.b3lyp_6-31g(d).log.xz 000675151.td-b3lyp_6-31g+(d).inp 000675151.td-b3lyp_6-31g+(d).log.xz

000675151.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675151.td-b3lyp_6-31+g(d).gjf (generated)

000675151.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675151.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675151.mol 000675151.PUBCHEM 000675151.mol (via Jmol)
000675152.b3lyp_6-31g(d).inp

000675152.b3lyp_6-31g(d).qchem.inp (generated)

000675152.b3lyp_6-31g(d).gjf (generated)

000675152.b3lyp_6-31g(d).firefly.inp (generated)

000675152.b3lyp_6-31g(d).smash.inp (generated)

000675152.b3lyp_6-31g(d).nwchem.inp (generated) 000675152.b3lyp_6-31g(d).log.xz 000675152.td-b3lyp_6-31g+(d).inp 000675152.td-b3lyp_6-31g+(d).log.xz

000675152.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675152.td-b3lyp_6-31+g(d).gjf (generated)

000675152.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675152.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675152.mol 000675152.PUBCHEM 000675152.mol (via Jmol)
000675184.b3lyp_6-31g(d).inp

000675184.b3lyp_6-31g(d).qchem.inp (generated)

000675184.b3lyp_6-31g(d).gjf (generated)

000675184.b3lyp_6-31g(d).firefly.inp (generated)

000675184.b3lyp_6-31g(d).smash.inp (generated)

000675184.b3lyp_6-31g(d).nwchem.inp (generated) 000675184.b3lyp_6-31g(d).log.xz 000675184.td-b3lyp_6-31g+(d).inp 000675184.td-b3lyp_6-31g+(d).log.xz

000675184.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675184.td-b3lyp_6-31+g(d).gjf (generated)

000675184.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675184.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675184.mol 000675184.PUBCHEM 000675184.mol (via Jmol)
000675191.b3lyp_6-31g(d).inp

000675191.b3lyp_6-31g(d).qchem.inp (generated)

000675191.b3lyp_6-31g(d).gjf (generated)

000675191.b3lyp_6-31g(d).firefly.inp (generated)

000675191.b3lyp_6-31g(d).smash.inp (generated)

000675191.b3lyp_6-31g(d).nwchem.inp (generated) 000675191.b3lyp_6-31g(d).log.xz 000675191.td-b3lyp_6-31g+(d).inp 000675191.td-b3lyp_6-31g+(d).log.xz

000675191.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675191.td-b3lyp_6-31+g(d).gjf (generated)

000675191.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675191.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675191.mol 000675191.PUBCHEM 000675191.mol (via Jmol)
000675234.b3lyp_6-31g(d).inp

000675234.b3lyp_6-31g(d).qchem.inp (generated)

000675234.b3lyp_6-31g(d).gjf (generated)

000675234.b3lyp_6-31g(d).firefly.inp (generated)

000675234.b3lyp_6-31g(d).smash.inp (generated)

000675234.b3lyp_6-31g(d).nwchem.inp (generated) 000675234.b3lyp_6-31g(d).log.xz 000675234.td-b3lyp_6-31g+(d).inp 000675234.td-b3lyp_6-31g+(d).log.xz

000675234.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675234.td-b3lyp_6-31+g(d).gjf (generated)

000675234.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675234.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675234.mol 000675234.PUBCHEM 000675234.mol (via Jmol)
000675257.b3lyp_6-31g(d).inp

000675257.b3lyp_6-31g(d).qchem.inp (generated)

000675257.b3lyp_6-31g(d).gjf (generated)

000675257.b3lyp_6-31g(d).firefly.inp (generated)

000675257.b3lyp_6-31g(d).smash.inp (generated)

000675257.b3lyp_6-31g(d).nwchem.inp (generated) 000675257.b3lyp_6-31g(d).log.xz 000675257.td-b3lyp_6-31g+(d).inp 000675257.td-b3lyp_6-31g+(d).log.xz

000675257.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675257.td-b3lyp_6-31+g(d).gjf (generated)

000675257.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675257.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675257.mol 000675257.PUBCHEM 000675257.mol (via Jmol)
000675258.b3lyp_6-31g(d).inp

000675258.b3lyp_6-31g(d).qchem.inp (generated)

000675258.b3lyp_6-31g(d).gjf (generated)

000675258.b3lyp_6-31g(d).firefly.inp (generated)

000675258.b3lyp_6-31g(d).smash.inp (generated)

000675258.b3lyp_6-31g(d).nwchem.inp (generated) 000675258.b3lyp_6-31g(d).log.xz 000675258.td-b3lyp_6-31g+(d).inp 000675258.td-b3lyp_6-31g+(d).log.xz

000675258.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675258.td-b3lyp_6-31+g(d).gjf (generated)

000675258.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675258.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675258.mol 000675258.PUBCHEM 000675258.mol (via Jmol)
000675259.b3lyp_6-31g(d).inp

000675259.b3lyp_6-31g(d).qchem.inp (generated)

000675259.b3lyp_6-31g(d).gjf (generated)

000675259.b3lyp_6-31g(d).firefly.inp (generated)

000675259.b3lyp_6-31g(d).smash.inp (generated)

000675259.b3lyp_6-31g(d).nwchem.inp (generated) 000675259.b3lyp_6-31g(d).log.xz 000675259.td-b3lyp_6-31g+(d).inp 000675259.td-b3lyp_6-31g+(d).log.xz

000675259.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675259.td-b3lyp_6-31+g(d).gjf (generated)

000675259.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675259.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675259.mol 000675259.PUBCHEM 000675259.mol (via Jmol)
000675260.b3lyp_6-31g(d).inp

000675260.b3lyp_6-31g(d).qchem.inp (generated)

000675260.b3lyp_6-31g(d).gjf (generated)

000675260.b3lyp_6-31g(d).firefly.inp (generated)

000675260.b3lyp_6-31g(d).smash.inp (generated)

000675260.b3lyp_6-31g(d).nwchem.inp (generated) 000675260.b3lyp_6-31g(d).log.xz 000675260.td-b3lyp_6-31g+(d).inp 000675260.td-b3lyp_6-31g+(d).log.xz

000675260.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675260.td-b3lyp_6-31+g(d).gjf (generated)

000675260.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675260.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675260.mol 000675260.PUBCHEM 000675260.mol (via Jmol)
000675261.b3lyp_6-31g(d).inp

000675261.b3lyp_6-31g(d).qchem.inp (generated)

000675261.b3lyp_6-31g(d).gjf (generated)

000675261.b3lyp_6-31g(d).firefly.inp (generated)

000675261.b3lyp_6-31g(d).smash.inp (generated)

000675261.b3lyp_6-31g(d).nwchem.inp (generated) 000675261.b3lyp_6-31g(d).log.xz 000675261.td-b3lyp_6-31g+(d).inp 000675261.td-b3lyp_6-31g+(d).log.xz

000675261.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675261.td-b3lyp_6-31+g(d).gjf (generated)

000675261.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675261.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675261.mol 000675261.PUBCHEM 000675261.mol (via Jmol)
000675262.b3lyp_6-31g(d).inp

000675262.b3lyp_6-31g(d).qchem.inp (generated)

000675262.b3lyp_6-31g(d).gjf (generated)

000675262.b3lyp_6-31g(d).firefly.inp (generated)

000675262.b3lyp_6-31g(d).smash.inp (generated)

000675262.b3lyp_6-31g(d).nwchem.inp (generated) 000675262.b3lyp_6-31g(d).log.xz 000675262.td-b3lyp_6-31g+(d).inp 000675262.td-b3lyp_6-31g+(d).log.xz

000675262.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675262.td-b3lyp_6-31+g(d).gjf (generated)

000675262.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675262.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675262.mol 000675262.PUBCHEM 000675262.mol (via Jmol)
000675264.b3lyp_6-31g(d).inp

000675264.b3lyp_6-31g(d).qchem.inp (generated)

000675264.b3lyp_6-31g(d).gjf (generated)

000675264.b3lyp_6-31g(d).firefly.inp (generated)

000675264.b3lyp_6-31g(d).smash.inp (generated)

000675264.b3lyp_6-31g(d).nwchem.inp (generated) 000675264.b3lyp_6-31g(d).log.xz 000675264.td-b3lyp_6-31g+(d).inp 000675264.td-b3lyp_6-31g+(d).log.xz

000675264.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675264.td-b3lyp_6-31+g(d).gjf (generated)

000675264.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675264.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675264.mol 000675264.PUBCHEM 000675264.mol (via Jmol)
000675265.b3lyp_6-31g(d).inp

000675265.b3lyp_6-31g(d).qchem.inp (generated)

000675265.b3lyp_6-31g(d).gjf (generated)

000675265.b3lyp_6-31g(d).firefly.inp (generated)

000675265.b3lyp_6-31g(d).smash.inp (generated)

000675265.b3lyp_6-31g(d).nwchem.inp (generated) 000675265.b3lyp_6-31g(d).log.xz 000675265.td-b3lyp_6-31g+(d).inp 000675265.td-b3lyp_6-31g+(d).log.xz

000675265.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675265.td-b3lyp_6-31+g(d).gjf (generated)

000675265.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675265.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675265.mol 000675265.PUBCHEM 000675265.mol (via Jmol)
000675281.b3lyp_6-31g(d).inp

000675281.b3lyp_6-31g(d).qchem.inp (generated)

000675281.b3lyp_6-31g(d).gjf (generated)

000675281.b3lyp_6-31g(d).firefly.inp (generated)

000675281.b3lyp_6-31g(d).smash.inp (generated)

000675281.b3lyp_6-31g(d).nwchem.inp (generated) 000675281.b3lyp_6-31g(d).log.xz 000675281.td-b3lyp_6-31g+(d).inp 000675281.td-b3lyp_6-31g+(d).log.xz

000675281.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675281.td-b3lyp_6-31+g(d).gjf (generated)

000675281.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675281.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675281.mol 000675281.PUBCHEM 000675281.mol (via Jmol)
000675282.b3lyp_6-31g(d).inp

000675282.b3lyp_6-31g(d).qchem.inp (generated)

000675282.b3lyp_6-31g(d).gjf (generated)

000675282.b3lyp_6-31g(d).firefly.inp (generated)

000675282.b3lyp_6-31g(d).smash.inp (generated)

000675282.b3lyp_6-31g(d).nwchem.inp (generated) 000675282.b3lyp_6-31g(d).log.xz 000675282.td-b3lyp_6-31g+(d).inp 000675282.td-b3lyp_6-31g+(d).log.xz

000675282.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675282.td-b3lyp_6-31+g(d).gjf (generated)

000675282.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675282.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675282.mol 000675282.PUBCHEM 000675282.mol (via Jmol)
000675283.b3lyp_6-31g(d).inp

000675283.b3lyp_6-31g(d).qchem.inp (generated)

000675283.b3lyp_6-31g(d).gjf (generated)

000675283.b3lyp_6-31g(d).firefly.inp (generated)

000675283.b3lyp_6-31g(d).smash.inp (generated)

000675283.b3lyp_6-31g(d).nwchem.inp (generated) 000675283.b3lyp_6-31g(d).log.xz 000675283.td-b3lyp_6-31g+(d).inp 000675283.td-b3lyp_6-31g+(d).log.xz

000675283.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675283.td-b3lyp_6-31+g(d).gjf (generated)

000675283.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675283.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675283.mol 000675283.PUBCHEM 000675283.mol (via Jmol)
000675303.b3lyp_6-31g(d).inp

000675303.b3lyp_6-31g(d).qchem.inp (generated)

000675303.b3lyp_6-31g(d).gjf (generated)

000675303.b3lyp_6-31g(d).firefly.inp (generated)

000675303.b3lyp_6-31g(d).smash.inp (generated)

000675303.b3lyp_6-31g(d).nwchem.inp (generated) 000675303.b3lyp_6-31g(d).log.xz 000675303.td-b3lyp_6-31g+(d).inp 000675303.td-b3lyp_6-31g+(d).log.xz

000675303.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675303.td-b3lyp_6-31+g(d).gjf (generated)

000675303.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675303.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675303.mol 000675303.PUBCHEM 000675303.mol (via Jmol)
000675386.b3lyp_6-31g(d).inp

000675386.b3lyp_6-31g(d).qchem.inp (generated)

000675386.b3lyp_6-31g(d).gjf (generated)

000675386.b3lyp_6-31g(d).firefly.inp (generated)

000675386.b3lyp_6-31g(d).smash.inp (generated)

000675386.b3lyp_6-31g(d).nwchem.inp (generated) 000675386.b3lyp_6-31g(d).log.xz 000675386.td-b3lyp_6-31g+(d).inp 000675386.td-b3lyp_6-31g+(d).log.xz

000675386.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675386.td-b3lyp_6-31+g(d).gjf (generated)

000675386.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675386.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675386.mol 000675386.PUBCHEM 000675386.mol (via Jmol)
000675398.b3lyp_6-31g(d).inp

000675398.b3lyp_6-31g(d).qchem.inp (generated)

000675398.b3lyp_6-31g(d).gjf (generated)

000675398.b3lyp_6-31g(d).firefly.inp (generated)

000675398.b3lyp_6-31g(d).smash.inp (generated)

000675398.b3lyp_6-31g(d).nwchem.inp (generated) 000675398.b3lyp_6-31g(d).log.xz 000675398.td-b3lyp_6-31g+(d).inp 000675398.td-b3lyp_6-31g+(d).log.xz

000675398.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675398.td-b3lyp_6-31+g(d).gjf (generated)

000675398.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675398.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675398.mol 000675398.PUBCHEM 000675398.mol (via Jmol)
000675404.b3lyp_6-31g(d).inp

000675404.b3lyp_6-31g(d).qchem.inp (generated)

000675404.b3lyp_6-31g(d).gjf (generated)

000675404.b3lyp_6-31g(d).firefly.inp (generated)

000675404.b3lyp_6-31g(d).smash.inp (generated)

000675404.b3lyp_6-31g(d).nwchem.inp (generated) 000675404.b3lyp_6-31g(d).log.xz 000675404.mol 000675404.PUBCHEM 000675404.mol (via Jmol)
000675405.b3lyp_6-31g(d).inp

000675405.b3lyp_6-31g(d).qchem.inp (generated)

000675405.b3lyp_6-31g(d).gjf (generated)

000675405.b3lyp_6-31g(d).firefly.inp (generated)

000675405.b3lyp_6-31g(d).smash.inp (generated)

000675405.b3lyp_6-31g(d).nwchem.inp (generated) 000675405.b3lyp_6-31g(d).log.xz 000675405.mol 000675405.PUBCHEM 000675405.mol (via Jmol)
000675406.b3lyp_6-31g(d).inp

000675406.b3lyp_6-31g(d).qchem.inp (generated)

000675406.b3lyp_6-31g(d).gjf (generated)

000675406.b3lyp_6-31g(d).firefly.inp (generated)

000675406.b3lyp_6-31g(d).smash.inp (generated)

000675406.b3lyp_6-31g(d).nwchem.inp (generated) 000675406.b3lyp_6-31g(d).log.xz 000675406.mol 000675406.PUBCHEM 000675406.mol (via Jmol)
000675408.b3lyp_6-31g(d).inp

000675408.b3lyp_6-31g(d).qchem.inp (generated)

000675408.b3lyp_6-31g(d).gjf (generated)

000675408.b3lyp_6-31g(d).firefly.inp (generated)

000675408.b3lyp_6-31g(d).smash.inp (generated)

000675408.b3lyp_6-31g(d).nwchem.inp (generated) 000675408.b3lyp_6-31g(d).log.xz 000675408.td-b3lyp_6-31g+(d).inp 000675408.td-b3lyp_6-31g+(d).log.xz

000675408.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675408.td-b3lyp_6-31+g(d).gjf (generated)

000675408.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675408.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675408.mol 000675408.PUBCHEM 000675408.mol (via Jmol)
000675417.b3lyp_6-31g(d).inp

000675417.b3lyp_6-31g(d).qchem.inp (generated)

000675417.b3lyp_6-31g(d).gjf (generated)

000675417.b3lyp_6-31g(d).firefly.inp (generated)

000675417.b3lyp_6-31g(d).smash.inp (generated)

000675417.b3lyp_6-31g(d).nwchem.inp (generated) 000675417.b3lyp_6-31g(d).log.xz 000675417.td-b3lyp_6-31g+(d).inp 000675417.td-b3lyp_6-31g+(d).log.xz

000675417.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675417.td-b3lyp_6-31+g(d).gjf (generated)

000675417.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675417.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675417.mol 000675417.PUBCHEM 000675417.mol (via Jmol)
000675426.b3lyp_6-31g(d).inp

000675426.b3lyp_6-31g(d).qchem.inp (generated)

000675426.b3lyp_6-31g(d).gjf (generated)

000675426.b3lyp_6-31g(d).firefly.inp (generated)

000675426.b3lyp_6-31g(d).smash.inp (generated)

000675426.b3lyp_6-31g(d).nwchem.inp (generated) 000675426.b3lyp_6-31g(d).log.xz 000675426.td-b3lyp_6-31g+(d).inp 000675426.td-b3lyp_6-31g+(d).log.xz

000675426.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675426.td-b3lyp_6-31+g(d).gjf (generated)

000675426.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675426.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675426.mol 000675426.PUBCHEM 000675426.mol (via Jmol)
000675431.b3lyp_6-31g(d).inp

000675431.b3lyp_6-31g(d).qchem.inp (generated)

000675431.b3lyp_6-31g(d).gjf (generated)

000675431.b3lyp_6-31g(d).firefly.inp (generated)

000675431.b3lyp_6-31g(d).smash.inp (generated)

000675431.b3lyp_6-31g(d).nwchem.inp (generated) 000675431.b3lyp_6-31g(d).log.xz 000675431.td-b3lyp_6-31g+(d).inp 000675431.td-b3lyp_6-31g+(d).log.xz

000675431.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675431.td-b3lyp_6-31+g(d).gjf (generated)

000675431.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675431.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675431.mol 000675431.PUBCHEM 000675431.mol (via Jmol)
000675536.b3lyp_6-31g(d).inp

000675536.b3lyp_6-31g(d).qchem.inp (generated)

000675536.b3lyp_6-31g(d).gjf (generated)

000675536.b3lyp_6-31g(d).firefly.inp (generated)

000675536.b3lyp_6-31g(d).smash.inp (generated)

000675536.b3lyp_6-31g(d).nwchem.inp (generated) 000675536.b3lyp_6-31g(d).log.xz 000675536.td-b3lyp_6-31g+(d).inp 000675536.td-b3lyp_6-31g+(d).log.xz

000675536.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675536.td-b3lyp_6-31+g(d).gjf (generated)

000675536.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675536.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675536.mol 000675536.PUBCHEM 000675536.mol (via Jmol)
000675566.b3lyp_6-31g(d).inp

000675566.b3lyp_6-31g(d).qchem.inp (generated)

000675566.b3lyp_6-31g(d).gjf (generated)

000675566.b3lyp_6-31g(d).firefly.inp (generated)

000675566.b3lyp_6-31g(d).smash.inp (generated)

000675566.b3lyp_6-31g(d).nwchem.inp (generated) 000675566.b3lyp_6-31g(d).log.xz 000675566.td-b3lyp_6-31g+(d).inp 000675566.td-b3lyp_6-31g+(d).log.xz

000675566.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675566.td-b3lyp_6-31+g(d).gjf (generated)

000675566.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675566.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675566.mol 000675566.PUBCHEM 000675566.mol (via Jmol)
000675600.b3lyp_6-31g(d).inp

000675600.b3lyp_6-31g(d).qchem.inp (generated)

000675600.b3lyp_6-31g(d).gjf (generated)

000675600.b3lyp_6-31g(d).firefly.inp (generated)

000675600.b3lyp_6-31g(d).smash.inp (generated)

000675600.b3lyp_6-31g(d).nwchem.inp (generated) 000675600.b3lyp_6-31g(d).log.xz 000675600.mol 000675600.PUBCHEM 000675600.mol (via Jmol)
000675606.b3lyp_6-31g(d).inp

000675606.b3lyp_6-31g(d).qchem.inp (generated)

000675606.b3lyp_6-31g(d).gjf (generated)

000675606.b3lyp_6-31g(d).firefly.inp (generated)

000675606.b3lyp_6-31g(d).smash.inp (generated)

000675606.b3lyp_6-31g(d).nwchem.inp (generated) 000675606.b3lyp_6-31g(d).log.xz 000675606.td-b3lyp_6-31g+(d).inp 000675606.td-b3lyp_6-31g+(d).log.xz

000675606.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675606.td-b3lyp_6-31+g(d).gjf (generated)

000675606.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675606.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675606.mol 000675606.PUBCHEM 000675606.mol (via Jmol)
000675621.b3lyp_6-31g(d).inp

000675621.b3lyp_6-31g(d).qchem.inp (generated)

000675621.b3lyp_6-31g(d).gjf (generated)

000675621.b3lyp_6-31g(d).firefly.inp (generated)

000675621.b3lyp_6-31g(d).smash.inp (generated)

000675621.b3lyp_6-31g(d).nwchem.inp (generated) 000675621.b3lyp_6-31g(d).log.xz 000675621.mol 000675621.PUBCHEM 000675621.mol (via Jmol)
000675622.b3lyp_6-31g(d).inp

000675622.b3lyp_6-31g(d).qchem.inp (generated)

000675622.b3lyp_6-31g(d).gjf (generated)

000675622.b3lyp_6-31g(d).firefly.inp (generated)

000675622.b3lyp_6-31g(d).smash.inp (generated)

000675622.b3lyp_6-31g(d).nwchem.inp (generated) 000675622.b3lyp_6-31g(d).log.xz 000675622.mol 000675622.PUBCHEM 000675622.mol (via Jmol)
000675652.b3lyp_6-31g(d).inp

000675652.b3lyp_6-31g(d).qchem.inp (generated)

000675652.b3lyp_6-31g(d).gjf (generated)

000675652.b3lyp_6-31g(d).firefly.inp (generated)

000675652.b3lyp_6-31g(d).smash.inp (generated)

000675652.b3lyp_6-31g(d).nwchem.inp (generated) 000675652.b3lyp_6-31g(d).log.xz 000675652.td-b3lyp_6-31g+(d).inp 000675652.td-b3lyp_6-31g+(d).log.xz

000675652.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675652.td-b3lyp_6-31+g(d).gjf (generated)

000675652.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675652.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675652.mol 000675652.PUBCHEM 000675652.mol (via Jmol)
000675664.b3lyp_6-31g(d).inp

000675664.b3lyp_6-31g(d).qchem.inp (generated)

000675664.b3lyp_6-31g(d).gjf (generated)

000675664.b3lyp_6-31g(d).firefly.inp (generated)

000675664.b3lyp_6-31g(d).smash.inp (generated)

000675664.b3lyp_6-31g(d).nwchem.inp (generated) 000675664.b3lyp_6-31g(d).log.xz 000675664.td-b3lyp_6-31g+(d).inp 000675664.td-b3lyp_6-31g+(d).log.xz

000675664.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675664.td-b3lyp_6-31+g(d).gjf (generated)

000675664.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675664.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675664.mol 000675664.PUBCHEM 000675664.mol (via Jmol)
000675674.b3lyp_6-31g(d).inp

000675674.b3lyp_6-31g(d).qchem.inp (generated)

000675674.b3lyp_6-31g(d).gjf (generated)

000675674.b3lyp_6-31g(d).firefly.inp (generated)

000675674.b3lyp_6-31g(d).smash.inp (generated)

000675674.b3lyp_6-31g(d).nwchem.inp (generated) 000675674.b3lyp_6-31g(d).log.xz 000675674.td-b3lyp_6-31g+(d).inp 000675674.td-b3lyp_6-31g+(d).log.xz

000675674.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675674.td-b3lyp_6-31+g(d).gjf (generated)

000675674.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675674.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675674.mol 000675674.PUBCHEM 000675674.mol (via Jmol)
000675675.b3lyp_6-31g(d).inp

000675675.b3lyp_6-31g(d).qchem.inp (generated)

000675675.b3lyp_6-31g(d).gjf (generated)

000675675.b3lyp_6-31g(d).firefly.inp (generated)

000675675.b3lyp_6-31g(d).smash.inp (generated)

000675675.b3lyp_6-31g(d).nwchem.inp (generated) 000675675.b3lyp_6-31g(d).log.xz 000675675.mol 000675675.PUBCHEM 000675675.mol (via Jmol)
000675684.b3lyp_6-31g(d).inp

000675684.b3lyp_6-31g(d).qchem.inp (generated)

000675684.b3lyp_6-31g(d).gjf (generated)

000675684.b3lyp_6-31g(d).firefly.inp (generated)

000675684.b3lyp_6-31g(d).smash.inp (generated)

000675684.b3lyp_6-31g(d).nwchem.inp (generated) 000675684.b3lyp_6-31g(d).log.xz 000675684.td-b3lyp_6-31g+(d).inp 000675684.td-b3lyp_6-31g+(d).log.xz

000675684.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675684.td-b3lyp_6-31+g(d).gjf (generated)

000675684.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675684.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675684.mol 000675684.PUBCHEM 000675684.mol (via Jmol)
000675699.b3lyp_6-31g(d).inp

000675699.b3lyp_6-31g(d).qchem.inp (generated)

000675699.b3lyp_6-31g(d).gjf (generated)

000675699.b3lyp_6-31g(d).firefly.inp (generated)

000675699.b3lyp_6-31g(d).smash.inp (generated)

000675699.b3lyp_6-31g(d).nwchem.inp (generated) 000675699.b3lyp_6-31g(d).log.xz 000675699.td-b3lyp_6-31g+(d).inp 000675699.td-b3lyp_6-31g+(d).log.xz

000675699.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675699.td-b3lyp_6-31+g(d).gjf (generated)

000675699.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675699.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675699.mol 000675699.PUBCHEM 000675699.mol (via Jmol)
000675738.b3lyp_6-31g(d).inp

000675738.b3lyp_6-31g(d).qchem.inp (generated)

000675738.b3lyp_6-31g(d).gjf (generated)

000675738.b3lyp_6-31g(d).firefly.inp (generated)

000675738.b3lyp_6-31g(d).smash.inp (generated)

000675738.b3lyp_6-31g(d).nwchem.inp (generated) 000675738.b3lyp_6-31g(d).log.xz 000675738.td-b3lyp_6-31g+(d).inp 000675738.td-b3lyp_6-31g+(d).log.xz

000675738.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675738.td-b3lyp_6-31+g(d).gjf (generated)

000675738.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675738.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675738.mol 000675738.PUBCHEM 000675738.mol (via Jmol)
000675756.b3lyp_6-31g(d).inp

000675756.b3lyp_6-31g(d).qchem.inp (generated)

000675756.b3lyp_6-31g(d).gjf (generated)

000675756.b3lyp_6-31g(d).firefly.inp (generated)

000675756.b3lyp_6-31g(d).smash.inp (generated)

000675756.b3lyp_6-31g(d).nwchem.inp (generated) 000675756.b3lyp_6-31g(d).log.xz 000675756.td-b3lyp_6-31g+(d).inp 000675756.td-b3lyp_6-31g+(d).log.xz

000675756.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675756.td-b3lyp_6-31+g(d).gjf (generated)

000675756.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675756.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675756.mol 000675756.PUBCHEM 000675756.mol (via Jmol)
000675772.b3lyp_6-31g(d).inp

000675772.b3lyp_6-31g(d).qchem.inp (generated)

000675772.b3lyp_6-31g(d).gjf (generated)

000675772.b3lyp_6-31g(d).firefly.inp (generated)

000675772.b3lyp_6-31g(d).smash.inp (generated)

000675772.b3lyp_6-31g(d).nwchem.inp (generated) 000675772.b3lyp_6-31g(d).log.xz 000675772.td-b3lyp_6-31g+(d).inp 000675772.td-b3lyp_6-31g+(d).log.xz

000675772.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675772.td-b3lyp_6-31+g(d).gjf (generated)

000675772.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675772.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675772.mol 000675772.PUBCHEM 000675772.mol (via Jmol)
000675786.b3lyp_6-31g(d).inp

000675786.b3lyp_6-31g(d).qchem.inp (generated)

000675786.b3lyp_6-31g(d).gjf (generated)

000675786.b3lyp_6-31g(d).firefly.inp (generated)

000675786.b3lyp_6-31g(d).smash.inp (generated)

000675786.b3lyp_6-31g(d).nwchem.inp (generated) 000675786.b3lyp_6-31g(d).log.xz 000675786.td-b3lyp_6-31g+(d).inp 000675786.td-b3lyp_6-31g+(d).log.xz

000675786.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675786.td-b3lyp_6-31+g(d).gjf (generated)

000675786.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675786.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675786.mol 000675786.PUBCHEM 000675786.mol (via Jmol)
000675787.b3lyp_6-31g(d).inp

000675787.b3lyp_6-31g(d).qchem.inp (generated)

000675787.b3lyp_6-31g(d).gjf (generated)

000675787.b3lyp_6-31g(d).firefly.inp (generated)

000675787.b3lyp_6-31g(d).smash.inp (generated)

000675787.b3lyp_6-31g(d).nwchem.inp (generated) 000675787.b3lyp_6-31g(d).log.xz 000675787.td-b3lyp_6-31g+(d).inp 000675787.td-b3lyp_6-31g+(d).log.xz

000675787.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675787.td-b3lyp_6-31+g(d).gjf (generated)

000675787.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675787.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675787.mol 000675787.PUBCHEM 000675787.mol (via Jmol)
000675801.b3lyp_6-31g(d).inp

000675801.b3lyp_6-31g(d).qchem.inp (generated)

000675801.b3lyp_6-31g(d).gjf (generated)

000675801.b3lyp_6-31g(d).firefly.inp (generated)

000675801.b3lyp_6-31g(d).smash.inp (generated)

000675801.b3lyp_6-31g(d).nwchem.inp (generated) 000675801.b3lyp_6-31g(d).log.xz 000675801.mol 000675801.PUBCHEM 000675801.mol (via Jmol)
000675807.b3lyp_6-31g(d).inp

000675807.b3lyp_6-31g(d).qchem.inp (generated)

000675807.b3lyp_6-31g(d).gjf (generated)

000675807.b3lyp_6-31g(d).firefly.inp (generated)

000675807.b3lyp_6-31g(d).smash.inp (generated)

000675807.b3lyp_6-31g(d).nwchem.inp (generated) 000675807.b3lyp_6-31g(d).log.xz 000675807.mol 000675807.PUBCHEM 000675807.mol (via Jmol)
000675808.b3lyp_6-31g(d).inp

000675808.b3lyp_6-31g(d).qchem.inp (generated)

000675808.b3lyp_6-31g(d).gjf (generated)

000675808.b3lyp_6-31g(d).firefly.inp (generated)

000675808.b3lyp_6-31g(d).smash.inp (generated)

000675808.b3lyp_6-31g(d).nwchem.inp (generated) 000675808.b3lyp_6-31g(d).log.xz 000675808.mol 000675808.PUBCHEM 000675808.mol (via Jmol)
000675864.b3lyp_6-31g(d).inp

000675864.b3lyp_6-31g(d).qchem.inp (generated)

000675864.b3lyp_6-31g(d).gjf (generated)

000675864.b3lyp_6-31g(d).firefly.inp (generated)

000675864.b3lyp_6-31g(d).smash.inp (generated)

000675864.b3lyp_6-31g(d).nwchem.inp (generated) 000675864.b3lyp_6-31g(d).log.xz 000675864.td-b3lyp_6-31g+(d).inp 000675864.td-b3lyp_6-31g+(d).log.xz

000675864.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675864.td-b3lyp_6-31+g(d).gjf (generated)

000675864.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675864.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675864.mol 000675864.PUBCHEM 000675864.mol (via Jmol)
000675878.b3lyp_6-31g(d).inp

000675878.b3lyp_6-31g(d).qchem.inp (generated)

000675878.b3lyp_6-31g(d).gjf (generated)

000675878.b3lyp_6-31g(d).firefly.inp (generated)

000675878.b3lyp_6-31g(d).smash.inp (generated)

000675878.b3lyp_6-31g(d).nwchem.inp (generated) 000675878.b3lyp_6-31g(d).log.xz 000675878.td-b3lyp_6-31g+(d).inp 000675878.td-b3lyp_6-31g+(d).log.xz

000675878.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675878.td-b3lyp_6-31+g(d).gjf (generated)

000675878.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675878.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675878.mol 000675878.PUBCHEM 000675878.mol (via Jmol)
000675880.b3lyp_6-31g(d).inp

000675880.b3lyp_6-31g(d).qchem.inp (generated)

000675880.b3lyp_6-31g(d).gjf (generated)

000675880.b3lyp_6-31g(d).firefly.inp (generated)

000675880.b3lyp_6-31g(d).smash.inp (generated)

000675880.b3lyp_6-31g(d).nwchem.inp (generated) 000675880.b3lyp_6-31g(d).log.xz 000675880.td-b3lyp_6-31g+(d).inp 000675880.td-b3lyp_6-31g+(d).log.xz

000675880.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675880.td-b3lyp_6-31+g(d).gjf (generated)

000675880.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675880.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675880.mol 000675880.PUBCHEM 000675880.mol (via Jmol)
000675950.b3lyp_6-31g(d).inp

000675950.b3lyp_6-31g(d).qchem.inp (generated)

000675950.b3lyp_6-31g(d).gjf (generated)

000675950.b3lyp_6-31g(d).firefly.inp (generated)

000675950.b3lyp_6-31g(d).smash.inp (generated)

000675950.b3lyp_6-31g(d).nwchem.inp (generated) 000675950.b3lyp_6-31g(d).log.xz 000675950.td-b3lyp_6-31g+(d).inp 000675950.td-b3lyp_6-31g+(d).log.xz

000675950.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675950.td-b3lyp_6-31+g(d).gjf (generated)

000675950.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675950.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675950.mol 000675950.PUBCHEM 000675950.mol (via Jmol)
000675962.b3lyp_6-31g(d).inp

000675962.b3lyp_6-31g(d).qchem.inp (generated)

000675962.b3lyp_6-31g(d).gjf (generated)

000675962.b3lyp_6-31g(d).firefly.inp (generated)

000675962.b3lyp_6-31g(d).smash.inp (generated)

000675962.b3lyp_6-31g(d).nwchem.inp (generated) 000675962.b3lyp_6-31g(d).log.xz 000675962.td-b3lyp_6-31g+(d).inp 000675962.td-b3lyp_6-31g+(d).log.xz

000675962.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675962.td-b3lyp_6-31+g(d).gjf (generated)

000675962.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675962.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675962.mol 000675962.PUBCHEM 000675962.mol (via Jmol)
000675975.b3lyp_6-31g(d).inp

000675975.b3lyp_6-31g(d).qchem.inp (generated)

000675975.b3lyp_6-31g(d).gjf (generated)

000675975.b3lyp_6-31g(d).firefly.inp (generated)

000675975.b3lyp_6-31g(d).smash.inp (generated)

000675975.b3lyp_6-31g(d).nwchem.inp (generated) 000675975.b3lyp_6-31g(d).log.xz 000675975.mol 000675975.PUBCHEM 000675975.mol (via Jmol)
000675983.b3lyp_6-31g(d).inp

000675983.b3lyp_6-31g(d).qchem.inp (generated)

000675983.b3lyp_6-31g(d).gjf (generated)

000675983.b3lyp_6-31g(d).firefly.inp (generated)

000675983.b3lyp_6-31g(d).smash.inp (generated)

000675983.b3lyp_6-31g(d).nwchem.inp (generated) 000675983.b3lyp_6-31g(d).log.xz 000675983.td-b3lyp_6-31g+(d).inp 000675983.td-b3lyp_6-31g+(d).log.xz

000675983.td-b3lyp_6-31+g(d).qchem.inp (generated)

000675983.td-b3lyp_6-31+g(d).gjf (generated)

000675983.td-b3lyp_6-31+g(d).firefly.inp (generated)

000675983.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000675983.mol 000675983.PUBCHEM 000675983.mol (via Jmol)
000676004.b3lyp_6-31g(d).inp

000676004.b3lyp_6-31g(d).qchem.inp (generated)

000676004.b3lyp_6-31g(d).gjf (generated)

000676004.b3lyp_6-31g(d).firefly.inp (generated)

000676004.b3lyp_6-31g(d).smash.inp (generated)

000676004.b3lyp_6-31g(d).nwchem.inp (generated) 000676004.b3lyp_6-31g(d).log.xz 000676004.mol 000676004.PUBCHEM 000676004.mol (via Jmol)
000676036.b3lyp_6-31g(d).inp

000676036.b3lyp_6-31g(d).qchem.inp (generated)

000676036.b3lyp_6-31g(d).gjf (generated)

000676036.b3lyp_6-31g(d).firefly.inp (generated)

000676036.b3lyp_6-31g(d).smash.inp (generated)

000676036.b3lyp_6-31g(d).nwchem.inp (generated) 000676036.b3lyp_6-31g(d).log.xz 000676036.td-b3lyp_6-31g+(d).inp 000676036.td-b3lyp_6-31g+(d).log.xz

000676036.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676036.td-b3lyp_6-31+g(d).gjf (generated)

000676036.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676036.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676036.mol 000676036.PUBCHEM 000676036.mol (via Jmol)
000676039.b3lyp_6-31g(d).inp

000676039.b3lyp_6-31g(d).qchem.inp (generated)

000676039.b3lyp_6-31g(d).gjf (generated)

000676039.b3lyp_6-31g(d).firefly.inp (generated)

000676039.b3lyp_6-31g(d).smash.inp (generated)

000676039.b3lyp_6-31g(d).nwchem.inp (generated) 000676039.b3lyp_6-31g(d).log.xz 000676039.td-b3lyp_6-31g+(d).inp 000676039.td-b3lyp_6-31g+(d).log.xz

000676039.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676039.td-b3lyp_6-31+g(d).gjf (generated)

000676039.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676039.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676039.mol 000676039.PUBCHEM 000676039.mol (via Jmol)
000676040.b3lyp_6-31g(d).inp

000676040.b3lyp_6-31g(d).qchem.inp (generated)

000676040.b3lyp_6-31g(d).gjf (generated)

000676040.b3lyp_6-31g(d).firefly.inp (generated)

000676040.b3lyp_6-31g(d).smash.inp (generated)

000676040.b3lyp_6-31g(d).nwchem.inp (generated) 000676040.b3lyp_6-31g(d).log.xz 000676040.mol 000676040.PUBCHEM 000676040.mol (via Jmol)
000676059.b3lyp_6-31g(d).inp

000676059.b3lyp_6-31g(d).qchem.inp (generated)

000676059.b3lyp_6-31g(d).gjf (generated)

000676059.b3lyp_6-31g(d).firefly.inp (generated)

000676059.b3lyp_6-31g(d).smash.inp (generated)

000676059.b3lyp_6-31g(d).nwchem.inp (generated) 000676059.b3lyp_6-31g(d).log.xz 000676059.td-b3lyp_6-31g+(d).inp 000676059.td-b3lyp_6-31g+(d).log.xz

000676059.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676059.td-b3lyp_6-31+g(d).gjf (generated)

000676059.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676059.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676059.mol 000676059.PUBCHEM 000676059.mol (via Jmol)
000676105.b3lyp_6-31g(d).inp

000676105.b3lyp_6-31g(d).qchem.inp (generated)

000676105.b3lyp_6-31g(d).gjf (generated)

000676105.b3lyp_6-31g(d).firefly.inp (generated)

000676105.b3lyp_6-31g(d).smash.inp (generated)

000676105.b3lyp_6-31g(d).nwchem.inp (generated) 000676105.b3lyp_6-31g(d).log.xz 000676105.td-b3lyp_6-31g+(d).inp 000676105.td-b3lyp_6-31g+(d).log.xz

000676105.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676105.td-b3lyp_6-31+g(d).gjf (generated)

000676105.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676105.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676105.mol 000676105.PUBCHEM 000676105.mol (via Jmol)
000676106.b3lyp_6-31g(d).inp

000676106.b3lyp_6-31g(d).qchem.inp (generated)

000676106.b3lyp_6-31g(d).gjf (generated)

000676106.b3lyp_6-31g(d).firefly.inp (generated)

000676106.b3lyp_6-31g(d).smash.inp (generated)

000676106.b3lyp_6-31g(d).nwchem.inp (generated) 000676106.b3lyp_6-31g(d).log.xz 000676106.td-b3lyp_6-31g+(d).inp 000676106.td-b3lyp_6-31g+(d).log.xz

000676106.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676106.td-b3lyp_6-31+g(d).gjf (generated)

000676106.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676106.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676106.mol 000676106.PUBCHEM 000676106.mol (via Jmol)
000676113.b3lyp_6-31g(d).inp

000676113.b3lyp_6-31g(d).qchem.inp (generated)

000676113.b3lyp_6-31g(d).gjf (generated)

000676113.b3lyp_6-31g(d).firefly.inp (generated)

000676113.b3lyp_6-31g(d).smash.inp (generated)

000676113.b3lyp_6-31g(d).nwchem.inp (generated) 000676113.b3lyp_6-31g(d).log.xz 000676113.mol 000676113.PUBCHEM 000676113.mol (via Jmol)
000676116.b3lyp_6-31g(d).inp

000676116.b3lyp_6-31g(d).qchem.inp (generated)

000676116.b3lyp_6-31g(d).gjf (generated)

000676116.b3lyp_6-31g(d).firefly.inp (generated)

000676116.b3lyp_6-31g(d).smash.inp (generated)

000676116.b3lyp_6-31g(d).nwchem.inp (generated) 000676116.b3lyp_6-31g(d).log.xz 000676116.td-b3lyp_6-31g+(d).inp 000676116.td-b3lyp_6-31g+(d).log.xz

000676116.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676116.td-b3lyp_6-31+g(d).gjf (generated)

000676116.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676116.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676116.mol 000676116.PUBCHEM 000676116.mol (via Jmol)
000676121.b3lyp_6-31g(d).inp

000676121.b3lyp_6-31g(d).qchem.inp (generated)

000676121.b3lyp_6-31g(d).gjf (generated)

000676121.b3lyp_6-31g(d).firefly.inp (generated)

000676121.b3lyp_6-31g(d).smash.inp (generated)

000676121.b3lyp_6-31g(d).nwchem.inp (generated) 000676121.b3lyp_6-31g(d).log.xz 000676121.td-b3lyp_6-31g+(d).inp 000676121.td-b3lyp_6-31g+(d).log.xz

000676121.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676121.td-b3lyp_6-31+g(d).gjf (generated)

000676121.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676121.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676121.mol 000676121.PUBCHEM 000676121.mol (via Jmol)
000676123.b3lyp_6-31g(d).inp

000676123.b3lyp_6-31g(d).qchem.inp (generated)

000676123.b3lyp_6-31g(d).gjf (generated)

000676123.b3lyp_6-31g(d).firefly.inp (generated)

000676123.b3lyp_6-31g(d).smash.inp (generated)

000676123.b3lyp_6-31g(d).nwchem.inp (generated) 000676123.b3lyp_6-31g(d).log.xz 000676123.td-b3lyp_6-31g+(d).inp 000676123.td-b3lyp_6-31g+(d).log.xz

000676123.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676123.td-b3lyp_6-31+g(d).gjf (generated)

000676123.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676123.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676123.mol 000676123.PUBCHEM 000676123.mol (via Jmol)
000676127.b3lyp_6-31g(d).inp

000676127.b3lyp_6-31g(d).qchem.inp (generated)

000676127.b3lyp_6-31g(d).gjf (generated)

000676127.b3lyp_6-31g(d).firefly.inp (generated)

000676127.b3lyp_6-31g(d).smash.inp (generated)

000676127.b3lyp_6-31g(d).nwchem.inp (generated) 000676127.b3lyp_6-31g(d).log.xz 000676127.td-b3lyp_6-31g+(d).inp 000676127.td-b3lyp_6-31g+(d).log.xz

000676127.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676127.td-b3lyp_6-31+g(d).gjf (generated)

000676127.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676127.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676127.mol 000676127.PUBCHEM 000676127.mol (via Jmol)
000676130.b3lyp_6-31g(d).inp

000676130.b3lyp_6-31g(d).qchem.inp (generated)

000676130.b3lyp_6-31g(d).gjf (generated)

000676130.b3lyp_6-31g(d).firefly.inp (generated)

000676130.b3lyp_6-31g(d).smash.inp (generated)

000676130.b3lyp_6-31g(d).nwchem.inp (generated) 000676130.b3lyp_6-31g(d).log.xz 000676130.td-b3lyp_6-31g+(d).inp 000676130.td-b3lyp_6-31g+(d).log.xz

000676130.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676130.td-b3lyp_6-31+g(d).gjf (generated)

000676130.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676130.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676130.mol 000676130.PUBCHEM 000676130.mol (via Jmol)
000676131.b3lyp_6-31g(d).inp

000676131.b3lyp_6-31g(d).qchem.inp (generated)

000676131.b3lyp_6-31g(d).gjf (generated)

000676131.b3lyp_6-31g(d).firefly.inp (generated)

000676131.b3lyp_6-31g(d).smash.inp (generated)

000676131.b3lyp_6-31g(d).nwchem.inp (generated) 000676131.b3lyp_6-31g(d).log.xz 000676131.td-b3lyp_6-31g+(d).inp 000676131.td-b3lyp_6-31g+(d).log.xz

000676131.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676131.td-b3lyp_6-31+g(d).gjf (generated)

000676131.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676131.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676131.mol 000676131.PUBCHEM 000676131.mol (via Jmol)
000676132.b3lyp_6-31g(d).inp

000676132.b3lyp_6-31g(d).qchem.inp (generated)

000676132.b3lyp_6-31g(d).gjf (generated)

000676132.b3lyp_6-31g(d).firefly.inp (generated)

000676132.b3lyp_6-31g(d).smash.inp (generated)

000676132.b3lyp_6-31g(d).nwchem.inp (generated) 000676132.b3lyp_6-31g(d).log.xz 000676132.td-b3lyp_6-31g+(d).inp 000676132.td-b3lyp_6-31g+(d).log.xz

000676132.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676132.td-b3lyp_6-31+g(d).gjf (generated)

000676132.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676132.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676132.mol 000676132.PUBCHEM 000676132.mol (via Jmol)
000676134.b3lyp_6-31g(d).inp

000676134.b3lyp_6-31g(d).qchem.inp (generated)

000676134.b3lyp_6-31g(d).gjf (generated)

000676134.b3lyp_6-31g(d).firefly.inp (generated)

000676134.b3lyp_6-31g(d).smash.inp (generated)

000676134.b3lyp_6-31g(d).nwchem.inp (generated) 000676134.b3lyp_6-31g(d).log.xz 000676134.td-b3lyp_6-31g+(d).inp 000676134.td-b3lyp_6-31g+(d).log.xz

000676134.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676134.td-b3lyp_6-31+g(d).gjf (generated)

000676134.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676134.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676134.mol 000676134.PUBCHEM 000676134.mol (via Jmol)
000676138.b3lyp_6-31g(d).inp

000676138.b3lyp_6-31g(d).qchem.inp (generated)

000676138.b3lyp_6-31g(d).gjf (generated)

000676138.b3lyp_6-31g(d).firefly.inp (generated)

000676138.b3lyp_6-31g(d).smash.inp (generated)

000676138.b3lyp_6-31g(d).nwchem.inp (generated) 000676138.b3lyp_6-31g(d).log.xz 000676138.mol 000676138.PUBCHEM 000676138.mol (via Jmol)
000676139.b3lyp_6-31g(d).inp

000676139.b3lyp_6-31g(d).qchem.inp (generated)

000676139.b3lyp_6-31g(d).gjf (generated)

000676139.b3lyp_6-31g(d).firefly.inp (generated)

000676139.b3lyp_6-31g(d).smash.inp (generated)

000676139.b3lyp_6-31g(d).nwchem.inp (generated) 000676139.b3lyp_6-31g(d).log.xz 000676139.mol 000676139.PUBCHEM 000676139.mol (via Jmol)
000676145.b3lyp_6-31g(d).inp

000676145.b3lyp_6-31g(d).qchem.inp (generated)

000676145.b3lyp_6-31g(d).gjf (generated)

000676145.b3lyp_6-31g(d).firefly.inp (generated)

000676145.b3lyp_6-31g(d).smash.inp (generated)

000676145.b3lyp_6-31g(d).nwchem.inp (generated) 000676145.b3lyp_6-31g(d).log.xz 000676145.mol 000676145.PUBCHEM 000676145.mol (via Jmol)
000676154.b3lyp_6-31g(d).inp

000676154.b3lyp_6-31g(d).qchem.inp (generated)

000676154.b3lyp_6-31g(d).gjf (generated)

000676154.b3lyp_6-31g(d).firefly.inp (generated)

000676154.b3lyp_6-31g(d).smash.inp (generated)

000676154.b3lyp_6-31g(d).nwchem.inp (generated) 000676154.b3lyp_6-31g(d).log.xz 000676154.td-b3lyp_6-31g+(d).inp 000676154.td-b3lyp_6-31g+(d).log.xz

000676154.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676154.td-b3lyp_6-31+g(d).gjf (generated)

000676154.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676154.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676154.mol 000676154.PUBCHEM 000676154.mol (via Jmol)
000676155.b3lyp_6-31g(d).inp

000676155.b3lyp_6-31g(d).qchem.inp (generated)

000676155.b3lyp_6-31g(d).gjf (generated)

000676155.b3lyp_6-31g(d).firefly.inp (generated)

000676155.b3lyp_6-31g(d).smash.inp (generated)

000676155.b3lyp_6-31g(d).nwchem.inp (generated) 000676155.b3lyp_6-31g(d).log.xz 000676155.td-b3lyp_6-31g+(d).inp 000676155.td-b3lyp_6-31g+(d).log.xz

000676155.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676155.td-b3lyp_6-31+g(d).gjf (generated)

000676155.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676155.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676155.mol 000676155.PUBCHEM 000676155.mol (via Jmol)
000676157.b3lyp_6-31g(d).inp

000676157.b3lyp_6-31g(d).qchem.inp (generated)

000676157.b3lyp_6-31g(d).gjf (generated)

000676157.b3lyp_6-31g(d).firefly.inp (generated)

000676157.b3lyp_6-31g(d).smash.inp (generated)

000676157.b3lyp_6-31g(d).nwchem.inp (generated) 000676157.b3lyp_6-31g(d).log.xz 000676157.td-b3lyp_6-31g+(d).inp 000676157.td-b3lyp_6-31g+(d).log.xz

000676157.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676157.td-b3lyp_6-31+g(d).gjf (generated)

000676157.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676157.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676157.mol 000676157.PUBCHEM 000676157.mol (via Jmol)
000676158.b3lyp_6-31g(d).inp

000676158.b3lyp_6-31g(d).qchem.inp (generated)

000676158.b3lyp_6-31g(d).gjf (generated)

000676158.b3lyp_6-31g(d).firefly.inp (generated)

000676158.b3lyp_6-31g(d).smash.inp (generated)

000676158.b3lyp_6-31g(d).nwchem.inp (generated) 000676158.b3lyp_6-31g(d).log.xz 000676158.td-b3lyp_6-31g+(d).inp 000676158.td-b3lyp_6-31g+(d).log.xz

000676158.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676158.td-b3lyp_6-31+g(d).gjf (generated)

000676158.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676158.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676158.mol 000676158.PUBCHEM 000676158.mol (via Jmol)
000676160.b3lyp_6-31g(d).inp

000676160.b3lyp_6-31g(d).qchem.inp (generated)

000676160.b3lyp_6-31g(d).gjf (generated)

000676160.b3lyp_6-31g(d).firefly.inp (generated)

000676160.b3lyp_6-31g(d).smash.inp (generated)

000676160.b3lyp_6-31g(d).nwchem.inp (generated) 000676160.b3lyp_6-31g(d).log.xz 000676160.mol 000676160.PUBCHEM 000676160.mol (via Jmol)
000676184.b3lyp_6-31g(d).inp

000676184.b3lyp_6-31g(d).qchem.inp (generated)

000676184.b3lyp_6-31g(d).gjf (generated)

000676184.b3lyp_6-31g(d).firefly.inp (generated)

000676184.b3lyp_6-31g(d).smash.inp (generated)

000676184.b3lyp_6-31g(d).nwchem.inp (generated) 000676184.b3lyp_6-31g(d).log.xz 000676184.td-b3lyp_6-31g+(d).inp 000676184.td-b3lyp_6-31g+(d).log.xz

000676184.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676184.td-b3lyp_6-31+g(d).gjf (generated)

000676184.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676184.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676184.mol 000676184.PUBCHEM 000676184.mol (via Jmol)
000676234.b3lyp_6-31g(d).inp

000676234.b3lyp_6-31g(d).qchem.inp (generated)

000676234.b3lyp_6-31g(d).gjf (generated)

000676234.b3lyp_6-31g(d).firefly.inp (generated)

000676234.b3lyp_6-31g(d).smash.inp (generated)

000676234.b3lyp_6-31g(d).nwchem.inp (generated) 000676234.b3lyp_6-31g(d).log.xz 000676234.mol 000676234.PUBCHEM 000676234.mol (via Jmol)
000676256.b3lyp_6-31g(d).inp

000676256.b3lyp_6-31g(d).qchem.inp (generated)

000676256.b3lyp_6-31g(d).gjf (generated)

000676256.b3lyp_6-31g(d).firefly.inp (generated)

000676256.b3lyp_6-31g(d).smash.inp (generated)

000676256.b3lyp_6-31g(d).nwchem.inp (generated) 000676256.b3lyp_6-31g(d).log.xz 000676256.td-b3lyp_6-31g+(d).inp 000676256.td-b3lyp_6-31g+(d).log.xz

000676256.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676256.td-b3lyp_6-31+g(d).gjf (generated)

000676256.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676256.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676256.mol 000676256.PUBCHEM 000676256.mol (via Jmol)
000676266.b3lyp_6-31g(d).inp

000676266.b3lyp_6-31g(d).qchem.inp (generated)

000676266.b3lyp_6-31g(d).gjf (generated)

000676266.b3lyp_6-31g(d).firefly.inp (generated)

000676266.b3lyp_6-31g(d).smash.inp (generated)

000676266.b3lyp_6-31g(d).nwchem.inp (generated) 000676266.b3lyp_6-31g(d).log.xz 000676266.td-b3lyp_6-31g+(d).inp 000676266.td-b3lyp_6-31g+(d).log.xz

000676266.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676266.td-b3lyp_6-31+g(d).gjf (generated)

000676266.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676266.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676266.mol 000676266.PUBCHEM 000676266.mol (via Jmol)
000676311.b3lyp_6-31g(d).inp

000676311.b3lyp_6-31g(d).qchem.inp (generated)

000676311.b3lyp_6-31g(d).gjf (generated)

000676311.b3lyp_6-31g(d).firefly.inp (generated)

000676311.b3lyp_6-31g(d).smash.inp (generated)

000676311.b3lyp_6-31g(d).nwchem.inp (generated) 000676311.b3lyp_6-31g(d).log.xz 000676311.td-b3lyp_6-31g+(d).inp 000676311.td-b3lyp_6-31g+(d).log.xz

000676311.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676311.td-b3lyp_6-31+g(d).gjf (generated)

000676311.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676311.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676311.mol 000676311.PUBCHEM 000676311.mol (via Jmol)
000676321.b3lyp_6-31g(d).inp

000676321.b3lyp_6-31g(d).qchem.inp (generated)

000676321.b3lyp_6-31g(d).gjf (generated)

000676321.b3lyp_6-31g(d).firefly.inp (generated)

000676321.b3lyp_6-31g(d).smash.inp (generated)

000676321.b3lyp_6-31g(d).nwchem.inp (generated) 000676321.b3lyp_6-31g(d).log.xz 000676321.mol 000676321.PUBCHEM 000676321.mol (via Jmol)
000676324.b3lyp_6-31g(d).inp

000676324.b3lyp_6-31g(d).qchem.inp (generated)

000676324.b3lyp_6-31g(d).gjf (generated)

000676324.b3lyp_6-31g(d).firefly.inp (generated)

000676324.b3lyp_6-31g(d).smash.inp (generated)

000676324.b3lyp_6-31g(d).nwchem.inp (generated) 000676324.b3lyp_6-31g(d).log.xz 000676324.td-b3lyp_6-31g+(d).inp 000676324.td-b3lyp_6-31g+(d).log.xz

000676324.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676324.td-b3lyp_6-31+g(d).gjf (generated)

000676324.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676324.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676324.mol 000676324.PUBCHEM 000676324.mol (via Jmol)
000676339.b3lyp_6-31g(d).inp

000676339.b3lyp_6-31g(d).qchem.inp (generated)

000676339.b3lyp_6-31g(d).gjf (generated)

000676339.b3lyp_6-31g(d).firefly.inp (generated)

000676339.b3lyp_6-31g(d).smash.inp (generated)

000676339.b3lyp_6-31g(d).nwchem.inp (generated) 000676339.b3lyp_6-31g(d).log.xz 000676339.td-b3lyp_6-31g+(d).inp 000676339.td-b3lyp_6-31g+(d).log.xz

000676339.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676339.td-b3lyp_6-31+g(d).gjf (generated)

000676339.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676339.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676339.mol 000676339.PUBCHEM 000676339.mol (via Jmol)
000676340.b3lyp_6-31g(d).inp

000676340.b3lyp_6-31g(d).qchem.inp (generated)

000676340.b3lyp_6-31g(d).gjf (generated)

000676340.b3lyp_6-31g(d).firefly.inp (generated)

000676340.b3lyp_6-31g(d).smash.inp (generated)

000676340.b3lyp_6-31g(d).nwchem.inp (generated) 000676340.b3lyp_6-31g(d).log.xz 000676340.td-b3lyp_6-31g+(d).inp 000676340.td-b3lyp_6-31g+(d).log.xz

000676340.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676340.td-b3lyp_6-31+g(d).gjf (generated)

000676340.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676340.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676340.mol 000676340.PUBCHEM 000676340.mol (via Jmol)
000676341.b3lyp_6-31g(d).inp

000676341.b3lyp_6-31g(d).qchem.inp (generated)

000676341.b3lyp_6-31g(d).gjf (generated)

000676341.b3lyp_6-31g(d).firefly.inp (generated)

000676341.b3lyp_6-31g(d).smash.inp (generated)

000676341.b3lyp_6-31g(d).nwchem.inp (generated) 000676341.b3lyp_6-31g(d).log.xz 000676341.mol 000676341.PUBCHEM 000676341.mol (via Jmol)
000676342.b3lyp_6-31g(d).inp

000676342.b3lyp_6-31g(d).qchem.inp (generated)

000676342.b3lyp_6-31g(d).gjf (generated)

000676342.b3lyp_6-31g(d).firefly.inp (generated)

000676342.b3lyp_6-31g(d).smash.inp (generated)

000676342.b3lyp_6-31g(d).nwchem.inp (generated) 000676342.b3lyp_6-31g(d).log.xz 000676342.mol 000676342.PUBCHEM 000676342.mol (via Jmol)
000676349.b3lyp_6-31g(d).inp

000676349.b3lyp_6-31g(d).qchem.inp (generated)

000676349.b3lyp_6-31g(d).gjf (generated)

000676349.b3lyp_6-31g(d).firefly.inp (generated)

000676349.b3lyp_6-31g(d).smash.inp (generated)

000676349.b3lyp_6-31g(d).nwchem.inp (generated) 000676349.b3lyp_6-31g(d).log.xz 000676349.td-b3lyp_6-31g+(d).inp 000676349.td-b3lyp_6-31g+(d).log.xz

000676349.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676349.td-b3lyp_6-31+g(d).gjf (generated)

000676349.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676349.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676349.mol 000676349.PUBCHEM 000676349.mol (via Jmol)
000676368.b3lyp_6-31g(d).inp

000676368.b3lyp_6-31g(d).qchem.inp (generated)

000676368.b3lyp_6-31g(d).gjf (generated)

000676368.b3lyp_6-31g(d).firefly.inp (generated)

000676368.b3lyp_6-31g(d).smash.inp (generated)

000676368.b3lyp_6-31g(d).nwchem.inp (generated) 000676368.b3lyp_6-31g(d).log.xz 000676368.td-b3lyp_6-31g+(d).inp 000676368.td-b3lyp_6-31g+(d).log.xz

000676368.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676368.td-b3lyp_6-31+g(d).gjf (generated)

000676368.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676368.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676368.mol 000676368.PUBCHEM 000676368.mol (via Jmol)
000676391.b3lyp_6-31g(d).inp

000676391.b3lyp_6-31g(d).qchem.inp (generated)

000676391.b3lyp_6-31g(d).gjf (generated)

000676391.b3lyp_6-31g(d).firefly.inp (generated)

000676391.b3lyp_6-31g(d).smash.inp (generated)

000676391.b3lyp_6-31g(d).nwchem.inp (generated) 000676391.b3lyp_6-31g(d).log.xz 000676391.td-b3lyp_6-31g+(d).inp 000676391.td-b3lyp_6-31g+(d).log.xz

000676391.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676391.td-b3lyp_6-31+g(d).gjf (generated)

000676391.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676391.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676391.mol 000676391.PUBCHEM 000676391.mol (via Jmol)
000676394.b3lyp_6-31g(d).inp

000676394.b3lyp_6-31g(d).qchem.inp (generated)

000676394.b3lyp_6-31g(d).gjf (generated)

000676394.b3lyp_6-31g(d).firefly.inp (generated)

000676394.b3lyp_6-31g(d).smash.inp (generated)

000676394.b3lyp_6-31g(d).nwchem.inp (generated) 000676394.b3lyp_6-31g(d).log.xz 000676394.td-b3lyp_6-31g+(d).inp 000676394.td-b3lyp_6-31g+(d).log.xz

000676394.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676394.td-b3lyp_6-31+g(d).gjf (generated)

000676394.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676394.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676394.mol 000676394.PUBCHEM 000676394.mol (via Jmol)
000676395.b3lyp_6-31g(d).inp

000676395.b3lyp_6-31g(d).qchem.inp (generated)

000676395.b3lyp_6-31g(d).gjf (generated)

000676395.b3lyp_6-31g(d).firefly.inp (generated)

000676395.b3lyp_6-31g(d).smash.inp (generated)

000676395.b3lyp_6-31g(d).nwchem.inp (generated) 000676395.b3lyp_6-31g(d).log.xz 000676395.td-b3lyp_6-31g+(d).inp 000676395.td-b3lyp_6-31g+(d).log.xz

000676395.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676395.td-b3lyp_6-31+g(d).gjf (generated)

000676395.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676395.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676395.mol 000676395.PUBCHEM 000676395.mol (via Jmol)
000676408.b3lyp_6-31g(d).inp

000676408.b3lyp_6-31g(d).qchem.inp (generated)

000676408.b3lyp_6-31g(d).gjf (generated)

000676408.b3lyp_6-31g(d).firefly.inp (generated)

000676408.b3lyp_6-31g(d).smash.inp (generated)

000676408.b3lyp_6-31g(d).nwchem.inp (generated) 000676408.b3lyp_6-31g(d).log.xz 000676408.td-b3lyp_6-31g+(d).inp 000676408.td-b3lyp_6-31g+(d).log.xz

000676408.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676408.td-b3lyp_6-31+g(d).gjf (generated)

000676408.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676408.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676408.mol 000676408.PUBCHEM 000676408.mol (via Jmol)
000676409.b3lyp_6-31g(d).inp

000676409.b3lyp_6-31g(d).qchem.inp (generated)

000676409.b3lyp_6-31g(d).gjf (generated)

000676409.b3lyp_6-31g(d).firefly.inp (generated)

000676409.b3lyp_6-31g(d).smash.inp (generated)

000676409.b3lyp_6-31g(d).nwchem.inp (generated) 000676409.b3lyp_6-31g(d).log.xz 000676409.td-b3lyp_6-31g+(d).inp 000676409.td-b3lyp_6-31g+(d).log.xz

000676409.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676409.td-b3lyp_6-31+g(d).gjf (generated)

000676409.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676409.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676409.mol 000676409.PUBCHEM 000676409.mol (via Jmol)
000676410.b3lyp_6-31g(d).inp

000676410.b3lyp_6-31g(d).qchem.inp (generated)

000676410.b3lyp_6-31g(d).gjf (generated)

000676410.b3lyp_6-31g(d).firefly.inp (generated)

000676410.b3lyp_6-31g(d).smash.inp (generated)

000676410.b3lyp_6-31g(d).nwchem.inp (generated) 000676410.b3lyp_6-31g(d).log.xz 000676410.td-b3lyp_6-31g+(d).inp 000676410.td-b3lyp_6-31g+(d).log.xz

000676410.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676410.td-b3lyp_6-31+g(d).gjf (generated)

000676410.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676410.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676410.mol 000676410.PUBCHEM 000676410.mol (via Jmol)
000676411.b3lyp_6-31g(d).inp

000676411.b3lyp_6-31g(d).qchem.inp (generated)

000676411.b3lyp_6-31g(d).gjf (generated)

000676411.b3lyp_6-31g(d).firefly.inp (generated)

000676411.b3lyp_6-31g(d).smash.inp (generated)

000676411.b3lyp_6-31g(d).nwchem.inp (generated) 000676411.b3lyp_6-31g(d).log.xz 000676411.td-b3lyp_6-31g+(d).inp 000676411.td-b3lyp_6-31g+(d).log.xz

000676411.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676411.td-b3lyp_6-31+g(d).gjf (generated)

000676411.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676411.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676411.mol 000676411.PUBCHEM 000676411.mol (via Jmol)
000676412.b3lyp_6-31g(d).inp

000676412.b3lyp_6-31g(d).qchem.inp (generated)

000676412.b3lyp_6-31g(d).gjf (generated)

000676412.b3lyp_6-31g(d).firefly.inp (generated)

000676412.b3lyp_6-31g(d).smash.inp (generated)

000676412.b3lyp_6-31g(d).nwchem.inp (generated) 000676412.b3lyp_6-31g(d).log.xz 000676412.td-b3lyp_6-31g+(d).inp 000676412.td-b3lyp_6-31g+(d).log.xz

000676412.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676412.td-b3lyp_6-31+g(d).gjf (generated)

000676412.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676412.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676412.mol 000676412.PUBCHEM 000676412.mol (via Jmol)
000676413.b3lyp_6-31g(d).inp

000676413.b3lyp_6-31g(d).qchem.inp (generated)

000676413.b3lyp_6-31g(d).gjf (generated)

000676413.b3lyp_6-31g(d).firefly.inp (generated)

000676413.b3lyp_6-31g(d).smash.inp (generated)

000676413.b3lyp_6-31g(d).nwchem.inp (generated) 000676413.b3lyp_6-31g(d).log.xz 000676413.td-b3lyp_6-31g+(d).inp 000676413.td-b3lyp_6-31g+(d).log.xz

000676413.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676413.td-b3lyp_6-31+g(d).gjf (generated)

000676413.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676413.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676413.mol 000676413.PUBCHEM 000676413.mol (via Jmol)
000676414.b3lyp_6-31g(d).inp

000676414.b3lyp_6-31g(d).qchem.inp (generated)

000676414.b3lyp_6-31g(d).gjf (generated)

000676414.b3lyp_6-31g(d).firefly.inp (generated)

000676414.b3lyp_6-31g(d).smash.inp (generated)

000676414.b3lyp_6-31g(d).nwchem.inp (generated) 000676414.b3lyp_6-31g(d).log.xz 000676414.td-b3lyp_6-31g+(d).inp 000676414.td-b3lyp_6-31g+(d).log.xz

000676414.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676414.td-b3lyp_6-31+g(d).gjf (generated)

000676414.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676414.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676414.mol 000676414.PUBCHEM 000676414.mol (via Jmol)
000676415.b3lyp_6-31g(d).inp

000676415.b3lyp_6-31g(d).qchem.inp (generated)

000676415.b3lyp_6-31g(d).gjf (generated)

000676415.b3lyp_6-31g(d).firefly.inp (generated)

000676415.b3lyp_6-31g(d).smash.inp (generated)

000676415.b3lyp_6-31g(d).nwchem.inp (generated) 000676415.b3lyp_6-31g(d).log.xz 000676415.td-b3lyp_6-31g+(d).inp 000676415.td-b3lyp_6-31g+(d).log.xz

000676415.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676415.td-b3lyp_6-31+g(d).gjf (generated)

000676415.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676415.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676415.mol 000676415.PUBCHEM 000676415.mol (via Jmol)
000676416.b3lyp_6-31g(d).inp

000676416.b3lyp_6-31g(d).qchem.inp (generated)

000676416.b3lyp_6-31g(d).gjf (generated)

000676416.b3lyp_6-31g(d).firefly.inp (generated)

000676416.b3lyp_6-31g(d).smash.inp (generated)

000676416.b3lyp_6-31g(d).nwchem.inp (generated) 000676416.b3lyp_6-31g(d).log.xz 000676416.td-b3lyp_6-31g+(d).inp 000676416.td-b3lyp_6-31g+(d).log.xz

000676416.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676416.td-b3lyp_6-31+g(d).gjf (generated)

000676416.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676416.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676416.mol 000676416.PUBCHEM 000676416.mol (via Jmol)
000676417.b3lyp_6-31g(d).inp

000676417.b3lyp_6-31g(d).qchem.inp (generated)

000676417.b3lyp_6-31g(d).gjf (generated)

000676417.b3lyp_6-31g(d).firefly.inp (generated)

000676417.b3lyp_6-31g(d).smash.inp (generated)

000676417.b3lyp_6-31g(d).nwchem.inp (generated) 000676417.b3lyp_6-31g(d).log.xz 000676417.td-b3lyp_6-31g+(d).inp 000676417.td-b3lyp_6-31g+(d).log.xz

000676417.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676417.td-b3lyp_6-31+g(d).gjf (generated)

000676417.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676417.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676417.mol 000676417.PUBCHEM 000676417.mol (via Jmol)
000676418.b3lyp_6-31g(d).inp

000676418.b3lyp_6-31g(d).qchem.inp (generated)

000676418.b3lyp_6-31g(d).gjf (generated)

000676418.b3lyp_6-31g(d).firefly.inp (generated)

000676418.b3lyp_6-31g(d).smash.inp (generated)

000676418.b3lyp_6-31g(d).nwchem.inp (generated) 000676418.b3lyp_6-31g(d).log.xz 000676418.td-b3lyp_6-31g+(d).inp 000676418.td-b3lyp_6-31g+(d).log.xz

000676418.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676418.td-b3lyp_6-31+g(d).gjf (generated)

000676418.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676418.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676418.mol 000676418.PUBCHEM 000676418.mol (via Jmol)
000676421.b3lyp_6-31g(d).inp

000676421.b3lyp_6-31g(d).qchem.inp (generated)

000676421.b3lyp_6-31g(d).gjf (generated)

000676421.b3lyp_6-31g(d).firefly.inp (generated)

000676421.b3lyp_6-31g(d).smash.inp (generated)

000676421.b3lyp_6-31g(d).nwchem.inp (generated) 000676421.b3lyp_6-31g(d).log.xz 000676421.td-b3lyp_6-31g+(d).inp 000676421.td-b3lyp_6-31g+(d).log.xz

000676421.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676421.td-b3lyp_6-31+g(d).gjf (generated)

000676421.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676421.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676421.mol 000676421.PUBCHEM 000676421.mol (via Jmol)
000676422.b3lyp_6-31g(d).inp

000676422.b3lyp_6-31g(d).qchem.inp (generated)

000676422.b3lyp_6-31g(d).gjf (generated)

000676422.b3lyp_6-31g(d).firefly.inp (generated)

000676422.b3lyp_6-31g(d).smash.inp (generated)

000676422.b3lyp_6-31g(d).nwchem.inp (generated) 000676422.b3lyp_6-31g(d).log.xz 000676422.td-b3lyp_6-31g+(d).inp 000676422.td-b3lyp_6-31g+(d).log.xz

000676422.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676422.td-b3lyp_6-31+g(d).gjf (generated)

000676422.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676422.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676422.mol 000676422.PUBCHEM 000676422.mol (via Jmol)
000676423.b3lyp_6-31g(d).inp

000676423.b3lyp_6-31g(d).qchem.inp (generated)

000676423.b3lyp_6-31g(d).gjf (generated)

000676423.b3lyp_6-31g(d).firefly.inp (generated)

000676423.b3lyp_6-31g(d).smash.inp (generated)

000676423.b3lyp_6-31g(d).nwchem.inp (generated) 000676423.b3lyp_6-31g(d).log.xz 000676423.td-b3lyp_6-31g+(d).inp 000676423.td-b3lyp_6-31g+(d).log.xz

000676423.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676423.td-b3lyp_6-31+g(d).gjf (generated)

000676423.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676423.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676423.mol 000676423.PUBCHEM 000676423.mol (via Jmol)
000676425.b3lyp_6-31g(d).inp

000676425.b3lyp_6-31g(d).qchem.inp (generated)

000676425.b3lyp_6-31g(d).gjf (generated)

000676425.b3lyp_6-31g(d).firefly.inp (generated)

000676425.b3lyp_6-31g(d).smash.inp (generated)

000676425.b3lyp_6-31g(d).nwchem.inp (generated) 000676425.b3lyp_6-31g(d).log.xz 000676425.td-b3lyp_6-31g+(d).inp 000676425.td-b3lyp_6-31g+(d).log.xz

000676425.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676425.td-b3lyp_6-31+g(d).gjf (generated)

000676425.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676425.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676425.mol 000676425.PUBCHEM 000676425.mol (via Jmol)
000676426.b3lyp_6-31g(d).inp

000676426.b3lyp_6-31g(d).qchem.inp (generated)

000676426.b3lyp_6-31g(d).gjf (generated)

000676426.b3lyp_6-31g(d).firefly.inp (generated)

000676426.b3lyp_6-31g(d).smash.inp (generated)

000676426.b3lyp_6-31g(d).nwchem.inp (generated) 000676426.b3lyp_6-31g(d).log.xz 000676426.td-b3lyp_6-31g+(d).inp 000676426.td-b3lyp_6-31g+(d).log.xz

000676426.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676426.td-b3lyp_6-31+g(d).gjf (generated)

000676426.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676426.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676426.mol 000676426.PUBCHEM 000676426.mol (via Jmol)
000676427.b3lyp_6-31g(d).inp

000676427.b3lyp_6-31g(d).qchem.inp (generated)

000676427.b3lyp_6-31g(d).gjf (generated)

000676427.b3lyp_6-31g(d).firefly.inp (generated)

000676427.b3lyp_6-31g(d).smash.inp (generated)

000676427.b3lyp_6-31g(d).nwchem.inp (generated) 000676427.b3lyp_6-31g(d).log.xz 000676427.td-b3lyp_6-31g+(d).inp 000676427.td-b3lyp_6-31g+(d).log.xz

000676427.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676427.td-b3lyp_6-31+g(d).gjf (generated)

000676427.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676427.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676427.mol 000676427.PUBCHEM 000676427.mol (via Jmol)
000676428.b3lyp_6-31g(d).inp

000676428.b3lyp_6-31g(d).qchem.inp (generated)

000676428.b3lyp_6-31g(d).gjf (generated)

000676428.b3lyp_6-31g(d).firefly.inp (generated)

000676428.b3lyp_6-31g(d).smash.inp (generated)

000676428.b3lyp_6-31g(d).nwchem.inp (generated) 000676428.b3lyp_6-31g(d).log.xz 000676428.td-b3lyp_6-31g+(d).inp 000676428.td-b3lyp_6-31g+(d).log.xz

000676428.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676428.td-b3lyp_6-31+g(d).gjf (generated)

000676428.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676428.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676428.mol 000676428.PUBCHEM 000676428.mol (via Jmol)
000676429.b3lyp_6-31g(d).inp

000676429.b3lyp_6-31g(d).qchem.inp (generated)

000676429.b3lyp_6-31g(d).gjf (generated)

000676429.b3lyp_6-31g(d).firefly.inp (generated)

000676429.b3lyp_6-31g(d).smash.inp (generated)

000676429.b3lyp_6-31g(d).nwchem.inp (generated) 000676429.b3lyp_6-31g(d).log.xz 000676429.td-b3lyp_6-31g+(d).inp 000676429.td-b3lyp_6-31g+(d).log.xz

000676429.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676429.td-b3lyp_6-31+g(d).gjf (generated)

000676429.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676429.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676429.mol 000676429.PUBCHEM 000676429.mol (via Jmol)
000676430.b3lyp_6-31g(d).inp

000676430.b3lyp_6-31g(d).qchem.inp (generated)

000676430.b3lyp_6-31g(d).gjf (generated)

000676430.b3lyp_6-31g(d).firefly.inp (generated)

000676430.b3lyp_6-31g(d).smash.inp (generated)

000676430.b3lyp_6-31g(d).nwchem.inp (generated) 000676430.b3lyp_6-31g(d).log.xz 000676430.td-b3lyp_6-31g+(d).inp 000676430.td-b3lyp_6-31g+(d).log.xz

000676430.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676430.td-b3lyp_6-31+g(d).gjf (generated)

000676430.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676430.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676430.mol 000676430.PUBCHEM 000676430.mol (via Jmol)
000676431.b3lyp_6-31g(d).inp

000676431.b3lyp_6-31g(d).qchem.inp (generated)

000676431.b3lyp_6-31g(d).gjf (generated)

000676431.b3lyp_6-31g(d).firefly.inp (generated)

000676431.b3lyp_6-31g(d).smash.inp (generated)

000676431.b3lyp_6-31g(d).nwchem.inp (generated) 000676431.b3lyp_6-31g(d).log.xz 000676431.td-b3lyp_6-31g+(d).inp 000676431.td-b3lyp_6-31g+(d).log.xz

000676431.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676431.td-b3lyp_6-31+g(d).gjf (generated)

000676431.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676431.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676431.mol 000676431.PUBCHEM 000676431.mol (via Jmol)
000676432.b3lyp_6-31g(d).inp

000676432.b3lyp_6-31g(d).qchem.inp (generated)

000676432.b3lyp_6-31g(d).gjf (generated)

000676432.b3lyp_6-31g(d).firefly.inp (generated)

000676432.b3lyp_6-31g(d).smash.inp (generated)

000676432.b3lyp_6-31g(d).nwchem.inp (generated) 000676432.b3lyp_6-31g(d).log.xz 000676432.td-b3lyp_6-31g+(d).inp 000676432.td-b3lyp_6-31g+(d).log.xz

000676432.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676432.td-b3lyp_6-31+g(d).gjf (generated)

000676432.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676432.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676432.mol 000676432.PUBCHEM 000676432.mol (via Jmol)
000676433.b3lyp_6-31g(d).inp

000676433.b3lyp_6-31g(d).qchem.inp (generated)

000676433.b3lyp_6-31g(d).gjf (generated)

000676433.b3lyp_6-31g(d).firefly.inp (generated)

000676433.b3lyp_6-31g(d).smash.inp (generated)

000676433.b3lyp_6-31g(d).nwchem.inp (generated) 000676433.b3lyp_6-31g(d).log.xz 000676433.td-b3lyp_6-31g+(d).inp 000676433.td-b3lyp_6-31g+(d).log.xz

000676433.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676433.td-b3lyp_6-31+g(d).gjf (generated)

000676433.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676433.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676433.mol 000676433.PUBCHEM 000676433.mol (via Jmol)
000676434.b3lyp_6-31g(d).inp

000676434.b3lyp_6-31g(d).qchem.inp (generated)

000676434.b3lyp_6-31g(d).gjf (generated)

000676434.b3lyp_6-31g(d).firefly.inp (generated)

000676434.b3lyp_6-31g(d).smash.inp (generated)

000676434.b3lyp_6-31g(d).nwchem.inp (generated) 000676434.b3lyp_6-31g(d).log.xz 000676434.td-b3lyp_6-31g+(d).inp 000676434.td-b3lyp_6-31g+(d).log.xz

000676434.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676434.td-b3lyp_6-31+g(d).gjf (generated)

000676434.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676434.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676434.mol 000676434.PUBCHEM 000676434.mol (via Jmol)
000676435.b3lyp_6-31g(d).inp

000676435.b3lyp_6-31g(d).qchem.inp (generated)

000676435.b3lyp_6-31g(d).gjf (generated)

000676435.b3lyp_6-31g(d).firefly.inp (generated)

000676435.b3lyp_6-31g(d).smash.inp (generated)

000676435.b3lyp_6-31g(d).nwchem.inp (generated) 000676435.b3lyp_6-31g(d).log.xz 000676435.td-b3lyp_6-31g+(d).inp 000676435.td-b3lyp_6-31g+(d).log.xz

000676435.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676435.td-b3lyp_6-31+g(d).gjf (generated)

000676435.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676435.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676435.mol 000676435.PUBCHEM 000676435.mol (via Jmol)
000676436.b3lyp_6-31g(d).inp

000676436.b3lyp_6-31g(d).qchem.inp (generated)

000676436.b3lyp_6-31g(d).gjf (generated)

000676436.b3lyp_6-31g(d).firefly.inp (generated)

000676436.b3lyp_6-31g(d).smash.inp (generated)

000676436.b3lyp_6-31g(d).nwchem.inp (generated) 000676436.b3lyp_6-31g(d).log.xz 000676436.td-b3lyp_6-31g+(d).inp 000676436.td-b3lyp_6-31g+(d).log.xz

000676436.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676436.td-b3lyp_6-31+g(d).gjf (generated)

000676436.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676436.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676436.mol 000676436.PUBCHEM 000676436.mol (via Jmol)
000676437.b3lyp_6-31g(d).inp

000676437.b3lyp_6-31g(d).qchem.inp (generated)

000676437.b3lyp_6-31g(d).gjf (generated)

000676437.b3lyp_6-31g(d).firefly.inp (generated)

000676437.b3lyp_6-31g(d).smash.inp (generated)

000676437.b3lyp_6-31g(d).nwchem.inp (generated) 000676437.b3lyp_6-31g(d).log.xz 000676437.td-b3lyp_6-31g+(d).inp 000676437.td-b3lyp_6-31g+(d).log.xz

000676437.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676437.td-b3lyp_6-31+g(d).gjf (generated)

000676437.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676437.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676437.mol 000676437.PUBCHEM 000676437.mol (via Jmol)
000676438.b3lyp_6-31g(d).inp

000676438.b3lyp_6-31g(d).qchem.inp (generated)

000676438.b3lyp_6-31g(d).gjf (generated)

000676438.b3lyp_6-31g(d).firefly.inp (generated)

000676438.b3lyp_6-31g(d).smash.inp (generated)

000676438.b3lyp_6-31g(d).nwchem.inp (generated) 000676438.b3lyp_6-31g(d).log.xz 000676438.td-b3lyp_6-31g+(d).inp 000676438.td-b3lyp_6-31g+(d).log.xz

000676438.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676438.td-b3lyp_6-31+g(d).gjf (generated)

000676438.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676438.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676438.mol 000676438.PUBCHEM 000676438.mol (via Jmol)
000676439.b3lyp_6-31g(d).inp

000676439.b3lyp_6-31g(d).qchem.inp (generated)

000676439.b3lyp_6-31g(d).gjf (generated)

000676439.b3lyp_6-31g(d).firefly.inp (generated)

000676439.b3lyp_6-31g(d).smash.inp (generated)

000676439.b3lyp_6-31g(d).nwchem.inp (generated) 000676439.b3lyp_6-31g(d).log.xz 000676439.td-b3lyp_6-31g+(d).inp 000676439.td-b3lyp_6-31g+(d).log.xz

000676439.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676439.td-b3lyp_6-31+g(d).gjf (generated)

000676439.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676439.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676439.mol 000676439.PUBCHEM 000676439.mol (via Jmol)
000676440.b3lyp_6-31g(d).inp

000676440.b3lyp_6-31g(d).qchem.inp (generated)

000676440.b3lyp_6-31g(d).gjf (generated)

000676440.b3lyp_6-31g(d).firefly.inp (generated)

000676440.b3lyp_6-31g(d).smash.inp (generated)

000676440.b3lyp_6-31g(d).nwchem.inp (generated) 000676440.b3lyp_6-31g(d).log.xz 000676440.td-b3lyp_6-31g+(d).inp 000676440.td-b3lyp_6-31g+(d).log.xz

000676440.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676440.td-b3lyp_6-31+g(d).gjf (generated)

000676440.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676440.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676440.mol 000676440.PUBCHEM 000676440.mol (via Jmol)
000676442.b3lyp_6-31g(d).inp

000676442.b3lyp_6-31g(d).qchem.inp (generated)

000676442.b3lyp_6-31g(d).gjf (generated)

000676442.b3lyp_6-31g(d).firefly.inp (generated)

000676442.b3lyp_6-31g(d).smash.inp (generated)

000676442.b3lyp_6-31g(d).nwchem.inp (generated) 000676442.b3lyp_6-31g(d).log.xz 000676442.td-b3lyp_6-31g+(d).inp 000676442.td-b3lyp_6-31g+(d).log.xz

000676442.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676442.td-b3lyp_6-31+g(d).gjf (generated)

000676442.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676442.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676442.mol 000676442.PUBCHEM 000676442.mol (via Jmol)
000676443.b3lyp_6-31g(d).inp

000676443.b3lyp_6-31g(d).qchem.inp (generated)

000676443.b3lyp_6-31g(d).gjf (generated)

000676443.b3lyp_6-31g(d).firefly.inp (generated)

000676443.b3lyp_6-31g(d).smash.inp (generated)

000676443.b3lyp_6-31g(d).nwchem.inp (generated) 000676443.b3lyp_6-31g(d).log.xz 000676443.td-b3lyp_6-31g+(d).inp 000676443.td-b3lyp_6-31g+(d).log.xz

000676443.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676443.td-b3lyp_6-31+g(d).gjf (generated)

000676443.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676443.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676443.mol 000676443.PUBCHEM 000676443.mol (via Jmol)
000676445.b3lyp_6-31g(d).inp

000676445.b3lyp_6-31g(d).qchem.inp (generated)

000676445.b3lyp_6-31g(d).gjf (generated)

000676445.b3lyp_6-31g(d).firefly.inp (generated)

000676445.b3lyp_6-31g(d).smash.inp (generated)

000676445.b3lyp_6-31g(d).nwchem.inp (generated) 000676445.b3lyp_6-31g(d).log.xz 000676445.mol 000676445.PUBCHEM 000676445.mol (via Jmol)
000676446.b3lyp_6-31g(d).inp

000676446.b3lyp_6-31g(d).qchem.inp (generated)

000676446.b3lyp_6-31g(d).gjf (generated)

000676446.b3lyp_6-31g(d).firefly.inp (generated)

000676446.b3lyp_6-31g(d).smash.inp (generated)

000676446.b3lyp_6-31g(d).nwchem.inp (generated) 000676446.b3lyp_6-31g(d).log.xz 000676446.td-b3lyp_6-31g+(d).inp 000676446.td-b3lyp_6-31g+(d).log.xz

000676446.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676446.td-b3lyp_6-31+g(d).gjf (generated)

000676446.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676446.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676446.mol 000676446.PUBCHEM 000676446.mol (via Jmol)
000676447.b3lyp_6-31g(d).inp

000676447.b3lyp_6-31g(d).qchem.inp (generated)

000676447.b3lyp_6-31g(d).gjf (generated)

000676447.b3lyp_6-31g(d).firefly.inp (generated)

000676447.b3lyp_6-31g(d).smash.inp (generated)

000676447.b3lyp_6-31g(d).nwchem.inp (generated) 000676447.b3lyp_6-31g(d).log.xz 000676447.td-b3lyp_6-31g+(d).inp 000676447.td-b3lyp_6-31g+(d).log.xz

000676447.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676447.td-b3lyp_6-31+g(d).gjf (generated)

000676447.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676447.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676447.mol 000676447.PUBCHEM 000676447.mol (via Jmol)
000676449.b3lyp_6-31g(d).inp

000676449.b3lyp_6-31g(d).qchem.inp (generated)

000676449.b3lyp_6-31g(d).gjf (generated)

000676449.b3lyp_6-31g(d).firefly.inp (generated)

000676449.b3lyp_6-31g(d).smash.inp (generated)

000676449.b3lyp_6-31g(d).nwchem.inp (generated) 000676449.b3lyp_6-31g(d).log.xz 000676449.td-b3lyp_6-31g+(d).inp 000676449.td-b3lyp_6-31g+(d).log.xz

000676449.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676449.td-b3lyp_6-31+g(d).gjf (generated)

000676449.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676449.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676449.mol 000676449.PUBCHEM 000676449.mol (via Jmol)
000676450.b3lyp_6-31g(d).inp

000676450.b3lyp_6-31g(d).qchem.inp (generated)

000676450.b3lyp_6-31g(d).gjf (generated)

000676450.b3lyp_6-31g(d).firefly.inp (generated)

000676450.b3lyp_6-31g(d).smash.inp (generated)

000676450.b3lyp_6-31g(d).nwchem.inp (generated) 000676450.b3lyp_6-31g(d).log.xz 000676450.td-b3lyp_6-31g+(d).inp 000676450.td-b3lyp_6-31g+(d).log.xz

000676450.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676450.td-b3lyp_6-31+g(d).gjf (generated)

000676450.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676450.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676450.mol 000676450.PUBCHEM 000676450.mol (via Jmol)
000676451.b3lyp_6-31g(d).inp

000676451.b3lyp_6-31g(d).qchem.inp (generated)

000676451.b3lyp_6-31g(d).gjf (generated)

000676451.b3lyp_6-31g(d).firefly.inp (generated)

000676451.b3lyp_6-31g(d).smash.inp (generated)

000676451.b3lyp_6-31g(d).nwchem.inp (generated) 000676451.b3lyp_6-31g(d).log.xz 000676451.td-b3lyp_6-31g+(d).inp 000676451.td-b3lyp_6-31g+(d).log.xz

000676451.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676451.td-b3lyp_6-31+g(d).gjf (generated)

000676451.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676451.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676451.mol 000676451.PUBCHEM 000676451.mol (via Jmol)
000676452.b3lyp_6-31g(d).inp

000676452.b3lyp_6-31g(d).qchem.inp (generated)

000676452.b3lyp_6-31g(d).gjf (generated)

000676452.b3lyp_6-31g(d).firefly.inp (generated)

000676452.b3lyp_6-31g(d).smash.inp (generated)

000676452.b3lyp_6-31g(d).nwchem.inp (generated) 000676452.b3lyp_6-31g(d).log.xz 000676452.td-b3lyp_6-31g+(d).inp 000676452.td-b3lyp_6-31g+(d).log.xz

000676452.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676452.td-b3lyp_6-31+g(d).gjf (generated)

000676452.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676452.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676452.mol 000676452.PUBCHEM 000676452.mol (via Jmol)
000676453.b3lyp_6-31g(d).inp

000676453.b3lyp_6-31g(d).qchem.inp (generated)

000676453.b3lyp_6-31g(d).gjf (generated)

000676453.b3lyp_6-31g(d).firefly.inp (generated)

000676453.b3lyp_6-31g(d).smash.inp (generated)

000676453.b3lyp_6-31g(d).nwchem.inp (generated) 000676453.b3lyp_6-31g(d).log.xz 000676453.td-b3lyp_6-31g+(d).inp 000676453.td-b3lyp_6-31g+(d).log.xz

000676453.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676453.td-b3lyp_6-31+g(d).gjf (generated)

000676453.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676453.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676453.mol 000676453.PUBCHEM 000676453.mol (via Jmol)
000676454.b3lyp_6-31g(d).inp

000676454.b3lyp_6-31g(d).qchem.inp (generated)

000676454.b3lyp_6-31g(d).gjf (generated)

000676454.b3lyp_6-31g(d).firefly.inp (generated)

000676454.b3lyp_6-31g(d).smash.inp (generated)

000676454.b3lyp_6-31g(d).nwchem.inp (generated) 000676454.b3lyp_6-31g(d).log.xz 000676454.td-b3lyp_6-31g+(d).inp 000676454.td-b3lyp_6-31g+(d).log.xz

000676454.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676454.td-b3lyp_6-31+g(d).gjf (generated)

000676454.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676454.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676454.mol 000676454.PUBCHEM 000676454.mol (via Jmol)
000676455.b3lyp_6-31g(d).inp

000676455.b3lyp_6-31g(d).qchem.inp (generated)

000676455.b3lyp_6-31g(d).gjf (generated)

000676455.b3lyp_6-31g(d).firefly.inp (generated)

000676455.b3lyp_6-31g(d).smash.inp (generated)

000676455.b3lyp_6-31g(d).nwchem.inp (generated) 000676455.b3lyp_6-31g(d).log.xz 000676455.td-b3lyp_6-31g+(d).inp 000676455.td-b3lyp_6-31g+(d).log.xz

000676455.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676455.td-b3lyp_6-31+g(d).gjf (generated)

000676455.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676455.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676455.mol 000676455.PUBCHEM 000676455.mol (via Jmol)
000676456.b3lyp_6-31g(d).inp

000676456.b3lyp_6-31g(d).qchem.inp (generated)

000676456.b3lyp_6-31g(d).gjf (generated)

000676456.b3lyp_6-31g(d).firefly.inp (generated)

000676456.b3lyp_6-31g(d).smash.inp (generated)

000676456.b3lyp_6-31g(d).nwchem.inp (generated) 000676456.b3lyp_6-31g(d).log.xz 000676456.td-b3lyp_6-31g+(d).inp 000676456.td-b3lyp_6-31g+(d).log.xz

000676456.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676456.td-b3lyp_6-31+g(d).gjf (generated)

000676456.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676456.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676456.mol 000676456.PUBCHEM 000676456.mol (via Jmol)
000676457.b3lyp_6-31g(d).inp

000676457.b3lyp_6-31g(d).qchem.inp (generated)

000676457.b3lyp_6-31g(d).gjf (generated)

000676457.b3lyp_6-31g(d).firefly.inp (generated)

000676457.b3lyp_6-31g(d).smash.inp (generated)

000676457.b3lyp_6-31g(d).nwchem.inp (generated) 000676457.b3lyp_6-31g(d).log.xz 000676457.td-b3lyp_6-31g+(d).inp 000676457.td-b3lyp_6-31g+(d).log.xz

000676457.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676457.td-b3lyp_6-31+g(d).gjf (generated)

000676457.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676457.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676457.mol 000676457.PUBCHEM 000676457.mol (via Jmol)
000676458.b3lyp_6-31g(d).inp

000676458.b3lyp_6-31g(d).qchem.inp (generated)

000676458.b3lyp_6-31g(d).gjf (generated)

000676458.b3lyp_6-31g(d).firefly.inp (generated)

000676458.b3lyp_6-31g(d).smash.inp (generated)

000676458.b3lyp_6-31g(d).nwchem.inp (generated) 000676458.b3lyp_6-31g(d).log.xz 000676458.td-b3lyp_6-31g+(d).inp 000676458.td-b3lyp_6-31g+(d).log.xz

000676458.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676458.td-b3lyp_6-31+g(d).gjf (generated)

000676458.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676458.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676458.mol 000676458.PUBCHEM 000676458.mol (via Jmol)
000676459.b3lyp_6-31g(d).inp

000676459.b3lyp_6-31g(d).qchem.inp (generated)

000676459.b3lyp_6-31g(d).gjf (generated)

000676459.b3lyp_6-31g(d).firefly.inp (generated)

000676459.b3lyp_6-31g(d).smash.inp (generated)

000676459.b3lyp_6-31g(d).nwchem.inp (generated) 000676459.b3lyp_6-31g(d).log.xz 000676459.td-b3lyp_6-31g+(d).inp 000676459.td-b3lyp_6-31g+(d).log.xz

000676459.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676459.td-b3lyp_6-31+g(d).gjf (generated)

000676459.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676459.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676459.mol 000676459.PUBCHEM 000676459.mol (via Jmol)
000676460.b3lyp_6-31g(d).inp

000676460.b3lyp_6-31g(d).qchem.inp (generated)

000676460.b3lyp_6-31g(d).gjf (generated)

000676460.b3lyp_6-31g(d).firefly.inp (generated)

000676460.b3lyp_6-31g(d).smash.inp (generated)

000676460.b3lyp_6-31g(d).nwchem.inp (generated) 000676460.b3lyp_6-31g(d).log.xz 000676460.td-b3lyp_6-31g+(d).inp 000676460.td-b3lyp_6-31g+(d).log.xz

000676460.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676460.td-b3lyp_6-31+g(d).gjf (generated)

000676460.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676460.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676460.mol 000676460.PUBCHEM 000676460.mol (via Jmol)
000676462.b3lyp_6-31g(d).inp

000676462.b3lyp_6-31g(d).qchem.inp (generated)

000676462.b3lyp_6-31g(d).gjf (generated)

000676462.b3lyp_6-31g(d).firefly.inp (generated)

000676462.b3lyp_6-31g(d).smash.inp (generated)

000676462.b3lyp_6-31g(d).nwchem.inp (generated) 000676462.b3lyp_6-31g(d).log.xz 000676462.td-b3lyp_6-31g+(d).inp 000676462.td-b3lyp_6-31g+(d).log.xz

000676462.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676462.td-b3lyp_6-31+g(d).gjf (generated)

000676462.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676462.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676462.mol 000676462.PUBCHEM 000676462.mol (via Jmol)
000676463.b3lyp_6-31g(d).inp

000676463.b3lyp_6-31g(d).qchem.inp (generated)

000676463.b3lyp_6-31g(d).gjf (generated)

000676463.b3lyp_6-31g(d).firefly.inp (generated)

000676463.b3lyp_6-31g(d).smash.inp (generated)

000676463.b3lyp_6-31g(d).nwchem.inp (generated) 000676463.b3lyp_6-31g(d).log.xz 000676463.td-b3lyp_6-31g+(d).inp 000676463.td-b3lyp_6-31g+(d).log.xz

000676463.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676463.td-b3lyp_6-31+g(d).gjf (generated)

000676463.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676463.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676463.mol 000676463.PUBCHEM 000676463.mol (via Jmol)
000676464.b3lyp_6-31g(d).inp

000676464.b3lyp_6-31g(d).qchem.inp (generated)

000676464.b3lyp_6-31g(d).gjf (generated)

000676464.b3lyp_6-31g(d).firefly.inp (generated)

000676464.b3lyp_6-31g(d).smash.inp (generated)

000676464.b3lyp_6-31g(d).nwchem.inp (generated) 000676464.b3lyp_6-31g(d).log.xz 000676464.td-b3lyp_6-31g+(d).inp 000676464.td-b3lyp_6-31g+(d).log.xz

000676464.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676464.td-b3lyp_6-31+g(d).gjf (generated)

000676464.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676464.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676464.mol 000676464.PUBCHEM 000676464.mol (via Jmol)
000676465.b3lyp_6-31g(d).inp

000676465.b3lyp_6-31g(d).qchem.inp (generated)

000676465.b3lyp_6-31g(d).gjf (generated)

000676465.b3lyp_6-31g(d).firefly.inp (generated)

000676465.b3lyp_6-31g(d).smash.inp (generated)

000676465.b3lyp_6-31g(d).nwchem.inp (generated) 000676465.b3lyp_6-31g(d).log.xz 000676465.td-b3lyp_6-31g+(d).inp 000676465.td-b3lyp_6-31g+(d).log.xz

000676465.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676465.td-b3lyp_6-31+g(d).gjf (generated)

000676465.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676465.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676465.mol 000676465.PUBCHEM 000676465.mol (via Jmol)
000676466.b3lyp_6-31g(d).inp

000676466.b3lyp_6-31g(d).qchem.inp (generated)

000676466.b3lyp_6-31g(d).gjf (generated)

000676466.b3lyp_6-31g(d).firefly.inp (generated)

000676466.b3lyp_6-31g(d).smash.inp (generated)

000676466.b3lyp_6-31g(d).nwchem.inp (generated) 000676466.b3lyp_6-31g(d).log.xz 000676466.td-b3lyp_6-31g+(d).inp 000676466.td-b3lyp_6-31g+(d).log.xz

000676466.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676466.td-b3lyp_6-31+g(d).gjf (generated)

000676466.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676466.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676466.mol 000676466.PUBCHEM 000676466.mol (via Jmol)
000676467.b3lyp_6-31g(d).inp

000676467.b3lyp_6-31g(d).qchem.inp (generated)

000676467.b3lyp_6-31g(d).gjf (generated)

000676467.b3lyp_6-31g(d).firefly.inp (generated)

000676467.b3lyp_6-31g(d).smash.inp (generated)

000676467.b3lyp_6-31g(d).nwchem.inp (generated) 000676467.b3lyp_6-31g(d).log.xz 000676467.td-b3lyp_6-31g+(d).inp 000676467.td-b3lyp_6-31g+(d).log.xz

000676467.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676467.td-b3lyp_6-31+g(d).gjf (generated)

000676467.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676467.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676467.mol 000676467.PUBCHEM 000676467.mol (via Jmol)
000676472.b3lyp_6-31g(d).inp

000676472.b3lyp_6-31g(d).qchem.inp (generated)

000676472.b3lyp_6-31g(d).gjf (generated)

000676472.b3lyp_6-31g(d).firefly.inp (generated)

000676472.b3lyp_6-31g(d).smash.inp (generated)

000676472.b3lyp_6-31g(d).nwchem.inp (generated) 000676472.b3lyp_6-31g(d).log.xz 000676472.td-b3lyp_6-31g+(d).inp 000676472.td-b3lyp_6-31g+(d).log.xz

000676472.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676472.td-b3lyp_6-31+g(d).gjf (generated)

000676472.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676472.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676472.mol 000676472.PUBCHEM 000676472.mol (via Jmol)
000676474.b3lyp_6-31g(d).inp

000676474.b3lyp_6-31g(d).qchem.inp (generated)

000676474.b3lyp_6-31g(d).gjf (generated)

000676474.b3lyp_6-31g(d).firefly.inp (generated)

000676474.b3lyp_6-31g(d).smash.inp (generated)

000676474.b3lyp_6-31g(d).nwchem.inp (generated) 000676474.b3lyp_6-31g(d).log.xz 000676474.td-b3lyp_6-31g+(d).inp 000676474.td-b3lyp_6-31g+(d).log.xz

000676474.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676474.td-b3lyp_6-31+g(d).gjf (generated)

000676474.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676474.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676474.mol 000676474.PUBCHEM 000676474.mol (via Jmol)
000676475.b3lyp_6-31g(d).inp

000676475.b3lyp_6-31g(d).qchem.inp (generated)

000676475.b3lyp_6-31g(d).gjf (generated)

000676475.b3lyp_6-31g(d).firefly.inp (generated)

000676475.b3lyp_6-31g(d).smash.inp (generated)

000676475.b3lyp_6-31g(d).nwchem.inp (generated) 000676475.b3lyp_6-31g(d).log.xz 000676475.td-b3lyp_6-31g+(d).inp 000676475.td-b3lyp_6-31g+(d).log.xz

000676475.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676475.td-b3lyp_6-31+g(d).gjf (generated)

000676475.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676475.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676475.mol 000676475.PUBCHEM 000676475.mol (via Jmol)
000676477.b3lyp_6-31g(d).inp

000676477.b3lyp_6-31g(d).qchem.inp (generated)

000676477.b3lyp_6-31g(d).gjf (generated)

000676477.b3lyp_6-31g(d).firefly.inp (generated)

000676477.b3lyp_6-31g(d).smash.inp (generated)

000676477.b3lyp_6-31g(d).nwchem.inp (generated) 000676477.b3lyp_6-31g(d).log.xz 000676477.td-b3lyp_6-31g+(d).inp 000676477.td-b3lyp_6-31g+(d).log.xz

000676477.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676477.td-b3lyp_6-31+g(d).gjf (generated)

000676477.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676477.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676477.mol 000676477.PUBCHEM 000676477.mol (via Jmol)
000676478.b3lyp_6-31g(d).inp

000676478.b3lyp_6-31g(d).qchem.inp (generated)

000676478.b3lyp_6-31g(d).gjf (generated)

000676478.b3lyp_6-31g(d).firefly.inp (generated)

000676478.b3lyp_6-31g(d).smash.inp (generated)

000676478.b3lyp_6-31g(d).nwchem.inp (generated) 000676478.b3lyp_6-31g(d).log.xz 000676478.td-b3lyp_6-31g+(d).inp 000676478.td-b3lyp_6-31g+(d).log.xz

000676478.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676478.td-b3lyp_6-31+g(d).gjf (generated)

000676478.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676478.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676478.mol 000676478.PUBCHEM 000676478.mol (via Jmol)
000676479.b3lyp_6-31g(d).inp

000676479.b3lyp_6-31g(d).qchem.inp (generated)

000676479.b3lyp_6-31g(d).gjf (generated)

000676479.b3lyp_6-31g(d).firefly.inp (generated)

000676479.b3lyp_6-31g(d).smash.inp (generated)

000676479.b3lyp_6-31g(d).nwchem.inp (generated) 000676479.b3lyp_6-31g(d).log.xz 000676479.td-b3lyp_6-31g+(d).inp 000676479.td-b3lyp_6-31g+(d).log.xz

000676479.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676479.td-b3lyp_6-31+g(d).gjf (generated)

000676479.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676479.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676479.mol 000676479.PUBCHEM 000676479.mol (via Jmol)
000676480.b3lyp_6-31g(d).inp

000676480.b3lyp_6-31g(d).qchem.inp (generated)

000676480.b3lyp_6-31g(d).gjf (generated)

000676480.b3lyp_6-31g(d).firefly.inp (generated)

000676480.b3lyp_6-31g(d).smash.inp (generated)

000676480.b3lyp_6-31g(d).nwchem.inp (generated) 000676480.b3lyp_6-31g(d).log.xz 000676480.td-b3lyp_6-31g+(d).inp 000676480.td-b3lyp_6-31g+(d).log.xz

000676480.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676480.td-b3lyp_6-31+g(d).gjf (generated)

000676480.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676480.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676480.mol 000676480.PUBCHEM 000676480.mol (via Jmol)
000676482.b3lyp_6-31g(d).inp

000676482.b3lyp_6-31g(d).qchem.inp (generated)

000676482.b3lyp_6-31g(d).gjf (generated)

000676482.b3lyp_6-31g(d).firefly.inp (generated)

000676482.b3lyp_6-31g(d).smash.inp (generated)

000676482.b3lyp_6-31g(d).nwchem.inp (generated) 000676482.b3lyp_6-31g(d).log.xz 000676482.td-b3lyp_6-31g+(d).inp 000676482.td-b3lyp_6-31g+(d).log.xz

000676482.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676482.td-b3lyp_6-31+g(d).gjf (generated)

000676482.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676482.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676482.mol 000676482.PUBCHEM 000676482.mol (via Jmol)
000676483.b3lyp_6-31g(d).inp

000676483.b3lyp_6-31g(d).qchem.inp (generated)

000676483.b3lyp_6-31g(d).gjf (generated)

000676483.b3lyp_6-31g(d).firefly.inp (generated)

000676483.b3lyp_6-31g(d).smash.inp (generated)

000676483.b3lyp_6-31g(d).nwchem.inp (generated) 000676483.b3lyp_6-31g(d).log.xz 000676483.td-b3lyp_6-31g+(d).inp 000676483.td-b3lyp_6-31g+(d).log.xz

000676483.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676483.td-b3lyp_6-31+g(d).gjf (generated)

000676483.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676483.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676483.mol 000676483.PUBCHEM 000676483.mol (via Jmol)
000676484.b3lyp_6-31g(d).inp

000676484.b3lyp_6-31g(d).qchem.inp (generated)

000676484.b3lyp_6-31g(d).gjf (generated)

000676484.b3lyp_6-31g(d).firefly.inp (generated)

000676484.b3lyp_6-31g(d).smash.inp (generated)

000676484.b3lyp_6-31g(d).nwchem.inp (generated) 000676484.b3lyp_6-31g(d).log.xz 000676484.td-b3lyp_6-31g+(d).inp 000676484.td-b3lyp_6-31g+(d).log.xz

000676484.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676484.td-b3lyp_6-31+g(d).gjf (generated)

000676484.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676484.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676484.mol 000676484.PUBCHEM 000676484.mol (via Jmol)
000676485.b3lyp_6-31g(d).inp

000676485.b3lyp_6-31g(d).qchem.inp (generated)

000676485.b3lyp_6-31g(d).gjf (generated)

000676485.b3lyp_6-31g(d).firefly.inp (generated)

000676485.b3lyp_6-31g(d).smash.inp (generated)

000676485.b3lyp_6-31g(d).nwchem.inp (generated) 000676485.b3lyp_6-31g(d).log.xz 000676485.td-b3lyp_6-31g+(d).inp 000676485.td-b3lyp_6-31g+(d).log.xz

000676485.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676485.td-b3lyp_6-31+g(d).gjf (generated)

000676485.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676485.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676485.mol 000676485.PUBCHEM 000676485.mol (via Jmol)
000676486.b3lyp_6-31g(d).inp

000676486.b3lyp_6-31g(d).qchem.inp (generated)

000676486.b3lyp_6-31g(d).gjf (generated)

000676486.b3lyp_6-31g(d).firefly.inp (generated)

000676486.b3lyp_6-31g(d).smash.inp (generated)

000676486.b3lyp_6-31g(d).nwchem.inp (generated) 000676486.b3lyp_6-31g(d).log.xz 000676486.td-b3lyp_6-31g+(d).inp 000676486.td-b3lyp_6-31g+(d).log.xz

000676486.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676486.td-b3lyp_6-31+g(d).gjf (generated)

000676486.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676486.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676486.mol 000676486.PUBCHEM 000676486.mol (via Jmol)
000676489.b3lyp_6-31g(d).inp

000676489.b3lyp_6-31g(d).qchem.inp (generated)

000676489.b3lyp_6-31g(d).gjf (generated)

000676489.b3lyp_6-31g(d).firefly.inp (generated)

000676489.b3lyp_6-31g(d).smash.inp (generated)

000676489.b3lyp_6-31g(d).nwchem.inp (generated) 000676489.b3lyp_6-31g(d).log.xz 000676489.td-b3lyp_6-31g+(d).inp 000676489.td-b3lyp_6-31g+(d).log.xz

000676489.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676489.td-b3lyp_6-31+g(d).gjf (generated)

000676489.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676489.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676489.mol 000676489.PUBCHEM 000676489.mol (via Jmol)
000676492.b3lyp_6-31g(d).inp

000676492.b3lyp_6-31g(d).qchem.inp (generated)

000676492.b3lyp_6-31g(d).gjf (generated)

000676492.b3lyp_6-31g(d).firefly.inp (generated)

000676492.b3lyp_6-31g(d).smash.inp (generated)

000676492.b3lyp_6-31g(d).nwchem.inp (generated) 000676492.b3lyp_6-31g(d).log.xz 000676492.td-b3lyp_6-31g+(d).inp 000676492.td-b3lyp_6-31g+(d).log.xz

000676492.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676492.td-b3lyp_6-31+g(d).gjf (generated)

000676492.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676492.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676492.mol 000676492.PUBCHEM 000676492.mol (via Jmol)
000676493.b3lyp_6-31g(d).inp

000676493.b3lyp_6-31g(d).qchem.inp (generated)

000676493.b3lyp_6-31g(d).gjf (generated)

000676493.b3lyp_6-31g(d).firefly.inp (generated)

000676493.b3lyp_6-31g(d).smash.inp (generated)

000676493.b3lyp_6-31g(d).nwchem.inp (generated) 000676493.b3lyp_6-31g(d).log.xz 000676493.td-b3lyp_6-31g+(d).inp 000676493.td-b3lyp_6-31g+(d).log.xz

000676493.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676493.td-b3lyp_6-31+g(d).gjf (generated)

000676493.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676493.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676493.mol 000676493.PUBCHEM 000676493.mol (via Jmol)
000676494.b3lyp_6-31g(d).inp

000676494.b3lyp_6-31g(d).qchem.inp (generated)

000676494.b3lyp_6-31g(d).gjf (generated)

000676494.b3lyp_6-31g(d).firefly.inp (generated)

000676494.b3lyp_6-31g(d).smash.inp (generated)

000676494.b3lyp_6-31g(d).nwchem.inp (generated) 000676494.b3lyp_6-31g(d).log.xz 000676494.td-b3lyp_6-31g+(d).inp 000676494.td-b3lyp_6-31g+(d).log.xz

000676494.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676494.td-b3lyp_6-31+g(d).gjf (generated)

000676494.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676494.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676494.mol 000676494.PUBCHEM 000676494.mol (via Jmol)
000676496.b3lyp_6-31g(d).inp

000676496.b3lyp_6-31g(d).qchem.inp (generated)

000676496.b3lyp_6-31g(d).gjf (generated)

000676496.b3lyp_6-31g(d).firefly.inp (generated)

000676496.b3lyp_6-31g(d).smash.inp (generated)

000676496.b3lyp_6-31g(d).nwchem.inp (generated) 000676496.b3lyp_6-31g(d).log.xz 000676496.td-b3lyp_6-31g+(d).inp 000676496.td-b3lyp_6-31g+(d).log.xz

000676496.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676496.td-b3lyp_6-31+g(d).gjf (generated)

000676496.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676496.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676496.mol 000676496.PUBCHEM 000676496.mol (via Jmol)
000676499.b3lyp_6-31g(d).inp

000676499.b3lyp_6-31g(d).qchem.inp (generated)

000676499.b3lyp_6-31g(d).gjf (generated)

000676499.b3lyp_6-31g(d).firefly.inp (generated)

000676499.b3lyp_6-31g(d).smash.inp (generated)

000676499.b3lyp_6-31g(d).nwchem.inp (generated) 000676499.b3lyp_6-31g(d).log.xz 000676499.td-b3lyp_6-31g+(d).inp 000676499.td-b3lyp_6-31g+(d).log.xz

000676499.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676499.td-b3lyp_6-31+g(d).gjf (generated)

000676499.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676499.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676499.mol 000676499.PUBCHEM 000676499.mol (via Jmol)
000676500.b3lyp_6-31g(d).inp

000676500.b3lyp_6-31g(d).qchem.inp (generated)

000676500.b3lyp_6-31g(d).gjf (generated)

000676500.b3lyp_6-31g(d).firefly.inp (generated)

000676500.b3lyp_6-31g(d).smash.inp (generated)

000676500.b3lyp_6-31g(d).nwchem.inp (generated) 000676500.b3lyp_6-31g(d).log.xz 000676500.td-b3lyp_6-31g+(d).inp 000676500.td-b3lyp_6-31g+(d).log.xz

000676500.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676500.td-b3lyp_6-31+g(d).gjf (generated)

000676500.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676500.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676500.mol 000676500.PUBCHEM 000676500.mol (via Jmol)
000676504.b3lyp_6-31g(d).inp

000676504.b3lyp_6-31g(d).qchem.inp (generated)

000676504.b3lyp_6-31g(d).gjf (generated)

000676504.b3lyp_6-31g(d).firefly.inp (generated)

000676504.b3lyp_6-31g(d).smash.inp (generated)

000676504.b3lyp_6-31g(d).nwchem.inp (generated) 000676504.b3lyp_6-31g(d).log.xz 000676504.td-b3lyp_6-31g+(d).inp 000676504.td-b3lyp_6-31g+(d).log.xz

000676504.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676504.td-b3lyp_6-31+g(d).gjf (generated)

000676504.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676504.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676504.mol 000676504.PUBCHEM 000676504.mol (via Jmol)
000676505.b3lyp_6-31g(d).inp

000676505.b3lyp_6-31g(d).qchem.inp (generated)

000676505.b3lyp_6-31g(d).gjf (generated)

000676505.b3lyp_6-31g(d).firefly.inp (generated)

000676505.b3lyp_6-31g(d).smash.inp (generated)

000676505.b3lyp_6-31g(d).nwchem.inp (generated) 000676505.b3lyp_6-31g(d).log.xz 000676505.td-b3lyp_6-31g+(d).inp 000676505.td-b3lyp_6-31g+(d).log.xz

000676505.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676505.td-b3lyp_6-31+g(d).gjf (generated)

000676505.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676505.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676505.mol 000676505.PUBCHEM 000676505.mol (via Jmol)
000676506.b3lyp_6-31g(d).inp

000676506.b3lyp_6-31g(d).qchem.inp (generated)

000676506.b3lyp_6-31g(d).gjf (generated)

000676506.b3lyp_6-31g(d).firefly.inp (generated)

000676506.b3lyp_6-31g(d).smash.inp (generated)

000676506.b3lyp_6-31g(d).nwchem.inp (generated) 000676506.b3lyp_6-31g(d).log.xz 000676506.td-b3lyp_6-31g+(d).inp 000676506.td-b3lyp_6-31g+(d).log.xz

000676506.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676506.td-b3lyp_6-31+g(d).gjf (generated)

000676506.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676506.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676506.mol 000676506.PUBCHEM 000676506.mol (via Jmol)
000676508.b3lyp_6-31g(d).inp

000676508.b3lyp_6-31g(d).qchem.inp (generated)

000676508.b3lyp_6-31g(d).gjf (generated)

000676508.b3lyp_6-31g(d).firefly.inp (generated)

000676508.b3lyp_6-31g(d).smash.inp (generated)

000676508.b3lyp_6-31g(d).nwchem.inp (generated) 000676508.b3lyp_6-31g(d).log.xz 000676508.td-b3lyp_6-31g+(d).inp 000676508.td-b3lyp_6-31g+(d).log.xz

000676508.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676508.td-b3lyp_6-31+g(d).gjf (generated)

000676508.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676508.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676508.mol 000676508.PUBCHEM 000676508.mol (via Jmol)
000676510.b3lyp_6-31g(d).inp

000676510.b3lyp_6-31g(d).qchem.inp (generated)

000676510.b3lyp_6-31g(d).gjf (generated)

000676510.b3lyp_6-31g(d).firefly.inp (generated)

000676510.b3lyp_6-31g(d).smash.inp (generated)

000676510.b3lyp_6-31g(d).nwchem.inp (generated) 000676510.b3lyp_6-31g(d).log.xz 000676510.td-b3lyp_6-31g+(d).inp 000676510.td-b3lyp_6-31g+(d).log.xz

000676510.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676510.td-b3lyp_6-31+g(d).gjf (generated)

000676510.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676510.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676510.mol 000676510.PUBCHEM 000676510.mol (via Jmol)
000676511.b3lyp_6-31g(d).inp

000676511.b3lyp_6-31g(d).qchem.inp (generated)

000676511.b3lyp_6-31g(d).gjf (generated)

000676511.b3lyp_6-31g(d).firefly.inp (generated)

000676511.b3lyp_6-31g(d).smash.inp (generated)

000676511.b3lyp_6-31g(d).nwchem.inp (generated) 000676511.b3lyp_6-31g(d).log.xz 000676511.td-b3lyp_6-31g+(d).inp 000676511.td-b3lyp_6-31g+(d).log.xz

000676511.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676511.td-b3lyp_6-31+g(d).gjf (generated)

000676511.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676511.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676511.mol 000676511.PUBCHEM 000676511.mol (via Jmol)
000676512.b3lyp_6-31g(d).inp

000676512.b3lyp_6-31g(d).qchem.inp (generated)

000676512.b3lyp_6-31g(d).gjf (generated)

000676512.b3lyp_6-31g(d).firefly.inp (generated)

000676512.b3lyp_6-31g(d).smash.inp (generated)

000676512.b3lyp_6-31g(d).nwchem.inp (generated) 000676512.b3lyp_6-31g(d).log.xz 000676512.mol 000676512.PUBCHEM 000676512.mol (via Jmol)
000676514.b3lyp_6-31g(d).inp

000676514.b3lyp_6-31g(d).qchem.inp (generated)

000676514.b3lyp_6-31g(d).gjf (generated)

000676514.b3lyp_6-31g(d).firefly.inp (generated)

000676514.b3lyp_6-31g(d).smash.inp (generated)

000676514.b3lyp_6-31g(d).nwchem.inp (generated) 000676514.b3lyp_6-31g(d).log.xz 000676514.td-b3lyp_6-31g+(d).inp 000676514.td-b3lyp_6-31g+(d).log.xz

000676514.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676514.td-b3lyp_6-31+g(d).gjf (generated)

000676514.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676514.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676514.mol 000676514.PUBCHEM 000676514.mol (via Jmol)
000676515.b3lyp_6-31g(d).inp

000676515.b3lyp_6-31g(d).qchem.inp (generated)

000676515.b3lyp_6-31g(d).gjf (generated)

000676515.b3lyp_6-31g(d).firefly.inp (generated)

000676515.b3lyp_6-31g(d).smash.inp (generated)

000676515.b3lyp_6-31g(d).nwchem.inp (generated) 000676515.b3lyp_6-31g(d).log.xz 000676515.td-b3lyp_6-31g+(d).inp 000676515.td-b3lyp_6-31g+(d).log.xz

000676515.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676515.td-b3lyp_6-31+g(d).gjf (generated)

000676515.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676515.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676515.mol 000676515.PUBCHEM 000676515.mol (via Jmol)
000676516.b3lyp_6-31g(d).inp

000676516.b3lyp_6-31g(d).qchem.inp (generated)

000676516.b3lyp_6-31g(d).gjf (generated)

000676516.b3lyp_6-31g(d).firefly.inp (generated)

000676516.b3lyp_6-31g(d).smash.inp (generated)

000676516.b3lyp_6-31g(d).nwchem.inp (generated) 000676516.b3lyp_6-31g(d).log.xz 000676516.td-b3lyp_6-31g+(d).inp 000676516.td-b3lyp_6-31g+(d).log.xz

000676516.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676516.td-b3lyp_6-31+g(d).gjf (generated)

000676516.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676516.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676516.mol 000676516.PUBCHEM 000676516.mol (via Jmol)
000676517.b3lyp_6-31g(d).inp

000676517.b3lyp_6-31g(d).qchem.inp (generated)

000676517.b3lyp_6-31g(d).gjf (generated)

000676517.b3lyp_6-31g(d).firefly.inp (generated)

000676517.b3lyp_6-31g(d).smash.inp (generated)

000676517.b3lyp_6-31g(d).nwchem.inp (generated) 000676517.b3lyp_6-31g(d).log.xz 000676517.td-b3lyp_6-31g+(d).inp 000676517.td-b3lyp_6-31g+(d).log.xz

000676517.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676517.td-b3lyp_6-31+g(d).gjf (generated)

000676517.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676517.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676517.mol 000676517.PUBCHEM 000676517.mol (via Jmol)
000676518.b3lyp_6-31g(d).inp

000676518.b3lyp_6-31g(d).qchem.inp (generated)

000676518.b3lyp_6-31g(d).gjf (generated)

000676518.b3lyp_6-31g(d).firefly.inp (generated)

000676518.b3lyp_6-31g(d).smash.inp (generated)

000676518.b3lyp_6-31g(d).nwchem.inp (generated) 000676518.b3lyp_6-31g(d).log.xz 000676518.td-b3lyp_6-31g+(d).inp 000676518.td-b3lyp_6-31g+(d).log.xz

000676518.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676518.td-b3lyp_6-31+g(d).gjf (generated)

000676518.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676518.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676518.mol 000676518.PUBCHEM 000676518.mol (via Jmol)
000676520.b3lyp_6-31g(d).inp

000676520.b3lyp_6-31g(d).qchem.inp (generated)

000676520.b3lyp_6-31g(d).gjf (generated)

000676520.b3lyp_6-31g(d).firefly.inp (generated)

000676520.b3lyp_6-31g(d).smash.inp (generated)

000676520.b3lyp_6-31g(d).nwchem.inp (generated) 000676520.b3lyp_6-31g(d).log.xz 000676520.td-b3lyp_6-31g+(d).inp 000676520.td-b3lyp_6-31g+(d).log.xz

000676520.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676520.td-b3lyp_6-31+g(d).gjf (generated)

000676520.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676520.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676520.mol 000676520.PUBCHEM 000676520.mol (via Jmol)
000676525.b3lyp_6-31g(d).inp

000676525.b3lyp_6-31g(d).qchem.inp (generated)

000676525.b3lyp_6-31g(d).gjf (generated)

000676525.b3lyp_6-31g(d).firefly.inp (generated)

000676525.b3lyp_6-31g(d).smash.inp (generated)

000676525.b3lyp_6-31g(d).nwchem.inp (generated) 000676525.b3lyp_6-31g(d).log.xz 000676525.td-b3lyp_6-31g+(d).inp 000676525.td-b3lyp_6-31g+(d).log.xz

000676525.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676525.td-b3lyp_6-31+g(d).gjf (generated)

000676525.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676525.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676525.mol 000676525.PUBCHEM 000676525.mol (via Jmol)
000676526.b3lyp_6-31g(d).inp

000676526.b3lyp_6-31g(d).qchem.inp (generated)

000676526.b3lyp_6-31g(d).gjf (generated)

000676526.b3lyp_6-31g(d).firefly.inp (generated)

000676526.b3lyp_6-31g(d).smash.inp (generated)

000676526.b3lyp_6-31g(d).nwchem.inp (generated) 000676526.b3lyp_6-31g(d).log.xz 000676526.td-b3lyp_6-31g+(d).inp 000676526.td-b3lyp_6-31g+(d).log.xz

000676526.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676526.td-b3lyp_6-31+g(d).gjf (generated)

000676526.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676526.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676526.mol 000676526.PUBCHEM 000676526.mol (via Jmol)
000676527.b3lyp_6-31g(d).inp

000676527.b3lyp_6-31g(d).qchem.inp (generated)

000676527.b3lyp_6-31g(d).gjf (generated)

000676527.b3lyp_6-31g(d).firefly.inp (generated)

000676527.b3lyp_6-31g(d).smash.inp (generated)

000676527.b3lyp_6-31g(d).nwchem.inp (generated) 000676527.b3lyp_6-31g(d).log.xz 000676527.td-b3lyp_6-31g+(d).inp 000676527.td-b3lyp_6-31g+(d).log.xz

000676527.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676527.td-b3lyp_6-31+g(d).gjf (generated)

000676527.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676527.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676527.mol 000676527.PUBCHEM 000676527.mol (via Jmol)
000676528.b3lyp_6-31g(d).inp

000676528.b3lyp_6-31g(d).qchem.inp (generated)

000676528.b3lyp_6-31g(d).gjf (generated)

000676528.b3lyp_6-31g(d).firefly.inp (generated)

000676528.b3lyp_6-31g(d).smash.inp (generated)

000676528.b3lyp_6-31g(d).nwchem.inp (generated) 000676528.b3lyp_6-31g(d).log.xz 000676528.mol 000676528.PUBCHEM 000676528.mol (via Jmol)
000676529.b3lyp_6-31g(d).inp

000676529.b3lyp_6-31g(d).qchem.inp (generated)

000676529.b3lyp_6-31g(d).gjf (generated)

000676529.b3lyp_6-31g(d).firefly.inp (generated)

000676529.b3lyp_6-31g(d).smash.inp (generated)

000676529.b3lyp_6-31g(d).nwchem.inp (generated) 000676529.b3lyp_6-31g(d).log.xz 000676529.mol 000676529.PUBCHEM 000676529.mol (via Jmol)
000676530.b3lyp_6-31g(d).inp

000676530.b3lyp_6-31g(d).qchem.inp (generated)

000676530.b3lyp_6-31g(d).gjf (generated)

000676530.b3lyp_6-31g(d).firefly.inp (generated)

000676530.b3lyp_6-31g(d).smash.inp (generated)

000676530.b3lyp_6-31g(d).nwchem.inp (generated) 000676530.b3lyp_6-31g(d).log.xz 000676530.td-b3lyp_6-31g+(d).inp 000676530.td-b3lyp_6-31g+(d).log.xz

000676530.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676530.td-b3lyp_6-31+g(d).gjf (generated)

000676530.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676530.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676530.mol 000676530.PUBCHEM 000676530.mol (via Jmol)
000676531.b3lyp_6-31g(d).inp

000676531.b3lyp_6-31g(d).qchem.inp (generated)

000676531.b3lyp_6-31g(d).gjf (generated)

000676531.b3lyp_6-31g(d).firefly.inp (generated)

000676531.b3lyp_6-31g(d).smash.inp (generated)

000676531.b3lyp_6-31g(d).nwchem.inp (generated) 000676531.b3lyp_6-31g(d).log.xz 000676531.td-b3lyp_6-31g+(d).inp 000676531.td-b3lyp_6-31g+(d).log.xz

000676531.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676531.td-b3lyp_6-31+g(d).gjf (generated)

000676531.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676531.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676531.mol 000676531.PUBCHEM 000676531.mol (via Jmol)
000676532.b3lyp_6-31g(d).inp

000676532.b3lyp_6-31g(d).qchem.inp (generated)

000676532.b3lyp_6-31g(d).gjf (generated)

000676532.b3lyp_6-31g(d).firefly.inp (generated)

000676532.b3lyp_6-31g(d).smash.inp (generated)

000676532.b3lyp_6-31g(d).nwchem.inp (generated) 000676532.b3lyp_6-31g(d).log.xz 000676532.td-b3lyp_6-31g+(d).inp 000676532.td-b3lyp_6-31g+(d).log.xz

000676532.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676532.td-b3lyp_6-31+g(d).gjf (generated)

000676532.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676532.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676532.mol 000676532.PUBCHEM 000676532.mol (via Jmol)
000676533.b3lyp_6-31g(d).inp

000676533.b3lyp_6-31g(d).qchem.inp (generated)

000676533.b3lyp_6-31g(d).gjf (generated)

000676533.b3lyp_6-31g(d).firefly.inp (generated)

000676533.b3lyp_6-31g(d).smash.inp (generated)

000676533.b3lyp_6-31g(d).nwchem.inp (generated) 000676533.b3lyp_6-31g(d).log.xz 000676533.td-b3lyp_6-31g+(d).inp 000676533.td-b3lyp_6-31g+(d).log.xz

000676533.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676533.td-b3lyp_6-31+g(d).gjf (generated)

000676533.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676533.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676533.mol 000676533.PUBCHEM 000676533.mol (via Jmol)
000676536.b3lyp_6-31g(d).inp

000676536.b3lyp_6-31g(d).qchem.inp (generated)

000676536.b3lyp_6-31g(d).gjf (generated)

000676536.b3lyp_6-31g(d).firefly.inp (generated)

000676536.b3lyp_6-31g(d).smash.inp (generated)

000676536.b3lyp_6-31g(d).nwchem.inp (generated) 000676536.b3lyp_6-31g(d).log.xz 000676536.td-b3lyp_6-31g+(d).inp 000676536.td-b3lyp_6-31g+(d).log.xz

000676536.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676536.td-b3lyp_6-31+g(d).gjf (generated)

000676536.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676536.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676536.mol 000676536.PUBCHEM 000676536.mol (via Jmol)
000676537.b3lyp_6-31g(d).inp

000676537.b3lyp_6-31g(d).qchem.inp (generated)

000676537.b3lyp_6-31g(d).gjf (generated)

000676537.b3lyp_6-31g(d).firefly.inp (generated)

000676537.b3lyp_6-31g(d).smash.inp (generated)

000676537.b3lyp_6-31g(d).nwchem.inp (generated) 000676537.b3lyp_6-31g(d).log.xz 000676537.td-b3lyp_6-31g+(d).inp 000676537.td-b3lyp_6-31g+(d).log.xz

000676537.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676537.td-b3lyp_6-31+g(d).gjf (generated)

000676537.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676537.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676537.mol 000676537.PUBCHEM 000676537.mol (via Jmol)
000676538.b3lyp_6-31g(d).inp

000676538.b3lyp_6-31g(d).qchem.inp (generated)

000676538.b3lyp_6-31g(d).gjf (generated)

000676538.b3lyp_6-31g(d).firefly.inp (generated)

000676538.b3lyp_6-31g(d).smash.inp (generated)

000676538.b3lyp_6-31g(d).nwchem.inp (generated) 000676538.b3lyp_6-31g(d).log.xz 000676538.td-b3lyp_6-31g+(d).inp 000676538.td-b3lyp_6-31g+(d).log.xz

000676538.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676538.td-b3lyp_6-31+g(d).gjf (generated)

000676538.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676538.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676538.mol 000676538.PUBCHEM 000676538.mol (via Jmol)
000676539.b3lyp_6-31g(d).inp

000676539.b3lyp_6-31g(d).qchem.inp (generated)

000676539.b3lyp_6-31g(d).gjf (generated)

000676539.b3lyp_6-31g(d).firefly.inp (generated)

000676539.b3lyp_6-31g(d).smash.inp (generated)

000676539.b3lyp_6-31g(d).nwchem.inp (generated) 000676539.b3lyp_6-31g(d).log.xz 000676539.td-b3lyp_6-31g+(d).inp 000676539.td-b3lyp_6-31g+(d).log.xz

000676539.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676539.td-b3lyp_6-31+g(d).gjf (generated)

000676539.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676539.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676539.mol 000676539.PUBCHEM 000676539.mol (via Jmol)
000676540.b3lyp_6-31g(d).inp

000676540.b3lyp_6-31g(d).qchem.inp (generated)

000676540.b3lyp_6-31g(d).gjf (generated)

000676540.b3lyp_6-31g(d).firefly.inp (generated)

000676540.b3lyp_6-31g(d).smash.inp (generated)

000676540.b3lyp_6-31g(d).nwchem.inp (generated) 000676540.b3lyp_6-31g(d).log.xz 000676540.td-b3lyp_6-31g+(d).inp 000676540.td-b3lyp_6-31g+(d).log.xz

000676540.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676540.td-b3lyp_6-31+g(d).gjf (generated)

000676540.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676540.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676540.mol 000676540.PUBCHEM 000676540.mol (via Jmol)
000676541.b3lyp_6-31g(d).inp

000676541.b3lyp_6-31g(d).qchem.inp (generated)

000676541.b3lyp_6-31g(d).gjf (generated)

000676541.b3lyp_6-31g(d).firefly.inp (generated)

000676541.b3lyp_6-31g(d).smash.inp (generated)

000676541.b3lyp_6-31g(d).nwchem.inp (generated) 000676541.b3lyp_6-31g(d).log.xz 000676541.td-b3lyp_6-31g+(d).inp 000676541.td-b3lyp_6-31g+(d).log.xz

000676541.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676541.td-b3lyp_6-31+g(d).gjf (generated)

000676541.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676541.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676541.mol 000676541.PUBCHEM 000676541.mol (via Jmol)
000676542.b3lyp_6-31g(d).inp

000676542.b3lyp_6-31g(d).qchem.inp (generated)

000676542.b3lyp_6-31g(d).gjf (generated)

000676542.b3lyp_6-31g(d).firefly.inp (generated)

000676542.b3lyp_6-31g(d).smash.inp (generated)

000676542.b3lyp_6-31g(d).nwchem.inp (generated) 000676542.b3lyp_6-31g(d).log.xz 000676542.td-b3lyp_6-31g+(d).inp 000676542.td-b3lyp_6-31g+(d).log.xz

000676542.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676542.td-b3lyp_6-31+g(d).gjf (generated)

000676542.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676542.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676542.mol 000676542.PUBCHEM 000676542.mol (via Jmol)
000676543.b3lyp_6-31g(d).inp

000676543.b3lyp_6-31g(d).qchem.inp (generated)

000676543.b3lyp_6-31g(d).gjf (generated)

000676543.b3lyp_6-31g(d).firefly.inp (generated)

000676543.b3lyp_6-31g(d).smash.inp (generated)

000676543.b3lyp_6-31g(d).nwchem.inp (generated) 000676543.b3lyp_6-31g(d).log.xz 000676543.td-b3lyp_6-31g+(d).inp 000676543.td-b3lyp_6-31g+(d).log.xz

000676543.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676543.td-b3lyp_6-31+g(d).gjf (generated)

000676543.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676543.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676543.mol 000676543.PUBCHEM 000676543.mol (via Jmol)
000676544.b3lyp_6-31g(d).inp

000676544.b3lyp_6-31g(d).qchem.inp (generated)

000676544.b3lyp_6-31g(d).gjf (generated)

000676544.b3lyp_6-31g(d).firefly.inp (generated)

000676544.b3lyp_6-31g(d).smash.inp (generated)

000676544.b3lyp_6-31g(d).nwchem.inp (generated) 000676544.b3lyp_6-31g(d).log.xz 000676544.td-b3lyp_6-31g+(d).inp 000676544.td-b3lyp_6-31g+(d).log.xz

000676544.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676544.td-b3lyp_6-31+g(d).gjf (generated)

000676544.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676544.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676544.mol 000676544.PUBCHEM 000676544.mol (via Jmol)
000676545.b3lyp_6-31g(d).inp

000676545.b3lyp_6-31g(d).qchem.inp (generated)

000676545.b3lyp_6-31g(d).gjf (generated)

000676545.b3lyp_6-31g(d).firefly.inp (generated)

000676545.b3lyp_6-31g(d).smash.inp (generated)

000676545.b3lyp_6-31g(d).nwchem.inp (generated) 000676545.b3lyp_6-31g(d).log.xz 000676545.td-b3lyp_6-31g+(d).inp 000676545.td-b3lyp_6-31g+(d).log.xz

000676545.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676545.td-b3lyp_6-31+g(d).gjf (generated)

000676545.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676545.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676545.mol 000676545.PUBCHEM 000676545.mol (via Jmol)
000676546.b3lyp_6-31g(d).inp

000676546.b3lyp_6-31g(d).qchem.inp (generated)

000676546.b3lyp_6-31g(d).gjf (generated)

000676546.b3lyp_6-31g(d).firefly.inp (generated)

000676546.b3lyp_6-31g(d).smash.inp (generated)

000676546.b3lyp_6-31g(d).nwchem.inp (generated) 000676546.b3lyp_6-31g(d).log.xz 000676546.td-b3lyp_6-31g+(d).inp 000676546.td-b3lyp_6-31g+(d).log.xz

000676546.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676546.td-b3lyp_6-31+g(d).gjf (generated)

000676546.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676546.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676546.mol 000676546.PUBCHEM 000676546.mol (via Jmol)
000676547.b3lyp_6-31g(d).inp

000676547.b3lyp_6-31g(d).qchem.inp (generated)

000676547.b3lyp_6-31g(d).gjf (generated)

000676547.b3lyp_6-31g(d).firefly.inp (generated)

000676547.b3lyp_6-31g(d).smash.inp (generated)

000676547.b3lyp_6-31g(d).nwchem.inp (generated) 000676547.b3lyp_6-31g(d).log.xz 000676547.td-b3lyp_6-31g+(d).inp 000676547.td-b3lyp_6-31g+(d).log.xz

000676547.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676547.td-b3lyp_6-31+g(d).gjf (generated)

000676547.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676547.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676547.mol 000676547.PUBCHEM 000676547.mol (via Jmol)
000676548.b3lyp_6-31g(d).inp

000676548.b3lyp_6-31g(d).qchem.inp (generated)

000676548.b3lyp_6-31g(d).gjf (generated)

000676548.b3lyp_6-31g(d).firefly.inp (generated)

000676548.b3lyp_6-31g(d).smash.inp (generated)

000676548.b3lyp_6-31g(d).nwchem.inp (generated) 000676548.b3lyp_6-31g(d).log.xz 000676548.td-b3lyp_6-31g+(d).inp 000676548.td-b3lyp_6-31g+(d).log.xz

000676548.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676548.td-b3lyp_6-31+g(d).gjf (generated)

000676548.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676548.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676548.mol 000676548.PUBCHEM 000676548.mol (via Jmol)
000676549.b3lyp_6-31g(d).inp

000676549.b3lyp_6-31g(d).qchem.inp (generated)

000676549.b3lyp_6-31g(d).gjf (generated)

000676549.b3lyp_6-31g(d).firefly.inp (generated)

000676549.b3lyp_6-31g(d).smash.inp (generated)

000676549.b3lyp_6-31g(d).nwchem.inp (generated) 000676549.b3lyp_6-31g(d).log.xz 000676549.td-b3lyp_6-31g+(d).inp 000676549.td-b3lyp_6-31g+(d).log.xz

000676549.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676549.td-b3lyp_6-31+g(d).gjf (generated)

000676549.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676549.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676549.mol 000676549.PUBCHEM 000676549.mol (via Jmol)
000676552.b3lyp_6-31g(d).inp

000676552.b3lyp_6-31g(d).qchem.inp (generated)

000676552.b3lyp_6-31g(d).gjf (generated)

000676552.b3lyp_6-31g(d).firefly.inp (generated)

000676552.b3lyp_6-31g(d).smash.inp (generated)

000676552.b3lyp_6-31g(d).nwchem.inp (generated) 000676552.b3lyp_6-31g(d).log.xz 000676552.td-b3lyp_6-31g+(d).inp 000676552.td-b3lyp_6-31g+(d).log.xz

000676552.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676552.td-b3lyp_6-31+g(d).gjf (generated)

000676552.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676552.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676552.mol 000676552.PUBCHEM 000676552.mol (via Jmol)
000676553.b3lyp_6-31g(d).inp

000676553.b3lyp_6-31g(d).qchem.inp (generated)

000676553.b3lyp_6-31g(d).gjf (generated)

000676553.b3lyp_6-31g(d).firefly.inp (generated)

000676553.b3lyp_6-31g(d).smash.inp (generated)

000676553.b3lyp_6-31g(d).nwchem.inp (generated) 000676553.b3lyp_6-31g(d).log.xz 000676553.td-b3lyp_6-31g+(d).inp 000676553.td-b3lyp_6-31g+(d).log.xz

000676553.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676553.td-b3lyp_6-31+g(d).gjf (generated)

000676553.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676553.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676553.mol 000676553.PUBCHEM 000676553.mol (via Jmol)
000676558.b3lyp_6-31g(d).inp

000676558.b3lyp_6-31g(d).qchem.inp (generated)

000676558.b3lyp_6-31g(d).gjf (generated)

000676558.b3lyp_6-31g(d).firefly.inp (generated)

000676558.b3lyp_6-31g(d).smash.inp (generated)

000676558.b3lyp_6-31g(d).nwchem.inp (generated) 000676558.b3lyp_6-31g(d).log.xz 000676558.td-b3lyp_6-31g+(d).inp 000676558.td-b3lyp_6-31g+(d).log.xz

000676558.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676558.td-b3lyp_6-31+g(d).gjf (generated)

000676558.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676558.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676558.mol 000676558.PUBCHEM 000676558.mol (via Jmol)
000676559.b3lyp_6-31g(d).inp

000676559.b3lyp_6-31g(d).qchem.inp (generated)

000676559.b3lyp_6-31g(d).gjf (generated)

000676559.b3lyp_6-31g(d).firefly.inp (generated)

000676559.b3lyp_6-31g(d).smash.inp (generated)

000676559.b3lyp_6-31g(d).nwchem.inp (generated) 000676559.b3lyp_6-31g(d).log.xz 000676559.td-b3lyp_6-31g+(d).inp 000676559.td-b3lyp_6-31g+(d).log.xz

000676559.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676559.td-b3lyp_6-31+g(d).gjf (generated)

000676559.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676559.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676559.mol 000676559.PUBCHEM 000676559.mol (via Jmol)
000676560.b3lyp_6-31g(d).inp

000676560.b3lyp_6-31g(d).qchem.inp (generated)

000676560.b3lyp_6-31g(d).gjf (generated)

000676560.b3lyp_6-31g(d).firefly.inp (generated)

000676560.b3lyp_6-31g(d).smash.inp (generated)

000676560.b3lyp_6-31g(d).nwchem.inp (generated) 000676560.b3lyp_6-31g(d).log.xz 000676560.td-b3lyp_6-31g+(d).inp 000676560.td-b3lyp_6-31g+(d).log.xz

000676560.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676560.td-b3lyp_6-31+g(d).gjf (generated)

000676560.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676560.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676560.mol 000676560.PUBCHEM 000676560.mol (via Jmol)
000676561.b3lyp_6-31g(d).inp

000676561.b3lyp_6-31g(d).qchem.inp (generated)

000676561.b3lyp_6-31g(d).gjf (generated)

000676561.b3lyp_6-31g(d).firefly.inp (generated)

000676561.b3lyp_6-31g(d).smash.inp (generated)

000676561.b3lyp_6-31g(d).nwchem.inp (generated) 000676561.b3lyp_6-31g(d).log.xz 000676561.mol 000676561.PUBCHEM 000676561.mol (via Jmol)
000676565.b3lyp_6-31g(d).inp

000676565.b3lyp_6-31g(d).qchem.inp (generated)

000676565.b3lyp_6-31g(d).gjf (generated)

000676565.b3lyp_6-31g(d).firefly.inp (generated)

000676565.b3lyp_6-31g(d).smash.inp (generated)

000676565.b3lyp_6-31g(d).nwchem.inp (generated) 000676565.b3lyp_6-31g(d).log.xz 000676565.td-b3lyp_6-31g+(d).inp 000676565.td-b3lyp_6-31g+(d).log.xz

000676565.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676565.td-b3lyp_6-31+g(d).gjf (generated)

000676565.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676565.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676565.mol 000676565.PUBCHEM 000676565.mol (via Jmol)
000676570.b3lyp_6-31g(d).inp

000676570.b3lyp_6-31g(d).qchem.inp (generated)

000676570.b3lyp_6-31g(d).gjf (generated)

000676570.b3lyp_6-31g(d).firefly.inp (generated)

000676570.b3lyp_6-31g(d).smash.inp (generated)

000676570.b3lyp_6-31g(d).nwchem.inp (generated) 000676570.b3lyp_6-31g(d).log.xz 000676570.mol 000676570.PUBCHEM 000676570.mol (via Jmol)
000676571.b3lyp_6-31g(d).inp

000676571.b3lyp_6-31g(d).qchem.inp (generated)

000676571.b3lyp_6-31g(d).gjf (generated)

000676571.b3lyp_6-31g(d).firefly.inp (generated)

000676571.b3lyp_6-31g(d).smash.inp (generated)

000676571.b3lyp_6-31g(d).nwchem.inp (generated) 000676571.b3lyp_6-31g(d).log.xz 000676571.td-b3lyp_6-31g+(d).inp 000676571.td-b3lyp_6-31g+(d).log.xz

000676571.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676571.td-b3lyp_6-31+g(d).gjf (generated)

000676571.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676571.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676571.mol 000676571.PUBCHEM 000676571.mol (via Jmol)
000676573.b3lyp_6-31g(d).inp

000676573.b3lyp_6-31g(d).qchem.inp (generated)

000676573.b3lyp_6-31g(d).gjf (generated)

000676573.b3lyp_6-31g(d).firefly.inp (generated)

000676573.b3lyp_6-31g(d).smash.inp (generated)

000676573.b3lyp_6-31g(d).nwchem.inp (generated) 000676573.b3lyp_6-31g(d).log.xz 000676573.td-b3lyp_6-31g+(d).inp 000676573.td-b3lyp_6-31g+(d).log.xz

000676573.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676573.td-b3lyp_6-31+g(d).gjf (generated)

000676573.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676573.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676573.mol 000676573.PUBCHEM 000676573.mol (via Jmol)
000676574.b3lyp_6-31g(d).inp

000676574.b3lyp_6-31g(d).qchem.inp (generated)

000676574.b3lyp_6-31g(d).gjf (generated)

000676574.b3lyp_6-31g(d).firefly.inp (generated)

000676574.b3lyp_6-31g(d).smash.inp (generated)

000676574.b3lyp_6-31g(d).nwchem.inp (generated) 000676574.b3lyp_6-31g(d).log.xz 000676574.td-b3lyp_6-31g+(d).inp 000676574.td-b3lyp_6-31g+(d).log.xz

000676574.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676574.td-b3lyp_6-31+g(d).gjf (generated)

000676574.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676574.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676574.mol 000676574.PUBCHEM 000676574.mol (via Jmol)
000676577.b3lyp_6-31g(d).inp

000676577.b3lyp_6-31g(d).qchem.inp (generated)

000676577.b3lyp_6-31g(d).gjf (generated)

000676577.b3lyp_6-31g(d).firefly.inp (generated)

000676577.b3lyp_6-31g(d).smash.inp (generated)

000676577.b3lyp_6-31g(d).nwchem.inp (generated) 000676577.b3lyp_6-31g(d).log.xz 000676577.td-b3lyp_6-31g+(d).inp 000676577.td-b3lyp_6-31g+(d).log.xz

000676577.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676577.td-b3lyp_6-31+g(d).gjf (generated)

000676577.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676577.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676577.mol 000676577.PUBCHEM 000676577.mol (via Jmol)
000676579.b3lyp_6-31g(d).inp

000676579.b3lyp_6-31g(d).qchem.inp (generated)

000676579.b3lyp_6-31g(d).gjf (generated)

000676579.b3lyp_6-31g(d).firefly.inp (generated)

000676579.b3lyp_6-31g(d).smash.inp (generated)

000676579.b3lyp_6-31g(d).nwchem.inp (generated) 000676579.b3lyp_6-31g(d).log.xz 000676579.td-b3lyp_6-31g+(d).inp 000676579.td-b3lyp_6-31g+(d).log.xz

000676579.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676579.td-b3lyp_6-31+g(d).gjf (generated)

000676579.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676579.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676579.mol 000676579.PUBCHEM 000676579.mol (via Jmol)
000676581.b3lyp_6-31g(d).inp

000676581.b3lyp_6-31g(d).qchem.inp (generated)

000676581.b3lyp_6-31g(d).gjf (generated)

000676581.b3lyp_6-31g(d).firefly.inp (generated)

000676581.b3lyp_6-31g(d).smash.inp (generated)

000676581.b3lyp_6-31g(d).nwchem.inp (generated) 000676581.b3lyp_6-31g(d).log.xz 000676581.td-b3lyp_6-31g+(d).inp 000676581.td-b3lyp_6-31g+(d).log.xz

000676581.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676581.td-b3lyp_6-31+g(d).gjf (generated)

000676581.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676581.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676581.mol 000676581.PUBCHEM 000676581.mol (via Jmol)
000676582.b3lyp_6-31g(d).inp

000676582.b3lyp_6-31g(d).qchem.inp (generated)

000676582.b3lyp_6-31g(d).gjf (generated)

000676582.b3lyp_6-31g(d).firefly.inp (generated)

000676582.b3lyp_6-31g(d).smash.inp (generated)

000676582.b3lyp_6-31g(d).nwchem.inp (generated) 000676582.b3lyp_6-31g(d).log.xz 000676582.td-b3lyp_6-31g+(d).inp 000676582.td-b3lyp_6-31g+(d).log.xz

000676582.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676582.td-b3lyp_6-31+g(d).gjf (generated)

000676582.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676582.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676582.mol 000676582.PUBCHEM 000676582.mol (via Jmol)
000676583.b3lyp_6-31g(d).inp

000676583.b3lyp_6-31g(d).qchem.inp (generated)

000676583.b3lyp_6-31g(d).gjf (generated)

000676583.b3lyp_6-31g(d).firefly.inp (generated)

000676583.b3lyp_6-31g(d).smash.inp (generated)

000676583.b3lyp_6-31g(d).nwchem.inp (generated) 000676583.b3lyp_6-31g(d).log.xz 000676583.td-b3lyp_6-31g+(d).inp 000676583.td-b3lyp_6-31g+(d).log.xz

000676583.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676583.td-b3lyp_6-31+g(d).gjf (generated)

000676583.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676583.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676583.mol 000676583.PUBCHEM 000676583.mol (via Jmol)
000676589.b3lyp_6-31g(d).inp

000676589.b3lyp_6-31g(d).qchem.inp (generated)

000676589.b3lyp_6-31g(d).gjf (generated)

000676589.b3lyp_6-31g(d).firefly.inp (generated)

000676589.b3lyp_6-31g(d).smash.inp (generated)

000676589.b3lyp_6-31g(d).nwchem.inp (generated) 000676589.b3lyp_6-31g(d).log.xz 000676589.td-b3lyp_6-31g+(d).inp 000676589.td-b3lyp_6-31g+(d).log.xz

000676589.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676589.td-b3lyp_6-31+g(d).gjf (generated)

000676589.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676589.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676589.mol 000676589.PUBCHEM 000676589.mol (via Jmol)
000676590.b3lyp_6-31g(d).inp

000676590.b3lyp_6-31g(d).qchem.inp (generated)

000676590.b3lyp_6-31g(d).gjf (generated)

000676590.b3lyp_6-31g(d).firefly.inp (generated)

000676590.b3lyp_6-31g(d).smash.inp (generated)

000676590.b3lyp_6-31g(d).nwchem.inp (generated) 000676590.b3lyp_6-31g(d).log.xz 000676590.td-b3lyp_6-31g+(d).inp 000676590.td-b3lyp_6-31g+(d).log.xz

000676590.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676590.td-b3lyp_6-31+g(d).gjf (generated)

000676590.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676590.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676590.mol 000676590.PUBCHEM 000676590.mol (via Jmol)
000676591.b3lyp_6-31g(d).inp

000676591.b3lyp_6-31g(d).qchem.inp (generated)

000676591.b3lyp_6-31g(d).gjf (generated)

000676591.b3lyp_6-31g(d).firefly.inp (generated)

000676591.b3lyp_6-31g(d).smash.inp (generated)

000676591.b3lyp_6-31g(d).nwchem.inp (generated) 000676591.b3lyp_6-31g(d).log.xz 000676591.td-b3lyp_6-31g+(d).inp 000676591.td-b3lyp_6-31g+(d).log.xz

000676591.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676591.td-b3lyp_6-31+g(d).gjf (generated)

000676591.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676591.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676591.mol 000676591.PUBCHEM 000676591.mol (via Jmol)
000676592.b3lyp_6-31g(d).inp

000676592.b3lyp_6-31g(d).qchem.inp (generated)

000676592.b3lyp_6-31g(d).gjf (generated)

000676592.b3lyp_6-31g(d).firefly.inp (generated)

000676592.b3lyp_6-31g(d).smash.inp (generated)

000676592.b3lyp_6-31g(d).nwchem.inp (generated) 000676592.b3lyp_6-31g(d).log.xz 000676592.mol 000676592.PUBCHEM 000676592.mol (via Jmol)
000676594.b3lyp_6-31g(d).inp

000676594.b3lyp_6-31g(d).qchem.inp (generated)

000676594.b3lyp_6-31g(d).gjf (generated)

000676594.b3lyp_6-31g(d).firefly.inp (generated)

000676594.b3lyp_6-31g(d).smash.inp (generated)

000676594.b3lyp_6-31g(d).nwchem.inp (generated) 000676594.b3lyp_6-31g(d).log.xz 000676594.td-b3lyp_6-31g+(d).inp 000676594.td-b3lyp_6-31g+(d).log.xz

000676594.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676594.td-b3lyp_6-31+g(d).gjf (generated)

000676594.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676594.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676594.mol 000676594.PUBCHEM 000676594.mol (via Jmol)
000676595.b3lyp_6-31g(d).inp

000676595.b3lyp_6-31g(d).qchem.inp (generated)

000676595.b3lyp_6-31g(d).gjf (generated)

000676595.b3lyp_6-31g(d).firefly.inp (generated)

000676595.b3lyp_6-31g(d).smash.inp (generated)

000676595.b3lyp_6-31g(d).nwchem.inp (generated) 000676595.b3lyp_6-31g(d).log.xz 000676595.mol 000676595.PUBCHEM 000676595.mol (via Jmol)
000676596.b3lyp_6-31g(d).inp

000676596.b3lyp_6-31g(d).qchem.inp (generated)

000676596.b3lyp_6-31g(d).gjf (generated)

000676596.b3lyp_6-31g(d).firefly.inp (generated)

000676596.b3lyp_6-31g(d).smash.inp (generated)

000676596.b3lyp_6-31g(d).nwchem.inp (generated) 000676596.b3lyp_6-31g(d).log.xz 000676596.mol 000676596.PUBCHEM 000676596.mol (via Jmol)
000676599.b3lyp_6-31g(d).inp

000676599.b3lyp_6-31g(d).qchem.inp (generated)

000676599.b3lyp_6-31g(d).gjf (generated)

000676599.b3lyp_6-31g(d).firefly.inp (generated)

000676599.b3lyp_6-31g(d).smash.inp (generated)

000676599.b3lyp_6-31g(d).nwchem.inp (generated) 000676599.b3lyp_6-31g(d).log.xz 000676599.td-b3lyp_6-31g+(d).inp 000676599.td-b3lyp_6-31g+(d).log.xz

000676599.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676599.td-b3lyp_6-31+g(d).gjf (generated)

000676599.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676599.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676599.mol 000676599.PUBCHEM 000676599.mol (via Jmol)
000676600.b3lyp_6-31g(d).inp

000676600.b3lyp_6-31g(d).qchem.inp (generated)

000676600.b3lyp_6-31g(d).gjf (generated)

000676600.b3lyp_6-31g(d).firefly.inp (generated)

000676600.b3lyp_6-31g(d).smash.inp (generated)

000676600.b3lyp_6-31g(d).nwchem.inp (generated) 000676600.b3lyp_6-31g(d).log.xz 000676600.td-b3lyp_6-31g+(d).inp 000676600.td-b3lyp_6-31g+(d).log.xz

000676600.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676600.td-b3lyp_6-31+g(d).gjf (generated)

000676600.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676600.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676600.mol 000676600.PUBCHEM 000676600.mol (via Jmol)
000676602.b3lyp_6-31g(d).inp

000676602.b3lyp_6-31g(d).qchem.inp (generated)

000676602.b3lyp_6-31g(d).gjf (generated)

000676602.b3lyp_6-31g(d).firefly.inp (generated)

000676602.b3lyp_6-31g(d).smash.inp (generated)

000676602.b3lyp_6-31g(d).nwchem.inp (generated) 000676602.b3lyp_6-31g(d).log.xz 000676602.td-b3lyp_6-31g+(d).inp 000676602.td-b3lyp_6-31g+(d).log.xz

000676602.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676602.td-b3lyp_6-31+g(d).gjf (generated)

000676602.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676602.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676602.mol 000676602.PUBCHEM 000676602.mol (via Jmol)
000676603.b3lyp_6-31g(d).inp

000676603.b3lyp_6-31g(d).qchem.inp (generated)

000676603.b3lyp_6-31g(d).gjf (generated)

000676603.b3lyp_6-31g(d).firefly.inp (generated)

000676603.b3lyp_6-31g(d).smash.inp (generated)

000676603.b3lyp_6-31g(d).nwchem.inp (generated) 000676603.b3lyp_6-31g(d).log.xz 000676603.mol 000676603.PUBCHEM 000676603.mol (via Jmol)
000676604.b3lyp_6-31g(d).inp

000676604.b3lyp_6-31g(d).qchem.inp (generated)

000676604.b3lyp_6-31g(d).gjf (generated)

000676604.b3lyp_6-31g(d).firefly.inp (generated)

000676604.b3lyp_6-31g(d).smash.inp (generated)

000676604.b3lyp_6-31g(d).nwchem.inp (generated) 000676604.b3lyp_6-31g(d).log.xz 000676604.td-b3lyp_6-31g+(d).inp 000676604.td-b3lyp_6-31g+(d).log.xz

000676604.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676604.td-b3lyp_6-31+g(d).gjf (generated)

000676604.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676604.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676604.mol 000676604.PUBCHEM 000676604.mol (via Jmol)
000676605.b3lyp_6-31g(d).inp

000676605.b3lyp_6-31g(d).qchem.inp (generated)

000676605.b3lyp_6-31g(d).gjf (generated)

000676605.b3lyp_6-31g(d).firefly.inp (generated)

000676605.b3lyp_6-31g(d).smash.inp (generated)

000676605.b3lyp_6-31g(d).nwchem.inp (generated) 000676605.b3lyp_6-31g(d).log.xz 000676605.td-b3lyp_6-31g+(d).inp 000676605.td-b3lyp_6-31g+(d).log.xz

000676605.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676605.td-b3lyp_6-31+g(d).gjf (generated)

000676605.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676605.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676605.mol 000676605.PUBCHEM 000676605.mol (via Jmol)
000676606.b3lyp_6-31g(d).inp

000676606.b3lyp_6-31g(d).qchem.inp (generated)

000676606.b3lyp_6-31g(d).gjf (generated)

000676606.b3lyp_6-31g(d).firefly.inp (generated)

000676606.b3lyp_6-31g(d).smash.inp (generated)

000676606.b3lyp_6-31g(d).nwchem.inp (generated) 000676606.b3lyp_6-31g(d).log.xz 000676606.mol 000676606.PUBCHEM 000676606.mol (via Jmol)
000676607.b3lyp_6-31g(d).inp

000676607.b3lyp_6-31g(d).qchem.inp (generated)

000676607.b3lyp_6-31g(d).gjf (generated)

000676607.b3lyp_6-31g(d).firefly.inp (generated)

000676607.b3lyp_6-31g(d).smash.inp (generated)

000676607.b3lyp_6-31g(d).nwchem.inp (generated) 000676607.b3lyp_6-31g(d).log.xz 000676607.mol 000676607.PUBCHEM 000676607.mol (via Jmol)
000676608.b3lyp_6-31g(d).inp

000676608.b3lyp_6-31g(d).qchem.inp (generated)

000676608.b3lyp_6-31g(d).gjf (generated)

000676608.b3lyp_6-31g(d).firefly.inp (generated)

000676608.b3lyp_6-31g(d).smash.inp (generated)

000676608.b3lyp_6-31g(d).nwchem.inp (generated) 000676608.b3lyp_6-31g(d).log.xz 000676608.mol 000676608.PUBCHEM 000676608.mol (via Jmol)
000676612.b3lyp_6-31g(d).inp

000676612.b3lyp_6-31g(d).qchem.inp (generated)

000676612.b3lyp_6-31g(d).gjf (generated)

000676612.b3lyp_6-31g(d).firefly.inp (generated)

000676612.b3lyp_6-31g(d).smash.inp (generated)

000676612.b3lyp_6-31g(d).nwchem.inp (generated) 000676612.b3lyp_6-31g(d).log.xz 000676612.td-b3lyp_6-31g+(d).inp 000676612.td-b3lyp_6-31g+(d).log.xz

000676612.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676612.td-b3lyp_6-31+g(d).gjf (generated)

000676612.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676612.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676612.mol 000676612.PUBCHEM 000676612.mol (via Jmol)
000676618.b3lyp_6-31g(d).inp

000676618.b3lyp_6-31g(d).qchem.inp (generated)

000676618.b3lyp_6-31g(d).gjf (generated)

000676618.b3lyp_6-31g(d).firefly.inp (generated)

000676618.b3lyp_6-31g(d).smash.inp (generated)

000676618.b3lyp_6-31g(d).nwchem.inp (generated) 000676618.b3lyp_6-31g(d).log.xz 000676618.td-b3lyp_6-31g+(d).inp 000676618.td-b3lyp_6-31g+(d).log.xz

000676618.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676618.td-b3lyp_6-31+g(d).gjf (generated)

000676618.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676618.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676618.mol 000676618.PUBCHEM 000676618.mol (via Jmol)
000676619.b3lyp_6-31g(d).inp

000676619.b3lyp_6-31g(d).qchem.inp (generated)

000676619.b3lyp_6-31g(d).gjf (generated)

000676619.b3lyp_6-31g(d).firefly.inp (generated)

000676619.b3lyp_6-31g(d).smash.inp (generated)

000676619.b3lyp_6-31g(d).nwchem.inp (generated) 000676619.b3lyp_6-31g(d).log.xz 000676619.td-b3lyp_6-31g+(d).inp 000676619.td-b3lyp_6-31g+(d).log.xz

000676619.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676619.td-b3lyp_6-31+g(d).gjf (generated)

000676619.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676619.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676619.mol 000676619.PUBCHEM 000676619.mol (via Jmol)
000676620.b3lyp_6-31g(d).inp

000676620.b3lyp_6-31g(d).qchem.inp (generated)

000676620.b3lyp_6-31g(d).gjf (generated)

000676620.b3lyp_6-31g(d).firefly.inp (generated)

000676620.b3lyp_6-31g(d).smash.inp (generated)

000676620.b3lyp_6-31g(d).nwchem.inp (generated) 000676620.b3lyp_6-31g(d).log.xz 000676620.td-b3lyp_6-31g+(d).inp 000676620.td-b3lyp_6-31g+(d).log.xz

000676620.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676620.td-b3lyp_6-31+g(d).gjf (generated)

000676620.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676620.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676620.mol 000676620.PUBCHEM 000676620.mol (via Jmol)
000676627.b3lyp_6-31g(d).inp

000676627.b3lyp_6-31g(d).qchem.inp (generated)

000676627.b3lyp_6-31g(d).gjf (generated)

000676627.b3lyp_6-31g(d).firefly.inp (generated)

000676627.b3lyp_6-31g(d).smash.inp (generated)

000676627.b3lyp_6-31g(d).nwchem.inp (generated) 000676627.b3lyp_6-31g(d).log.xz 000676627.mol 000676627.PUBCHEM 000676627.mol (via Jmol)
000676628.b3lyp_6-31g(d).inp

000676628.b3lyp_6-31g(d).qchem.inp (generated)

000676628.b3lyp_6-31g(d).gjf (generated)

000676628.b3lyp_6-31g(d).firefly.inp (generated)

000676628.b3lyp_6-31g(d).smash.inp (generated)

000676628.b3lyp_6-31g(d).nwchem.inp (generated) 000676628.b3lyp_6-31g(d).log.xz 000676628.mol 000676628.PUBCHEM 000676628.mol (via Jmol)
000676630.b3lyp_6-31g(d).inp

000676630.b3lyp_6-31g(d).qchem.inp (generated)

000676630.b3lyp_6-31g(d).gjf (generated)

000676630.b3lyp_6-31g(d).firefly.inp (generated)

000676630.b3lyp_6-31g(d).smash.inp (generated)

000676630.b3lyp_6-31g(d).nwchem.inp (generated) 000676630.b3lyp_6-31g(d).log.xz 000676630.td-b3lyp_6-31g+(d).inp 000676630.td-b3lyp_6-31g+(d).log.xz

000676630.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676630.td-b3lyp_6-31+g(d).gjf (generated)

000676630.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676630.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676630.mol 000676630.PUBCHEM 000676630.mol (via Jmol)
000676634.b3lyp_6-31g(d).inp

000676634.b3lyp_6-31g(d).qchem.inp (generated)

000676634.b3lyp_6-31g(d).gjf (generated)

000676634.b3lyp_6-31g(d).firefly.inp (generated)

000676634.b3lyp_6-31g(d).smash.inp (generated)

000676634.b3lyp_6-31g(d).nwchem.inp (generated) 000676634.b3lyp_6-31g(d).log.xz 000676634.td-b3lyp_6-31g+(d).inp 000676634.td-b3lyp_6-31g+(d).log.xz

000676634.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676634.td-b3lyp_6-31+g(d).gjf (generated)

000676634.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676634.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676634.mol 000676634.PUBCHEM 000676634.mol (via Jmol)
000676635.b3lyp_6-31g(d).inp

000676635.b3lyp_6-31g(d).qchem.inp (generated)

000676635.b3lyp_6-31g(d).gjf (generated)

000676635.b3lyp_6-31g(d).firefly.inp (generated)

000676635.b3lyp_6-31g(d).smash.inp (generated)

000676635.b3lyp_6-31g(d).nwchem.inp (generated) 000676635.b3lyp_6-31g(d).log.xz 000676635.td-b3lyp_6-31g+(d).inp 000676635.td-b3lyp_6-31g+(d).log.xz

000676635.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676635.td-b3lyp_6-31+g(d).gjf (generated)

000676635.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676635.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676635.mol 000676635.PUBCHEM 000676635.mol (via Jmol)
000676639.b3lyp_6-31g(d).inp

000676639.b3lyp_6-31g(d).qchem.inp (generated)

000676639.b3lyp_6-31g(d).gjf (generated)

000676639.b3lyp_6-31g(d).firefly.inp (generated)

000676639.b3lyp_6-31g(d).smash.inp (generated)

000676639.b3lyp_6-31g(d).nwchem.inp (generated) 000676639.b3lyp_6-31g(d).log.xz 000676639.td-b3lyp_6-31g+(d).inp 000676639.td-b3lyp_6-31g+(d).log.xz

000676639.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676639.td-b3lyp_6-31+g(d).gjf (generated)

000676639.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676639.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676639.mol 000676639.PUBCHEM 000676639.mol (via Jmol)
000676642.b3lyp_6-31g(d).inp

000676642.b3lyp_6-31g(d).qchem.inp (generated)

000676642.b3lyp_6-31g(d).gjf (generated)

000676642.b3lyp_6-31g(d).firefly.inp (generated)

000676642.b3lyp_6-31g(d).smash.inp (generated)

000676642.b3lyp_6-31g(d).nwchem.inp (generated) 000676642.b3lyp_6-31g(d).log.xz 000676642.td-b3lyp_6-31g+(d).inp 000676642.td-b3lyp_6-31g+(d).log.xz

000676642.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676642.td-b3lyp_6-31+g(d).gjf (generated)

000676642.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676642.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676642.mol 000676642.PUBCHEM 000676642.mol (via Jmol)
000676644.b3lyp_6-31g(d).inp

000676644.b3lyp_6-31g(d).qchem.inp (generated)

000676644.b3lyp_6-31g(d).gjf (generated)

000676644.b3lyp_6-31g(d).firefly.inp (generated)

000676644.b3lyp_6-31g(d).smash.inp (generated)

000676644.b3lyp_6-31g(d).nwchem.inp (generated) 000676644.b3lyp_6-31g(d).log.xz 000676644.td-b3lyp_6-31g+(d).inp 000676644.td-b3lyp_6-31g+(d).log.xz

000676644.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676644.td-b3lyp_6-31+g(d).gjf (generated)

000676644.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676644.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676644.mol 000676644.PUBCHEM 000676644.mol (via Jmol)
000676645.b3lyp_6-31g(d).inp

000676645.b3lyp_6-31g(d).qchem.inp (generated)

000676645.b3lyp_6-31g(d).gjf (generated)

000676645.b3lyp_6-31g(d).firefly.inp (generated)

000676645.b3lyp_6-31g(d).smash.inp (generated)

000676645.b3lyp_6-31g(d).nwchem.inp (generated) 000676645.b3lyp_6-31g(d).log.xz 000676645.mol 000676645.PUBCHEM 000676645.mol (via Jmol)
000676648.b3lyp_6-31g(d).inp

000676648.b3lyp_6-31g(d).qchem.inp (generated)

000676648.b3lyp_6-31g(d).gjf (generated)

000676648.b3lyp_6-31g(d).firefly.inp (generated)

000676648.b3lyp_6-31g(d).smash.inp (generated)

000676648.b3lyp_6-31g(d).nwchem.inp (generated) 000676648.b3lyp_6-31g(d).log.xz 000676648.td-b3lyp_6-31g+(d).inp 000676648.td-b3lyp_6-31g+(d).log.xz

000676648.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676648.td-b3lyp_6-31+g(d).gjf (generated)

000676648.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676648.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676648.mol 000676648.PUBCHEM 000676648.mol (via Jmol)
000676649.b3lyp_6-31g(d).inp

000676649.b3lyp_6-31g(d).qchem.inp (generated)

000676649.b3lyp_6-31g(d).gjf (generated)

000676649.b3lyp_6-31g(d).firefly.inp (generated)

000676649.b3lyp_6-31g(d).smash.inp (generated)

000676649.b3lyp_6-31g(d).nwchem.inp (generated) 000676649.b3lyp_6-31g(d).log.xz 000676649.td-b3lyp_6-31g+(d).inp 000676649.td-b3lyp_6-31g+(d).log.xz

000676649.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676649.td-b3lyp_6-31+g(d).gjf (generated)

000676649.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676649.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676649.mol 000676649.PUBCHEM 000676649.mol (via Jmol)
000676650.b3lyp_6-31g(d).inp

000676650.b3lyp_6-31g(d).qchem.inp (generated)

000676650.b3lyp_6-31g(d).gjf (generated)

000676650.b3lyp_6-31g(d).firefly.inp (generated)

000676650.b3lyp_6-31g(d).smash.inp (generated)

000676650.b3lyp_6-31g(d).nwchem.inp (generated) 000676650.b3lyp_6-31g(d).log.xz 000676650.td-b3lyp_6-31g+(d).inp 000676650.td-b3lyp_6-31g+(d).log.xz

000676650.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676650.td-b3lyp_6-31+g(d).gjf (generated)

000676650.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676650.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676650.mol 000676650.PUBCHEM 000676650.mol (via Jmol)
000676651.b3lyp_6-31g(d).inp

000676651.b3lyp_6-31g(d).qchem.inp (generated)

000676651.b3lyp_6-31g(d).gjf (generated)

000676651.b3lyp_6-31g(d).firefly.inp (generated)

000676651.b3lyp_6-31g(d).smash.inp (generated)

000676651.b3lyp_6-31g(d).nwchem.inp (generated) 000676651.b3lyp_6-31g(d).log.xz 000676651.td-b3lyp_6-31g+(d).inp 000676651.td-b3lyp_6-31g+(d).log.xz

000676651.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676651.td-b3lyp_6-31+g(d).gjf (generated)

000676651.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676651.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676651.mol 000676651.PUBCHEM 000676651.mol (via Jmol)
000676652.b3lyp_6-31g(d).inp

000676652.b3lyp_6-31g(d).qchem.inp (generated)

000676652.b3lyp_6-31g(d).gjf (generated)

000676652.b3lyp_6-31g(d).firefly.inp (generated)

000676652.b3lyp_6-31g(d).smash.inp (generated)

000676652.b3lyp_6-31g(d).nwchem.inp (generated) 000676652.b3lyp_6-31g(d).log.xz 000676652.td-b3lyp_6-31g+(d).inp 000676652.td-b3lyp_6-31g+(d).log.xz

000676652.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676652.td-b3lyp_6-31+g(d).gjf (generated)

000676652.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676652.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676652.mol 000676652.PUBCHEM 000676652.mol (via Jmol)
000676654.b3lyp_6-31g(d).inp

000676654.b3lyp_6-31g(d).qchem.inp (generated)

000676654.b3lyp_6-31g(d).gjf (generated)

000676654.b3lyp_6-31g(d).firefly.inp (generated)

000676654.b3lyp_6-31g(d).smash.inp (generated)

000676654.b3lyp_6-31g(d).nwchem.inp (generated) 000676654.b3lyp_6-31g(d).log.xz 000676654.td-b3lyp_6-31g+(d).inp 000676654.td-b3lyp_6-31g+(d).log.xz

000676654.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676654.td-b3lyp_6-31+g(d).gjf (generated)

000676654.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676654.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676654.mol 000676654.PUBCHEM 000676654.mol (via Jmol)
000676655.b3lyp_6-31g(d).inp

000676655.b3lyp_6-31g(d).qchem.inp (generated)

000676655.b3lyp_6-31g(d).gjf (generated)

000676655.b3lyp_6-31g(d).firefly.inp (generated)

000676655.b3lyp_6-31g(d).smash.inp (generated)

000676655.b3lyp_6-31g(d).nwchem.inp (generated) 000676655.b3lyp_6-31g(d).log.xz 000676655.td-b3lyp_6-31g+(d).inp 000676655.td-b3lyp_6-31g+(d).log.xz

000676655.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676655.td-b3lyp_6-31+g(d).gjf (generated)

000676655.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676655.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676655.mol 000676655.PUBCHEM 000676655.mol (via Jmol)
000676656.b3lyp_6-31g(d).inp

000676656.b3lyp_6-31g(d).qchem.inp (generated)

000676656.b3lyp_6-31g(d).gjf (generated)

000676656.b3lyp_6-31g(d).firefly.inp (generated)

000676656.b3lyp_6-31g(d).smash.inp (generated)

000676656.b3lyp_6-31g(d).nwchem.inp (generated) 000676656.b3lyp_6-31g(d).log.xz 000676656.td-b3lyp_6-31g+(d).inp 000676656.td-b3lyp_6-31g+(d).log.xz

000676656.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676656.td-b3lyp_6-31+g(d).gjf (generated)

000676656.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676656.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676656.mol 000676656.PUBCHEM 000676656.mol (via Jmol)
000676657.b3lyp_6-31g(d).inp

000676657.b3lyp_6-31g(d).qchem.inp (generated)

000676657.b3lyp_6-31g(d).gjf (generated)

000676657.b3lyp_6-31g(d).firefly.inp (generated)

000676657.b3lyp_6-31g(d).smash.inp (generated)

000676657.b3lyp_6-31g(d).nwchem.inp (generated) 000676657.b3lyp_6-31g(d).log.xz 000676657.td-b3lyp_6-31g+(d).inp 000676657.td-b3lyp_6-31g+(d).log.xz

000676657.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676657.td-b3lyp_6-31+g(d).gjf (generated)

000676657.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676657.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676657.mol 000676657.PUBCHEM 000676657.mol (via Jmol)
000676662.b3lyp_6-31g(d).inp

000676662.b3lyp_6-31g(d).qchem.inp (generated)

000676662.b3lyp_6-31g(d).gjf (generated)

000676662.b3lyp_6-31g(d).firefly.inp (generated)

000676662.b3lyp_6-31g(d).smash.inp (generated)

000676662.b3lyp_6-31g(d).nwchem.inp (generated) 000676662.b3lyp_6-31g(d).log.xz 000676662.td-b3lyp_6-31g+(d).inp 000676662.td-b3lyp_6-31g+(d).log.xz

000676662.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676662.td-b3lyp_6-31+g(d).gjf (generated)

000676662.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676662.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676662.mol 000676662.PUBCHEM 000676662.mol (via Jmol)
000676667.b3lyp_6-31g(d).inp

000676667.b3lyp_6-31g(d).qchem.inp (generated)

000676667.b3lyp_6-31g(d).gjf (generated)

000676667.b3lyp_6-31g(d).firefly.inp (generated)

000676667.b3lyp_6-31g(d).smash.inp (generated)

000676667.b3lyp_6-31g(d).nwchem.inp (generated) 000676667.b3lyp_6-31g(d).log.xz 000676667.td-b3lyp_6-31g+(d).inp 000676667.td-b3lyp_6-31g+(d).log.xz

000676667.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676667.td-b3lyp_6-31+g(d).gjf (generated)

000676667.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676667.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676667.mol 000676667.PUBCHEM 000676667.mol (via Jmol)
000676668.b3lyp_6-31g(d).inp

000676668.b3lyp_6-31g(d).qchem.inp (generated)

000676668.b3lyp_6-31g(d).gjf (generated)

000676668.b3lyp_6-31g(d).firefly.inp (generated)

000676668.b3lyp_6-31g(d).smash.inp (generated)

000676668.b3lyp_6-31g(d).nwchem.inp (generated) 000676668.b3lyp_6-31g(d).log.xz 000676668.td-b3lyp_6-31g+(d).inp 000676668.td-b3lyp_6-31g+(d).log.xz

000676668.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676668.td-b3lyp_6-31+g(d).gjf (generated)

000676668.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676668.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676668.mol 000676668.PUBCHEM 000676668.mol (via Jmol)
000676669.b3lyp_6-31g(d).inp

000676669.b3lyp_6-31g(d).qchem.inp (generated)

000676669.b3lyp_6-31g(d).gjf (generated)

000676669.b3lyp_6-31g(d).firefly.inp (generated)

000676669.b3lyp_6-31g(d).smash.inp (generated)

000676669.b3lyp_6-31g(d).nwchem.inp (generated) 000676669.b3lyp_6-31g(d).log.xz 000676669.td-b3lyp_6-31g+(d).inp 000676669.td-b3lyp_6-31g+(d).log.xz

000676669.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676669.td-b3lyp_6-31+g(d).gjf (generated)

000676669.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676669.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676669.mol 000676669.PUBCHEM 000676669.mol (via Jmol)
000676670.b3lyp_6-31g(d).inp

000676670.b3lyp_6-31g(d).qchem.inp (generated)

000676670.b3lyp_6-31g(d).gjf (generated)

000676670.b3lyp_6-31g(d).firefly.inp (generated)

000676670.b3lyp_6-31g(d).smash.inp (generated)

000676670.b3lyp_6-31g(d).nwchem.inp (generated) 000676670.b3lyp_6-31g(d).log.xz 000676670.mol 000676670.PUBCHEM 000676670.mol (via Jmol)
000676671.b3lyp_6-31g(d).inp

000676671.b3lyp_6-31g(d).qchem.inp (generated)

000676671.b3lyp_6-31g(d).gjf (generated)

000676671.b3lyp_6-31g(d).firefly.inp (generated)

000676671.b3lyp_6-31g(d).smash.inp (generated)

000676671.b3lyp_6-31g(d).nwchem.inp (generated) 000676671.b3lyp_6-31g(d).log.xz 000676671.td-b3lyp_6-31g+(d).inp 000676671.td-b3lyp_6-31g+(d).log.xz

000676671.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676671.td-b3lyp_6-31+g(d).gjf (generated)

000676671.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676671.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676671.mol 000676671.PUBCHEM 000676671.mol (via Jmol)
000676676.b3lyp_6-31g(d).inp

000676676.b3lyp_6-31g(d).qchem.inp (generated)

000676676.b3lyp_6-31g(d).gjf (generated)

000676676.b3lyp_6-31g(d).firefly.inp (generated)

000676676.b3lyp_6-31g(d).smash.inp (generated)

000676676.b3lyp_6-31g(d).nwchem.inp (generated) 000676676.b3lyp_6-31g(d).log.xz 000676676.mol 000676676.PUBCHEM 000676676.mol (via Jmol)
000676678.b3lyp_6-31g(d).inp

000676678.b3lyp_6-31g(d).qchem.inp (generated)

000676678.b3lyp_6-31g(d).gjf (generated)

000676678.b3lyp_6-31g(d).firefly.inp (generated)

000676678.b3lyp_6-31g(d).smash.inp (generated)

000676678.b3lyp_6-31g(d).nwchem.inp (generated) 000676678.b3lyp_6-31g(d).log.xz 000676678.td-b3lyp_6-31g+(d).inp 000676678.td-b3lyp_6-31g+(d).log.xz

000676678.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676678.td-b3lyp_6-31+g(d).gjf (generated)

000676678.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676678.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676678.mol 000676678.PUBCHEM 000676678.mol (via Jmol)
000676679.b3lyp_6-31g(d).inp

000676679.b3lyp_6-31g(d).qchem.inp (generated)

000676679.b3lyp_6-31g(d).gjf (generated)

000676679.b3lyp_6-31g(d).firefly.inp (generated)

000676679.b3lyp_6-31g(d).smash.inp (generated)

000676679.b3lyp_6-31g(d).nwchem.inp (generated) 000676679.b3lyp_6-31g(d).log.xz 000676679.mol 000676679.PUBCHEM 000676679.mol (via Jmol)
000676682.b3lyp_6-31g(d).inp

000676682.b3lyp_6-31g(d).qchem.inp (generated)

000676682.b3lyp_6-31g(d).gjf (generated)

000676682.b3lyp_6-31g(d).firefly.inp (generated)

000676682.b3lyp_6-31g(d).smash.inp (generated)

000676682.b3lyp_6-31g(d).nwchem.inp (generated) 000676682.b3lyp_6-31g(d).log.xz 000676682.td-b3lyp_6-31g+(d).inp 000676682.td-b3lyp_6-31g+(d).log.xz

000676682.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676682.td-b3lyp_6-31+g(d).gjf (generated)

000676682.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676682.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676682.mol 000676682.PUBCHEM 000676682.mol (via Jmol)
000676687.b3lyp_6-31g(d).inp

000676687.b3lyp_6-31g(d).qchem.inp (generated)

000676687.b3lyp_6-31g(d).gjf (generated)

000676687.b3lyp_6-31g(d).firefly.inp (generated)

000676687.b3lyp_6-31g(d).smash.inp (generated)

000676687.b3lyp_6-31g(d).nwchem.inp (generated) 000676687.b3lyp_6-31g(d).log.xz 000676687.td-b3lyp_6-31g+(d).inp 000676687.td-b3lyp_6-31g+(d).log.xz

000676687.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676687.td-b3lyp_6-31+g(d).gjf (generated)

000676687.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676687.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676687.mol 000676687.PUBCHEM 000676687.mol (via Jmol)
000676690.b3lyp_6-31g(d).inp

000676690.b3lyp_6-31g(d).qchem.inp (generated)

000676690.b3lyp_6-31g(d).gjf (generated)

000676690.b3lyp_6-31g(d).firefly.inp (generated)

000676690.b3lyp_6-31g(d).smash.inp (generated)

000676690.b3lyp_6-31g(d).nwchem.inp (generated) 000676690.b3lyp_6-31g(d).log.xz 000676690.td-b3lyp_6-31g+(d).inp 000676690.td-b3lyp_6-31g+(d).log.xz

000676690.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676690.td-b3lyp_6-31+g(d).gjf (generated)

000676690.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676690.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676690.mol 000676690.PUBCHEM 000676690.mol (via Jmol)
000676691.b3lyp_6-31g(d).inp

000676691.b3lyp_6-31g(d).qchem.inp (generated)

000676691.b3lyp_6-31g(d).gjf (generated)

000676691.b3lyp_6-31g(d).firefly.inp (generated)

000676691.b3lyp_6-31g(d).smash.inp (generated)

000676691.b3lyp_6-31g(d).nwchem.inp (generated) 000676691.b3lyp_6-31g(d).log.xz 000676691.td-b3lyp_6-31g+(d).inp 000676691.td-b3lyp_6-31g+(d).log.xz

000676691.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676691.td-b3lyp_6-31+g(d).gjf (generated)

000676691.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676691.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676691.mol 000676691.PUBCHEM 000676691.mol (via Jmol)
000676692.b3lyp_6-31g(d).inp

000676692.b3lyp_6-31g(d).qchem.inp (generated)

000676692.b3lyp_6-31g(d).gjf (generated)

000676692.b3lyp_6-31g(d).firefly.inp (generated)

000676692.b3lyp_6-31g(d).smash.inp (generated)

000676692.b3lyp_6-31g(d).nwchem.inp (generated) 000676692.b3lyp_6-31g(d).log.xz 000676692.td-b3lyp_6-31g+(d).inp 000676692.td-b3lyp_6-31g+(d).log.xz

000676692.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676692.td-b3lyp_6-31+g(d).gjf (generated)

000676692.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676692.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676692.mol 000676692.PUBCHEM 000676692.mol (via Jmol)
000676693.b3lyp_6-31g(d).inp

000676693.b3lyp_6-31g(d).qchem.inp (generated)

000676693.b3lyp_6-31g(d).gjf (generated)

000676693.b3lyp_6-31g(d).firefly.inp (generated)

000676693.b3lyp_6-31g(d).smash.inp (generated)

000676693.b3lyp_6-31g(d).nwchem.inp (generated) 000676693.b3lyp_6-31g(d).log.xz 000676693.td-b3lyp_6-31g+(d).inp 000676693.td-b3lyp_6-31g+(d).log.xz

000676693.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676693.td-b3lyp_6-31+g(d).gjf (generated)

000676693.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676693.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676693.mol 000676693.PUBCHEM 000676693.mol (via Jmol)
000676694.b3lyp_6-31g(d).inp

000676694.b3lyp_6-31g(d).qchem.inp (generated)

000676694.b3lyp_6-31g(d).gjf (generated)

000676694.b3lyp_6-31g(d).firefly.inp (generated)

000676694.b3lyp_6-31g(d).smash.inp (generated)

000676694.b3lyp_6-31g(d).nwchem.inp (generated) 000676694.b3lyp_6-31g(d).log.xz 000676694.td-b3lyp_6-31g+(d).inp 000676694.td-b3lyp_6-31g+(d).log.xz

000676694.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676694.td-b3lyp_6-31+g(d).gjf (generated)

000676694.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676694.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676694.mol 000676694.PUBCHEM 000676694.mol (via Jmol)
000676695.b3lyp_6-31g(d).inp

000676695.b3lyp_6-31g(d).qchem.inp (generated)

000676695.b3lyp_6-31g(d).gjf (generated)

000676695.b3lyp_6-31g(d).firefly.inp (generated)

000676695.b3lyp_6-31g(d).smash.inp (generated)

000676695.b3lyp_6-31g(d).nwchem.inp (generated) 000676695.b3lyp_6-31g(d).log.xz 000676695.mol 000676695.PUBCHEM 000676695.mol (via Jmol)
000676696.b3lyp_6-31g(d).inp

000676696.b3lyp_6-31g(d).qchem.inp (generated)

000676696.b3lyp_6-31g(d).gjf (generated)

000676696.b3lyp_6-31g(d).firefly.inp (generated)

000676696.b3lyp_6-31g(d).smash.inp (generated)

000676696.b3lyp_6-31g(d).nwchem.inp (generated) 000676696.b3lyp_6-31g(d).log.xz 000676696.td-b3lyp_6-31g+(d).inp 000676696.td-b3lyp_6-31g+(d).log.xz

000676696.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676696.td-b3lyp_6-31+g(d).gjf (generated)

000676696.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676696.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676696.mol 000676696.PUBCHEM 000676696.mol (via Jmol)
000676703.b3lyp_6-31g(d).inp

000676703.b3lyp_6-31g(d).qchem.inp (generated)

000676703.b3lyp_6-31g(d).gjf (generated)

000676703.b3lyp_6-31g(d).firefly.inp (generated)

000676703.b3lyp_6-31g(d).smash.inp (generated)

000676703.b3lyp_6-31g(d).nwchem.inp (generated) 000676703.b3lyp_6-31g(d).log.xz 000676703.td-b3lyp_6-31g+(d).inp 000676703.td-b3lyp_6-31g+(d).log.xz

000676703.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676703.td-b3lyp_6-31+g(d).gjf (generated)

000676703.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676703.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676703.mol 000676703.PUBCHEM 000676703.mol (via Jmol)
000676715.b3lyp_6-31g(d).inp

000676715.b3lyp_6-31g(d).qchem.inp (generated)

000676715.b3lyp_6-31g(d).gjf (generated)

000676715.b3lyp_6-31g(d).firefly.inp (generated)

000676715.b3lyp_6-31g(d).smash.inp (generated)

000676715.b3lyp_6-31g(d).nwchem.inp (generated) 000676715.b3lyp_6-31g(d).log.xz 000676715.td-b3lyp_6-31g+(d).inp 000676715.td-b3lyp_6-31g+(d).log.xz

000676715.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676715.td-b3lyp_6-31+g(d).gjf (generated)

000676715.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676715.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676715.mol 000676715.PUBCHEM 000676715.mol (via Jmol)
000676716.b3lyp_6-31g(d).inp

000676716.b3lyp_6-31g(d).qchem.inp (generated)

000676716.b3lyp_6-31g(d).gjf (generated)

000676716.b3lyp_6-31g(d).firefly.inp (generated)

000676716.b3lyp_6-31g(d).smash.inp (generated)

000676716.b3lyp_6-31g(d).nwchem.inp (generated) 000676716.b3lyp_6-31g(d).log.xz 000676716.td-b3lyp_6-31g+(d).inp 000676716.td-b3lyp_6-31g+(d).log.xz

000676716.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676716.td-b3lyp_6-31+g(d).gjf (generated)

000676716.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676716.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676716.mol 000676716.PUBCHEM 000676716.mol (via Jmol)
000676717.b3lyp_6-31g(d).inp

000676717.b3lyp_6-31g(d).qchem.inp (generated)

000676717.b3lyp_6-31g(d).gjf (generated)

000676717.b3lyp_6-31g(d).firefly.inp (generated)

000676717.b3lyp_6-31g(d).smash.inp (generated)

000676717.b3lyp_6-31g(d).nwchem.inp (generated) 000676717.b3lyp_6-31g(d).log.xz 000676717.mol 000676717.PUBCHEM 000676717.mol (via Jmol)
000676718.b3lyp_6-31g(d).inp

000676718.b3lyp_6-31g(d).qchem.inp (generated)

000676718.b3lyp_6-31g(d).gjf (generated)

000676718.b3lyp_6-31g(d).firefly.inp (generated)

000676718.b3lyp_6-31g(d).smash.inp (generated)

000676718.b3lyp_6-31g(d).nwchem.inp (generated) 000676718.b3lyp_6-31g(d).log.xz 000676718.td-b3lyp_6-31g+(d).inp 000676718.td-b3lyp_6-31g+(d).log.xz

000676718.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676718.td-b3lyp_6-31+g(d).gjf (generated)

000676718.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676718.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676718.mol 000676718.PUBCHEM 000676718.mol (via Jmol)
000676719.b3lyp_6-31g(d).inp

000676719.b3lyp_6-31g(d).qchem.inp (generated)

000676719.b3lyp_6-31g(d).gjf (generated)

000676719.b3lyp_6-31g(d).firefly.inp (generated)

000676719.b3lyp_6-31g(d).smash.inp (generated)

000676719.b3lyp_6-31g(d).nwchem.inp (generated) 000676719.b3lyp_6-31g(d).log.xz 000676719.td-b3lyp_6-31g+(d).inp 000676719.td-b3lyp_6-31g+(d).log.xz

000676719.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676719.td-b3lyp_6-31+g(d).gjf (generated)

000676719.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676719.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676719.mol 000676719.PUBCHEM 000676719.mol (via Jmol)
000676720.b3lyp_6-31g(d).inp

000676720.b3lyp_6-31g(d).qchem.inp (generated)

000676720.b3lyp_6-31g(d).gjf (generated)

000676720.b3lyp_6-31g(d).firefly.inp (generated)

000676720.b3lyp_6-31g(d).smash.inp (generated)

000676720.b3lyp_6-31g(d).nwchem.inp (generated) 000676720.b3lyp_6-31g(d).log.xz 000676720.mol 000676720.PUBCHEM 000676720.mol (via Jmol)
000676721.b3lyp_6-31g(d).inp

000676721.b3lyp_6-31g(d).qchem.inp (generated)

000676721.b3lyp_6-31g(d).gjf (generated)

000676721.b3lyp_6-31g(d).firefly.inp (generated)

000676721.b3lyp_6-31g(d).smash.inp (generated)

000676721.b3lyp_6-31g(d).nwchem.inp (generated) 000676721.b3lyp_6-31g(d).log.xz 000676721.mol 000676721.PUBCHEM 000676721.mol (via Jmol)
000676722.b3lyp_6-31g(d).inp

000676722.b3lyp_6-31g(d).qchem.inp (generated)

000676722.b3lyp_6-31g(d).gjf (generated)

000676722.b3lyp_6-31g(d).firefly.inp (generated)

000676722.b3lyp_6-31g(d).smash.inp (generated)

000676722.b3lyp_6-31g(d).nwchem.inp (generated) 000676722.b3lyp_6-31g(d).log.xz 000676722.td-b3lyp_6-31g+(d).inp 000676722.td-b3lyp_6-31g+(d).log.xz

000676722.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676722.td-b3lyp_6-31+g(d).gjf (generated)

000676722.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676722.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676722.mol 000676722.PUBCHEM 000676722.mol (via Jmol)
000676723.b3lyp_6-31g(d).inp

000676723.b3lyp_6-31g(d).qchem.inp (generated)

000676723.b3lyp_6-31g(d).gjf (generated)

000676723.b3lyp_6-31g(d).firefly.inp (generated)

000676723.b3lyp_6-31g(d).smash.inp (generated)

000676723.b3lyp_6-31g(d).nwchem.inp (generated) 000676723.b3lyp_6-31g(d).log.xz 000676723.td-b3lyp_6-31g+(d).inp 000676723.td-b3lyp_6-31g+(d).log.xz

000676723.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676723.td-b3lyp_6-31+g(d).gjf (generated)

000676723.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676723.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676723.mol 000676723.PUBCHEM 000676723.mol (via Jmol)
000676724.b3lyp_6-31g(d).inp

000676724.b3lyp_6-31g(d).qchem.inp (generated)

000676724.b3lyp_6-31g(d).gjf (generated)

000676724.b3lyp_6-31g(d).firefly.inp (generated)

000676724.b3lyp_6-31g(d).smash.inp (generated)

000676724.b3lyp_6-31g(d).nwchem.inp (generated) 000676724.b3lyp_6-31g(d).log.xz 000676724.td-b3lyp_6-31g+(d).inp 000676724.td-b3lyp_6-31g+(d).log.xz

000676724.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676724.td-b3lyp_6-31+g(d).gjf (generated)

000676724.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676724.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676724.mol 000676724.PUBCHEM 000676724.mol (via Jmol)
000676730.b3lyp_6-31g(d).inp

000676730.b3lyp_6-31g(d).qchem.inp (generated)

000676730.b3lyp_6-31g(d).gjf (generated)

000676730.b3lyp_6-31g(d).firefly.inp (generated)

000676730.b3lyp_6-31g(d).smash.inp (generated)

000676730.b3lyp_6-31g(d).nwchem.inp (generated) 000676730.b3lyp_6-31g(d).log.xz 000676730.td-b3lyp_6-31g+(d).inp 000676730.td-b3lyp_6-31g+(d).log.xz

000676730.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676730.td-b3lyp_6-31+g(d).gjf (generated)

000676730.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676730.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676730.mol 000676730.PUBCHEM 000676730.mol (via Jmol)
000676731.b3lyp_6-31g(d).inp

000676731.b3lyp_6-31g(d).qchem.inp (generated)

000676731.b3lyp_6-31g(d).gjf (generated)

000676731.b3lyp_6-31g(d).firefly.inp (generated)

000676731.b3lyp_6-31g(d).smash.inp (generated)

000676731.b3lyp_6-31g(d).nwchem.inp (generated) 000676731.b3lyp_6-31g(d).log.xz 000676731.td-b3lyp_6-31g+(d).inp 000676731.td-b3lyp_6-31g+(d).log.xz

000676731.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676731.td-b3lyp_6-31+g(d).gjf (generated)

000676731.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676731.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676731.mol 000676731.PUBCHEM 000676731.mol (via Jmol)
000676732.b3lyp_6-31g(d).inp

000676732.b3lyp_6-31g(d).qchem.inp (generated)

000676732.b3lyp_6-31g(d).gjf (generated)

000676732.b3lyp_6-31g(d).firefly.inp (generated)

000676732.b3lyp_6-31g(d).smash.inp (generated)

000676732.b3lyp_6-31g(d).nwchem.inp (generated) 000676732.b3lyp_6-31g(d).log.xz 000676732.td-b3lyp_6-31g+(d).inp 000676732.td-b3lyp_6-31g+(d).log.xz

000676732.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676732.td-b3lyp_6-31+g(d).gjf (generated)

000676732.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676732.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676732.mol 000676732.PUBCHEM 000676732.mol (via Jmol)
000676740.b3lyp_6-31g(d).inp

000676740.b3lyp_6-31g(d).qchem.inp (generated)

000676740.b3lyp_6-31g(d).gjf (generated)

000676740.b3lyp_6-31g(d).firefly.inp (generated)

000676740.b3lyp_6-31g(d).smash.inp (generated)

000676740.b3lyp_6-31g(d).nwchem.inp (generated) 000676740.b3lyp_6-31g(d).log.xz 000676740.td-b3lyp_6-31g+(d).inp 000676740.td-b3lyp_6-31g+(d).log.xz

000676740.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676740.td-b3lyp_6-31+g(d).gjf (generated)

000676740.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676740.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676740.mol 000676740.PUBCHEM 000676740.mol (via Jmol)
000676744.b3lyp_6-31g(d).inp

000676744.b3lyp_6-31g(d).qchem.inp (generated)

000676744.b3lyp_6-31g(d).gjf (generated)

000676744.b3lyp_6-31g(d).firefly.inp (generated)

000676744.b3lyp_6-31g(d).smash.inp (generated)

000676744.b3lyp_6-31g(d).nwchem.inp (generated) 000676744.b3lyp_6-31g(d).log.xz 000676744.td-b3lyp_6-31g+(d).inp 000676744.td-b3lyp_6-31g+(d).log.xz

000676744.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676744.td-b3lyp_6-31+g(d).gjf (generated)

000676744.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676744.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676744.mol 000676744.PUBCHEM 000676744.mol (via Jmol)
000676746.b3lyp_6-31g(d).inp

000676746.b3lyp_6-31g(d).qchem.inp (generated)

000676746.b3lyp_6-31g(d).gjf (generated)

000676746.b3lyp_6-31g(d).firefly.inp (generated)

000676746.b3lyp_6-31g(d).smash.inp (generated)

000676746.b3lyp_6-31g(d).nwchem.inp (generated) 000676746.b3lyp_6-31g(d).log.xz 000676746.mol 000676746.PUBCHEM 000676746.mol (via Jmol)
000676747.b3lyp_6-31g(d).inp

000676747.b3lyp_6-31g(d).qchem.inp (generated)

000676747.b3lyp_6-31g(d).gjf (generated)

000676747.b3lyp_6-31g(d).firefly.inp (generated)

000676747.b3lyp_6-31g(d).smash.inp (generated)

000676747.b3lyp_6-31g(d).nwchem.inp (generated) 000676747.b3lyp_6-31g(d).log.xz 000676747.mol 000676747.PUBCHEM 000676747.mol (via Jmol)
000676748.b3lyp_6-31g(d).inp

000676748.b3lyp_6-31g(d).qchem.inp (generated)

000676748.b3lyp_6-31g(d).gjf (generated)

000676748.b3lyp_6-31g(d).firefly.inp (generated)

000676748.b3lyp_6-31g(d).smash.inp (generated)

000676748.b3lyp_6-31g(d).nwchem.inp (generated) 000676748.b3lyp_6-31g(d).log.xz 000676748.mol 000676748.PUBCHEM 000676748.mol (via Jmol)
000676750.b3lyp_6-31g(d).inp

000676750.b3lyp_6-31g(d).qchem.inp (generated)

000676750.b3lyp_6-31g(d).gjf (generated)

000676750.b3lyp_6-31g(d).firefly.inp (generated)

000676750.b3lyp_6-31g(d).smash.inp (generated)

000676750.b3lyp_6-31g(d).nwchem.inp (generated) 000676750.b3lyp_6-31g(d).log.xz 000676750.td-b3lyp_6-31g+(d).inp 000676750.td-b3lyp_6-31g+(d).log.xz

000676750.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676750.td-b3lyp_6-31+g(d).gjf (generated)

000676750.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676750.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676750.mol 000676750.PUBCHEM 000676750.mol (via Jmol)
000676751.b3lyp_6-31g(d).inp

000676751.b3lyp_6-31g(d).qchem.inp (generated)

000676751.b3lyp_6-31g(d).gjf (generated)

000676751.b3lyp_6-31g(d).firefly.inp (generated)

000676751.b3lyp_6-31g(d).smash.inp (generated)

000676751.b3lyp_6-31g(d).nwchem.inp (generated) 000676751.b3lyp_6-31g(d).log.xz 000676751.mol 000676751.PUBCHEM 000676751.mol (via Jmol)
000676752.b3lyp_6-31g(d).inp

000676752.b3lyp_6-31g(d).qchem.inp (generated)

000676752.b3lyp_6-31g(d).gjf (generated)

000676752.b3lyp_6-31g(d).firefly.inp (generated)

000676752.b3lyp_6-31g(d).smash.inp (generated)

000676752.b3lyp_6-31g(d).nwchem.inp (generated) 000676752.b3lyp_6-31g(d).log.xz 000676752.mol 000676752.PUBCHEM 000676752.mol (via Jmol)
000676753.b3lyp_6-31g(d).inp

000676753.b3lyp_6-31g(d).qchem.inp (generated)

000676753.b3lyp_6-31g(d).gjf (generated)

000676753.b3lyp_6-31g(d).firefly.inp (generated)

000676753.b3lyp_6-31g(d).smash.inp (generated)

000676753.b3lyp_6-31g(d).nwchem.inp (generated) 000676753.b3lyp_6-31g(d).log.xz 000676753.mol 000676753.PUBCHEM 000676753.mol (via Jmol)
000676754.b3lyp_6-31g(d).inp

000676754.b3lyp_6-31g(d).qchem.inp (generated)

000676754.b3lyp_6-31g(d).gjf (generated)

000676754.b3lyp_6-31g(d).firefly.inp (generated)

000676754.b3lyp_6-31g(d).smash.inp (generated)

000676754.b3lyp_6-31g(d).nwchem.inp (generated) 000676754.b3lyp_6-31g(d).log.xz 000676754.mol 000676754.PUBCHEM 000676754.mol (via Jmol)
000676755.b3lyp_6-31g(d).inp

000676755.b3lyp_6-31g(d).qchem.inp (generated)

000676755.b3lyp_6-31g(d).gjf (generated)

000676755.b3lyp_6-31g(d).firefly.inp (generated)

000676755.b3lyp_6-31g(d).smash.inp (generated)

000676755.b3lyp_6-31g(d).nwchem.inp (generated) 000676755.b3lyp_6-31g(d).log.xz 000676755.mol 000676755.PUBCHEM 000676755.mol (via Jmol)
000676756.b3lyp_6-31g(d).inp

000676756.b3lyp_6-31g(d).qchem.inp (generated)

000676756.b3lyp_6-31g(d).gjf (generated)

000676756.b3lyp_6-31g(d).firefly.inp (generated)

000676756.b3lyp_6-31g(d).smash.inp (generated)

000676756.b3lyp_6-31g(d).nwchem.inp (generated) 000676756.b3lyp_6-31g(d).log.xz 000676756.td-b3lyp_6-31g+(d).inp 000676756.td-b3lyp_6-31g+(d).log.xz

000676756.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676756.td-b3lyp_6-31+g(d).gjf (generated)

000676756.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676756.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676756.mol 000676756.PUBCHEM 000676756.mol (via Jmol)
000676757.b3lyp_6-31g(d).inp

000676757.b3lyp_6-31g(d).qchem.inp (generated)

000676757.b3lyp_6-31g(d).gjf (generated)

000676757.b3lyp_6-31g(d).firefly.inp (generated)

000676757.b3lyp_6-31g(d).smash.inp (generated)

000676757.b3lyp_6-31g(d).nwchem.inp (generated) 000676757.b3lyp_6-31g(d).log.xz 000676757.mol 000676757.PUBCHEM 000676757.mol (via Jmol)
000676758.b3lyp_6-31g(d).inp

000676758.b3lyp_6-31g(d).qchem.inp (generated)

000676758.b3lyp_6-31g(d).gjf (generated)

000676758.b3lyp_6-31g(d).firefly.inp (generated)

000676758.b3lyp_6-31g(d).smash.inp (generated)

000676758.b3lyp_6-31g(d).nwchem.inp (generated) 000676758.b3lyp_6-31g(d).log.xz 000676758.mol 000676758.PUBCHEM 000676758.mol (via Jmol)
000676759.b3lyp_6-31g(d).inp

000676759.b3lyp_6-31g(d).qchem.inp (generated)

000676759.b3lyp_6-31g(d).gjf (generated)

000676759.b3lyp_6-31g(d).firefly.inp (generated)

000676759.b3lyp_6-31g(d).smash.inp (generated)

000676759.b3lyp_6-31g(d).nwchem.inp (generated) 000676759.b3lyp_6-31g(d).log.xz 000676759.td-b3lyp_6-31g+(d).inp 000676759.td-b3lyp_6-31g+(d).log.xz

000676759.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676759.td-b3lyp_6-31+g(d).gjf (generated)

000676759.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676759.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676759.mol 000676759.PUBCHEM 000676759.mol (via Jmol)
000676760.b3lyp_6-31g(d).inp

000676760.b3lyp_6-31g(d).qchem.inp (generated)

000676760.b3lyp_6-31g(d).gjf (generated)

000676760.b3lyp_6-31g(d).firefly.inp (generated)

000676760.b3lyp_6-31g(d).smash.inp (generated)

000676760.b3lyp_6-31g(d).nwchem.inp (generated) 000676760.b3lyp_6-31g(d).log.xz 000676760.td-b3lyp_6-31g+(d).inp 000676760.td-b3lyp_6-31g+(d).log.xz

000676760.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676760.td-b3lyp_6-31+g(d).gjf (generated)

000676760.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676760.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676760.mol 000676760.PUBCHEM 000676760.mol (via Jmol)
000676763.b3lyp_6-31g(d).inp

000676763.b3lyp_6-31g(d).qchem.inp (generated)

000676763.b3lyp_6-31g(d).gjf (generated)

000676763.b3lyp_6-31g(d).firefly.inp (generated)

000676763.b3lyp_6-31g(d).smash.inp (generated)

000676763.b3lyp_6-31g(d).nwchem.inp (generated) 000676763.b3lyp_6-31g(d).log.xz 000676763.td-b3lyp_6-31g+(d).inp 000676763.td-b3lyp_6-31g+(d).log.xz

000676763.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676763.td-b3lyp_6-31+g(d).gjf (generated)

000676763.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676763.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676763.mol 000676763.PUBCHEM 000676763.mol (via Jmol)
000676764.b3lyp_6-31g(d).inp

000676764.b3lyp_6-31g(d).qchem.inp (generated)

000676764.b3lyp_6-31g(d).gjf (generated)

000676764.b3lyp_6-31g(d).firefly.inp (generated)

000676764.b3lyp_6-31g(d).smash.inp (generated)

000676764.b3lyp_6-31g(d).nwchem.inp (generated) 000676764.b3lyp_6-31g(d).log.xz 000676764.td-b3lyp_6-31g+(d).inp 000676764.td-b3lyp_6-31g+(d).log.xz

000676764.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676764.td-b3lyp_6-31+g(d).gjf (generated)

000676764.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676764.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676764.mol 000676764.PUBCHEM 000676764.mol (via Jmol)
000676768.b3lyp_6-31g(d).inp

000676768.b3lyp_6-31g(d).qchem.inp (generated)

000676768.b3lyp_6-31g(d).gjf (generated)

000676768.b3lyp_6-31g(d).firefly.inp (generated)

000676768.b3lyp_6-31g(d).smash.inp (generated)

000676768.b3lyp_6-31g(d).nwchem.inp (generated) 000676768.b3lyp_6-31g(d).log.xz 000676768.td-b3lyp_6-31g+(d).inp 000676768.td-b3lyp_6-31g+(d).log.xz

000676768.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676768.td-b3lyp_6-31+g(d).gjf (generated)

000676768.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676768.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676768.mol 000676768.PUBCHEM 000676768.mol (via Jmol)
000676770.b3lyp_6-31g(d).inp

000676770.b3lyp_6-31g(d).qchem.inp (generated)

000676770.b3lyp_6-31g(d).gjf (generated)

000676770.b3lyp_6-31g(d).firefly.inp (generated)

000676770.b3lyp_6-31g(d).smash.inp (generated)

000676770.b3lyp_6-31g(d).nwchem.inp (generated) 000676770.b3lyp_6-31g(d).log.xz 000676770.td-b3lyp_6-31g+(d).inp 000676770.td-b3lyp_6-31g+(d).log.xz

000676770.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676770.td-b3lyp_6-31+g(d).gjf (generated)

000676770.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676770.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676770.mol 000676770.PUBCHEM 000676770.mol (via Jmol)
000676771.b3lyp_6-31g(d).inp

000676771.b3lyp_6-31g(d).qchem.inp (generated)

000676771.b3lyp_6-31g(d).gjf (generated)

000676771.b3lyp_6-31g(d).firefly.inp (generated)

000676771.b3lyp_6-31g(d).smash.inp (generated)

000676771.b3lyp_6-31g(d).nwchem.inp (generated) 000676771.b3lyp_6-31g(d).log.xz 000676771.td-b3lyp_6-31g+(d).inp 000676771.td-b3lyp_6-31g+(d).log.xz

000676771.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676771.td-b3lyp_6-31+g(d).gjf (generated)

000676771.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676771.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676771.mol 000676771.PUBCHEM 000676771.mol (via Jmol)
000676772.b3lyp_6-31g(d).inp

000676772.b3lyp_6-31g(d).qchem.inp (generated)

000676772.b3lyp_6-31g(d).gjf (generated)

000676772.b3lyp_6-31g(d).firefly.inp (generated)

000676772.b3lyp_6-31g(d).smash.inp (generated)

000676772.b3lyp_6-31g(d).nwchem.inp (generated) 000676772.b3lyp_6-31g(d).log.xz 000676772.mol 000676772.PUBCHEM 000676772.mol (via Jmol)
000676774.b3lyp_6-31g(d).inp

000676774.b3lyp_6-31g(d).qchem.inp (generated)

000676774.b3lyp_6-31g(d).gjf (generated)

000676774.b3lyp_6-31g(d).firefly.inp (generated)

000676774.b3lyp_6-31g(d).smash.inp (generated)

000676774.b3lyp_6-31g(d).nwchem.inp (generated) 000676774.b3lyp_6-31g(d).log.xz 000676774.mol 000676774.PUBCHEM 000676774.mol (via Jmol)
000676776.b3lyp_6-31g(d).inp

000676776.b3lyp_6-31g(d).qchem.inp (generated)

000676776.b3lyp_6-31g(d).gjf (generated)

000676776.b3lyp_6-31g(d).firefly.inp (generated)

000676776.b3lyp_6-31g(d).smash.inp (generated)

000676776.b3lyp_6-31g(d).nwchem.inp (generated) 000676776.b3lyp_6-31g(d).log.xz 000676776.td-b3lyp_6-31g+(d).inp 000676776.td-b3lyp_6-31g+(d).log.xz

000676776.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676776.td-b3lyp_6-31+g(d).gjf (generated)

000676776.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676776.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676776.mol 000676776.PUBCHEM 000676776.mol (via Jmol)
000676778.b3lyp_6-31g(d).inp

000676778.b3lyp_6-31g(d).qchem.inp (generated)

000676778.b3lyp_6-31g(d).gjf (generated)

000676778.b3lyp_6-31g(d).firefly.inp (generated)

000676778.b3lyp_6-31g(d).smash.inp (generated)

000676778.b3lyp_6-31g(d).nwchem.inp (generated) 000676778.b3lyp_6-31g(d).log.xz 000676778.td-b3lyp_6-31g+(d).inp 000676778.td-b3lyp_6-31g+(d).log.xz

000676778.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676778.td-b3lyp_6-31+g(d).gjf (generated)

000676778.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676778.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676778.mol 000676778.PUBCHEM 000676778.mol (via Jmol)
000676779.b3lyp_6-31g(d).inp

000676779.b3lyp_6-31g(d).qchem.inp (generated)

000676779.b3lyp_6-31g(d).gjf (generated)

000676779.b3lyp_6-31g(d).firefly.inp (generated)

000676779.b3lyp_6-31g(d).smash.inp (generated)

000676779.b3lyp_6-31g(d).nwchem.inp (generated) 000676779.b3lyp_6-31g(d).log.xz 000676779.td-b3lyp_6-31g+(d).inp 000676779.td-b3lyp_6-31g+(d).log.xz

000676779.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676779.td-b3lyp_6-31+g(d).gjf (generated)

000676779.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676779.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676779.mol 000676779.PUBCHEM 000676779.mol (via Jmol)
000676780.b3lyp_6-31g(d).inp

000676780.b3lyp_6-31g(d).qchem.inp (generated)

000676780.b3lyp_6-31g(d).gjf (generated)

000676780.b3lyp_6-31g(d).firefly.inp (generated)

000676780.b3lyp_6-31g(d).smash.inp (generated)

000676780.b3lyp_6-31g(d).nwchem.inp (generated) 000676780.b3lyp_6-31g(d).log.xz 000676780.mol 000676780.PUBCHEM 000676780.mol (via Jmol)
000676783.b3lyp_6-31g(d).inp

000676783.b3lyp_6-31g(d).qchem.inp (generated)

000676783.b3lyp_6-31g(d).gjf (generated)

000676783.b3lyp_6-31g(d).firefly.inp (generated)

000676783.b3lyp_6-31g(d).smash.inp (generated)

000676783.b3lyp_6-31g(d).nwchem.inp (generated) 000676783.b3lyp_6-31g(d).log.xz 000676783.td-b3lyp_6-31g+(d).inp 000676783.td-b3lyp_6-31g+(d).log.xz

000676783.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676783.td-b3lyp_6-31+g(d).gjf (generated)

000676783.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676783.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676783.mol 000676783.PUBCHEM 000676783.mol (via Jmol)
000676788.b3lyp_6-31g(d).inp

000676788.b3lyp_6-31g(d).qchem.inp (generated)

000676788.b3lyp_6-31g(d).gjf (generated)

000676788.b3lyp_6-31g(d).firefly.inp (generated)

000676788.b3lyp_6-31g(d).smash.inp (generated)

000676788.b3lyp_6-31g(d).nwchem.inp (generated) 000676788.b3lyp_6-31g(d).log.xz 000676788.td-b3lyp_6-31g+(d).inp 000676788.td-b3lyp_6-31g+(d).log.xz

000676788.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676788.td-b3lyp_6-31+g(d).gjf (generated)

000676788.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676788.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676788.mol 000676788.PUBCHEM 000676788.mol (via Jmol)
000676790.b3lyp_6-31g(d).inp

000676790.b3lyp_6-31g(d).qchem.inp (generated)

000676790.b3lyp_6-31g(d).gjf (generated)

000676790.b3lyp_6-31g(d).firefly.inp (generated)

000676790.b3lyp_6-31g(d).smash.inp (generated)

000676790.b3lyp_6-31g(d).nwchem.inp (generated) 000676790.b3lyp_6-31g(d).log.xz 000676790.td-b3lyp_6-31g+(d).inp 000676790.td-b3lyp_6-31g+(d).log.xz

000676790.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676790.td-b3lyp_6-31+g(d).gjf (generated)

000676790.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676790.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676790.mol 000676790.PUBCHEM 000676790.mol (via Jmol)
000676794.b3lyp_6-31g(d).inp

000676794.b3lyp_6-31g(d).qchem.inp (generated)

000676794.b3lyp_6-31g(d).gjf (generated)

000676794.b3lyp_6-31g(d).firefly.inp (generated)

000676794.b3lyp_6-31g(d).smash.inp (generated)

000676794.b3lyp_6-31g(d).nwchem.inp (generated) 000676794.b3lyp_6-31g(d).log.xz 000676794.td-b3lyp_6-31g+(d).inp 000676794.td-b3lyp_6-31g+(d).log.xz

000676794.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676794.td-b3lyp_6-31+g(d).gjf (generated)

000676794.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676794.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676794.mol 000676794.PUBCHEM 000676794.mol (via Jmol)
000676796.b3lyp_6-31g(d).inp

000676796.b3lyp_6-31g(d).qchem.inp (generated)

000676796.b3lyp_6-31g(d).gjf (generated)

000676796.b3lyp_6-31g(d).firefly.inp (generated)

000676796.b3lyp_6-31g(d).smash.inp (generated)

000676796.b3lyp_6-31g(d).nwchem.inp (generated) 000676796.b3lyp_6-31g(d).log.xz 000676796.td-b3lyp_6-31g+(d).inp 000676796.td-b3lyp_6-31g+(d).log.xz

000676796.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676796.td-b3lyp_6-31+g(d).gjf (generated)

000676796.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676796.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676796.mol 000676796.PUBCHEM 000676796.mol (via Jmol)
000676797.b3lyp_6-31g(d).inp

000676797.b3lyp_6-31g(d).qchem.inp (generated)

000676797.b3lyp_6-31g(d).gjf (generated)

000676797.b3lyp_6-31g(d).firefly.inp (generated)

000676797.b3lyp_6-31g(d).smash.inp (generated)

000676797.b3lyp_6-31g(d).nwchem.inp (generated) 000676797.b3lyp_6-31g(d).log.xz 000676797.td-b3lyp_6-31g+(d).inp 000676797.td-b3lyp_6-31g+(d).log.xz

000676797.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676797.td-b3lyp_6-31+g(d).gjf (generated)

000676797.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676797.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676797.mol 000676797.PUBCHEM 000676797.mol (via Jmol)
000676798.b3lyp_6-31g(d).inp

000676798.b3lyp_6-31g(d).qchem.inp (generated)

000676798.b3lyp_6-31g(d).gjf (generated)

000676798.b3lyp_6-31g(d).firefly.inp (generated)

000676798.b3lyp_6-31g(d).smash.inp (generated)

000676798.b3lyp_6-31g(d).nwchem.inp (generated) 000676798.b3lyp_6-31g(d).log.xz 000676798.td-b3lyp_6-31g+(d).inp 000676798.td-b3lyp_6-31g+(d).log.xz

000676798.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676798.td-b3lyp_6-31+g(d).gjf (generated)

000676798.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676798.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676798.mol 000676798.PUBCHEM 000676798.mol (via Jmol)
000676799.b3lyp_6-31g(d).inp

000676799.b3lyp_6-31g(d).qchem.inp (generated)

000676799.b3lyp_6-31g(d).gjf (generated)

000676799.b3lyp_6-31g(d).firefly.inp (generated)

000676799.b3lyp_6-31g(d).smash.inp (generated)

000676799.b3lyp_6-31g(d).nwchem.inp (generated) 000676799.b3lyp_6-31g(d).log.xz 000676799.td-b3lyp_6-31g+(d).inp 000676799.td-b3lyp_6-31g+(d).log.xz

000676799.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676799.td-b3lyp_6-31+g(d).gjf (generated)

000676799.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676799.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676799.mol 000676799.PUBCHEM 000676799.mol (via Jmol)
000676800.b3lyp_6-31g(d).inp

000676800.b3lyp_6-31g(d).qchem.inp (generated)

000676800.b3lyp_6-31g(d).gjf (generated)

000676800.b3lyp_6-31g(d).firefly.inp (generated)

000676800.b3lyp_6-31g(d).smash.inp (generated)

000676800.b3lyp_6-31g(d).nwchem.inp (generated) 000676800.b3lyp_6-31g(d).log.xz 000676800.td-b3lyp_6-31g+(d).inp 000676800.td-b3lyp_6-31g+(d).log.xz

000676800.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676800.td-b3lyp_6-31+g(d).gjf (generated)

000676800.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676800.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676800.mol 000676800.PUBCHEM 000676800.mol (via Jmol)
000676801.b3lyp_6-31g(d).inp

000676801.b3lyp_6-31g(d).qchem.inp (generated)

000676801.b3lyp_6-31g(d).gjf (generated)

000676801.b3lyp_6-31g(d).firefly.inp (generated)

000676801.b3lyp_6-31g(d).smash.inp (generated)

000676801.b3lyp_6-31g(d).nwchem.inp (generated) 000676801.b3lyp_6-31g(d).log.xz 000676801.td-b3lyp_6-31g+(d).inp 000676801.td-b3lyp_6-31g+(d).log.xz

000676801.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676801.td-b3lyp_6-31+g(d).gjf (generated)

000676801.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676801.mol 000676801.PUBCHEM 000676801.mol (via Jmol)
000676802.b3lyp_6-31g(d).inp

000676802.b3lyp_6-31g(d).qchem.inp (generated)

000676802.b3lyp_6-31g(d).gjf (generated)

000676802.b3lyp_6-31g(d).firefly.inp (generated)

000676802.b3lyp_6-31g(d).smash.inp (generated)

000676802.b3lyp_6-31g(d).nwchem.inp (generated) 000676802.b3lyp_6-31g(d).log.xz 000676802.td-b3lyp_6-31g+(d).inp 000676802.td-b3lyp_6-31g+(d).log.xz

000676802.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676802.td-b3lyp_6-31+g(d).gjf (generated)

000676802.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676802.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676802.mol 000676802.PUBCHEM 000676802.mol (via Jmol)
000676803.b3lyp_6-31g(d).inp

000676803.b3lyp_6-31g(d).qchem.inp (generated)

000676803.b3lyp_6-31g(d).gjf (generated)

000676803.b3lyp_6-31g(d).firefly.inp (generated)

000676803.b3lyp_6-31g(d).smash.inp (generated)

000676803.b3lyp_6-31g(d).nwchem.inp (generated) 000676803.b3lyp_6-31g(d).log.xz 000676803.mol 000676803.PUBCHEM 000676803.mol (via Jmol)
000676804.b3lyp_6-31g(d).inp

000676804.b3lyp_6-31g(d).qchem.inp (generated)

000676804.b3lyp_6-31g(d).gjf (generated)

000676804.b3lyp_6-31g(d).firefly.inp (generated)

000676804.b3lyp_6-31g(d).smash.inp (generated)

000676804.b3lyp_6-31g(d).nwchem.inp (generated) 000676804.b3lyp_6-31g(d).log.xz 000676804.mol 000676804.PUBCHEM 000676804.mol (via Jmol)
000676807.b3lyp_6-31g(d).inp

000676807.b3lyp_6-31g(d).qchem.inp (generated)

000676807.b3lyp_6-31g(d).gjf (generated)

000676807.b3lyp_6-31g(d).firefly.inp (generated)

000676807.b3lyp_6-31g(d).smash.inp (generated)

000676807.b3lyp_6-31g(d).nwchem.inp (generated) 000676807.b3lyp_6-31g(d).log.xz 000676807.td-b3lyp_6-31g+(d).inp 000676807.td-b3lyp_6-31g+(d).log.xz

000676807.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676807.td-b3lyp_6-31+g(d).gjf (generated)

000676807.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676807.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676807.mol 000676807.PUBCHEM 000676807.mol (via Jmol)
000676808.b3lyp_6-31g(d).inp

000676808.b3lyp_6-31g(d).qchem.inp (generated)

000676808.b3lyp_6-31g(d).gjf (generated)

000676808.b3lyp_6-31g(d).firefly.inp (generated)

000676808.b3lyp_6-31g(d).smash.inp (generated)

000676808.b3lyp_6-31g(d).nwchem.inp (generated) 000676808.b3lyp_6-31g(d).log.xz 000676808.td-b3lyp_6-31g+(d).inp 000676808.td-b3lyp_6-31g+(d).log.xz

000676808.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676808.td-b3lyp_6-31+g(d).gjf (generated)

000676808.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676808.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676808.mol 000676808.PUBCHEM 000676808.mol (via Jmol)
000676809.b3lyp_6-31g(d).inp

000676809.b3lyp_6-31g(d).qchem.inp (generated)

000676809.b3lyp_6-31g(d).gjf (generated)

000676809.b3lyp_6-31g(d).firefly.inp (generated)

000676809.b3lyp_6-31g(d).smash.inp (generated)

000676809.b3lyp_6-31g(d).nwchem.inp (generated) 000676809.b3lyp_6-31g(d).log.xz 000676809.td-b3lyp_6-31g+(d).inp 000676809.td-b3lyp_6-31g+(d).log.xz

000676809.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676809.td-b3lyp_6-31+g(d).gjf (generated)

000676809.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676809.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676809.mol 000676809.PUBCHEM 000676809.mol (via Jmol)
000676812.b3lyp_6-31g(d).inp

000676812.b3lyp_6-31g(d).qchem.inp (generated)

000676812.b3lyp_6-31g(d).gjf (generated)

000676812.b3lyp_6-31g(d).firefly.inp (generated)

000676812.b3lyp_6-31g(d).smash.inp (generated)

000676812.b3lyp_6-31g(d).nwchem.inp (generated) 000676812.b3lyp_6-31g(d).log.xz 000676812.td-b3lyp_6-31g+(d).inp 000676812.td-b3lyp_6-31g+(d).log.xz

000676812.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676812.td-b3lyp_6-31+g(d).gjf (generated)

000676812.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676812.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676812.mol 000676812.PUBCHEM 000676812.mol (via Jmol)
000676813.b3lyp_6-31g(d).inp

000676813.b3lyp_6-31g(d).qchem.inp (generated)

000676813.b3lyp_6-31g(d).gjf (generated)

000676813.b3lyp_6-31g(d).firefly.inp (generated)

000676813.b3lyp_6-31g(d).smash.inp (generated)

000676813.b3lyp_6-31g(d).nwchem.inp (generated) 000676813.b3lyp_6-31g(d).log.xz 000676813.mol 000676813.PUBCHEM 000676813.mol (via Jmol)
000676822.b3lyp_6-31g(d).inp

000676822.b3lyp_6-31g(d).qchem.inp (generated)

000676822.b3lyp_6-31g(d).gjf (generated)

000676822.b3lyp_6-31g(d).firefly.inp (generated)

000676822.b3lyp_6-31g(d).smash.inp (generated)

000676822.b3lyp_6-31g(d).nwchem.inp (generated) 000676822.b3lyp_6-31g(d).log.xz 000676822.td-b3lyp_6-31g+(d).inp 000676822.td-b3lyp_6-31g+(d).log.xz

000676822.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676822.td-b3lyp_6-31+g(d).gjf (generated)

000676822.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676822.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676822.mol 000676822.PUBCHEM 000676822.mol (via Jmol)
000676823.b3lyp_6-31g(d).inp

000676823.b3lyp_6-31g(d).qchem.inp (generated)

000676823.b3lyp_6-31g(d).gjf (generated)

000676823.b3lyp_6-31g(d).firefly.inp (generated)

000676823.b3lyp_6-31g(d).smash.inp (generated)

000676823.b3lyp_6-31g(d).nwchem.inp (generated) 000676823.b3lyp_6-31g(d).log.xz 000676823.td-b3lyp_6-31g+(d).inp 000676823.td-b3lyp_6-31g+(d).log.xz

000676823.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676823.td-b3lyp_6-31+g(d).gjf (generated)

000676823.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676823.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676823.mol 000676823.PUBCHEM 000676823.mol (via Jmol)
000676856.b3lyp_6-31g(d).inp

000676856.b3lyp_6-31g(d).qchem.inp (generated)

000676856.b3lyp_6-31g(d).gjf (generated)

000676856.b3lyp_6-31g(d).firefly.inp (generated)

000676856.b3lyp_6-31g(d).smash.inp (generated)

000676856.b3lyp_6-31g(d).nwchem.inp (generated) 000676856.b3lyp_6-31g(d).log.xz 000676856.td-b3lyp_6-31g+(d).inp 000676856.td-b3lyp_6-31g+(d).log.xz

000676856.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676856.td-b3lyp_6-31+g(d).gjf (generated)

000676856.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676856.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676856.mol 000676856.PUBCHEM 000676856.mol (via Jmol)
000676858.b3lyp_6-31g(d).inp

000676858.b3lyp_6-31g(d).qchem.inp (generated)

000676858.b3lyp_6-31g(d).gjf (generated)

000676858.b3lyp_6-31g(d).firefly.inp (generated)

000676858.b3lyp_6-31g(d).smash.inp (generated)

000676858.b3lyp_6-31g(d).nwchem.inp (generated) 000676858.b3lyp_6-31g(d).log.xz 000676858.mol 000676858.PUBCHEM 000676858.mol (via Jmol)
000676860.b3lyp_6-31g(d).inp

000676860.b3lyp_6-31g(d).qchem.inp (generated)

000676860.b3lyp_6-31g(d).gjf (generated)

000676860.b3lyp_6-31g(d).firefly.inp (generated)

000676860.b3lyp_6-31g(d).smash.inp (generated)

000676860.b3lyp_6-31g(d).nwchem.inp (generated) 000676860.b3lyp_6-31g(d).log.xz 000676860.mol 000676860.PUBCHEM 000676860.mol (via Jmol)
000676861.b3lyp_6-31g(d).inp

000676861.b3lyp_6-31g(d).qchem.inp (generated)

000676861.b3lyp_6-31g(d).gjf (generated)

000676861.b3lyp_6-31g(d).firefly.inp (generated)

000676861.b3lyp_6-31g(d).smash.inp (generated)

000676861.b3lyp_6-31g(d).nwchem.inp (generated) 000676861.b3lyp_6-31g(d).log.xz 000676861.td-b3lyp_6-31g+(d).inp 000676861.td-b3lyp_6-31g+(d).log.xz

000676861.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676861.td-b3lyp_6-31+g(d).gjf (generated)

000676861.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676861.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676861.mol 000676861.PUBCHEM 000676861.mol (via Jmol)
000676862.b3lyp_6-31g(d).inp

000676862.b3lyp_6-31g(d).qchem.inp (generated)

000676862.b3lyp_6-31g(d).gjf (generated)

000676862.b3lyp_6-31g(d).firefly.inp (generated)

000676862.b3lyp_6-31g(d).smash.inp (generated)

000676862.b3lyp_6-31g(d).nwchem.inp (generated) 000676862.b3lyp_6-31g(d).log.xz 000676862.td-b3lyp_6-31g+(d).inp 000676862.td-b3lyp_6-31g+(d).log.xz

000676862.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676862.td-b3lyp_6-31+g(d).gjf (generated)

000676862.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676862.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676862.mol 000676862.PUBCHEM 000676862.mol (via Jmol)
000676864.b3lyp_6-31g(d).inp

000676864.b3lyp_6-31g(d).qchem.inp (generated)

000676864.b3lyp_6-31g(d).gjf (generated)

000676864.b3lyp_6-31g(d).firefly.inp (generated)

000676864.b3lyp_6-31g(d).smash.inp (generated)

000676864.b3lyp_6-31g(d).nwchem.inp (generated) 000676864.b3lyp_6-31g(d).log.xz 000676864.td-b3lyp_6-31g+(d).inp 000676864.td-b3lyp_6-31g+(d).log.xz

000676864.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676864.td-b3lyp_6-31+g(d).gjf (generated)

000676864.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676864.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676864.mol 000676864.PUBCHEM 000676864.mol (via Jmol)
000676865.b3lyp_6-31g(d).inp

000676865.b3lyp_6-31g(d).qchem.inp (generated)

000676865.b3lyp_6-31g(d).gjf (generated)

000676865.b3lyp_6-31g(d).firefly.inp (generated)

000676865.b3lyp_6-31g(d).smash.inp (generated)

000676865.b3lyp_6-31g(d).nwchem.inp (generated) 000676865.b3lyp_6-31g(d).log.xz 000676865.td-b3lyp_6-31g+(d).inp 000676865.td-b3lyp_6-31g+(d).log.xz

000676865.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676865.td-b3lyp_6-31+g(d).gjf (generated)

000676865.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676865.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676865.mol 000676865.PUBCHEM 000676865.mol (via Jmol)
000676866.b3lyp_6-31g(d).inp

000676866.b3lyp_6-31g(d).qchem.inp (generated)

000676866.b3lyp_6-31g(d).gjf (generated)

000676866.b3lyp_6-31g(d).firefly.inp (generated)

000676866.b3lyp_6-31g(d).smash.inp (generated)

000676866.b3lyp_6-31g(d).nwchem.inp (generated) 000676866.b3lyp_6-31g(d).log.xz 000676866.td-b3lyp_6-31g+(d).inp 000676866.td-b3lyp_6-31g+(d).log.xz

000676866.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676866.td-b3lyp_6-31+g(d).gjf (generated)

000676866.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676866.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676866.mol 000676866.PUBCHEM 000676866.mol (via Jmol)
000676875.b3lyp_6-31g(d).inp

000676875.b3lyp_6-31g(d).qchem.inp (generated)

000676875.b3lyp_6-31g(d).gjf (generated)

000676875.b3lyp_6-31g(d).firefly.inp (generated)

000676875.b3lyp_6-31g(d).smash.inp (generated)

000676875.b3lyp_6-31g(d).nwchem.inp (generated) 000676875.b3lyp_6-31g(d).log.xz 000676875.td-b3lyp_6-31g+(d).inp 000676875.td-b3lyp_6-31g+(d).log.xz

000676875.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676875.td-b3lyp_6-31+g(d).gjf (generated)

000676875.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676875.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676875.mol 000676875.PUBCHEM 000676875.mol (via Jmol)
000676886.b3lyp_6-31g(d).inp

000676886.b3lyp_6-31g(d).qchem.inp (generated)

000676886.b3lyp_6-31g(d).gjf (generated)

000676886.b3lyp_6-31g(d).firefly.inp (generated)

000676886.b3lyp_6-31g(d).smash.inp (generated)

000676886.b3lyp_6-31g(d).nwchem.inp (generated) 000676886.b3lyp_6-31g(d).log.xz 000676886.td-b3lyp_6-31g+(d).inp 000676886.td-b3lyp_6-31g+(d).log.xz

000676886.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676886.td-b3lyp_6-31+g(d).gjf (generated)

000676886.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676886.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676886.mol 000676886.PUBCHEM 000676886.mol (via Jmol)
000676888.b3lyp_6-31g(d).inp

000676888.b3lyp_6-31g(d).qchem.inp (generated)

000676888.b3lyp_6-31g(d).gjf (generated)

000676888.b3lyp_6-31g(d).firefly.inp (generated)

000676888.b3lyp_6-31g(d).smash.inp (generated)

000676888.b3lyp_6-31g(d).nwchem.inp (generated) 000676888.b3lyp_6-31g(d).log.xz 000676888.td-b3lyp_6-31g+(d).inp 000676888.td-b3lyp_6-31g+(d).log.xz

000676888.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676888.td-b3lyp_6-31+g(d).gjf (generated)

000676888.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676888.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676888.mol 000676888.PUBCHEM 000676888.mol (via Jmol)
000676890.b3lyp_6-31g(d).inp

000676890.b3lyp_6-31g(d).qchem.inp (generated)

000676890.b3lyp_6-31g(d).gjf (generated)

000676890.b3lyp_6-31g(d).firefly.inp (generated)

000676890.b3lyp_6-31g(d).smash.inp (generated)

000676890.b3lyp_6-31g(d).nwchem.inp (generated) 000676890.b3lyp_6-31g(d).log.xz 000676890.td-b3lyp_6-31g+(d).inp 000676890.td-b3lyp_6-31g+(d).log.xz

000676890.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676890.td-b3lyp_6-31+g(d).gjf (generated)

000676890.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676890.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676890.mol 000676890.PUBCHEM 000676890.mol (via Jmol)
000676892.b3lyp_6-31g(d).inp

000676892.b3lyp_6-31g(d).qchem.inp (generated)

000676892.b3lyp_6-31g(d).gjf (generated)

000676892.b3lyp_6-31g(d).firefly.inp (generated)

000676892.b3lyp_6-31g(d).smash.inp (generated)

000676892.b3lyp_6-31g(d).nwchem.inp (generated) 000676892.b3lyp_6-31g(d).log.xz 000676892.td-b3lyp_6-31g+(d).inp 000676892.td-b3lyp_6-31g+(d).log.xz

000676892.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676892.td-b3lyp_6-31+g(d).gjf (generated)

000676892.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676892.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676892.mol 000676892.PUBCHEM 000676892.mol (via Jmol)
000676899.b3lyp_6-31g(d).inp

000676899.b3lyp_6-31g(d).qchem.inp (generated)

000676899.b3lyp_6-31g(d).gjf (generated)

000676899.b3lyp_6-31g(d).firefly.inp (generated)

000676899.b3lyp_6-31g(d).smash.inp (generated)

000676899.b3lyp_6-31g(d).nwchem.inp (generated) 000676899.b3lyp_6-31g(d).log.xz 000676899.td-b3lyp_6-31g+(d).inp 000676899.td-b3lyp_6-31g+(d).log.xz

000676899.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676899.td-b3lyp_6-31+g(d).gjf (generated)

000676899.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676899.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676899.mol 000676899.PUBCHEM 000676899.mol (via Jmol)
000676903.b3lyp_6-31g(d).inp

000676903.b3lyp_6-31g(d).qchem.inp (generated)

000676903.b3lyp_6-31g(d).gjf (generated)

000676903.b3lyp_6-31g(d).firefly.inp (generated)

000676903.b3lyp_6-31g(d).smash.inp (generated)

000676903.b3lyp_6-31g(d).nwchem.inp (generated) 000676903.b3lyp_6-31g(d).log.xz 000676903.mol 000676903.PUBCHEM 000676903.mol (via Jmol)
000676906.b3lyp_6-31g(d).inp

000676906.b3lyp_6-31g(d).qchem.inp (generated)

000676906.b3lyp_6-31g(d).gjf (generated)

000676906.b3lyp_6-31g(d).firefly.inp (generated)

000676906.b3lyp_6-31g(d).smash.inp (generated)

000676906.b3lyp_6-31g(d).nwchem.inp (generated) 000676906.b3lyp_6-31g(d).log.xz 000676906.td-b3lyp_6-31g+(d).inp 000676906.td-b3lyp_6-31g+(d).log.xz

000676906.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676906.td-b3lyp_6-31+g(d).gjf (generated)

000676906.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676906.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676906.mol 000676906.PUBCHEM 000676906.mol (via Jmol)
000676907.b3lyp_6-31g(d).inp

000676907.b3lyp_6-31g(d).qchem.inp (generated)

000676907.b3lyp_6-31g(d).gjf (generated)

000676907.b3lyp_6-31g(d).firefly.inp (generated)

000676907.b3lyp_6-31g(d).smash.inp (generated)

000676907.b3lyp_6-31g(d).nwchem.inp (generated) 000676907.b3lyp_6-31g(d).log.xz 000676907.td-b3lyp_6-31g+(d).inp 000676907.td-b3lyp_6-31g+(d).log.xz

000676907.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676907.td-b3lyp_6-31+g(d).gjf (generated)

000676907.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676907.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676907.mol 000676907.PUBCHEM 000676907.mol (via Jmol)
000676908.b3lyp_6-31g(d).inp

000676908.b3lyp_6-31g(d).qchem.inp (generated)

000676908.b3lyp_6-31g(d).gjf (generated)

000676908.b3lyp_6-31g(d).firefly.inp (generated)

000676908.b3lyp_6-31g(d).smash.inp (generated)

000676908.b3lyp_6-31g(d).nwchem.inp (generated) 000676908.b3lyp_6-31g(d).log.xz 000676908.td-b3lyp_6-31g+(d).inp 000676908.td-b3lyp_6-31g+(d).log.xz

000676908.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676908.td-b3lyp_6-31+g(d).gjf (generated)

000676908.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676908.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676908.mol 000676908.PUBCHEM 000676908.mol (via Jmol)
000676909.b3lyp_6-31g(d).inp

000676909.b3lyp_6-31g(d).qchem.inp (generated)

000676909.b3lyp_6-31g(d).gjf (generated)

000676909.b3lyp_6-31g(d).firefly.inp (generated)

000676909.b3lyp_6-31g(d).smash.inp (generated)

000676909.b3lyp_6-31g(d).nwchem.inp (generated) 000676909.b3lyp_6-31g(d).log.xz 000676909.td-b3lyp_6-31g+(d).inp 000676909.td-b3lyp_6-31g+(d).log.xz

000676909.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676909.td-b3lyp_6-31+g(d).gjf (generated)

000676909.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676909.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676909.mol 000676909.PUBCHEM 000676909.mol (via Jmol)
000676910.b3lyp_6-31g(d).inp

000676910.b3lyp_6-31g(d).qchem.inp (generated)

000676910.b3lyp_6-31g(d).gjf (generated)

000676910.b3lyp_6-31g(d).firefly.inp (generated)

000676910.b3lyp_6-31g(d).smash.inp (generated)

000676910.b3lyp_6-31g(d).nwchem.inp (generated) 000676910.b3lyp_6-31g(d).log.xz 000676910.td-b3lyp_6-31g+(d).inp 000676910.td-b3lyp_6-31g+(d).log.xz

000676910.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676910.td-b3lyp_6-31+g(d).gjf (generated)

000676910.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676910.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676910.mol 000676910.PUBCHEM 000676910.mol (via Jmol)
000676911.b3lyp_6-31g(d).inp

000676911.b3lyp_6-31g(d).qchem.inp (generated)

000676911.b3lyp_6-31g(d).gjf (generated)

000676911.b3lyp_6-31g(d).firefly.inp (generated)

000676911.b3lyp_6-31g(d).smash.inp (generated)

000676911.b3lyp_6-31g(d).nwchem.inp (generated) 000676911.b3lyp_6-31g(d).log.xz 000676911.td-b3lyp_6-31g+(d).inp 000676911.td-b3lyp_6-31g+(d).log.xz

000676911.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676911.td-b3lyp_6-31+g(d).gjf (generated)

000676911.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676911.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676911.mol 000676911.PUBCHEM 000676911.mol (via Jmol)
000676912.b3lyp_6-31g(d).inp

000676912.b3lyp_6-31g(d).qchem.inp (generated)

000676912.b3lyp_6-31g(d).gjf (generated)

000676912.b3lyp_6-31g(d).firefly.inp (generated)

000676912.b3lyp_6-31g(d).smash.inp (generated)

000676912.b3lyp_6-31g(d).nwchem.inp (generated) 000676912.b3lyp_6-31g(d).log.xz 000676912.td-b3lyp_6-31g+(d).inp 000676912.td-b3lyp_6-31g+(d).log.xz

000676912.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676912.td-b3lyp_6-31+g(d).gjf (generated)

000676912.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676912.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676912.mol 000676912.PUBCHEM 000676912.mol (via Jmol)
000676913.b3lyp_6-31g(d).inp

000676913.b3lyp_6-31g(d).qchem.inp (generated)

000676913.b3lyp_6-31g(d).gjf (generated)

000676913.b3lyp_6-31g(d).firefly.inp (generated)

000676913.b3lyp_6-31g(d).smash.inp (generated)

000676913.b3lyp_6-31g(d).nwchem.inp (generated) 000676913.b3lyp_6-31g(d).log.xz 000676913.td-b3lyp_6-31g+(d).inp 000676913.td-b3lyp_6-31g+(d).log.xz

000676913.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676913.td-b3lyp_6-31+g(d).gjf (generated)

000676913.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676913.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676913.mol 000676913.PUBCHEM 000676913.mol (via Jmol)
000676919.b3lyp_6-31g(d).inp

000676919.b3lyp_6-31g(d).qchem.inp (generated)

000676919.b3lyp_6-31g(d).gjf (generated)

000676919.b3lyp_6-31g(d).firefly.inp (generated)

000676919.b3lyp_6-31g(d).smash.inp (generated)

000676919.b3lyp_6-31g(d).nwchem.inp (generated) 000676919.b3lyp_6-31g(d).log.xz 000676919.td-b3lyp_6-31g+(d).inp 000676919.td-b3lyp_6-31g+(d).log.xz

000676919.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676919.td-b3lyp_6-31+g(d).gjf (generated)

000676919.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676919.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676919.mol 000676919.PUBCHEM 000676919.mol (via Jmol)
000676920.b3lyp_6-31g(d).inp

000676920.b3lyp_6-31g(d).qchem.inp (generated)

000676920.b3lyp_6-31g(d).gjf (generated)

000676920.b3lyp_6-31g(d).firefly.inp (generated)

000676920.b3lyp_6-31g(d).smash.inp (generated)

000676920.b3lyp_6-31g(d).nwchem.inp (generated) 000676920.b3lyp_6-31g(d).log.xz 000676920.td-b3lyp_6-31g+(d).inp 000676920.td-b3lyp_6-31g+(d).log.xz

000676920.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676920.td-b3lyp_6-31+g(d).gjf (generated)

000676920.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676920.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676920.mol 000676920.PUBCHEM 000676920.mol (via Jmol)
000676921.b3lyp_6-31g(d).inp

000676921.b3lyp_6-31g(d).qchem.inp (generated)

000676921.b3lyp_6-31g(d).gjf (generated)

000676921.b3lyp_6-31g(d).firefly.inp (generated)

000676921.b3lyp_6-31g(d).smash.inp (generated)

000676921.b3lyp_6-31g(d).nwchem.inp (generated) 000676921.b3lyp_6-31g(d).log.xz 000676921.td-b3lyp_6-31g+(d).inp 000676921.td-b3lyp_6-31g+(d).log.xz

000676921.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676921.td-b3lyp_6-31+g(d).gjf (generated)

000676921.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676921.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676921.mol 000676921.PUBCHEM 000676921.mol (via Jmol)
000676926.b3lyp_6-31g(d).inp

000676926.b3lyp_6-31g(d).qchem.inp (generated)

000676926.b3lyp_6-31g(d).gjf (generated)

000676926.b3lyp_6-31g(d).firefly.inp (generated)

000676926.b3lyp_6-31g(d).smash.inp (generated)

000676926.b3lyp_6-31g(d).nwchem.inp (generated) 000676926.b3lyp_6-31g(d).log.xz 000676926.td-b3lyp_6-31g+(d).inp 000676926.td-b3lyp_6-31g+(d).log.xz

000676926.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676926.td-b3lyp_6-31+g(d).gjf (generated)

000676926.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676926.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676926.mol 000676926.PUBCHEM 000676926.mol (via Jmol)
000676927.b3lyp_6-31g(d).inp

000676927.b3lyp_6-31g(d).qchem.inp (generated)

000676927.b3lyp_6-31g(d).gjf (generated)

000676927.b3lyp_6-31g(d).firefly.inp (generated)

000676927.b3lyp_6-31g(d).smash.inp (generated)

000676927.b3lyp_6-31g(d).nwchem.inp (generated) 000676927.b3lyp_6-31g(d).log.xz 000676927.td-b3lyp_6-31g+(d).inp 000676927.td-b3lyp_6-31g+(d).log.xz

000676927.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676927.td-b3lyp_6-31+g(d).gjf (generated)

000676927.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676927.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676927.mol 000676927.PUBCHEM 000676927.mol (via Jmol)
000676930.b3lyp_6-31g(d).inp

000676930.b3lyp_6-31g(d).qchem.inp (generated)

000676930.b3lyp_6-31g(d).gjf (generated)

000676930.b3lyp_6-31g(d).firefly.inp (generated)

000676930.b3lyp_6-31g(d).smash.inp (generated)

000676930.b3lyp_6-31g(d).nwchem.inp (generated) 000676930.b3lyp_6-31g(d).log.xz 000676930.td-b3lyp_6-31g+(d).inp 000676930.td-b3lyp_6-31g+(d).log.xz

000676930.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676930.td-b3lyp_6-31+g(d).gjf (generated)

000676930.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676930.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676930.mol 000676930.PUBCHEM 000676930.mol (via Jmol)
000676931.b3lyp_6-31g(d).inp

000676931.b3lyp_6-31g(d).qchem.inp (generated)

000676931.b3lyp_6-31g(d).gjf (generated)

000676931.b3lyp_6-31g(d).firefly.inp (generated)

000676931.b3lyp_6-31g(d).smash.inp (generated)

000676931.b3lyp_6-31g(d).nwchem.inp (generated) 000676931.b3lyp_6-31g(d).log.xz 000676931.td-b3lyp_6-31g+(d).inp 000676931.td-b3lyp_6-31g+(d).log.xz

000676931.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676931.td-b3lyp_6-31+g(d).gjf (generated)

000676931.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676931.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676931.mol 000676931.PUBCHEM 000676931.mol (via Jmol)
000676936.b3lyp_6-31g(d).inp

000676936.b3lyp_6-31g(d).qchem.inp (generated)

000676936.b3lyp_6-31g(d).gjf (generated)

000676936.b3lyp_6-31g(d).firefly.inp (generated)

000676936.b3lyp_6-31g(d).smash.inp (generated)

000676936.b3lyp_6-31g(d).nwchem.inp (generated) 000676936.b3lyp_6-31g(d).log.xz 000676936.mol 000676936.PUBCHEM 000676936.mol (via Jmol)
000676939.b3lyp_6-31g(d).inp

000676939.b3lyp_6-31g(d).qchem.inp (generated)

000676939.b3lyp_6-31g(d).gjf (generated)

000676939.b3lyp_6-31g(d).firefly.inp (generated)

000676939.b3lyp_6-31g(d).smash.inp (generated)

000676939.b3lyp_6-31g(d).nwchem.inp (generated) 000676939.b3lyp_6-31g(d).log.xz 000676939.mol 000676939.PUBCHEM 000676939.mol (via Jmol)
000676940.b3lyp_6-31g(d).inp

000676940.b3lyp_6-31g(d).qchem.inp (generated)

000676940.b3lyp_6-31g(d).gjf (generated)

000676940.b3lyp_6-31g(d).firefly.inp (generated)

000676940.b3lyp_6-31g(d).smash.inp (generated)

000676940.b3lyp_6-31g(d).nwchem.inp (generated) 000676940.b3lyp_6-31g(d).log.xz 000676940.td-b3lyp_6-31g+(d).inp 000676940.td-b3lyp_6-31g+(d).log.xz

000676940.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676940.td-b3lyp_6-31+g(d).gjf (generated)

000676940.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676940.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676940.mol 000676940.PUBCHEM 000676940.mol (via Jmol)
000676942.b3lyp_6-31g(d).inp

000676942.b3lyp_6-31g(d).qchem.inp (generated)

000676942.b3lyp_6-31g(d).gjf (generated)

000676942.b3lyp_6-31g(d).firefly.inp (generated)

000676942.b3lyp_6-31g(d).smash.inp (generated)

000676942.b3lyp_6-31g(d).nwchem.inp (generated) 000676942.b3lyp_6-31g(d).log.xz 000676942.mol 000676942.PUBCHEM 000676942.mol (via Jmol)
000676943.b3lyp_6-31g(d).inp

000676943.b3lyp_6-31g(d).qchem.inp (generated)

000676943.b3lyp_6-31g(d).gjf (generated)

000676943.b3lyp_6-31g(d).firefly.inp (generated)

000676943.b3lyp_6-31g(d).smash.inp (generated)

000676943.b3lyp_6-31g(d).nwchem.inp (generated) 000676943.b3lyp_6-31g(d).log.xz 000676943.mol 000676943.PUBCHEM 000676943.mol (via Jmol)
000676944.b3lyp_6-31g(d).inp

000676944.b3lyp_6-31g(d).qchem.inp (generated)

000676944.b3lyp_6-31g(d).gjf (generated)

000676944.b3lyp_6-31g(d).firefly.inp (generated)

000676944.b3lyp_6-31g(d).smash.inp (generated)

000676944.b3lyp_6-31g(d).nwchem.inp (generated) 000676944.b3lyp_6-31g(d).log.xz 000676944.td-b3lyp_6-31g+(d).inp 000676944.td-b3lyp_6-31g+(d).log.xz

000676944.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676944.td-b3lyp_6-31+g(d).gjf (generated)

000676944.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676944.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676944.mol 000676944.PUBCHEM 000676944.mol (via Jmol)
000676945.b3lyp_6-31g(d).inp

000676945.b3lyp_6-31g(d).qchem.inp (generated)

000676945.b3lyp_6-31g(d).gjf (generated)

000676945.b3lyp_6-31g(d).firefly.inp (generated)

000676945.b3lyp_6-31g(d).smash.inp (generated)

000676945.b3lyp_6-31g(d).nwchem.inp (generated) 000676945.b3lyp_6-31g(d).log.xz 000676945.td-b3lyp_6-31g+(d).inp 000676945.td-b3lyp_6-31g+(d).log.xz

000676945.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676945.td-b3lyp_6-31+g(d).gjf (generated)

000676945.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676945.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676945.mol 000676945.PUBCHEM 000676945.mol (via Jmol)
000676950.b3lyp_6-31g(d).inp

000676950.b3lyp_6-31g(d).qchem.inp (generated)

000676950.b3lyp_6-31g(d).gjf (generated)

000676950.b3lyp_6-31g(d).firefly.inp (generated)

000676950.b3lyp_6-31g(d).smash.inp (generated)

000676950.b3lyp_6-31g(d).nwchem.inp (generated) 000676950.b3lyp_6-31g(d).log.xz 000676950.td-b3lyp_6-31g+(d).inp 000676950.td-b3lyp_6-31g+(d).log.xz

000676950.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676950.td-b3lyp_6-31+g(d).gjf (generated)

000676950.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676950.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676950.mol 000676950.PUBCHEM 000676950.mol (via Jmol)
000676953.b3lyp_6-31g(d).inp

000676953.b3lyp_6-31g(d).qchem.inp (generated)

000676953.b3lyp_6-31g(d).gjf (generated)

000676953.b3lyp_6-31g(d).firefly.inp (generated)

000676953.b3lyp_6-31g(d).smash.inp (generated)

000676953.b3lyp_6-31g(d).nwchem.inp (generated) 000676953.b3lyp_6-31g(d).log.xz 000676953.td-b3lyp_6-31g+(d).inp 000676953.td-b3lyp_6-31g+(d).log.xz

000676953.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676953.td-b3lyp_6-31+g(d).gjf (generated)

000676953.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676953.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676953.mol 000676953.PUBCHEM 000676953.mol (via Jmol)
000676954.b3lyp_6-31g(d).inp

000676954.b3lyp_6-31g(d).qchem.inp (generated)

000676954.b3lyp_6-31g(d).gjf (generated)

000676954.b3lyp_6-31g(d).firefly.inp (generated)

000676954.b3lyp_6-31g(d).smash.inp (generated)

000676954.b3lyp_6-31g(d).nwchem.inp (generated) 000676954.b3lyp_6-31g(d).log.xz 000676954.mol 000676954.PUBCHEM 000676954.mol (via Jmol)
000676955.b3lyp_6-31g(d).inp

000676955.b3lyp_6-31g(d).qchem.inp (generated)

000676955.b3lyp_6-31g(d).gjf (generated)

000676955.b3lyp_6-31g(d).firefly.inp (generated)

000676955.b3lyp_6-31g(d).smash.inp (generated)

000676955.b3lyp_6-31g(d).nwchem.inp (generated) 000676955.b3lyp_6-31g(d).log.xz 000676955.mol 000676955.PUBCHEM 000676955.mol (via Jmol)
000676956.b3lyp_6-31g(d).inp

000676956.b3lyp_6-31g(d).qchem.inp (generated)

000676956.b3lyp_6-31g(d).gjf (generated)

000676956.b3lyp_6-31g(d).firefly.inp (generated)

000676956.b3lyp_6-31g(d).smash.inp (generated)

000676956.b3lyp_6-31g(d).nwchem.inp (generated) 000676956.b3lyp_6-31g(d).log.xz 000676956.mol 000676956.PUBCHEM 000676956.mol (via Jmol)
000676957.b3lyp_6-31g(d).inp

000676957.b3lyp_6-31g(d).qchem.inp (generated)

000676957.b3lyp_6-31g(d).gjf (generated)

000676957.b3lyp_6-31g(d).firefly.inp (generated)

000676957.b3lyp_6-31g(d).smash.inp (generated)

000676957.b3lyp_6-31g(d).nwchem.inp (generated) 000676957.b3lyp_6-31g(d).log.xz 000676957.mol 000676957.PUBCHEM 000676957.mol (via Jmol)
000676958.b3lyp_6-31g(d).inp

000676958.b3lyp_6-31g(d).qchem.inp (generated)

000676958.b3lyp_6-31g(d).gjf (generated)

000676958.b3lyp_6-31g(d).firefly.inp (generated)

000676958.b3lyp_6-31g(d).smash.inp (generated)

000676958.b3lyp_6-31g(d).nwchem.inp (generated) 000676958.b3lyp_6-31g(d).log.xz 000676958.mol 000676958.PUBCHEM 000676958.mol (via Jmol)
000676959.b3lyp_6-31g(d).inp

000676959.b3lyp_6-31g(d).qchem.inp (generated)

000676959.b3lyp_6-31g(d).gjf (generated)

000676959.b3lyp_6-31g(d).firefly.inp (generated)

000676959.b3lyp_6-31g(d).smash.inp (generated)

000676959.b3lyp_6-31g(d).nwchem.inp (generated) 000676959.b3lyp_6-31g(d).log.xz 000676959.mol 000676959.PUBCHEM 000676959.mol (via Jmol)
000676962.b3lyp_6-31g(d).inp

000676962.b3lyp_6-31g(d).qchem.inp (generated)

000676962.b3lyp_6-31g(d).gjf (generated)

000676962.b3lyp_6-31g(d).firefly.inp (generated)

000676962.b3lyp_6-31g(d).smash.inp (generated)

000676962.b3lyp_6-31g(d).nwchem.inp (generated) 000676962.b3lyp_6-31g(d).log.xz 000676962.td-b3lyp_6-31g+(d).inp 000676962.td-b3lyp_6-31g+(d).log.xz

000676962.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676962.td-b3lyp_6-31+g(d).gjf (generated)

000676962.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676962.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676962.mol 000676962.PUBCHEM 000676962.mol (via Jmol)
000676963.b3lyp_6-31g(d).inp

000676963.b3lyp_6-31g(d).qchem.inp (generated)

000676963.b3lyp_6-31g(d).gjf (generated)

000676963.b3lyp_6-31g(d).firefly.inp (generated)

000676963.b3lyp_6-31g(d).smash.inp (generated)

000676963.b3lyp_6-31g(d).nwchem.inp (generated) 000676963.b3lyp_6-31g(d).log.xz 000676963.td-b3lyp_6-31g+(d).inp 000676963.td-b3lyp_6-31g+(d).log.xz

000676963.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676963.td-b3lyp_6-31+g(d).gjf (generated)

000676963.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676963.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676963.mol 000676963.PUBCHEM 000676963.mol (via Jmol)
000676965.b3lyp_6-31g(d).inp

000676965.b3lyp_6-31g(d).qchem.inp (generated)

000676965.b3lyp_6-31g(d).gjf (generated)

000676965.b3lyp_6-31g(d).firefly.inp (generated)

000676965.b3lyp_6-31g(d).smash.inp (generated)

000676965.b3lyp_6-31g(d).nwchem.inp (generated) 000676965.b3lyp_6-31g(d).log.xz 000676965.td-b3lyp_6-31g+(d).inp 000676965.td-b3lyp_6-31g+(d).log.xz

000676965.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676965.td-b3lyp_6-31+g(d).gjf (generated)

000676965.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676965.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676965.mol 000676965.PUBCHEM 000676965.mol (via Jmol)
000676967.b3lyp_6-31g(d).inp

000676967.b3lyp_6-31g(d).qchem.inp (generated)

000676967.b3lyp_6-31g(d).gjf (generated)

000676967.b3lyp_6-31g(d).firefly.inp (generated)

000676967.b3lyp_6-31g(d).smash.inp (generated)

000676967.b3lyp_6-31g(d).nwchem.inp (generated) 000676967.b3lyp_6-31g(d).log.xz 000676967.td-b3lyp_6-31g+(d).inp 000676967.td-b3lyp_6-31g+(d).log.xz

000676967.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676967.td-b3lyp_6-31+g(d).gjf (generated)

000676967.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676967.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676967.mol 000676967.PUBCHEM 000676967.mol (via Jmol)
000676971.b3lyp_6-31g(d).inp

000676971.b3lyp_6-31g(d).qchem.inp (generated)

000676971.b3lyp_6-31g(d).gjf (generated)

000676971.b3lyp_6-31g(d).firefly.inp (generated)

000676971.b3lyp_6-31g(d).smash.inp (generated)

000676971.b3lyp_6-31g(d).nwchem.inp (generated) 000676971.b3lyp_6-31g(d).log.xz 000676971.mol 000676971.PUBCHEM 000676971.mol (via Jmol)
000676979.b3lyp_6-31g(d).inp

000676979.b3lyp_6-31g(d).qchem.inp (generated)

000676979.b3lyp_6-31g(d).gjf (generated)

000676979.b3lyp_6-31g(d).firefly.inp (generated)

000676979.b3lyp_6-31g(d).smash.inp (generated)

000676979.b3lyp_6-31g(d).nwchem.inp (generated) 000676979.b3lyp_6-31g(d).log.xz 000676979.td-b3lyp_6-31g+(d).inp 000676979.td-b3lyp_6-31g+(d).log.xz

000676979.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676979.td-b3lyp_6-31+g(d).gjf (generated)

000676979.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676979.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676979.mol 000676979.PUBCHEM 000676979.mol (via Jmol)
000676980.b3lyp_6-31g(d).inp

000676980.b3lyp_6-31g(d).qchem.inp (generated)

000676980.b3lyp_6-31g(d).gjf (generated)

000676980.b3lyp_6-31g(d).firefly.inp (generated)

000676980.b3lyp_6-31g(d).smash.inp (generated)

000676980.b3lyp_6-31g(d).nwchem.inp (generated) 000676980.b3lyp_6-31g(d).log.xz 000676980.td-b3lyp_6-31g+(d).inp 000676980.td-b3lyp_6-31g+(d).log.xz

000676980.td-b3lyp_6-31+g(d).qchem.inp (generated)

000676980.td-b3lyp_6-31+g(d).gjf (generated)

000676980.td-b3lyp_6-31+g(d).firefly.inp (generated)

000676980.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000676980.mol 000676980.PUBCHEM 000676980.mol (via Jmol)
000676981.b3lyp_6-31g(d).inp

000676981.b3lyp_6-31g(d).qchem.inp (generated)

000676981.b3lyp_6-31g(d).gjf (generated)

000676981.b3lyp_6-31g(d).firefly.inp (generated)

000676981.b3lyp_6-31g(d).smash.inp (generated)

000676981.b3lyp_6-31g(d).nwchem.inp (generated) 000676981.b3lyp_6-31g(d).log.xz 000676981.mol 000676981.PUBCHEM 000676981.mol (via Jmol)
000676982.b3lyp_6-31g(d).inp

000676982.b3lyp_6-31g(d).qchem.inp (generated)

000676982.b3lyp_6-31g(d).gjf (generated)

000676982.b3lyp_6-31g(d).firefly.inp (generated)

000676982.b3lyp_6-31g(d).smash.inp (generated)

000676982.b3lyp_6-31g(d).nwchem.inp (generated) 000676982.b3lyp_6-31g(d).log.xz 000676982.mol 000676982.PUBCHEM 000676982.mol (via Jmol)
000676983.b3lyp_6-31g(d).inp

000676983.b3lyp_6-31g(d).qchem.inp (generated)

000676983.b3lyp_6-31g(d).gjf (generated)

000676983.b3lyp_6-31g(d).firefly.inp (generated)

000676983.b3lyp_6-31g(d).smash.inp (generated)

000676983.b3lyp_6-31g(d).nwchem.inp (generated) 000676983.b3lyp_6-31g(d).log.xz 000676983.mol 000676983.PUBCHEM 000676983.mol (via Jmol)
000676996.b3lyp_6-31g(d).inp

000676996.b3lyp_6-31g(d).qchem.inp (generated)

000676996.b3lyp_6-31g(d).gjf (generated)

000676996.b3lyp_6-31g(d).firefly.inp (generated)

000676996.b3lyp_6-31g(d).smash.inp (generated)

000676996.b3lyp_6-31g(d).nwchem.inp (generated) 000676996.b3lyp_6-31g(d).log.xz 000676996.mol 000676996.PUBCHEM 000676996.mol (via Jmol)
000676997.b3lyp_6-31g(d).inp

000676997.b3lyp_6-31g(d).qchem.inp (generated)

000676997.b3lyp_6-31g(d).gjf (generated)

000676997.b3lyp_6-31g(d).firefly.inp (generated)

000676997.b3lyp_6-31g(d).smash.inp (generated)

000676997.b3lyp_6-31g(d).nwchem.inp (generated) 000676997.b3lyp_6-31g(d).log.xz 000676997.mol 000676997.PUBCHEM 000676997.mol (via Jmol)
000677002.b3lyp_6-31g(d).inp

000677002.b3lyp_6-31g(d).qchem.inp (generated)

000677002.b3lyp_6-31g(d).gjf (generated)

000677002.b3lyp_6-31g(d).firefly.inp (generated)

000677002.b3lyp_6-31g(d).smash.inp (generated)

000677002.b3lyp_6-31g(d).nwchem.inp (generated) 000677002.b3lyp_6-31g(d).log.xz 000677002.td-b3lyp_6-31g+(d).inp 000677002.td-b3lyp_6-31g+(d).log.xz

000677002.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677002.td-b3lyp_6-31+g(d).gjf (generated)

000677002.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677002.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677002.mol 000677002.PUBCHEM 000677002.mol (via Jmol)
000677017.b3lyp_6-31g(d).inp

000677017.b3lyp_6-31g(d).qchem.inp (generated)

000677017.b3lyp_6-31g(d).gjf (generated)

000677017.b3lyp_6-31g(d).firefly.inp (generated)

000677017.b3lyp_6-31g(d).smash.inp (generated)

000677017.b3lyp_6-31g(d).nwchem.inp (generated) 000677017.b3lyp_6-31g(d).log.xz 000677017.mol 000677017.PUBCHEM 000677017.mol (via Jmol)
000677018.b3lyp_6-31g(d).inp

000677018.b3lyp_6-31g(d).qchem.inp (generated)

000677018.b3lyp_6-31g(d).gjf (generated)

000677018.b3lyp_6-31g(d).firefly.inp (generated)

000677018.b3lyp_6-31g(d).smash.inp (generated)

000677018.b3lyp_6-31g(d).nwchem.inp (generated) 000677018.b3lyp_6-31g(d).log.xz 000677018.td-b3lyp_6-31g+(d).inp 000677018.td-b3lyp_6-31g+(d).log.xz

000677018.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677018.td-b3lyp_6-31+g(d).gjf (generated)

000677018.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677018.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677018.mol 000677018.PUBCHEM 000677018.mol (via Jmol)
000677021.b3lyp_6-31g(d).inp

000677021.b3lyp_6-31g(d).qchem.inp (generated)

000677021.b3lyp_6-31g(d).gjf (generated)

000677021.b3lyp_6-31g(d).firefly.inp (generated)

000677021.b3lyp_6-31g(d).smash.inp (generated)

000677021.b3lyp_6-31g(d).nwchem.inp (generated) 000677021.b3lyp_6-31g(d).log.xz 000677021.mol 000677021.PUBCHEM 000677021.mol (via Jmol)
000677022.b3lyp_6-31g(d).inp

000677022.b3lyp_6-31g(d).qchem.inp (generated)

000677022.b3lyp_6-31g(d).gjf (generated)

000677022.b3lyp_6-31g(d).firefly.inp (generated)

000677022.b3lyp_6-31g(d).smash.inp (generated)

000677022.b3lyp_6-31g(d).nwchem.inp (generated) 000677022.b3lyp_6-31g(d).log.xz 000677022.td-b3lyp_6-31g+(d).inp 000677022.td-b3lyp_6-31g+(d).log.xz

000677022.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677022.td-b3lyp_6-31+g(d).gjf (generated)

000677022.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677022.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677022.mol 000677022.PUBCHEM 000677022.mol (via Jmol)
000677025.b3lyp_6-31g(d).inp

000677025.b3lyp_6-31g(d).qchem.inp (generated)

000677025.b3lyp_6-31g(d).gjf (generated)

000677025.b3lyp_6-31g(d).firefly.inp (generated)

000677025.b3lyp_6-31g(d).smash.inp (generated)

000677025.b3lyp_6-31g(d).nwchem.inp (generated) 000677025.b3lyp_6-31g(d).log.xz 000677025.td-b3lyp_6-31g+(d).inp 000677025.td-b3lyp_6-31g+(d).log.xz

000677025.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677025.td-b3lyp_6-31+g(d).gjf (generated)

000677025.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677025.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677025.mol 000677025.PUBCHEM 000677025.mol (via Jmol)
000677035.b3lyp_6-31g(d).inp

000677035.b3lyp_6-31g(d).qchem.inp (generated)

000677035.b3lyp_6-31g(d).gjf (generated)

000677035.b3lyp_6-31g(d).firefly.inp (generated)

000677035.b3lyp_6-31g(d).smash.inp (generated)

000677035.b3lyp_6-31g(d).nwchem.inp (generated) 000677035.b3lyp_6-31g(d).log.xz 000677035.td-b3lyp_6-31g+(d).inp 000677035.td-b3lyp_6-31g+(d).log.xz

000677035.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677035.td-b3lyp_6-31+g(d).gjf (generated)

000677035.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677035.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677035.mol 000677035.PUBCHEM 000677035.mol (via Jmol)
000677036.b3lyp_6-31g(d).inp

000677036.b3lyp_6-31g(d).qchem.inp (generated)

000677036.b3lyp_6-31g(d).gjf (generated)

000677036.b3lyp_6-31g(d).firefly.inp (generated)

000677036.b3lyp_6-31g(d).smash.inp (generated)

000677036.b3lyp_6-31g(d).nwchem.inp (generated) 000677036.b3lyp_6-31g(d).log.xz 000677036.td-b3lyp_6-31g+(d).inp 000677036.td-b3lyp_6-31g+(d).log.xz

000677036.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677036.td-b3lyp_6-31+g(d).gjf (generated)

000677036.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677036.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677036.mol 000677036.PUBCHEM 000677036.mol (via Jmol)
000677037.b3lyp_6-31g(d).inp

000677037.b3lyp_6-31g(d).qchem.inp (generated)

000677037.b3lyp_6-31g(d).gjf (generated)

000677037.b3lyp_6-31g(d).firefly.inp (generated)

000677037.b3lyp_6-31g(d).smash.inp (generated)

000677037.b3lyp_6-31g(d).nwchem.inp (generated) 000677037.b3lyp_6-31g(d).log.xz 000677037.td-b3lyp_6-31g+(d).inp 000677037.td-b3lyp_6-31g+(d).log.xz

000677037.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677037.td-b3lyp_6-31+g(d).gjf (generated)

000677037.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677037.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677037.mol 000677037.PUBCHEM 000677037.mol (via Jmol)
000677045.b3lyp_6-31g(d).inp

000677045.b3lyp_6-31g(d).qchem.inp (generated)

000677045.b3lyp_6-31g(d).gjf (generated)

000677045.b3lyp_6-31g(d).firefly.inp (generated)

000677045.b3lyp_6-31g(d).smash.inp (generated)

000677045.b3lyp_6-31g(d).nwchem.inp (generated) 000677045.b3lyp_6-31g(d).log.xz 000677045.td-b3lyp_6-31g+(d).inp 000677045.td-b3lyp_6-31g+(d).log.xz

000677045.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677045.td-b3lyp_6-31+g(d).gjf (generated)

000677045.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677045.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677045.mol 000677045.PUBCHEM 000677045.mol (via Jmol)
000677046.b3lyp_6-31g(d).inp

000677046.b3lyp_6-31g(d).qchem.inp (generated)

000677046.b3lyp_6-31g(d).gjf (generated)

000677046.b3lyp_6-31g(d).firefly.inp (generated)

000677046.b3lyp_6-31g(d).smash.inp (generated)

000677046.b3lyp_6-31g(d).nwchem.inp (generated) 000677046.b3lyp_6-31g(d).log.xz 000677046.td-b3lyp_6-31g+(d).inp 000677046.td-b3lyp_6-31g+(d).log.xz

000677046.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677046.td-b3lyp_6-31+g(d).gjf (generated)

000677046.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677046.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677046.mol 000677046.PUBCHEM 000677046.mol (via Jmol)
000677062.b3lyp_6-31g(d).inp

000677062.b3lyp_6-31g(d).qchem.inp (generated)

000677062.b3lyp_6-31g(d).gjf (generated)

000677062.b3lyp_6-31g(d).firefly.inp (generated)

000677062.b3lyp_6-31g(d).smash.inp (generated)

000677062.b3lyp_6-31g(d).nwchem.inp (generated) 000677062.b3lyp_6-31g(d).log.xz 000677062.td-b3lyp_6-31g+(d).inp 000677062.td-b3lyp_6-31g+(d).log.xz

000677062.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677062.td-b3lyp_6-31+g(d).gjf (generated)

000677062.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677062.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677062.mol 000677062.PUBCHEM 000677062.mol (via Jmol)
000677070.b3lyp_6-31g(d).inp

000677070.b3lyp_6-31g(d).qchem.inp (generated)

000677070.b3lyp_6-31g(d).gjf (generated)

000677070.b3lyp_6-31g(d).firefly.inp (generated)

000677070.b3lyp_6-31g(d).smash.inp (generated)

000677070.b3lyp_6-31g(d).nwchem.inp (generated) 000677070.b3lyp_6-31g(d).log.xz 000677070.td-b3lyp_6-31g+(d).inp 000677070.td-b3lyp_6-31g+(d).log.xz

000677070.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677070.td-b3lyp_6-31+g(d).gjf (generated)

000677070.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677070.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677070.mol 000677070.PUBCHEM 000677070.mol (via Jmol)
000677085.b3lyp_6-31g(d).inp

000677085.b3lyp_6-31g(d).qchem.inp (generated)

000677085.b3lyp_6-31g(d).gjf (generated)

000677085.b3lyp_6-31g(d).firefly.inp (generated)

000677085.b3lyp_6-31g(d).smash.inp (generated)

000677085.b3lyp_6-31g(d).nwchem.inp (generated) 000677085.b3lyp_6-31g(d).log.xz 000677085.td-b3lyp_6-31g+(d).inp 000677085.td-b3lyp_6-31g+(d).log.xz

000677085.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677085.td-b3lyp_6-31+g(d).gjf (generated)

000677085.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677085.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677085.mol 000677085.PUBCHEM 000677085.mol (via Jmol)
000677099.b3lyp_6-31g(d).inp

000677099.b3lyp_6-31g(d).qchem.inp (generated)

000677099.b3lyp_6-31g(d).gjf (generated)

000677099.b3lyp_6-31g(d).firefly.inp (generated)

000677099.b3lyp_6-31g(d).smash.inp (generated)

000677099.b3lyp_6-31g(d).nwchem.inp (generated) 000677099.b3lyp_6-31g(d).log.xz 000677099.td-b3lyp_6-31g+(d).inp 000677099.td-b3lyp_6-31g+(d).log.xz

000677099.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677099.td-b3lyp_6-31+g(d).gjf (generated)

000677099.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677099.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677099.mol 000677099.PUBCHEM 000677099.mol (via Jmol)
000677111.b3lyp_6-31g(d).inp

000677111.b3lyp_6-31g(d).qchem.inp (generated)

000677111.b3lyp_6-31g(d).gjf (generated)

000677111.b3lyp_6-31g(d).firefly.inp (generated)

000677111.b3lyp_6-31g(d).smash.inp (generated)

000677111.b3lyp_6-31g(d).nwchem.inp (generated) 000677111.b3lyp_6-31g(d).log.xz 000677111.td-b3lyp_6-31g+(d).inp 000677111.td-b3lyp_6-31g+(d).log.xz

000677111.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677111.td-b3lyp_6-31+g(d).gjf (generated)

000677111.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677111.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677111.mol 000677111.PUBCHEM 000677111.mol (via Jmol)
000677112.b3lyp_6-31g(d).inp

000677112.b3lyp_6-31g(d).qchem.inp (generated)

000677112.b3lyp_6-31g(d).gjf (generated)

000677112.b3lyp_6-31g(d).firefly.inp (generated)

000677112.b3lyp_6-31g(d).smash.inp (generated)

000677112.b3lyp_6-31g(d).nwchem.inp (generated) 000677112.b3lyp_6-31g(d).log.xz 000677112.td-b3lyp_6-31g+(d).inp 000677112.td-b3lyp_6-31g+(d).log.xz

000677112.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677112.td-b3lyp_6-31+g(d).gjf (generated)

000677112.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677112.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677112.mol 000677112.PUBCHEM 000677112.mol (via Jmol)
000677113.b3lyp_6-31g(d).inp

000677113.b3lyp_6-31g(d).qchem.inp (generated)

000677113.b3lyp_6-31g(d).gjf (generated)

000677113.b3lyp_6-31g(d).firefly.inp (generated)

000677113.b3lyp_6-31g(d).smash.inp (generated)

000677113.b3lyp_6-31g(d).nwchem.inp (generated) 000677113.b3lyp_6-31g(d).log.xz 000677113.td-b3lyp_6-31g+(d).inp 000677113.td-b3lyp_6-31g+(d).log.xz

000677113.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677113.td-b3lyp_6-31+g(d).gjf (generated)

000677113.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677113.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677113.mol 000677113.PUBCHEM 000677113.mol (via Jmol)
000677114.b3lyp_6-31g(d).inp

000677114.b3lyp_6-31g(d).qchem.inp (generated)

000677114.b3lyp_6-31g(d).gjf (generated)

000677114.b3lyp_6-31g(d).firefly.inp (generated)

000677114.b3lyp_6-31g(d).smash.inp (generated)

000677114.b3lyp_6-31g(d).nwchem.inp (generated) 000677114.b3lyp_6-31g(d).log.xz 000677114.td-b3lyp_6-31g+(d).inp 000677114.td-b3lyp_6-31g+(d).log.xz

000677114.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677114.td-b3lyp_6-31+g(d).gjf (generated)

000677114.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677114.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677114.mol 000677114.PUBCHEM 000677114.mol (via Jmol)
000677116.b3lyp_6-31g(d).inp

000677116.b3lyp_6-31g(d).qchem.inp (generated)

000677116.b3lyp_6-31g(d).gjf (generated)

000677116.b3lyp_6-31g(d).firefly.inp (generated)

000677116.b3lyp_6-31g(d).smash.inp (generated)

000677116.b3lyp_6-31g(d).nwchem.inp (generated) 000677116.b3lyp_6-31g(d).log.xz 000677116.td-b3lyp_6-31g+(d).inp 000677116.td-b3lyp_6-31g+(d).log.xz

000677116.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677116.td-b3lyp_6-31+g(d).gjf (generated)

000677116.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677116.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677116.mol 000677116.PUBCHEM 000677116.mol (via Jmol)
000677117.b3lyp_6-31g(d).inp

000677117.b3lyp_6-31g(d).qchem.inp (generated)

000677117.b3lyp_6-31g(d).gjf (generated)

000677117.b3lyp_6-31g(d).firefly.inp (generated)

000677117.b3lyp_6-31g(d).smash.inp (generated)

000677117.b3lyp_6-31g(d).nwchem.inp (generated) 000677117.b3lyp_6-31g(d).log.xz 000677117.td-b3lyp_6-31g+(d).inp 000677117.td-b3lyp_6-31g+(d).log.xz

000677117.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677117.td-b3lyp_6-31+g(d).gjf (generated)

000677117.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677117.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677117.mol 000677117.PUBCHEM 000677117.mol (via Jmol)
000677128.b3lyp_6-31g(d).inp

000677128.b3lyp_6-31g(d).qchem.inp (generated)

000677128.b3lyp_6-31g(d).gjf (generated)

000677128.b3lyp_6-31g(d).firefly.inp (generated)

000677128.b3lyp_6-31g(d).smash.inp (generated)

000677128.b3lyp_6-31g(d).nwchem.inp (generated) 000677128.b3lyp_6-31g(d).log.xz 000677128.td-b3lyp_6-31g+(d).inp 000677128.td-b3lyp_6-31g+(d).log.xz

000677128.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677128.td-b3lyp_6-31+g(d).gjf (generated)

000677128.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677128.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677128.mol 000677128.PUBCHEM 000677128.mol (via Jmol)
000677134.b3lyp_6-31g(d).inp

000677134.b3lyp_6-31g(d).qchem.inp (generated)

000677134.b3lyp_6-31g(d).gjf (generated)

000677134.b3lyp_6-31g(d).firefly.inp (generated)

000677134.b3lyp_6-31g(d).smash.inp (generated)

000677134.b3lyp_6-31g(d).nwchem.inp (generated) 000677134.b3lyp_6-31g(d).log.xz 000677134.td-b3lyp_6-31g+(d).inp 000677134.td-b3lyp_6-31g+(d).log.xz

000677134.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677134.td-b3lyp_6-31+g(d).gjf (generated)

000677134.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677134.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677134.mol 000677134.PUBCHEM 000677134.mol (via Jmol)
000677135.b3lyp_6-31g(d).inp

000677135.b3lyp_6-31g(d).qchem.inp (generated)

000677135.b3lyp_6-31g(d).gjf (generated)

000677135.b3lyp_6-31g(d).firefly.inp (generated)

000677135.b3lyp_6-31g(d).smash.inp (generated)

000677135.b3lyp_6-31g(d).nwchem.inp (generated) 000677135.b3lyp_6-31g(d).log.xz 000677135.td-b3lyp_6-31g+(d).inp 000677135.td-b3lyp_6-31g+(d).log.xz

000677135.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677135.td-b3lyp_6-31+g(d).gjf (generated)

000677135.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677135.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677135.mol 000677135.PUBCHEM 000677135.mol (via Jmol)
000677136.b3lyp_6-31g(d).inp

000677136.b3lyp_6-31g(d).qchem.inp (generated)

000677136.b3lyp_6-31g(d).gjf (generated)

000677136.b3lyp_6-31g(d).firefly.inp (generated)

000677136.b3lyp_6-31g(d).smash.inp (generated)

000677136.b3lyp_6-31g(d).nwchem.inp (generated) 000677136.b3lyp_6-31g(d).log.xz 000677136.mol 000677136.PUBCHEM 000677136.mol (via Jmol)
000677139.b3lyp_6-31g(d).inp

000677139.b3lyp_6-31g(d).qchem.inp (generated)

000677139.b3lyp_6-31g(d).gjf (generated)

000677139.b3lyp_6-31g(d).firefly.inp (generated)

000677139.b3lyp_6-31g(d).smash.inp (generated)

000677139.b3lyp_6-31g(d).nwchem.inp (generated) 000677139.b3lyp_6-31g(d).log.xz 000677139.td-b3lyp_6-31g+(d).inp 000677139.td-b3lyp_6-31g+(d).log.xz

000677139.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677139.td-b3lyp_6-31+g(d).gjf (generated)

000677139.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677139.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677139.mol 000677139.PUBCHEM 000677139.mol (via Jmol)
000677140.b3lyp_6-31g(d).inp

000677140.b3lyp_6-31g(d).qchem.inp (generated)

000677140.b3lyp_6-31g(d).gjf (generated)

000677140.b3lyp_6-31g(d).firefly.inp (generated)

000677140.b3lyp_6-31g(d).smash.inp (generated)

000677140.b3lyp_6-31g(d).nwchem.inp (generated) 000677140.b3lyp_6-31g(d).log.xz 000677140.td-b3lyp_6-31g+(d).inp 000677140.td-b3lyp_6-31g+(d).log.xz

000677140.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677140.td-b3lyp_6-31+g(d).gjf (generated)

000677140.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677140.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677140.mol 000677140.PUBCHEM 000677140.mol (via Jmol)
000677141.b3lyp_6-31g(d).inp

000677141.b3lyp_6-31g(d).qchem.inp (generated)

000677141.b3lyp_6-31g(d).gjf (generated)

000677141.b3lyp_6-31g(d).firefly.inp (generated)

000677141.b3lyp_6-31g(d).smash.inp (generated)

000677141.b3lyp_6-31g(d).nwchem.inp (generated) 000677141.b3lyp_6-31g(d).log.xz 000677141.td-b3lyp_6-31g+(d).inp 000677141.td-b3lyp_6-31g+(d).log.xz

000677141.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677141.td-b3lyp_6-31+g(d).gjf (generated)

000677141.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677141.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677141.mol 000677141.PUBCHEM 000677141.mol (via Jmol)
000677142.b3lyp_6-31g(d).inp

000677142.b3lyp_6-31g(d).qchem.inp (generated)

000677142.b3lyp_6-31g(d).gjf (generated)

000677142.b3lyp_6-31g(d).firefly.inp (generated)

000677142.b3lyp_6-31g(d).smash.inp (generated)

000677142.b3lyp_6-31g(d).nwchem.inp (generated) 000677142.b3lyp_6-31g(d).log.xz 000677142.td-b3lyp_6-31g+(d).inp 000677142.td-b3lyp_6-31g+(d).log.xz

000677142.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677142.td-b3lyp_6-31+g(d).gjf (generated)

000677142.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677142.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677142.mol 000677142.PUBCHEM 000677142.mol (via Jmol)
000677145.b3lyp_6-31g(d).inp

000677145.b3lyp_6-31g(d).qchem.inp (generated)

000677145.b3lyp_6-31g(d).gjf (generated)

000677145.b3lyp_6-31g(d).firefly.inp (generated)

000677145.b3lyp_6-31g(d).smash.inp (generated)

000677145.b3lyp_6-31g(d).nwchem.inp (generated) 000677145.b3lyp_6-31g(d).log.xz 000677145.td-b3lyp_6-31g+(d).inp 000677145.td-b3lyp_6-31g+(d).log.xz

000677145.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677145.td-b3lyp_6-31+g(d).gjf (generated)

000677145.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677145.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677145.mol 000677145.PUBCHEM 000677145.mol (via Jmol)
000677150.b3lyp_6-31g(d).inp

000677150.b3lyp_6-31g(d).qchem.inp (generated)

000677150.b3lyp_6-31g(d).gjf (generated)

000677150.b3lyp_6-31g(d).firefly.inp (generated)

000677150.b3lyp_6-31g(d).smash.inp (generated)

000677150.b3lyp_6-31g(d).nwchem.inp (generated) 000677150.b3lyp_6-31g(d).log.xz 000677150.mol 000677150.PUBCHEM 000677150.mol (via Jmol)
000677157.b3lyp_6-31g(d).inp

000677157.b3lyp_6-31g(d).qchem.inp (generated)

000677157.b3lyp_6-31g(d).gjf (generated)

000677157.b3lyp_6-31g(d).firefly.inp (generated)

000677157.b3lyp_6-31g(d).smash.inp (generated)

000677157.b3lyp_6-31g(d).nwchem.inp (generated) 000677157.b3lyp_6-31g(d).log.xz 000677157.td-b3lyp_6-31g+(d).inp 000677157.td-b3lyp_6-31g+(d).log.xz

000677157.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677157.td-b3lyp_6-31+g(d).gjf (generated)

000677157.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677157.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677157.mol 000677157.PUBCHEM 000677157.mol (via Jmol)
000677158.b3lyp_6-31g(d).inp

000677158.b3lyp_6-31g(d).qchem.inp (generated)

000677158.b3lyp_6-31g(d).gjf (generated)

000677158.b3lyp_6-31g(d).firefly.inp (generated)

000677158.b3lyp_6-31g(d).smash.inp (generated)

000677158.b3lyp_6-31g(d).nwchem.inp (generated) 000677158.b3lyp_6-31g(d).log.xz 000677158.td-b3lyp_6-31g+(d).inp 000677158.td-b3lyp_6-31g+(d).log.xz

000677158.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677158.td-b3lyp_6-31+g(d).gjf (generated)

000677158.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677158.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677158.mol 000677158.PUBCHEM 000677158.mol (via Jmol)
000677161.b3lyp_6-31g(d).inp

000677161.b3lyp_6-31g(d).qchem.inp (generated)

000677161.b3lyp_6-31g(d).gjf (generated)

000677161.b3lyp_6-31g(d).firefly.inp (generated)

000677161.b3lyp_6-31g(d).smash.inp (generated)

000677161.b3lyp_6-31g(d).nwchem.inp (generated) 000677161.b3lyp_6-31g(d).log.xz 000677161.td-b3lyp_6-31g+(d).inp 000677161.td-b3lyp_6-31g+(d).log.xz

000677161.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677161.td-b3lyp_6-31+g(d).gjf (generated)

000677161.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677161.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677161.mol 000677161.PUBCHEM 000677161.mol (via Jmol)
000677162.b3lyp_6-31g(d).inp

000677162.b3lyp_6-31g(d).qchem.inp (generated)

000677162.b3lyp_6-31g(d).gjf (generated)

000677162.b3lyp_6-31g(d).firefly.inp (generated)

000677162.b3lyp_6-31g(d).smash.inp (generated)

000677162.b3lyp_6-31g(d).nwchem.inp (generated) 000677162.b3lyp_6-31g(d).log.xz 000677162.td-b3lyp_6-31g+(d).inp 000677162.td-b3lyp_6-31g+(d).log.xz

000677162.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677162.td-b3lyp_6-31+g(d).gjf (generated)

000677162.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677162.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677162.mol 000677162.PUBCHEM 000677162.mol (via Jmol)
000677167.b3lyp_6-31g(d).inp

000677167.b3lyp_6-31g(d).qchem.inp (generated)

000677167.b3lyp_6-31g(d).gjf (generated)

000677167.b3lyp_6-31g(d).firefly.inp (generated)

000677167.b3lyp_6-31g(d).smash.inp (generated)

000677167.b3lyp_6-31g(d).nwchem.inp (generated) 000677167.b3lyp_6-31g(d).log.xz 000677167.td-b3lyp_6-31g+(d).inp 000677167.td-b3lyp_6-31g+(d).log.xz

000677167.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677167.td-b3lyp_6-31+g(d).gjf (generated)

000677167.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677167.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677167.mol 000677167.PUBCHEM 000677167.mol (via Jmol)
000677175.b3lyp_6-31g(d).inp

000677175.b3lyp_6-31g(d).qchem.inp (generated)

000677175.b3lyp_6-31g(d).gjf (generated)

000677175.b3lyp_6-31g(d).firefly.inp (generated)

000677175.b3lyp_6-31g(d).smash.inp (generated)

000677175.b3lyp_6-31g(d).nwchem.inp (generated) 000677175.b3lyp_6-31g(d).log.xz 000677175.mol 000677175.PUBCHEM 000677175.mol (via Jmol)
000677178.b3lyp_6-31g(d).inp

000677178.b3lyp_6-31g(d).qchem.inp (generated)

000677178.b3lyp_6-31g(d).gjf (generated)

000677178.b3lyp_6-31g(d).firefly.inp (generated)

000677178.b3lyp_6-31g(d).smash.inp (generated)

000677178.b3lyp_6-31g(d).nwchem.inp (generated) 000677178.b3lyp_6-31g(d).log.xz 000677178.td-b3lyp_6-31g+(d).inp 000677178.td-b3lyp_6-31g+(d).log.xz

000677178.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677178.td-b3lyp_6-31+g(d).gjf (generated)

000677178.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677178.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677178.mol 000677178.PUBCHEM 000677178.mol (via Jmol)
000677179.b3lyp_6-31g(d).inp

000677179.b3lyp_6-31g(d).qchem.inp (generated)

000677179.b3lyp_6-31g(d).gjf (generated)

000677179.b3lyp_6-31g(d).firefly.inp (generated)

000677179.b3lyp_6-31g(d).smash.inp (generated)

000677179.b3lyp_6-31g(d).nwchem.inp (generated) 000677179.b3lyp_6-31g(d).log.xz 000677179.td-b3lyp_6-31g+(d).inp 000677179.td-b3lyp_6-31g+(d).log.xz

000677179.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677179.td-b3lyp_6-31+g(d).gjf (generated)

000677179.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677179.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677179.mol 000677179.PUBCHEM 000677179.mol (via Jmol)
000677188.b3lyp_6-31g(d).inp

000677188.b3lyp_6-31g(d).qchem.inp (generated)

000677188.b3lyp_6-31g(d).gjf (generated)

000677188.b3lyp_6-31g(d).firefly.inp (generated)

000677188.b3lyp_6-31g(d).smash.inp (generated)

000677188.b3lyp_6-31g(d).nwchem.inp (generated) 000677188.b3lyp_6-31g(d).log.xz 000677188.td-b3lyp_6-31g+(d).inp 000677188.td-b3lyp_6-31g+(d).log.xz

000677188.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677188.td-b3lyp_6-31+g(d).gjf (generated)

000677188.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677188.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677188.mol 000677188.PUBCHEM 000677188.mol (via Jmol)
000677189.b3lyp_6-31g(d).inp

000677189.b3lyp_6-31g(d).qchem.inp (generated)

000677189.b3lyp_6-31g(d).gjf (generated)

000677189.b3lyp_6-31g(d).firefly.inp (generated)

000677189.b3lyp_6-31g(d).smash.inp (generated)

000677189.b3lyp_6-31g(d).nwchem.inp (generated) 000677189.b3lyp_6-31g(d).log.xz 000677189.td-b3lyp_6-31g+(d).inp 000677189.td-b3lyp_6-31g+(d).log.xz

000677189.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677189.td-b3lyp_6-31+g(d).gjf (generated)

000677189.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677189.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677189.mol 000677189.PUBCHEM 000677189.mol (via Jmol)
000677190.b3lyp_6-31g(d).inp

000677190.b3lyp_6-31g(d).qchem.inp (generated)

000677190.b3lyp_6-31g(d).gjf (generated)

000677190.b3lyp_6-31g(d).firefly.inp (generated)

000677190.b3lyp_6-31g(d).smash.inp (generated)

000677190.b3lyp_6-31g(d).nwchem.inp (generated) 000677190.b3lyp_6-31g(d).log.xz 000677190.td-b3lyp_6-31g+(d).inp 000677190.td-b3lyp_6-31g+(d).log.xz

000677190.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677190.td-b3lyp_6-31+g(d).gjf (generated)

000677190.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677190.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677190.mol 000677190.PUBCHEM 000677190.mol (via Jmol)
000677197.b3lyp_6-31g(d).inp

000677197.b3lyp_6-31g(d).qchem.inp (generated)

000677197.b3lyp_6-31g(d).gjf (generated)

000677197.b3lyp_6-31g(d).firefly.inp (generated)

000677197.b3lyp_6-31g(d).smash.inp (generated)

000677197.b3lyp_6-31g(d).nwchem.inp (generated) 000677197.b3lyp_6-31g(d).log.xz 000677197.td-b3lyp_6-31g+(d).inp 000677197.td-b3lyp_6-31g+(d).log.xz

000677197.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677197.td-b3lyp_6-31+g(d).gjf (generated)

000677197.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677197.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677197.mol 000677197.PUBCHEM 000677197.mol (via Jmol)
000677202.b3lyp_6-31g(d).inp

000677202.b3lyp_6-31g(d).qchem.inp (generated)

000677202.b3lyp_6-31g(d).gjf (generated)

000677202.b3lyp_6-31g(d).firefly.inp (generated)

000677202.b3lyp_6-31g(d).smash.inp (generated)

000677202.b3lyp_6-31g(d).nwchem.inp (generated) 000677202.b3lyp_6-31g(d).log.xz 000677202.mol 000677202.PUBCHEM 000677202.mol (via Jmol)
000677211.b3lyp_6-31g(d).inp

000677211.b3lyp_6-31g(d).qchem.inp (generated)

000677211.b3lyp_6-31g(d).gjf (generated)

000677211.b3lyp_6-31g(d).firefly.inp (generated)

000677211.b3lyp_6-31g(d).smash.inp (generated)

000677211.b3lyp_6-31g(d).nwchem.inp (generated) 000677211.b3lyp_6-31g(d).log.xz 000677211.td-b3lyp_6-31g+(d).inp 000677211.td-b3lyp_6-31g+(d).log.xz

000677211.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677211.td-b3lyp_6-31+g(d).gjf (generated)

000677211.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677211.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677211.mol 000677211.PUBCHEM 000677211.mol (via Jmol)
000677212.b3lyp_6-31g(d).inp

000677212.b3lyp_6-31g(d).qchem.inp (generated)

000677212.b3lyp_6-31g(d).gjf (generated)

000677212.b3lyp_6-31g(d).firefly.inp (generated)

000677212.b3lyp_6-31g(d).smash.inp (generated)

000677212.b3lyp_6-31g(d).nwchem.inp (generated) 000677212.b3lyp_6-31g(d).log.xz 000677212.mol 000677212.PUBCHEM 000677212.mol (via Jmol)
000677231.b3lyp_6-31g(d).inp

000677231.b3lyp_6-31g(d).qchem.inp (generated)

000677231.b3lyp_6-31g(d).gjf (generated)

000677231.b3lyp_6-31g(d).firefly.inp (generated)

000677231.b3lyp_6-31g(d).smash.inp (generated)

000677231.b3lyp_6-31g(d).nwchem.inp (generated) 000677231.b3lyp_6-31g(d).log.xz 000677231.mol 000677231.PUBCHEM 000677231.mol (via Jmol)
000677237.b3lyp_6-31g(d).inp

000677237.b3lyp_6-31g(d).qchem.inp (generated)

000677237.b3lyp_6-31g(d).gjf (generated)

000677237.b3lyp_6-31g(d).firefly.inp (generated)

000677237.b3lyp_6-31g(d).smash.inp (generated)

000677237.b3lyp_6-31g(d).nwchem.inp (generated) 000677237.b3lyp_6-31g(d).log.xz 000677237.mol 000677237.PUBCHEM 000677237.mol (via Jmol)
000677238.b3lyp_6-31g(d).inp

000677238.b3lyp_6-31g(d).qchem.inp (generated)

000677238.b3lyp_6-31g(d).gjf (generated)

000677238.b3lyp_6-31g(d).firefly.inp (generated)

000677238.b3lyp_6-31g(d).smash.inp (generated)

000677238.b3lyp_6-31g(d).nwchem.inp (generated) 000677238.b3lyp_6-31g(d).log.xz 000677238.mol 000677238.PUBCHEM 000677238.mol (via Jmol)
000677240.b3lyp_6-31g(d).inp

000677240.b3lyp_6-31g(d).qchem.inp (generated)

000677240.b3lyp_6-31g(d).gjf (generated)

000677240.b3lyp_6-31g(d).firefly.inp (generated)

000677240.b3lyp_6-31g(d).smash.inp (generated)

000677240.b3lyp_6-31g(d).nwchem.inp (generated) 000677240.b3lyp_6-31g(d).log.xz 000677240.td-b3lyp_6-31g+(d).inp 000677240.td-b3lyp_6-31g+(d).log.xz

000677240.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677240.td-b3lyp_6-31+g(d).gjf (generated)

000677240.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677240.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677240.mol 000677240.PUBCHEM 000677240.mol (via Jmol)
000677254.b3lyp_6-31g(d).inp

000677254.b3lyp_6-31g(d).qchem.inp (generated)

000677254.b3lyp_6-31g(d).gjf (generated)

000677254.b3lyp_6-31g(d).firefly.inp (generated)

000677254.b3lyp_6-31g(d).smash.inp (generated)

000677254.b3lyp_6-31g(d).nwchem.inp (generated) 000677254.b3lyp_6-31g(d).log.xz 000677254.mol 000677254.PUBCHEM 000677254.mol (via Jmol)
000677255.b3lyp_6-31g(d).inp

000677255.b3lyp_6-31g(d).qchem.inp (generated)

000677255.b3lyp_6-31g(d).gjf (generated)

000677255.b3lyp_6-31g(d).firefly.inp (generated)

000677255.b3lyp_6-31g(d).smash.inp (generated)

000677255.b3lyp_6-31g(d).nwchem.inp (generated) 000677255.b3lyp_6-31g(d).log.xz 000677255.mol 000677255.PUBCHEM 000677255.mol (via Jmol)
000677258.b3lyp_6-31g(d).inp

000677258.b3lyp_6-31g(d).qchem.inp (generated)

000677258.b3lyp_6-31g(d).gjf (generated)

000677258.b3lyp_6-31g(d).firefly.inp (generated)

000677258.b3lyp_6-31g(d).smash.inp (generated)

000677258.b3lyp_6-31g(d).nwchem.inp (generated) 000677258.b3lyp_6-31g(d).log.xz 000677258.td-b3lyp_6-31g+(d).inp 000677258.td-b3lyp_6-31g+(d).log.xz

000677258.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677258.td-b3lyp_6-31+g(d).gjf (generated)

000677258.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677258.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677258.mol 000677258.PUBCHEM 000677258.mol (via Jmol)
000677259.b3lyp_6-31g(d).inp

000677259.b3lyp_6-31g(d).qchem.inp (generated)

000677259.b3lyp_6-31g(d).gjf (generated)

000677259.b3lyp_6-31g(d).firefly.inp (generated)

000677259.b3lyp_6-31g(d).smash.inp (generated)

000677259.b3lyp_6-31g(d).nwchem.inp (generated) 000677259.b3lyp_6-31g(d).log.xz 000677259.td-b3lyp_6-31g+(d).inp 000677259.td-b3lyp_6-31g+(d).log.xz

000677259.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677259.td-b3lyp_6-31+g(d).gjf (generated)

000677259.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677259.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677259.mol 000677259.PUBCHEM 000677259.mol (via Jmol)
000677266.b3lyp_6-31g(d).inp

000677266.b3lyp_6-31g(d).qchem.inp (generated)

000677266.b3lyp_6-31g(d).gjf (generated)

000677266.b3lyp_6-31g(d).firefly.inp (generated)

000677266.b3lyp_6-31g(d).smash.inp (generated)

000677266.b3lyp_6-31g(d).nwchem.inp (generated) 000677266.b3lyp_6-31g(d).log.xz 000677266.td-b3lyp_6-31g+(d).inp 000677266.td-b3lyp_6-31g+(d).log.xz

000677266.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677266.td-b3lyp_6-31+g(d).gjf (generated)

000677266.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677266.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677266.mol 000677266.PUBCHEM 000677266.mol (via Jmol)
000677294.b3lyp_6-31g(d).inp

000677294.b3lyp_6-31g(d).qchem.inp (generated)

000677294.b3lyp_6-31g(d).gjf (generated)

000677294.b3lyp_6-31g(d).firefly.inp (generated)

000677294.b3lyp_6-31g(d).smash.inp (generated)

000677294.b3lyp_6-31g(d).nwchem.inp (generated) 000677294.b3lyp_6-31g(d).log.xz 000677294.td-b3lyp_6-31g+(d).inp 000677294.td-b3lyp_6-31g+(d).log.xz

000677294.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677294.td-b3lyp_6-31+g(d).gjf (generated)

000677294.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677294.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677294.mol 000677294.PUBCHEM 000677294.mol (via Jmol)
000677296.b3lyp_6-31g(d).inp

000677296.b3lyp_6-31g(d).qchem.inp (generated)

000677296.b3lyp_6-31g(d).gjf (generated)

000677296.b3lyp_6-31g(d).firefly.inp (generated)

000677296.b3lyp_6-31g(d).smash.inp (generated)

000677296.b3lyp_6-31g(d).nwchem.inp (generated) 000677296.b3lyp_6-31g(d).log.xz 000677296.td-b3lyp_6-31g+(d).inp 000677296.td-b3lyp_6-31g+(d).log.xz

000677296.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677296.td-b3lyp_6-31+g(d).gjf (generated)

000677296.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677296.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677296.mol 000677296.PUBCHEM 000677296.mol (via Jmol)
000677307.b3lyp_6-31g(d).inp

000677307.b3lyp_6-31g(d).qchem.inp (generated)

000677307.b3lyp_6-31g(d).gjf (generated)

000677307.b3lyp_6-31g(d).firefly.inp (generated)

000677307.b3lyp_6-31g(d).smash.inp (generated)

000677307.b3lyp_6-31g(d).nwchem.inp (generated) 000677307.b3lyp_6-31g(d).log.xz 000677307.td-b3lyp_6-31g+(d).inp 000677307.td-b3lyp_6-31g+(d).log.xz

000677307.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677307.td-b3lyp_6-31+g(d).gjf (generated)

000677307.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677307.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677307.mol 000677307.PUBCHEM 000677307.mol (via Jmol)
000677310.b3lyp_6-31g(d).inp

000677310.b3lyp_6-31g(d).qchem.inp (generated)

000677310.b3lyp_6-31g(d).gjf (generated)

000677310.b3lyp_6-31g(d).firefly.inp (generated)

000677310.b3lyp_6-31g(d).smash.inp (generated)

000677310.b3lyp_6-31g(d).nwchem.inp (generated) 000677310.b3lyp_6-31g(d).log.xz 000677310.mol 000677310.PUBCHEM 000677310.mol (via Jmol)
000677326.b3lyp_6-31g(d).inp

000677326.b3lyp_6-31g(d).qchem.inp (generated)

000677326.b3lyp_6-31g(d).gjf (generated)

000677326.b3lyp_6-31g(d).firefly.inp (generated)

000677326.b3lyp_6-31g(d).smash.inp (generated)

000677326.b3lyp_6-31g(d).nwchem.inp (generated) 000677326.b3lyp_6-31g(d).log.xz 000677326.td-b3lyp_6-31g+(d).inp 000677326.td-b3lyp_6-31g+(d).log.xz

000677326.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677326.td-b3lyp_6-31+g(d).gjf (generated)

000677326.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677326.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677326.mol 000677326.PUBCHEM 000677326.mol (via Jmol)
000677327.b3lyp_6-31g(d).inp

000677327.b3lyp_6-31g(d).qchem.inp (generated)

000677327.b3lyp_6-31g(d).gjf (generated)

000677327.b3lyp_6-31g(d).firefly.inp (generated)

000677327.b3lyp_6-31g(d).smash.inp (generated)

000677327.b3lyp_6-31g(d).nwchem.inp (generated) 000677327.b3lyp_6-31g(d).log.xz 000677327.td-b3lyp_6-31g+(d).inp 000677327.td-b3lyp_6-31g+(d).log.xz

000677327.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677327.td-b3lyp_6-31+g(d).gjf (generated)

000677327.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677327.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677327.mol 000677327.PUBCHEM 000677327.mol (via Jmol)
000677328.b3lyp_6-31g(d).inp

000677328.b3lyp_6-31g(d).qchem.inp (generated)

000677328.b3lyp_6-31g(d).gjf (generated)

000677328.b3lyp_6-31g(d).firefly.inp (generated)

000677328.b3lyp_6-31g(d).smash.inp (generated)

000677328.b3lyp_6-31g(d).nwchem.inp (generated) 000677328.b3lyp_6-31g(d).log.xz 000677328.mol 000677328.PUBCHEM 000677328.mol (via Jmol)
000677329.b3lyp_6-31g(d).inp

000677329.b3lyp_6-31g(d).qchem.inp (generated)

000677329.b3lyp_6-31g(d).gjf (generated)

000677329.b3lyp_6-31g(d).firefly.inp (generated)

000677329.b3lyp_6-31g(d).smash.inp (generated)

000677329.b3lyp_6-31g(d).nwchem.inp (generated) 000677329.b3lyp_6-31g(d).log.xz 000677329.td-b3lyp_6-31g+(d).inp 000677329.td-b3lyp_6-31g+(d).log.xz

000677329.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677329.td-b3lyp_6-31+g(d).gjf (generated)

000677329.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677329.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677329.mol 000677329.PUBCHEM 000677329.mol (via Jmol)
000677330.b3lyp_6-31g(d).inp

000677330.b3lyp_6-31g(d).qchem.inp (generated)

000677330.b3lyp_6-31g(d).gjf (generated)

000677330.b3lyp_6-31g(d).firefly.inp (generated)

000677330.b3lyp_6-31g(d).smash.inp (generated)

000677330.b3lyp_6-31g(d).nwchem.inp (generated) 000677330.b3lyp_6-31g(d).log.xz 000677330.td-b3lyp_6-31g+(d).inp 000677330.td-b3lyp_6-31g+(d).log.xz

000677330.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677330.td-b3lyp_6-31+g(d).gjf (generated)

000677330.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677330.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677330.mol 000677330.PUBCHEM 000677330.mol (via Jmol)
000677351.b3lyp_6-31g(d).inp

000677351.b3lyp_6-31g(d).qchem.inp (generated)

000677351.b3lyp_6-31g(d).gjf (generated)

000677351.b3lyp_6-31g(d).firefly.inp (generated)

000677351.b3lyp_6-31g(d).smash.inp (generated)

000677351.b3lyp_6-31g(d).nwchem.inp (generated) 000677351.b3lyp_6-31g(d).log.xz 000677351.td-b3lyp_6-31g+(d).inp 000677351.td-b3lyp_6-31g+(d).log.xz

000677351.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677351.td-b3lyp_6-31+g(d).gjf (generated)

000677351.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677351.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677351.mol 000677351.PUBCHEM 000677351.mol (via Jmol)
000677364.b3lyp_6-31g(d).inp

000677364.b3lyp_6-31g(d).qchem.inp (generated)

000677364.b3lyp_6-31g(d).gjf (generated)

000677364.b3lyp_6-31g(d).firefly.inp (generated)

000677364.b3lyp_6-31g(d).smash.inp (generated)

000677364.b3lyp_6-31g(d).nwchem.inp (generated) 000677364.b3lyp_6-31g(d).log.xz 000677364.td-b3lyp_6-31g+(d).inp 000677364.td-b3lyp_6-31g+(d).log.xz

000677364.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677364.td-b3lyp_6-31+g(d).gjf (generated)

000677364.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677364.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677364.mol 000677364.PUBCHEM 000677364.mol (via Jmol)
000677383.b3lyp_6-31g(d).inp

000677383.b3lyp_6-31g(d).qchem.inp (generated)

000677383.b3lyp_6-31g(d).gjf (generated)

000677383.b3lyp_6-31g(d).firefly.inp (generated)

000677383.b3lyp_6-31g(d).smash.inp (generated)

000677383.b3lyp_6-31g(d).nwchem.inp (generated) 000677383.b3lyp_6-31g(d).log.xz 000677383.td-b3lyp_6-31g+(d).inp 000677383.td-b3lyp_6-31g+(d).log.xz

000677383.td-b3lyp_6-31+g(d).qchem.inp (generated)

000677383.td-b3lyp_6-31+g(d).gjf (generated)

000677383.td-b3lyp_6-31+g(d).firefly.inp (generated)

000677383.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000677383.mol 000677383.PUBCHEM 000677383.mol (via Jmol)
000677396.b3lyp_6-31g(d).inp

000677396.b3lyp_6-31g(d).qchem.inp (generated)

000677396.b3lyp_6-31g(d).gjf (generated)

000677396.b3lyp_6-31g(d).firefly.inp (generated)

000677396.b3lyp_6-31g(d).smash.inp (generated)

000677396.b3lyp_6-31g(d).nwchem.inp (generated) 000677396.b3lyp_6-31g(d).log.xz 000677396.mol 000677396.PUBCHEM 000677396.mol (via Jmol)
000677397.b3lyp_6-31g(d).inp

000677397.b3lyp_6-31g(d).qchem.inp (generated)

000677397.b3lyp_6-31g(d).gjf (generated)

000677397.b3lyp_6-31g(d).firefly.inp (generated)

000677397.b3lyp_6-31g(d).smash.inp (generated)

000677397.b3lyp_6-31g(d).nwchem.inp (generated) 000677397.b3lyp_6-31g(d).log.xz 000677397.mol 000677397.PUBCHEM 000677397.mol (via Jmol)
000677405.b3lyp_6-31g(d).inp

000677405.b3lyp_6-31g(d).qchem.inp (generated)

000677405.b3lyp_6-31g(d).gjf (generated)