Index of

Last updated : Thu Jun 22 02:29:55 JST 2017
Total : 10810 (10806) in this page
000550002.b3lyp_6-31g(d).inp

000550002.b3lyp_6-31g(d).qchem.inp (generated)

000550002.b3lyp_6-31g(d).gjf (generated)

000550002.b3lyp_6-31g(d).firefly.inp (generated)

000550002.b3lyp_6-31g(d).smash.inp (generated)

000550002.b3lyp_6-31g(d).nwchem.inp (generated) 000550002.b3lyp_6-31g(d).log.xz 000550002.td-b3lyp_6-31g+(d).inp 000550002.td-b3lyp_6-31g+(d).log.xz

000550002.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550002.td-b3lyp_6-31+g(d).gjf (generated)

000550002.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550002.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550002.mol 000550002.PUBCHEM 000550002.mol (via Jmol)
000550003.b3lyp_6-31g(d).inp

000550003.b3lyp_6-31g(d).qchem.inp (generated)

000550003.b3lyp_6-31g(d).gjf (generated)

000550003.b3lyp_6-31g(d).firefly.inp (generated)

000550003.b3lyp_6-31g(d).smash.inp (generated)

000550003.b3lyp_6-31g(d).nwchem.inp (generated) 000550003.b3lyp_6-31g(d).log.xz 000550003.td-b3lyp_6-31g+(d).inp 000550003.td-b3lyp_6-31g+(d).log.xz

000550003.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550003.td-b3lyp_6-31+g(d).gjf (generated)

000550003.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550003.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550003.mol 000550003.PUBCHEM 000550003.mol (via Jmol)
000550004.b3lyp_6-31g(d).inp

000550004.b3lyp_6-31g(d).qchem.inp (generated)

000550004.b3lyp_6-31g(d).gjf (generated)

000550004.b3lyp_6-31g(d).firefly.inp (generated)

000550004.b3lyp_6-31g(d).smash.inp (generated)

000550004.b3lyp_6-31g(d).nwchem.inp (generated) 000550004.b3lyp_6-31g(d).log.xz 000550004.td-b3lyp_6-31g+(d).inp 000550004.td-b3lyp_6-31g+(d).log.xz

000550004.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550004.td-b3lyp_6-31+g(d).gjf (generated)

000550004.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550004.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550004.mol 000550004.PUBCHEM 000550004.mol (via Jmol)
000550005.b3lyp_6-31g(d).inp

000550005.b3lyp_6-31g(d).qchem.inp (generated)

000550005.b3lyp_6-31g(d).gjf (generated)

000550005.b3lyp_6-31g(d).firefly.inp (generated)

000550005.b3lyp_6-31g(d).smash.inp (generated)

000550005.b3lyp_6-31g(d).nwchem.inp (generated) 000550005.b3lyp_6-31g(d).log.xz 000550005.td-b3lyp_6-31g+(d).inp 000550005.td-b3lyp_6-31g+(d).log.xz

000550005.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550005.td-b3lyp_6-31+g(d).gjf (generated)

000550005.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550005.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550005.mol 000550005.PUBCHEM 000550005.mol (via Jmol)
000550007.b3lyp_6-31g(d).inp

000550007.b3lyp_6-31g(d).qchem.inp (generated)

000550007.b3lyp_6-31g(d).gjf (generated)

000550007.b3lyp_6-31g(d).firefly.inp (generated)

000550007.b3lyp_6-31g(d).smash.inp (generated)

000550007.b3lyp_6-31g(d).nwchem.inp (generated) 000550007.b3lyp_6-31g(d).log.xz 000550007.td-b3lyp_6-31g+(d).inp 000550007.td-b3lyp_6-31g+(d).log.xz

000550007.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550007.td-b3lyp_6-31+g(d).gjf (generated)

000550007.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550007.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550007.mol 000550007.PUBCHEM 000550007.mol (via Jmol)
000550008.b3lyp_6-31g(d).inp

000550008.b3lyp_6-31g(d).qchem.inp (generated)

000550008.b3lyp_6-31g(d).gjf (generated)

000550008.b3lyp_6-31g(d).firefly.inp (generated)

000550008.b3lyp_6-31g(d).smash.inp (generated)

000550008.b3lyp_6-31g(d).nwchem.inp (generated) 000550008.b3lyp_6-31g(d).log.xz 000550008.td-b3lyp_6-31g+(d).inp 000550008.td-b3lyp_6-31g+(d).log.xz

000550008.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550008.td-b3lyp_6-31+g(d).gjf (generated)

000550008.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550008.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550008.mol 000550008.PUBCHEM 000550008.mol (via Jmol)
000550009.b3lyp_6-31g(d).inp

000550009.b3lyp_6-31g(d).qchem.inp (generated)

000550009.b3lyp_6-31g(d).gjf (generated)

000550009.b3lyp_6-31g(d).firefly.inp (generated)

000550009.b3lyp_6-31g(d).smash.inp (generated)

000550009.b3lyp_6-31g(d).nwchem.inp (generated) 000550009.b3lyp_6-31g(d).log.xz 000550009.td-b3lyp_6-31g+(d).inp 000550009.td-b3lyp_6-31g+(d).log.xz

000550009.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550009.td-b3lyp_6-31+g(d).gjf (generated)

000550009.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550009.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550009.mol 000550009.PUBCHEM 000550009.mol (via Jmol)
000550010.b3lyp_6-31g(d).inp

000550010.b3lyp_6-31g(d).qchem.inp (generated)

000550010.b3lyp_6-31g(d).gjf (generated)

000550010.b3lyp_6-31g(d).firefly.inp (generated)

000550010.b3lyp_6-31g(d).smash.inp (generated)

000550010.b3lyp_6-31g(d).nwchem.inp (generated) 000550010.b3lyp_6-31g(d).log.xz 000550010.td-b3lyp_6-31g+(d).inp 000550010.td-b3lyp_6-31g+(d).log.xz

000550010.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550010.td-b3lyp_6-31+g(d).gjf (generated)

000550010.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550010.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550010.mol 000550010.PUBCHEM 000550010.mol (via Jmol)
000550013.b3lyp_6-31g(d).inp

000550013.b3lyp_6-31g(d).qchem.inp (generated)

000550013.b3lyp_6-31g(d).gjf (generated)

000550013.b3lyp_6-31g(d).firefly.inp (generated)

000550013.b3lyp_6-31g(d).smash.inp (generated)

000550013.b3lyp_6-31g(d).nwchem.inp (generated) 000550013.b3lyp_6-31g(d).log.xz 000550013.td-b3lyp_6-31g+(d).inp 000550013.td-b3lyp_6-31g+(d).log.xz

000550013.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550013.td-b3lyp_6-31+g(d).gjf (generated)

000550013.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550013.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550013.mol 000550013.PUBCHEM 000550013.mol (via Jmol)
000550015.b3lyp_6-31g(d).inp

000550015.b3lyp_6-31g(d).qchem.inp (generated)

000550015.b3lyp_6-31g(d).gjf (generated)

000550015.b3lyp_6-31g(d).firefly.inp (generated)

000550015.b3lyp_6-31g(d).smash.inp (generated)

000550015.b3lyp_6-31g(d).nwchem.inp (generated) 000550015.b3lyp_6-31g(d).log.xz 000550015.td-b3lyp_6-31g+(d).inp 000550015.td-b3lyp_6-31g+(d).log.xz

000550015.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550015.td-b3lyp_6-31+g(d).gjf (generated)

000550015.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550015.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550015.mol 000550015.PUBCHEM 000550015.mol (via Jmol)
000550016.b3lyp_6-31g(d).inp

000550016.b3lyp_6-31g(d).qchem.inp (generated)

000550016.b3lyp_6-31g(d).gjf (generated)

000550016.b3lyp_6-31g(d).firefly.inp (generated)

000550016.b3lyp_6-31g(d).smash.inp (generated)

000550016.b3lyp_6-31g(d).nwchem.inp (generated) 000550016.b3lyp_6-31g(d).log.xz 000550016.td-b3lyp_6-31g+(d).inp 000550016.td-b3lyp_6-31g+(d).log.xz

000550016.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550016.td-b3lyp_6-31+g(d).gjf (generated)

000550016.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550016.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550016.mol 000550016.PUBCHEM 000550016.mol (via Jmol)
000550017.b3lyp_6-31g(d).inp

000550017.b3lyp_6-31g(d).qchem.inp (generated)

000550017.b3lyp_6-31g(d).gjf (generated)

000550017.b3lyp_6-31g(d).firefly.inp (generated)

000550017.b3lyp_6-31g(d).smash.inp (generated)

000550017.b3lyp_6-31g(d).nwchem.inp (generated) 000550017.b3lyp_6-31g(d).log.xz 000550017.td-b3lyp_6-31g+(d).inp 000550017.td-b3lyp_6-31g+(d).log.xz

000550017.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550017.td-b3lyp_6-31+g(d).gjf (generated)

000550017.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550017.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550017.mol 000550017.PUBCHEM 000550017.mol (via Jmol)
000550020.b3lyp_6-31g(d).inp

000550020.b3lyp_6-31g(d).qchem.inp (generated)

000550020.b3lyp_6-31g(d).gjf (generated)

000550020.b3lyp_6-31g(d).firefly.inp (generated)

000550020.b3lyp_6-31g(d).smash.inp (generated)

000550020.b3lyp_6-31g(d).nwchem.inp (generated) 000550020.b3lyp_6-31g(d).log.xz 000550020.td-b3lyp_6-31g+(d).inp 000550020.td-b3lyp_6-31g+(d).log.xz

000550020.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550020.td-b3lyp_6-31+g(d).gjf (generated)

000550020.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550020.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550020.mol 000550020.PUBCHEM 000550020.mol (via Jmol)
000550026.b3lyp_6-31g(d).inp

000550026.b3lyp_6-31g(d).qchem.inp (generated)

000550026.b3lyp_6-31g(d).gjf (generated)

000550026.b3lyp_6-31g(d).firefly.inp (generated)

000550026.b3lyp_6-31g(d).smash.inp (generated)

000550026.b3lyp_6-31g(d).nwchem.inp (generated) 000550026.b3lyp_6-31g(d).log.xz 000550026.td-b3lyp_6-31g+(d).inp 000550026.td-b3lyp_6-31g+(d).log.xz

000550026.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550026.td-b3lyp_6-31+g(d).gjf (generated)

000550026.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550026.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550026.mol 000550026.PUBCHEM 000550026.mol (via Jmol)
000550027.b3lyp_6-31g(d).inp

000550027.b3lyp_6-31g(d).qchem.inp (generated)

000550027.b3lyp_6-31g(d).gjf (generated)

000550027.b3lyp_6-31g(d).firefly.inp (generated)

000550027.b3lyp_6-31g(d).smash.inp (generated)

000550027.b3lyp_6-31g(d).nwchem.inp (generated) 000550027.b3lyp_6-31g(d).log.xz 000550027.td-b3lyp_6-31g+(d).inp 000550027.td-b3lyp_6-31g+(d).log.xz

000550027.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550027.td-b3lyp_6-31+g(d).gjf (generated)

000550027.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550027.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550027.mol 000550027.PUBCHEM 000550027.mol (via Jmol)
000550028.b3lyp_6-31g(d).inp

000550028.b3lyp_6-31g(d).qchem.inp (generated)

000550028.b3lyp_6-31g(d).gjf (generated)

000550028.b3lyp_6-31g(d).firefly.inp (generated)

000550028.b3lyp_6-31g(d).smash.inp (generated)

000550028.b3lyp_6-31g(d).nwchem.inp (generated) 000550028.b3lyp_6-31g(d).log.xz 000550028.td-b3lyp_6-31g+(d).inp 000550028.td-b3lyp_6-31g+(d).log.xz

000550028.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550028.td-b3lyp_6-31+g(d).gjf (generated)

000550028.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550028.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550028.mol 000550028.PUBCHEM 000550028.mol (via Jmol)
000550029.b3lyp_6-31g(d).inp

000550029.b3lyp_6-31g(d).qchem.inp (generated)

000550029.b3lyp_6-31g(d).gjf (generated)

000550029.b3lyp_6-31g(d).firefly.inp (generated)

000550029.b3lyp_6-31g(d).smash.inp (generated)

000550029.b3lyp_6-31g(d).nwchem.inp (generated) 000550029.b3lyp_6-31g(d).log.xz 000550029.td-b3lyp_6-31g+(d).inp 000550029.td-b3lyp_6-31g+(d).log.xz

000550029.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550029.td-b3lyp_6-31+g(d).gjf (generated)

000550029.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550029.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550029.mol 000550029.PUBCHEM 000550029.mol (via Jmol)
000550030.b3lyp_6-31g(d).inp

000550030.b3lyp_6-31g(d).qchem.inp (generated)

000550030.b3lyp_6-31g(d).gjf (generated)

000550030.b3lyp_6-31g(d).firefly.inp (generated)

000550030.b3lyp_6-31g(d).smash.inp (generated)

000550030.b3lyp_6-31g(d).nwchem.inp (generated) 000550030.b3lyp_6-31g(d).log.xz 000550030.td-b3lyp_6-31g+(d).inp 000550030.td-b3lyp_6-31g+(d).log.xz

000550030.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550030.td-b3lyp_6-31+g(d).gjf (generated)

000550030.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550030.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550030.mol 000550030.PUBCHEM 000550030.mol (via Jmol)
000550032.b3lyp_6-31g(d).inp

000550032.b3lyp_6-31g(d).qchem.inp (generated)

000550032.b3lyp_6-31g(d).gjf (generated)

000550032.b3lyp_6-31g(d).firefly.inp (generated)

000550032.b3lyp_6-31g(d).smash.inp (generated)

000550032.b3lyp_6-31g(d).nwchem.inp (generated) 000550032.b3lyp_6-31g(d).log.xz 000550032.td-b3lyp_6-31g+(d).inp 000550032.td-b3lyp_6-31g+(d).log.xz

000550032.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550032.td-b3lyp_6-31+g(d).gjf (generated)

000550032.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550032.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550032.mol 000550032.PUBCHEM 000550032.mol (via Jmol)
000550035.b3lyp_6-31g(d).inp

000550035.b3lyp_6-31g(d).qchem.inp (generated)

000550035.b3lyp_6-31g(d).gjf (generated)

000550035.b3lyp_6-31g(d).firefly.inp (generated)

000550035.b3lyp_6-31g(d).smash.inp (generated)

000550035.b3lyp_6-31g(d).nwchem.inp (generated) 000550035.b3lyp_6-31g(d).log.xz 000550035.td-b3lyp_6-31g+(d).inp 000550035.td-b3lyp_6-31g+(d).log.xz

000550035.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550035.td-b3lyp_6-31+g(d).gjf (generated)

000550035.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550035.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550035.mol 000550035.PUBCHEM 000550035.mol (via Jmol)
000550036.b3lyp_6-31g(d).inp

000550036.b3lyp_6-31g(d).qchem.inp (generated)

000550036.b3lyp_6-31g(d).gjf (generated)

000550036.b3lyp_6-31g(d).firefly.inp (generated)

000550036.b3lyp_6-31g(d).smash.inp (generated)

000550036.b3lyp_6-31g(d).nwchem.inp (generated) 000550036.b3lyp_6-31g(d).log.xz 000550036.td-b3lyp_6-31g+(d).inp 000550036.td-b3lyp_6-31g+(d).log.xz

000550036.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550036.td-b3lyp_6-31+g(d).gjf (generated)

000550036.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550036.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550036.mol 000550036.PUBCHEM 000550036.mol (via Jmol)
000550039.b3lyp_6-31g(d).inp

000550039.b3lyp_6-31g(d).qchem.inp (generated)

000550039.b3lyp_6-31g(d).gjf (generated)

000550039.b3lyp_6-31g(d).firefly.inp (generated)

000550039.b3lyp_6-31g(d).smash.inp (generated)

000550039.b3lyp_6-31g(d).nwchem.inp (generated) 000550039.b3lyp_6-31g(d).log.xz 000550039.td-b3lyp_6-31g+(d).inp 000550039.td-b3lyp_6-31g+(d).log.xz

000550039.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550039.td-b3lyp_6-31+g(d).gjf (generated)

000550039.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550039.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550039.mol 000550039.PUBCHEM 000550039.mol (via Jmol)
000550040.b3lyp_6-31g(d).inp

000550040.b3lyp_6-31g(d).qchem.inp (generated)

000550040.b3lyp_6-31g(d).gjf (generated)

000550040.b3lyp_6-31g(d).firefly.inp (generated)

000550040.b3lyp_6-31g(d).smash.inp (generated)

000550040.b3lyp_6-31g(d).nwchem.inp (generated) 000550040.b3lyp_6-31g(d).log.xz 000550040.td-b3lyp_6-31g+(d).inp 000550040.td-b3lyp_6-31g+(d).log.xz

000550040.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550040.td-b3lyp_6-31+g(d).gjf (generated)

000550040.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550040.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550040.mol 000550040.PUBCHEM 000550040.mol (via Jmol)
000550042.b3lyp_6-31g(d).inp

000550042.b3lyp_6-31g(d).qchem.inp (generated)

000550042.b3lyp_6-31g(d).gjf (generated)

000550042.b3lyp_6-31g(d).firefly.inp (generated)

000550042.b3lyp_6-31g(d).smash.inp (generated)

000550042.b3lyp_6-31g(d).nwchem.inp (generated) 000550042.b3lyp_6-31g(d).log.xz 000550042.td-b3lyp_6-31g+(d).inp 000550042.td-b3lyp_6-31g+(d).log.xz

000550042.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550042.td-b3lyp_6-31+g(d).gjf (generated)

000550042.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550042.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550042.mol 000550042.PUBCHEM 000550042.mol (via Jmol)
000550043.b3lyp_6-31g(d).inp

000550043.b3lyp_6-31g(d).qchem.inp (generated)

000550043.b3lyp_6-31g(d).gjf (generated)

000550043.b3lyp_6-31g(d).firefly.inp (generated)

000550043.b3lyp_6-31g(d).smash.inp (generated)

000550043.b3lyp_6-31g(d).nwchem.inp (generated) 000550043.b3lyp_6-31g(d).log.xz 000550043.td-b3lyp_6-31g+(d).inp 000550043.td-b3lyp_6-31g+(d).log.xz

000550043.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550043.td-b3lyp_6-31+g(d).gjf (generated)

000550043.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550043.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550043.mol 000550043.PUBCHEM 000550043.mol (via Jmol)
000550045.b3lyp_6-31g(d).inp

000550045.b3lyp_6-31g(d).qchem.inp (generated)

000550045.b3lyp_6-31g(d).gjf (generated)

000550045.b3lyp_6-31g(d).firefly.inp (generated)

000550045.b3lyp_6-31g(d).smash.inp (generated)

000550045.b3lyp_6-31g(d).nwchem.inp (generated) 000550045.b3lyp_6-31g(d).log.xz 000550045.td-b3lyp_6-31g+(d).inp 000550045.td-b3lyp_6-31g+(d).log.xz

000550045.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550045.td-b3lyp_6-31+g(d).gjf (generated)

000550045.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550045.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550045.mol 000550045.PUBCHEM 000550045.mol (via Jmol)
000550046.b3lyp_6-31g(d).inp

000550046.b3lyp_6-31g(d).qchem.inp (generated)

000550046.b3lyp_6-31g(d).gjf (generated)

000550046.b3lyp_6-31g(d).firefly.inp (generated)

000550046.b3lyp_6-31g(d).smash.inp (generated)

000550046.b3lyp_6-31g(d).nwchem.inp (generated) 000550046.b3lyp_6-31g(d).log.xz 000550046.td-b3lyp_6-31g+(d).inp 000550046.td-b3lyp_6-31g+(d).log.xz

000550046.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550046.td-b3lyp_6-31+g(d).gjf (generated)

000550046.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550046.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550046.mol 000550046.PUBCHEM 000550046.mol (via Jmol)
000550048.b3lyp_6-31g(d).inp

000550048.b3lyp_6-31g(d).qchem.inp (generated)

000550048.b3lyp_6-31g(d).gjf (generated)

000550048.b3lyp_6-31g(d).firefly.inp (generated)

000550048.b3lyp_6-31g(d).smash.inp (generated)

000550048.b3lyp_6-31g(d).nwchem.inp (generated) 000550048.b3lyp_6-31g(d).log.xz 000550048.td-b3lyp_6-31g+(d).inp 000550048.td-b3lyp_6-31g+(d).log.xz

000550048.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550048.td-b3lyp_6-31+g(d).gjf (generated)

000550048.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550048.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550048.mol 000550048.PUBCHEM 000550048.mol (via Jmol)
000550050.b3lyp_6-31g(d).inp

000550050.b3lyp_6-31g(d).qchem.inp (generated)

000550050.b3lyp_6-31g(d).gjf (generated)

000550050.b3lyp_6-31g(d).firefly.inp (generated)

000550050.b3lyp_6-31g(d).smash.inp (generated)

000550050.b3lyp_6-31g(d).nwchem.inp (generated) 000550050.b3lyp_6-31g(d).log.xz 000550050.td-b3lyp_6-31g+(d).inp 000550050.td-b3lyp_6-31g+(d).log.xz

000550050.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550050.td-b3lyp_6-31+g(d).gjf (generated)

000550050.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550050.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550050.mol 000550050.PUBCHEM 000550050.mol (via Jmol)
000550064.b3lyp_6-31g(d).inp

000550064.b3lyp_6-31g(d).qchem.inp (generated)

000550064.b3lyp_6-31g(d).gjf (generated)

000550064.b3lyp_6-31g(d).firefly.inp (generated)

000550064.b3lyp_6-31g(d).smash.inp (generated)

000550064.b3lyp_6-31g(d).nwchem.inp (generated) 000550064.b3lyp_6-31g(d).log.xz 000550064.td-b3lyp_6-31g+(d).inp 000550064.td-b3lyp_6-31g+(d).log.xz

000550064.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550064.td-b3lyp_6-31+g(d).gjf (generated)

000550064.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550064.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550064.mol 000550064.PUBCHEM 000550064.mol (via Jmol)
000550065.b3lyp_6-31g(d).inp

000550065.b3lyp_6-31g(d).qchem.inp (generated)

000550065.b3lyp_6-31g(d).gjf (generated)

000550065.b3lyp_6-31g(d).firefly.inp (generated)

000550065.b3lyp_6-31g(d).smash.inp (generated)

000550065.b3lyp_6-31g(d).nwchem.inp (generated) 000550065.b3lyp_6-31g(d).log.xz 000550065.td-b3lyp_6-31g+(d).inp 000550065.td-b3lyp_6-31g+(d).log.xz

000550065.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550065.td-b3lyp_6-31+g(d).gjf (generated)

000550065.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550065.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550065.mol 000550065.PUBCHEM 000550065.mol (via Jmol)
000550066.b3lyp_6-31g(d).inp

000550066.b3lyp_6-31g(d).qchem.inp (generated)

000550066.b3lyp_6-31g(d).gjf (generated)

000550066.b3lyp_6-31g(d).firefly.inp (generated)

000550066.b3lyp_6-31g(d).smash.inp (generated)

000550066.b3lyp_6-31g(d).nwchem.inp (generated) 000550066.b3lyp_6-31g(d).log.xz 000550066.td-b3lyp_6-31g+(d).inp 000550066.td-b3lyp_6-31g+(d).log.xz

000550066.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550066.td-b3lyp_6-31+g(d).gjf (generated)

000550066.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550066.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550066.mol 000550066.PUBCHEM 000550066.mol (via Jmol)
000550067.b3lyp_6-31g(d).inp

000550067.b3lyp_6-31g(d).qchem.inp (generated)

000550067.b3lyp_6-31g(d).gjf (generated)

000550067.b3lyp_6-31g(d).firefly.inp (generated)

000550067.b3lyp_6-31g(d).smash.inp (generated)

000550067.b3lyp_6-31g(d).nwchem.inp (generated) 000550067.b3lyp_6-31g(d).log.xz 000550067.td-b3lyp_6-31g+(d).inp 000550067.td-b3lyp_6-31g+(d).log.xz

000550067.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550067.td-b3lyp_6-31+g(d).gjf (generated)

000550067.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550067.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550067.mol 000550067.PUBCHEM 000550067.mol (via Jmol)
000550070.b3lyp_6-31g(d).inp

000550070.b3lyp_6-31g(d).qchem.inp (generated)

000550070.b3lyp_6-31g(d).gjf (generated)

000550070.b3lyp_6-31g(d).firefly.inp (generated)

000550070.b3lyp_6-31g(d).smash.inp (generated)

000550070.b3lyp_6-31g(d).nwchem.inp (generated) 000550070.b3lyp_6-31g(d).log.xz 000550070.td-b3lyp_6-31g+(d).inp 000550070.td-b3lyp_6-31g+(d).log.xz

000550070.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550070.td-b3lyp_6-31+g(d).gjf (generated)

000550070.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550070.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550070.mol 000550070.PUBCHEM 000550070.mol (via Jmol)
000550073.b3lyp_6-31g(d).inp

000550073.b3lyp_6-31g(d).qchem.inp (generated)

000550073.b3lyp_6-31g(d).gjf (generated)

000550073.b3lyp_6-31g(d).firefly.inp (generated)

000550073.b3lyp_6-31g(d).smash.inp (generated)

000550073.b3lyp_6-31g(d).nwchem.inp (generated) 000550073.b3lyp_6-31g(d).log.xz 000550073.td-b3lyp_6-31g+(d).inp 000550073.td-b3lyp_6-31g+(d).log.xz

000550073.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550073.td-b3lyp_6-31+g(d).gjf (generated)

000550073.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550073.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550073.mol 000550073.PUBCHEM 000550073.mol (via Jmol)
000550076.b3lyp_6-31g(d).inp

000550076.b3lyp_6-31g(d).qchem.inp (generated)

000550076.b3lyp_6-31g(d).gjf (generated)

000550076.b3lyp_6-31g(d).firefly.inp (generated)

000550076.b3lyp_6-31g(d).smash.inp (generated)

000550076.b3lyp_6-31g(d).nwchem.inp (generated) 000550076.b3lyp_6-31g(d).log.xz 000550076.td-b3lyp_6-31g+(d).inp 000550076.td-b3lyp_6-31g+(d).log.xz

000550076.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550076.td-b3lyp_6-31+g(d).gjf (generated)

000550076.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550076.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550076.mol 000550076.PUBCHEM 000550076.mol (via Jmol)
000550079.b3lyp_6-31g(d).inp

000550079.b3lyp_6-31g(d).qchem.inp (generated)

000550079.b3lyp_6-31g(d).gjf (generated)

000550079.b3lyp_6-31g(d).firefly.inp (generated)

000550079.b3lyp_6-31g(d).smash.inp (generated)

000550079.b3lyp_6-31g(d).nwchem.inp (generated) 000550079.b3lyp_6-31g(d).log.xz 000550079.td-b3lyp_6-31g+(d).inp 000550079.td-b3lyp_6-31g+(d).log.xz

000550079.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550079.td-b3lyp_6-31+g(d).gjf (generated)

000550079.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550079.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550079.mol 000550079.PUBCHEM 000550079.mol (via Jmol)
000550088.b3lyp_6-31g(d).inp

000550088.b3lyp_6-31g(d).qchem.inp (generated)

000550088.b3lyp_6-31g(d).gjf (generated)

000550088.b3lyp_6-31g(d).firefly.inp (generated)

000550088.b3lyp_6-31g(d).smash.inp (generated)

000550088.b3lyp_6-31g(d).nwchem.inp (generated) 000550088.b3lyp_6-31g(d).log.xz 000550088.td-b3lyp_6-31g+(d).inp 000550088.td-b3lyp_6-31g+(d).log.xz

000550088.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550088.td-b3lyp_6-31+g(d).gjf (generated)

000550088.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550088.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550088.mol 000550088.PUBCHEM 000550088.mol (via Jmol)
000550089.b3lyp_6-31g(d).inp

000550089.b3lyp_6-31g(d).qchem.inp (generated)

000550089.b3lyp_6-31g(d).gjf (generated)

000550089.b3lyp_6-31g(d).firefly.inp (generated)

000550089.b3lyp_6-31g(d).smash.inp (generated)

000550089.b3lyp_6-31g(d).nwchem.inp (generated) 000550089.b3lyp_6-31g(d).log.xz 000550089.td-b3lyp_6-31g+(d).inp 000550089.td-b3lyp_6-31g+(d).log.xz

000550089.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550089.td-b3lyp_6-31+g(d).gjf (generated)

000550089.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550089.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550089.mol 000550089.PUBCHEM 000550089.mol (via Jmol)
000550095.b3lyp_6-31g(d).inp

000550095.b3lyp_6-31g(d).qchem.inp (generated)

000550095.b3lyp_6-31g(d).gjf (generated)

000550095.b3lyp_6-31g(d).firefly.inp (generated)

000550095.b3lyp_6-31g(d).smash.inp (generated)

000550095.b3lyp_6-31g(d).nwchem.inp (generated) 000550095.b3lyp_6-31g(d).log.xz 000550095.td-b3lyp_6-31g+(d).inp 000550095.td-b3lyp_6-31g+(d).log.xz

000550095.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550095.td-b3lyp_6-31+g(d).gjf (generated)

000550095.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550095.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550095.mol 000550095.PUBCHEM 000550095.mol (via Jmol)
000550098.b3lyp_6-31g(d).inp

000550098.b3lyp_6-31g(d).qchem.inp (generated)

000550098.b3lyp_6-31g(d).gjf (generated)

000550098.b3lyp_6-31g(d).firefly.inp (generated)

000550098.b3lyp_6-31g(d).smash.inp (generated)

000550098.b3lyp_6-31g(d).nwchem.inp (generated) 000550098.b3lyp_6-31g(d).log.xz 000550098.td-b3lyp_6-31g+(d).inp 000550098.td-b3lyp_6-31g+(d).log.xz

000550098.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550098.td-b3lyp_6-31+g(d).gjf (generated)

000550098.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550098.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550098.mol 000550098.PUBCHEM 000550098.mol (via Jmol)
000550106.b3lyp_6-31g(d).inp

000550106.b3lyp_6-31g(d).qchem.inp (generated)

000550106.b3lyp_6-31g(d).gjf (generated)

000550106.b3lyp_6-31g(d).firefly.inp (generated)

000550106.b3lyp_6-31g(d).smash.inp (generated)

000550106.b3lyp_6-31g(d).nwchem.inp (generated) 000550106.b3lyp_6-31g(d).log.xz 000550106.td-b3lyp_6-31g+(d).inp 000550106.td-b3lyp_6-31g+(d).log.xz

000550106.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550106.td-b3lyp_6-31+g(d).gjf (generated)

000550106.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550106.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550106.mol 000550106.PUBCHEM 000550106.mol (via Jmol)
000550107.b3lyp_6-31g(d).inp

000550107.b3lyp_6-31g(d).qchem.inp (generated)

000550107.b3lyp_6-31g(d).gjf (generated)

000550107.b3lyp_6-31g(d).firefly.inp (generated)

000550107.b3lyp_6-31g(d).smash.inp (generated)

000550107.b3lyp_6-31g(d).nwchem.inp (generated) 000550107.b3lyp_6-31g(d).log.xz 000550107.td-b3lyp_6-31g+(d).inp 000550107.td-b3lyp_6-31g+(d).log.xz

000550107.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550107.td-b3lyp_6-31+g(d).gjf (generated)

000550107.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550107.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550107.mol 000550107.PUBCHEM 000550107.mol (via Jmol)
000550110.b3lyp_6-31g(d).inp

000550110.b3lyp_6-31g(d).qchem.inp (generated)

000550110.b3lyp_6-31g(d).gjf (generated)

000550110.b3lyp_6-31g(d).firefly.inp (generated)

000550110.b3lyp_6-31g(d).smash.inp (generated)

000550110.b3lyp_6-31g(d).nwchem.inp (generated) 000550110.b3lyp_6-31g(d).log.xz 000550110.td-b3lyp_6-31g+(d).inp 000550110.td-b3lyp_6-31g+(d).log.xz

000550110.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550110.td-b3lyp_6-31+g(d).gjf (generated)

000550110.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550110.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550110.mol 000550110.PUBCHEM 000550110.mol (via Jmol)
000550112.b3lyp_6-31g(d).inp

000550112.b3lyp_6-31g(d).qchem.inp (generated)

000550112.b3lyp_6-31g(d).gjf (generated)

000550112.b3lyp_6-31g(d).firefly.inp (generated)

000550112.b3lyp_6-31g(d).smash.inp (generated)

000550112.b3lyp_6-31g(d).nwchem.inp (generated) 000550112.b3lyp_6-31g(d).log.xz 000550112.td-b3lyp_6-31g+(d).inp 000550112.td-b3lyp_6-31g+(d).log.xz

000550112.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550112.td-b3lyp_6-31+g(d).gjf (generated)

000550112.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550112.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550112.mol 000550112.PUBCHEM 000550112.mol (via Jmol)
000550118.b3lyp_6-31g(d).inp

000550118.b3lyp_6-31g(d).qchem.inp (generated)

000550118.b3lyp_6-31g(d).gjf (generated)

000550118.b3lyp_6-31g(d).firefly.inp (generated)

000550118.b3lyp_6-31g(d).smash.inp (generated)

000550118.b3lyp_6-31g(d).nwchem.inp (generated) 000550118.b3lyp_6-31g(d).log.xz 000550118.td-b3lyp_6-31g+(d).inp 000550118.td-b3lyp_6-31g+(d).log.xz

000550118.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550118.td-b3lyp_6-31+g(d).gjf (generated)

000550118.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550118.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550118.mol 000550118.PUBCHEM 000550118.mol (via Jmol)
000550119.b3lyp_6-31g(d).inp

000550119.b3lyp_6-31g(d).qchem.inp (generated)

000550119.b3lyp_6-31g(d).gjf (generated)

000550119.b3lyp_6-31g(d).firefly.inp (generated)

000550119.b3lyp_6-31g(d).smash.inp (generated)

000550119.b3lyp_6-31g(d).nwchem.inp (generated) 000550119.b3lyp_6-31g(d).log.xz 000550119.td-b3lyp_6-31g+(d).inp 000550119.td-b3lyp_6-31g+(d).log.xz

000550119.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550119.td-b3lyp_6-31+g(d).gjf (generated)

000550119.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550119.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550119.mol 000550119.PUBCHEM 000550119.mol (via Jmol)
000550129.b3lyp_6-31g(d).inp

000550129.b3lyp_6-31g(d).qchem.inp (generated)

000550129.b3lyp_6-31g(d).gjf (generated)

000550129.b3lyp_6-31g(d).firefly.inp (generated)

000550129.b3lyp_6-31g(d).smash.inp (generated)

000550129.b3lyp_6-31g(d).nwchem.inp (generated) 000550129.b3lyp_6-31g(d).log.xz 000550129.td-b3lyp_6-31g+(d).inp 000550129.td-b3lyp_6-31g+(d).log.xz

000550129.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550129.td-b3lyp_6-31+g(d).gjf (generated)

000550129.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550129.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550129.mol 000550129.PUBCHEM 000550129.mol (via Jmol)
000550133.b3lyp_6-31g(d).inp

000550133.b3lyp_6-31g(d).qchem.inp (generated)

000550133.b3lyp_6-31g(d).gjf (generated)

000550133.b3lyp_6-31g(d).firefly.inp (generated)

000550133.b3lyp_6-31g(d).smash.inp (generated)

000550133.b3lyp_6-31g(d).nwchem.inp (generated) 000550133.b3lyp_6-31g(d).log.xz 000550133.td-b3lyp_6-31g+(d).inp 000550133.td-b3lyp_6-31g+(d).log.xz

000550133.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550133.td-b3lyp_6-31+g(d).gjf (generated)

000550133.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550133.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550133.mol 000550133.PUBCHEM 000550133.mol (via Jmol)
000550134.b3lyp_6-31g(d).inp

000550134.b3lyp_6-31g(d).qchem.inp (generated)

000550134.b3lyp_6-31g(d).gjf (generated)

000550134.b3lyp_6-31g(d).firefly.inp (generated)

000550134.b3lyp_6-31g(d).smash.inp (generated)

000550134.b3lyp_6-31g(d).nwchem.inp (generated) 000550134.b3lyp_6-31g(d).log.xz 000550134.td-b3lyp_6-31g+(d).inp 000550134.td-b3lyp_6-31g+(d).log.xz

000550134.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550134.td-b3lyp_6-31+g(d).gjf (generated)

000550134.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550134.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550134.mol 000550134.PUBCHEM 000550134.mol (via Jmol)
000550135.b3lyp_6-31g(d).inp

000550135.b3lyp_6-31g(d).qchem.inp (generated)

000550135.b3lyp_6-31g(d).gjf (generated)

000550135.b3lyp_6-31g(d).firefly.inp (generated)

000550135.b3lyp_6-31g(d).smash.inp (generated)

000550135.b3lyp_6-31g(d).nwchem.inp (generated) 000550135.b3lyp_6-31g(d).log.xz 000550135.td-b3lyp_6-31g+(d).inp 000550135.td-b3lyp_6-31g+(d).log.xz

000550135.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550135.td-b3lyp_6-31+g(d).gjf (generated)

000550135.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550135.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550135.mol 000550135.PUBCHEM 000550135.mol (via Jmol)
000550136.b3lyp_6-31g(d).inp

000550136.b3lyp_6-31g(d).qchem.inp (generated)

000550136.b3lyp_6-31g(d).gjf (generated)

000550136.b3lyp_6-31g(d).firefly.inp (generated)

000550136.b3lyp_6-31g(d).smash.inp (generated)

000550136.b3lyp_6-31g(d).nwchem.inp (generated) 000550136.b3lyp_6-31g(d).log.xz 000550136.td-b3lyp_6-31g+(d).inp 000550136.td-b3lyp_6-31g+(d).log.xz

000550136.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550136.td-b3lyp_6-31+g(d).gjf (generated)

000550136.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550136.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550136.mol 000550136.PUBCHEM 000550136.mol (via Jmol)
000550137.b3lyp_6-31g(d).inp

000550137.b3lyp_6-31g(d).qchem.inp (generated)

000550137.b3lyp_6-31g(d).gjf (generated)

000550137.b3lyp_6-31g(d).firefly.inp (generated)

000550137.b3lyp_6-31g(d).smash.inp (generated)

000550137.b3lyp_6-31g(d).nwchem.inp (generated) 000550137.b3lyp_6-31g(d).log.xz 000550137.td-b3lyp_6-31g+(d).inp 000550137.td-b3lyp_6-31g+(d).log.xz

000550137.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550137.td-b3lyp_6-31+g(d).gjf (generated)

000550137.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550137.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550137.mol 000550137.PUBCHEM 000550137.mol (via Jmol)
000550139.b3lyp_6-31g(d).inp

000550139.b3lyp_6-31g(d).qchem.inp (generated)

000550139.b3lyp_6-31g(d).gjf (generated)

000550139.b3lyp_6-31g(d).firefly.inp (generated)

000550139.b3lyp_6-31g(d).smash.inp (generated)

000550139.b3lyp_6-31g(d).nwchem.inp (generated) 000550139.b3lyp_6-31g(d).log.xz 000550139.td-b3lyp_6-31g+(d).inp 000550139.td-b3lyp_6-31g+(d).log.xz

000550139.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550139.td-b3lyp_6-31+g(d).gjf (generated)

000550139.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550139.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550139.mol 000550139.PUBCHEM 000550139.mol (via Jmol)
000550140.b3lyp_6-31g(d).inp

000550140.b3lyp_6-31g(d).qchem.inp (generated)

000550140.b3lyp_6-31g(d).gjf (generated)

000550140.b3lyp_6-31g(d).firefly.inp (generated)

000550140.b3lyp_6-31g(d).smash.inp (generated)

000550140.b3lyp_6-31g(d).nwchem.inp (generated) 000550140.b3lyp_6-31g(d).log.xz 000550140.td-b3lyp_6-31g+(d).inp 000550140.td-b3lyp_6-31g+(d).log.xz

000550140.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550140.td-b3lyp_6-31+g(d).gjf (generated)

000550140.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550140.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550140.mol 000550140.PUBCHEM 000550140.mol (via Jmol)
000550142.b3lyp_6-31g(d).inp

000550142.b3lyp_6-31g(d).qchem.inp (generated)

000550142.b3lyp_6-31g(d).gjf (generated)

000550142.b3lyp_6-31g(d).firefly.inp (generated)

000550142.b3lyp_6-31g(d).smash.inp (generated)

000550142.b3lyp_6-31g(d).nwchem.inp (generated) 000550142.b3lyp_6-31g(d).log.xz 000550142.td-b3lyp_6-31g+(d).inp 000550142.td-b3lyp_6-31g+(d).log.xz

000550142.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550142.td-b3lyp_6-31+g(d).gjf (generated)

000550142.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550142.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550142.mol 000550142.PUBCHEM 000550142.mol (via Jmol)
000550144.b3lyp_6-31g(d).inp

000550144.b3lyp_6-31g(d).qchem.inp (generated)

000550144.b3lyp_6-31g(d).gjf (generated)

000550144.b3lyp_6-31g(d).firefly.inp (generated)

000550144.b3lyp_6-31g(d).smash.inp (generated)

000550144.b3lyp_6-31g(d).nwchem.inp (generated) 000550144.b3lyp_6-31g(d).log.xz 000550144.td-b3lyp_6-31g+(d).inp 000550144.td-b3lyp_6-31g+(d).log.xz

000550144.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550144.td-b3lyp_6-31+g(d).gjf (generated)

000550144.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550144.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550144.mol 000550144.PUBCHEM 000550144.mol (via Jmol)
000550148.b3lyp_6-31g(d).inp

000550148.b3lyp_6-31g(d).qchem.inp (generated)

000550148.b3lyp_6-31g(d).gjf (generated)

000550148.b3lyp_6-31g(d).firefly.inp (generated)

000550148.b3lyp_6-31g(d).smash.inp (generated)

000550148.b3lyp_6-31g(d).nwchem.inp (generated) 000550148.b3lyp_6-31g(d).log.xz 000550148.td-b3lyp_6-31g+(d).inp 000550148.td-b3lyp_6-31g+(d).log.xz

000550148.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550148.td-b3lyp_6-31+g(d).gjf (generated)

000550148.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550148.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550148.mol 000550148.PUBCHEM 000550148.mol (via Jmol)
000550150.b3lyp_6-31g(d).inp

000550150.b3lyp_6-31g(d).qchem.inp (generated)

000550150.b3lyp_6-31g(d).gjf (generated)

000550150.b3lyp_6-31g(d).firefly.inp (generated)

000550150.b3lyp_6-31g(d).smash.inp (generated)

000550150.b3lyp_6-31g(d).nwchem.inp (generated) 000550150.b3lyp_6-31g(d).log.xz 000550150.td-b3lyp_6-31g+(d).inp 000550150.td-b3lyp_6-31g+(d).log.xz

000550150.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550150.td-b3lyp_6-31+g(d).gjf (generated)

000550150.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550150.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550150.mol 000550150.PUBCHEM 000550150.mol (via Jmol)
000550151.b3lyp_6-31g(d).inp

000550151.b3lyp_6-31g(d).qchem.inp (generated)

000550151.b3lyp_6-31g(d).gjf (generated)

000550151.b3lyp_6-31g(d).firefly.inp (generated)

000550151.b3lyp_6-31g(d).smash.inp (generated)

000550151.b3lyp_6-31g(d).nwchem.inp (generated) 000550151.b3lyp_6-31g(d).log.xz 000550151.td-b3lyp_6-31g+(d).inp 000550151.td-b3lyp_6-31g+(d).log.xz

000550151.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550151.td-b3lyp_6-31+g(d).gjf (generated)

000550151.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550151.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550151.mol 000550151.PUBCHEM 000550151.mol (via Jmol)
000550152.b3lyp_6-31g(d).inp

000550152.b3lyp_6-31g(d).qchem.inp (generated)

000550152.b3lyp_6-31g(d).gjf (generated)

000550152.b3lyp_6-31g(d).firefly.inp (generated)

000550152.b3lyp_6-31g(d).smash.inp (generated)

000550152.b3lyp_6-31g(d).nwchem.inp (generated) 000550152.b3lyp_6-31g(d).log.xz 000550152.td-b3lyp_6-31g+(d).inp 000550152.td-b3lyp_6-31g+(d).log.xz

000550152.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550152.td-b3lyp_6-31+g(d).gjf (generated)

000550152.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550152.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550152.mol 000550152.PUBCHEM 000550152.mol (via Jmol)
000550158.b3lyp_6-31g(d).inp

000550158.b3lyp_6-31g(d).qchem.inp (generated)

000550158.b3lyp_6-31g(d).gjf (generated)

000550158.b3lyp_6-31g(d).firefly.inp (generated)

000550158.b3lyp_6-31g(d).smash.inp (generated)

000550158.b3lyp_6-31g(d).nwchem.inp (generated) 000550158.b3lyp_6-31g(d).log.xz 000550158.td-b3lyp_6-31g+(d).inp 000550158.td-b3lyp_6-31g+(d).log.xz

000550158.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550158.td-b3lyp_6-31+g(d).gjf (generated)

000550158.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550158.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550158.mol 000550158.PUBCHEM 000550158.mol (via Jmol)
000550165.b3lyp_6-31g(d).inp

000550165.b3lyp_6-31g(d).qchem.inp (generated)

000550165.b3lyp_6-31g(d).gjf (generated)

000550165.b3lyp_6-31g(d).firefly.inp (generated)

000550165.b3lyp_6-31g(d).smash.inp (generated)

000550165.b3lyp_6-31g(d).nwchem.inp (generated) 000550165.b3lyp_6-31g(d).log.xz 000550165.td-b3lyp_6-31g+(d).inp 000550165.td-b3lyp_6-31g+(d).log.xz

000550165.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550165.td-b3lyp_6-31+g(d).gjf (generated)

000550165.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550165.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550165.mol 000550165.PUBCHEM 000550165.mol (via Jmol)
000550166.b3lyp_6-31g(d).inp

000550166.b3lyp_6-31g(d).qchem.inp (generated)

000550166.b3lyp_6-31g(d).gjf (generated)

000550166.b3lyp_6-31g(d).firefly.inp (generated)

000550166.b3lyp_6-31g(d).smash.inp (generated)

000550166.b3lyp_6-31g(d).nwchem.inp (generated) 000550166.b3lyp_6-31g(d).log.xz 000550166.td-b3lyp_6-31g+(d).inp 000550166.td-b3lyp_6-31g+(d).log.xz

000550166.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550166.td-b3lyp_6-31+g(d).gjf (generated)

000550166.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550166.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550166.mol 000550166.PUBCHEM 000550166.mol (via Jmol)
000550167.b3lyp_6-31g(d).inp

000550167.b3lyp_6-31g(d).qchem.inp (generated)

000550167.b3lyp_6-31g(d).gjf (generated)

000550167.b3lyp_6-31g(d).firefly.inp (generated)

000550167.b3lyp_6-31g(d).smash.inp (generated)

000550167.b3lyp_6-31g(d).nwchem.inp (generated) 000550167.b3lyp_6-31g(d).log.xz 000550167.td-b3lyp_6-31g+(d).inp 000550167.td-b3lyp_6-31g+(d).log.xz

000550167.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550167.td-b3lyp_6-31+g(d).gjf (generated)

000550167.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550167.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550167.mol 000550167.PUBCHEM 000550167.mol (via Jmol)
000550168.b3lyp_6-31g(d).inp

000550168.b3lyp_6-31g(d).qchem.inp (generated)

000550168.b3lyp_6-31g(d).gjf (generated)

000550168.b3lyp_6-31g(d).firefly.inp (generated)

000550168.b3lyp_6-31g(d).smash.inp (generated)

000550168.b3lyp_6-31g(d).nwchem.inp (generated) 000550168.b3lyp_6-31g(d).log.xz 000550168.td-b3lyp_6-31g+(d).inp 000550168.td-b3lyp_6-31g+(d).log.xz

000550168.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550168.td-b3lyp_6-31+g(d).gjf (generated)

000550168.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550168.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550168.mol 000550168.PUBCHEM 000550168.mol (via Jmol)
000550169.b3lyp_6-31g(d).inp

000550169.b3lyp_6-31g(d).qchem.inp (generated)

000550169.b3lyp_6-31g(d).gjf (generated)

000550169.b3lyp_6-31g(d).firefly.inp (generated)

000550169.b3lyp_6-31g(d).smash.inp (generated)

000550169.b3lyp_6-31g(d).nwchem.inp (generated) 000550169.b3lyp_6-31g(d).log.xz 000550169.td-b3lyp_6-31g+(d).inp 000550169.td-b3lyp_6-31g+(d).log.xz

000550169.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550169.td-b3lyp_6-31+g(d).gjf (generated)

000550169.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550169.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550169.mol 000550169.PUBCHEM 000550169.mol (via Jmol)
000550170.b3lyp_6-31g(d).inp

000550170.b3lyp_6-31g(d).qchem.inp (generated)

000550170.b3lyp_6-31g(d).gjf (generated)

000550170.b3lyp_6-31g(d).firefly.inp (generated)

000550170.b3lyp_6-31g(d).smash.inp (generated)

000550170.b3lyp_6-31g(d).nwchem.inp (generated) 000550170.b3lyp_6-31g(d).log.xz 000550170.td-b3lyp_6-31g+(d).inp 000550170.td-b3lyp_6-31g+(d).log.xz

000550170.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550170.td-b3lyp_6-31+g(d).gjf (generated)

000550170.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550170.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550170.mol 000550170.PUBCHEM 000550170.mol (via Jmol)
000550171.b3lyp_6-31g(d).inp

000550171.b3lyp_6-31g(d).qchem.inp (generated)

000550171.b3lyp_6-31g(d).gjf (generated)

000550171.b3lyp_6-31g(d).firefly.inp (generated)

000550171.b3lyp_6-31g(d).smash.inp (generated)

000550171.b3lyp_6-31g(d).nwchem.inp (generated) 000550171.b3lyp_6-31g(d).log.xz 000550171.td-b3lyp_6-31g+(d).inp 000550171.td-b3lyp_6-31g+(d).log.xz

000550171.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550171.td-b3lyp_6-31+g(d).gjf (generated)

000550171.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550171.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550171.mol 000550171.PUBCHEM 000550171.mol (via Jmol)
000550172.b3lyp_6-31g(d).inp

000550172.b3lyp_6-31g(d).qchem.inp (generated)

000550172.b3lyp_6-31g(d).gjf (generated)

000550172.b3lyp_6-31g(d).firefly.inp (generated)

000550172.b3lyp_6-31g(d).smash.inp (generated)

000550172.b3lyp_6-31g(d).nwchem.inp (generated) 000550172.b3lyp_6-31g(d).log.xz 000550172.td-b3lyp_6-31g+(d).inp 000550172.td-b3lyp_6-31g+(d).log.xz

000550172.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550172.td-b3lyp_6-31+g(d).gjf (generated)

000550172.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550172.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550172.mol 000550172.PUBCHEM 000550172.mol (via Jmol)
000550173.b3lyp_6-31g(d).inp

000550173.b3lyp_6-31g(d).qchem.inp (generated)

000550173.b3lyp_6-31g(d).gjf (generated)

000550173.b3lyp_6-31g(d).firefly.inp (generated)

000550173.b3lyp_6-31g(d).smash.inp (generated)

000550173.b3lyp_6-31g(d).nwchem.inp (generated) 000550173.b3lyp_6-31g(d).log.xz 000550173.td-b3lyp_6-31g+(d).inp 000550173.td-b3lyp_6-31g+(d).log.xz

000550173.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550173.td-b3lyp_6-31+g(d).gjf (generated)

000550173.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550173.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550173.mol 000550173.PUBCHEM 000550173.mol (via Jmol)
000550174.b3lyp_6-31g(d).inp

000550174.b3lyp_6-31g(d).qchem.inp (generated)

000550174.b3lyp_6-31g(d).gjf (generated)

000550174.b3lyp_6-31g(d).firefly.inp (generated)

000550174.b3lyp_6-31g(d).smash.inp (generated)

000550174.b3lyp_6-31g(d).nwchem.inp (generated) 000550174.b3lyp_6-31g(d).log.xz 000550174.td-b3lyp_6-31g+(d).inp 000550174.td-b3lyp_6-31g+(d).log.xz

000550174.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550174.td-b3lyp_6-31+g(d).gjf (generated)

000550174.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550174.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550174.mol 000550174.PUBCHEM 000550174.mol (via Jmol)
000550175.b3lyp_6-31g(d).inp

000550175.b3lyp_6-31g(d).qchem.inp (generated)

000550175.b3lyp_6-31g(d).gjf (generated)

000550175.b3lyp_6-31g(d).firefly.inp (generated)

000550175.b3lyp_6-31g(d).smash.inp (generated)

000550175.b3lyp_6-31g(d).nwchem.inp (generated) 000550175.b3lyp_6-31g(d).log.xz 000550175.td-b3lyp_6-31g+(d).inp 000550175.td-b3lyp_6-31g+(d).log.xz

000550175.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550175.td-b3lyp_6-31+g(d).gjf (generated)

000550175.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550175.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550175.mol 000550175.PUBCHEM 000550175.mol (via Jmol)
000550185.b3lyp_6-31g(d).inp

000550185.b3lyp_6-31g(d).qchem.inp (generated)

000550185.b3lyp_6-31g(d).gjf (generated)

000550185.b3lyp_6-31g(d).firefly.inp (generated)

000550185.b3lyp_6-31g(d).smash.inp (generated)

000550185.b3lyp_6-31g(d).nwchem.inp (generated) 000550185.b3lyp_6-31g(d).log.xz 000550185.td-b3lyp_6-31g+(d).inp 000550185.td-b3lyp_6-31g+(d).log.xz

000550185.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550185.td-b3lyp_6-31+g(d).gjf (generated)

000550185.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550185.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550185.mol 000550185.PUBCHEM 000550185.mol (via Jmol)
000550189.b3lyp_6-31g(d).inp

000550189.b3lyp_6-31g(d).qchem.inp (generated)

000550189.b3lyp_6-31g(d).gjf (generated)

000550189.b3lyp_6-31g(d).firefly.inp (generated)

000550189.b3lyp_6-31g(d).smash.inp (generated)

000550189.b3lyp_6-31g(d).nwchem.inp (generated) 000550189.b3lyp_6-31g(d).log.xz 000550189.td-b3lyp_6-31g+(d).inp 000550189.td-b3lyp_6-31g+(d).log.xz

000550189.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550189.td-b3lyp_6-31+g(d).gjf (generated)

000550189.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550189.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550189.mol 000550189.PUBCHEM 000550189.mol (via Jmol)
000550193.b3lyp_6-31g(d).inp

000550193.b3lyp_6-31g(d).qchem.inp (generated)

000550193.b3lyp_6-31g(d).gjf (generated)

000550193.b3lyp_6-31g(d).firefly.inp (generated)

000550193.b3lyp_6-31g(d).smash.inp (generated)

000550193.b3lyp_6-31g(d).nwchem.inp (generated) 000550193.b3lyp_6-31g(d).log.xz 000550193.td-b3lyp_6-31g+(d).inp 000550193.td-b3lyp_6-31g+(d).log.xz

000550193.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550193.td-b3lyp_6-31+g(d).gjf (generated)

000550193.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550193.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550193.mol 000550193.PUBCHEM 000550193.mol (via Jmol)
000550196.b3lyp_6-31g(d).inp

000550196.b3lyp_6-31g(d).qchem.inp (generated)

000550196.b3lyp_6-31g(d).gjf (generated)

000550196.b3lyp_6-31g(d).firefly.inp (generated)

000550196.b3lyp_6-31g(d).smash.inp (generated)

000550196.b3lyp_6-31g(d).nwchem.inp (generated) 000550196.b3lyp_6-31g(d).log.xz 000550196.td-b3lyp_6-31g+(d).inp 000550196.td-b3lyp_6-31g+(d).log.xz

000550196.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550196.td-b3lyp_6-31+g(d).gjf (generated)

000550196.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550196.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550196.mol 000550196.PUBCHEM 000550196.mol (via Jmol)
000550198.b3lyp_6-31g(d).inp

000550198.b3lyp_6-31g(d).qchem.inp (generated)

000550198.b3lyp_6-31g(d).gjf (generated)

000550198.b3lyp_6-31g(d).firefly.inp (generated)

000550198.b3lyp_6-31g(d).smash.inp (generated)

000550198.b3lyp_6-31g(d).nwchem.inp (generated) 000550198.b3lyp_6-31g(d).log.xz 000550198.td-b3lyp_6-31g+(d).inp 000550198.td-b3lyp_6-31g+(d).log.xz

000550198.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550198.td-b3lyp_6-31+g(d).gjf (generated)

000550198.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550198.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550198.mol 000550198.PUBCHEM 000550198.mol (via Jmol)
000550200.b3lyp_6-31g(d).inp

000550200.b3lyp_6-31g(d).qchem.inp (generated)

000550200.b3lyp_6-31g(d).gjf (generated)

000550200.b3lyp_6-31g(d).firefly.inp (generated)

000550200.b3lyp_6-31g(d).smash.inp (generated)

000550200.b3lyp_6-31g(d).nwchem.inp (generated) 000550200.b3lyp_6-31g(d).log.xz 000550200.td-b3lyp_6-31g+(d).inp 000550200.td-b3lyp_6-31g+(d).log.xz

000550200.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550200.td-b3lyp_6-31+g(d).gjf (generated)

000550200.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550200.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550200.mol 000550200.PUBCHEM 000550200.mol (via Jmol)
000550202.b3lyp_6-31g(d).inp

000550202.b3lyp_6-31g(d).qchem.inp (generated)

000550202.b3lyp_6-31g(d).gjf (generated)

000550202.b3lyp_6-31g(d).firefly.inp (generated)

000550202.b3lyp_6-31g(d).smash.inp (generated)

000550202.b3lyp_6-31g(d).nwchem.inp (generated) 000550202.b3lyp_6-31g(d).log.xz 000550202.td-b3lyp_6-31g+(d).inp 000550202.td-b3lyp_6-31g+(d).log.xz

000550202.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550202.td-b3lyp_6-31+g(d).gjf (generated)

000550202.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550202.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550202.mol 000550202.PUBCHEM 000550202.mol (via Jmol)
000550203.b3lyp_6-31g(d).inp

000550203.b3lyp_6-31g(d).qchem.inp (generated)

000550203.b3lyp_6-31g(d).gjf (generated)

000550203.b3lyp_6-31g(d).firefly.inp (generated)

000550203.b3lyp_6-31g(d).smash.inp (generated)

000550203.b3lyp_6-31g(d).nwchem.inp (generated) 000550203.b3lyp_6-31g(d).log.xz 000550203.td-b3lyp_6-31g+(d).inp 000550203.td-b3lyp_6-31g+(d).log.xz

000550203.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550203.td-b3lyp_6-31+g(d).gjf (generated)

000550203.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550203.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550203.mol 000550203.PUBCHEM 000550203.mol (via Jmol)
000550204.b3lyp_6-31g(d).inp

000550204.b3lyp_6-31g(d).qchem.inp (generated)

000550204.b3lyp_6-31g(d).gjf (generated)

000550204.b3lyp_6-31g(d).firefly.inp (generated)

000550204.b3lyp_6-31g(d).smash.inp (generated)

000550204.b3lyp_6-31g(d).nwchem.inp (generated) 000550204.b3lyp_6-31g(d).log.xz 000550204.td-b3lyp_6-31g+(d).inp 000550204.td-b3lyp_6-31g+(d).log.xz

000550204.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550204.td-b3lyp_6-31+g(d).gjf (generated)

000550204.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550204.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550204.mol 000550204.PUBCHEM 000550204.mol (via Jmol)
000550206.b3lyp_6-31g(d).inp

000550206.b3lyp_6-31g(d).qchem.inp (generated)

000550206.b3lyp_6-31g(d).gjf (generated)

000550206.b3lyp_6-31g(d).firefly.inp (generated)

000550206.b3lyp_6-31g(d).smash.inp (generated)

000550206.b3lyp_6-31g(d).nwchem.inp (generated) 000550206.b3lyp_6-31g(d).log.xz 000550206.td-b3lyp_6-31g+(d).inp 000550206.td-b3lyp_6-31g+(d).log.xz

000550206.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550206.td-b3lyp_6-31+g(d).gjf (generated)

000550206.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550206.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550206.mol 000550206.PUBCHEM 000550206.mol (via Jmol)
000550211.b3lyp_6-31g(d).inp

000550211.b3lyp_6-31g(d).qchem.inp (generated)

000550211.b3lyp_6-31g(d).gjf (generated)

000550211.b3lyp_6-31g(d).firefly.inp (generated)

000550211.b3lyp_6-31g(d).smash.inp (generated)

000550211.b3lyp_6-31g(d).nwchem.inp (generated) 000550211.b3lyp_6-31g(d).log.xz 000550211.td-b3lyp_6-31g+(d).inp 000550211.td-b3lyp_6-31g+(d).log.xz

000550211.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550211.td-b3lyp_6-31+g(d).gjf (generated)

000550211.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550211.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550211.mol 000550211.PUBCHEM 000550211.mol (via Jmol)
000550212.b3lyp_6-31g(d).inp

000550212.b3lyp_6-31g(d).qchem.inp (generated)

000550212.b3lyp_6-31g(d).gjf (generated)

000550212.b3lyp_6-31g(d).firefly.inp (generated)

000550212.b3lyp_6-31g(d).smash.inp (generated)

000550212.b3lyp_6-31g(d).nwchem.inp (generated) 000550212.b3lyp_6-31g(d).log.xz 000550212.td-b3lyp_6-31g+(d).inp 000550212.td-b3lyp_6-31g+(d).log.xz

000550212.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550212.td-b3lyp_6-31+g(d).gjf (generated)

000550212.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550212.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550212.mol 000550212.PUBCHEM 000550212.mol (via Jmol)
000550214.b3lyp_6-31g(d).inp

000550214.b3lyp_6-31g(d).qchem.inp (generated)

000550214.b3lyp_6-31g(d).gjf (generated)

000550214.b3lyp_6-31g(d).firefly.inp (generated)

000550214.b3lyp_6-31g(d).smash.inp (generated)

000550214.b3lyp_6-31g(d).nwchem.inp (generated) 000550214.b3lyp_6-31g(d).log.xz 000550214.td-b3lyp_6-31g+(d).inp 000550214.td-b3lyp_6-31g+(d).log.xz

000550214.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550214.td-b3lyp_6-31+g(d).gjf (generated)

000550214.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550214.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550214.mol 000550214.PUBCHEM 000550214.mol (via Jmol)
000550217.b3lyp_6-31g(d).inp

000550217.b3lyp_6-31g(d).qchem.inp (generated)

000550217.b3lyp_6-31g(d).gjf (generated)

000550217.b3lyp_6-31g(d).firefly.inp (generated)

000550217.b3lyp_6-31g(d).smash.inp (generated)

000550217.b3lyp_6-31g(d).nwchem.inp (generated) 000550217.b3lyp_6-31g(d).log.xz 000550217.td-b3lyp_6-31g+(d).inp 000550217.td-b3lyp_6-31g+(d).log.xz

000550217.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550217.td-b3lyp_6-31+g(d).gjf (generated)

000550217.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550217.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550217.mol 000550217.PUBCHEM 000550217.mol (via Jmol)
000550221.b3lyp_6-31g(d).inp

000550221.b3lyp_6-31g(d).qchem.inp (generated)

000550221.b3lyp_6-31g(d).gjf (generated)

000550221.b3lyp_6-31g(d).firefly.inp (generated)

000550221.b3lyp_6-31g(d).smash.inp (generated)

000550221.b3lyp_6-31g(d).nwchem.inp (generated) 000550221.b3lyp_6-31g(d).log.xz 000550221.td-b3lyp_6-31g+(d).inp 000550221.td-b3lyp_6-31g+(d).log.xz

000550221.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550221.td-b3lyp_6-31+g(d).gjf (generated)

000550221.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550221.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550221.mol 000550221.PUBCHEM 000550221.mol (via Jmol)
000550222.b3lyp_6-31g(d).inp

000550222.b3lyp_6-31g(d).qchem.inp (generated)

000550222.b3lyp_6-31g(d).gjf (generated)

000550222.b3lyp_6-31g(d).firefly.inp (generated)

000550222.b3lyp_6-31g(d).smash.inp (generated)

000550222.b3lyp_6-31g(d).nwchem.inp (generated) 000550222.b3lyp_6-31g(d).log.xz 000550222.td-b3lyp_6-31g+(d).inp 000550222.td-b3lyp_6-31g+(d).log.xz

000550222.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550222.td-b3lyp_6-31+g(d).gjf (generated)

000550222.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550222.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550222.mol 000550222.PUBCHEM 000550222.mol (via Jmol)
000550224.b3lyp_6-31g(d).inp

000550224.b3lyp_6-31g(d).qchem.inp (generated)

000550224.b3lyp_6-31g(d).gjf (generated)

000550224.b3lyp_6-31g(d).firefly.inp (generated)

000550224.b3lyp_6-31g(d).smash.inp (generated)

000550224.b3lyp_6-31g(d).nwchem.inp (generated) 000550224.b3lyp_6-31g(d).log.xz 000550224.td-b3lyp_6-31g+(d).inp 000550224.td-b3lyp_6-31g+(d).log.xz

000550224.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550224.td-b3lyp_6-31+g(d).gjf (generated)

000550224.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550224.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550224.mol 000550224.PUBCHEM 000550224.mol (via Jmol)
000550225.b3lyp_6-31g(d).inp

000550225.b3lyp_6-31g(d).qchem.inp (generated)

000550225.b3lyp_6-31g(d).gjf (generated)

000550225.b3lyp_6-31g(d).firefly.inp (generated)

000550225.b3lyp_6-31g(d).smash.inp (generated)

000550225.b3lyp_6-31g(d).nwchem.inp (generated) 000550225.b3lyp_6-31g(d).log.xz 000550225.td-b3lyp_6-31g+(d).inp 000550225.td-b3lyp_6-31g+(d).log.xz

000550225.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550225.td-b3lyp_6-31+g(d).gjf (generated)

000550225.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550225.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550225.mol 000550225.PUBCHEM 000550225.mol (via Jmol)
000550226.b3lyp_6-31g(d).inp

000550226.b3lyp_6-31g(d).qchem.inp (generated)

000550226.b3lyp_6-31g(d).gjf (generated)

000550226.b3lyp_6-31g(d).firefly.inp (generated)

000550226.b3lyp_6-31g(d).smash.inp (generated)

000550226.b3lyp_6-31g(d).nwchem.inp (generated) 000550226.b3lyp_6-31g(d).log.xz 000550226.td-b3lyp_6-31g+(d).inp 000550226.td-b3lyp_6-31g+(d).log.xz

000550226.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550226.td-b3lyp_6-31+g(d).gjf (generated)

000550226.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550226.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550226.mol 000550226.PUBCHEM 000550226.mol (via Jmol)
000550227.b3lyp_6-31g(d).inp

000550227.b3lyp_6-31g(d).qchem.inp (generated)

000550227.b3lyp_6-31g(d).gjf (generated)

000550227.b3lyp_6-31g(d).firefly.inp (generated)

000550227.b3lyp_6-31g(d).smash.inp (generated)

000550227.b3lyp_6-31g(d).nwchem.inp (generated) 000550227.b3lyp_6-31g(d).log.xz 000550227.td-b3lyp_6-31g+(d).inp 000550227.td-b3lyp_6-31g+(d).log.xz

000550227.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550227.td-b3lyp_6-31+g(d).gjf (generated)

000550227.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550227.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550227.mol 000550227.PUBCHEM 000550227.mol (via Jmol)
000550231.b3lyp_6-31g(d).inp

000550231.b3lyp_6-31g(d).qchem.inp (generated)

000550231.b3lyp_6-31g(d).gjf (generated)

000550231.b3lyp_6-31g(d).firefly.inp (generated)

000550231.b3lyp_6-31g(d).smash.inp (generated)

000550231.b3lyp_6-31g(d).nwchem.inp (generated) 000550231.b3lyp_6-31g(d).log.xz 000550231.td-b3lyp_6-31g+(d).inp 000550231.td-b3lyp_6-31g+(d).log.xz

000550231.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550231.td-b3lyp_6-31+g(d).gjf (generated)

000550231.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550231.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550231.mol 000550231.PUBCHEM 000550231.mol (via Jmol)
000550232.b3lyp_6-31g(d).inp

000550232.b3lyp_6-31g(d).qchem.inp (generated)

000550232.b3lyp_6-31g(d).gjf (generated)

000550232.b3lyp_6-31g(d).firefly.inp (generated)

000550232.b3lyp_6-31g(d).smash.inp (generated)

000550232.b3lyp_6-31g(d).nwchem.inp (generated) 000550232.b3lyp_6-31g(d).log.xz 000550232.td-b3lyp_6-31g+(d).inp 000550232.td-b3lyp_6-31g+(d).log.xz

000550232.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550232.td-b3lyp_6-31+g(d).gjf (generated)

000550232.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550232.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550232.mol 000550232.PUBCHEM 000550232.mol (via Jmol)
000550233.b3lyp_6-31g(d).inp

000550233.b3lyp_6-31g(d).qchem.inp (generated)

000550233.b3lyp_6-31g(d).gjf (generated)

000550233.b3lyp_6-31g(d).firefly.inp (generated)

000550233.b3lyp_6-31g(d).smash.inp (generated)

000550233.b3lyp_6-31g(d).nwchem.inp (generated) 000550233.b3lyp_6-31g(d).log.xz 000550233.td-b3lyp_6-31g+(d).inp 000550233.td-b3lyp_6-31g+(d).log.xz

000550233.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550233.td-b3lyp_6-31+g(d).gjf (generated)

000550233.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550233.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550233.mol 000550233.PUBCHEM 000550233.mol (via Jmol)
000550235.b3lyp_6-31g(d).inp

000550235.b3lyp_6-31g(d).qchem.inp (generated)

000550235.b3lyp_6-31g(d).gjf (generated)

000550235.b3lyp_6-31g(d).firefly.inp (generated)

000550235.b3lyp_6-31g(d).smash.inp (generated)

000550235.b3lyp_6-31g(d).nwchem.inp (generated) 000550235.b3lyp_6-31g(d).log.xz 000550235.td-b3lyp_6-31g+(d).inp 000550235.td-b3lyp_6-31g+(d).log.xz

000550235.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550235.td-b3lyp_6-31+g(d).gjf (generated)

000550235.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550235.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550235.mol 000550235.PUBCHEM 000550235.mol (via Jmol)
000550237.b3lyp_6-31g(d).inp

000550237.b3lyp_6-31g(d).qchem.inp (generated)

000550237.b3lyp_6-31g(d).gjf (generated)

000550237.b3lyp_6-31g(d).firefly.inp (generated)

000550237.b3lyp_6-31g(d).smash.inp (generated)

000550237.b3lyp_6-31g(d).nwchem.inp (generated) 000550237.b3lyp_6-31g(d).log.xz 000550237.td-b3lyp_6-31g+(d).inp 000550237.td-b3lyp_6-31g+(d).log.xz

000550237.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550237.td-b3lyp_6-31+g(d).gjf (generated)

000550237.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550237.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550237.mol 000550237.PUBCHEM 000550237.mol (via Jmol)
000550243.b3lyp_6-31g(d).inp

000550243.b3lyp_6-31g(d).qchem.inp (generated)

000550243.b3lyp_6-31g(d).gjf (generated)

000550243.b3lyp_6-31g(d).firefly.inp (generated)

000550243.b3lyp_6-31g(d).smash.inp (generated)

000550243.b3lyp_6-31g(d).nwchem.inp (generated) 000550243.b3lyp_6-31g(d).log.xz 000550243.td-b3lyp_6-31g+(d).inp 000550243.td-b3lyp_6-31g+(d).log.xz

000550243.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550243.td-b3lyp_6-31+g(d).gjf (generated)

000550243.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550243.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550243.mol 000550243.PUBCHEM 000550243.mol (via Jmol)
000550244.b3lyp_6-31g(d).inp

000550244.b3lyp_6-31g(d).qchem.inp (generated)

000550244.b3lyp_6-31g(d).gjf (generated)

000550244.b3lyp_6-31g(d).firefly.inp (generated)

000550244.b3lyp_6-31g(d).smash.inp (generated)

000550244.b3lyp_6-31g(d).nwchem.inp (generated) 000550244.b3lyp_6-31g(d).log.xz 000550244.td-b3lyp_6-31g+(d).inp 000550244.td-b3lyp_6-31g+(d).log.xz

000550244.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550244.td-b3lyp_6-31+g(d).gjf (generated)

000550244.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550244.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550244.mol 000550244.PUBCHEM 000550244.mol (via Jmol)
000550247.b3lyp_6-31g(d).inp

000550247.b3lyp_6-31g(d).qchem.inp (generated)

000550247.b3lyp_6-31g(d).gjf (generated)

000550247.b3lyp_6-31g(d).firefly.inp (generated)

000550247.b3lyp_6-31g(d).smash.inp (generated)

000550247.b3lyp_6-31g(d).nwchem.inp (generated) 000550247.b3lyp_6-31g(d).log.xz 000550247.td-b3lyp_6-31g+(d).inp 000550247.td-b3lyp_6-31g+(d).log.xz

000550247.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550247.td-b3lyp_6-31+g(d).gjf (generated)

000550247.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550247.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550247.mol 000550247.PUBCHEM 000550247.mol (via Jmol)
000550248.b3lyp_6-31g(d).inp

000550248.b3lyp_6-31g(d).qchem.inp (generated)

000550248.b3lyp_6-31g(d).gjf (generated)

000550248.b3lyp_6-31g(d).firefly.inp (generated)

000550248.b3lyp_6-31g(d).smash.inp (generated)

000550248.b3lyp_6-31g(d).nwchem.inp (generated) 000550248.b3lyp_6-31g(d).log.xz 000550248.td-b3lyp_6-31g+(d).inp 000550248.td-b3lyp_6-31g+(d).log.xz

000550248.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550248.td-b3lyp_6-31+g(d).gjf (generated)

000550248.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550248.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550248.mol 000550248.PUBCHEM 000550248.mol (via Jmol)
000550249.b3lyp_6-31g(d).inp

000550249.b3lyp_6-31g(d).qchem.inp (generated)

000550249.b3lyp_6-31g(d).gjf (generated)

000550249.b3lyp_6-31g(d).firefly.inp (generated)

000550249.b3lyp_6-31g(d).smash.inp (generated)

000550249.b3lyp_6-31g(d).nwchem.inp (generated) 000550249.b3lyp_6-31g(d).log.xz 000550249.td-b3lyp_6-31g+(d).inp 000550249.td-b3lyp_6-31g+(d).log.xz

000550249.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550249.td-b3lyp_6-31+g(d).gjf (generated)

000550249.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550249.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550249.mol 000550249.PUBCHEM 000550249.mol (via Jmol)
000550250.b3lyp_6-31g(d).inp

000550250.b3lyp_6-31g(d).qchem.inp (generated)

000550250.b3lyp_6-31g(d).gjf (generated)

000550250.b3lyp_6-31g(d).firefly.inp (generated)

000550250.b3lyp_6-31g(d).smash.inp (generated)

000550250.b3lyp_6-31g(d).nwchem.inp (generated) 000550250.b3lyp_6-31g(d).log.xz 000550250.td-b3lyp_6-31g+(d).inp 000550250.td-b3lyp_6-31g+(d).log.xz

000550250.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550250.td-b3lyp_6-31+g(d).gjf (generated)

000550250.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550250.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550250.mol 000550250.PUBCHEM 000550250.mol (via Jmol)
000550252.b3lyp_6-31g(d).inp

000550252.b3lyp_6-31g(d).qchem.inp (generated)

000550252.b3lyp_6-31g(d).gjf (generated)

000550252.b3lyp_6-31g(d).firefly.inp (generated)

000550252.b3lyp_6-31g(d).smash.inp (generated)

000550252.b3lyp_6-31g(d).nwchem.inp (generated) 000550252.b3lyp_6-31g(d).log.xz 000550252.td-b3lyp_6-31g+(d).inp 000550252.td-b3lyp_6-31g+(d).log.xz

000550252.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550252.td-b3lyp_6-31+g(d).gjf (generated)

000550252.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550252.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550252.mol 000550252.PUBCHEM 000550252.mol (via Jmol)
000550256.b3lyp_6-31g(d).inp

000550256.b3lyp_6-31g(d).qchem.inp (generated)

000550256.b3lyp_6-31g(d).gjf (generated)

000550256.b3lyp_6-31g(d).firefly.inp (generated)

000550256.b3lyp_6-31g(d).smash.inp (generated)

000550256.b3lyp_6-31g(d).nwchem.inp (generated) 000550256.b3lyp_6-31g(d).log.xz 000550256.td-b3lyp_6-31g+(d).inp 000550256.td-b3lyp_6-31g+(d).log.xz

000550256.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550256.td-b3lyp_6-31+g(d).gjf (generated)

000550256.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550256.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550256.mol 000550256.PUBCHEM 000550256.mol (via Jmol)
000550264.b3lyp_6-31g(d).inp

000550264.b3lyp_6-31g(d).qchem.inp (generated)

000550264.b3lyp_6-31g(d).gjf (generated)

000550264.b3lyp_6-31g(d).firefly.inp (generated)

000550264.b3lyp_6-31g(d).smash.inp (generated)

000550264.b3lyp_6-31g(d).nwchem.inp (generated) 000550264.b3lyp_6-31g(d).log.xz 000550264.td-b3lyp_6-31g+(d).inp 000550264.td-b3lyp_6-31g+(d).log.xz

000550264.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550264.td-b3lyp_6-31+g(d).gjf (generated)

000550264.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550264.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550264.mol 000550264.PUBCHEM 000550264.mol (via Jmol)
000550265.b3lyp_6-31g(d).inp

000550265.b3lyp_6-31g(d).qchem.inp (generated)

000550265.b3lyp_6-31g(d).gjf (generated)

000550265.b3lyp_6-31g(d).firefly.inp (generated)

000550265.b3lyp_6-31g(d).smash.inp (generated)

000550265.b3lyp_6-31g(d).nwchem.inp (generated) 000550265.b3lyp_6-31g(d).log.xz 000550265.td-b3lyp_6-31g+(d).inp 000550265.td-b3lyp_6-31g+(d).log.xz

000550265.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550265.td-b3lyp_6-31+g(d).gjf (generated)

000550265.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550265.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550265.mol 000550265.PUBCHEM 000550265.mol (via Jmol)
000550266.b3lyp_6-31g(d).inp

000550266.b3lyp_6-31g(d).qchem.inp (generated)

000550266.b3lyp_6-31g(d).gjf (generated)

000550266.b3lyp_6-31g(d).firefly.inp (generated)

000550266.b3lyp_6-31g(d).smash.inp (generated)

000550266.b3lyp_6-31g(d).nwchem.inp (generated) 000550266.b3lyp_6-31g(d).log.xz 000550266.td-b3lyp_6-31g+(d).inp 000550266.td-b3lyp_6-31g+(d).log.xz

000550266.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550266.td-b3lyp_6-31+g(d).gjf (generated)

000550266.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550266.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550266.mol 000550266.PUBCHEM 000550266.mol (via Jmol)
000550267.b3lyp_6-31g(d).inp

000550267.b3lyp_6-31g(d).qchem.inp (generated)

000550267.b3lyp_6-31g(d).gjf (generated)

000550267.b3lyp_6-31g(d).firefly.inp (generated)

000550267.b3lyp_6-31g(d).smash.inp (generated)

000550267.b3lyp_6-31g(d).nwchem.inp (generated) 000550267.b3lyp_6-31g(d).log.xz 000550267.td-b3lyp_6-31g+(d).inp 000550267.td-b3lyp_6-31g+(d).log.xz

000550267.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550267.td-b3lyp_6-31+g(d).gjf (generated)

000550267.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550267.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550267.mol 000550267.PUBCHEM 000550267.mol (via Jmol)
000550269.b3lyp_6-31g(d).inp

000550269.b3lyp_6-31g(d).qchem.inp (generated)

000550269.b3lyp_6-31g(d).gjf (generated)

000550269.b3lyp_6-31g(d).firefly.inp (generated)

000550269.b3lyp_6-31g(d).smash.inp (generated)

000550269.b3lyp_6-31g(d).nwchem.inp (generated) 000550269.b3lyp_6-31g(d).log.xz 000550269.td-b3lyp_6-31g+(d).inp 000550269.td-b3lyp_6-31g+(d).log.xz

000550269.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550269.td-b3lyp_6-31+g(d).gjf (generated)

000550269.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550269.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550269.mol 000550269.PUBCHEM 000550269.mol (via Jmol)
000550271.b3lyp_6-31g(d).inp

000550271.b3lyp_6-31g(d).qchem.inp (generated)

000550271.b3lyp_6-31g(d).gjf (generated)

000550271.b3lyp_6-31g(d).firefly.inp (generated)

000550271.b3lyp_6-31g(d).smash.inp (generated)

000550271.b3lyp_6-31g(d).nwchem.inp (generated) 000550271.b3lyp_6-31g(d).log.xz 000550271.td-b3lyp_6-31g+(d).inp 000550271.td-b3lyp_6-31g+(d).log.xz

000550271.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550271.td-b3lyp_6-31+g(d).gjf (generated)

000550271.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550271.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550271.mol 000550271.PUBCHEM 000550271.mol (via Jmol)
000550272.b3lyp_6-31g(d).inp

000550272.b3lyp_6-31g(d).qchem.inp (generated)

000550272.b3lyp_6-31g(d).gjf (generated)

000550272.b3lyp_6-31g(d).firefly.inp (generated)

000550272.b3lyp_6-31g(d).smash.inp (generated)

000550272.b3lyp_6-31g(d).nwchem.inp (generated) 000550272.b3lyp_6-31g(d).log.xz 000550272.td-b3lyp_6-31g+(d).inp 000550272.td-b3lyp_6-31g+(d).log.xz

000550272.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550272.td-b3lyp_6-31+g(d).gjf (generated)

000550272.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550272.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550272.mol 000550272.PUBCHEM 000550272.mol (via Jmol)
000550273.b3lyp_6-31g(d).inp

000550273.b3lyp_6-31g(d).qchem.inp (generated)

000550273.b3lyp_6-31g(d).gjf (generated)

000550273.b3lyp_6-31g(d).firefly.inp (generated)

000550273.b3lyp_6-31g(d).smash.inp (generated)

000550273.b3lyp_6-31g(d).nwchem.inp (generated) 000550273.b3lyp_6-31g(d).log.xz 000550273.td-b3lyp_6-31g+(d).inp 000550273.td-b3lyp_6-31g+(d).log.xz

000550273.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550273.td-b3lyp_6-31+g(d).gjf (generated)

000550273.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550273.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550273.mol 000550273.PUBCHEM 000550273.mol (via Jmol)
000550279.b3lyp_6-31g(d).inp

000550279.b3lyp_6-31g(d).qchem.inp (generated)

000550279.b3lyp_6-31g(d).gjf (generated)

000550279.b3lyp_6-31g(d).firefly.inp (generated)

000550279.b3lyp_6-31g(d).smash.inp (generated)

000550279.b3lyp_6-31g(d).nwchem.inp (generated) 000550279.b3lyp_6-31g(d).log.xz 000550279.td-b3lyp_6-31g+(d).inp 000550279.td-b3lyp_6-31g+(d).log.xz

000550279.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550279.td-b3lyp_6-31+g(d).gjf (generated)

000550279.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550279.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550279.mol 000550279.PUBCHEM 000550279.mol (via Jmol)
000550281.b3lyp_6-31g(d).inp

000550281.b3lyp_6-31g(d).qchem.inp (generated)

000550281.b3lyp_6-31g(d).gjf (generated)

000550281.b3lyp_6-31g(d).firefly.inp (generated)

000550281.b3lyp_6-31g(d).smash.inp (generated)

000550281.b3lyp_6-31g(d).nwchem.inp (generated) 000550281.b3lyp_6-31g(d).log.xz 000550281.td-b3lyp_6-31g+(d).inp 000550281.td-b3lyp_6-31g+(d).log.xz

000550281.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550281.td-b3lyp_6-31+g(d).gjf (generated)

000550281.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550281.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550281.mol 000550281.PUBCHEM 000550281.mol (via Jmol)
000550283.b3lyp_6-31g(d).inp

000550283.b3lyp_6-31g(d).qchem.inp (generated)

000550283.b3lyp_6-31g(d).gjf (generated)

000550283.b3lyp_6-31g(d).firefly.inp (generated)

000550283.b3lyp_6-31g(d).smash.inp (generated)

000550283.b3lyp_6-31g(d).nwchem.inp (generated) 000550283.b3lyp_6-31g(d).log.xz 000550283.td-b3lyp_6-31g+(d).inp 000550283.td-b3lyp_6-31g+(d).log.xz

000550283.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550283.td-b3lyp_6-31+g(d).gjf (generated)

000550283.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550283.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550283.mol 000550283.PUBCHEM 000550283.mol (via Jmol)
000550284.b3lyp_6-31g(d).inp

000550284.b3lyp_6-31g(d).qchem.inp (generated)

000550284.b3lyp_6-31g(d).gjf (generated)

000550284.b3lyp_6-31g(d).firefly.inp (generated)

000550284.b3lyp_6-31g(d).smash.inp (generated)

000550284.b3lyp_6-31g(d).nwchem.inp (generated) 000550284.b3lyp_6-31g(d).log.xz 000550284.td-b3lyp_6-31g+(d).inp 000550284.td-b3lyp_6-31g+(d).log.xz

000550284.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550284.td-b3lyp_6-31+g(d).gjf (generated)

000550284.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550284.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550284.mol 000550284.PUBCHEM 000550284.mol (via Jmol)
000550286.b3lyp_6-31g(d).inp

000550286.b3lyp_6-31g(d).qchem.inp (generated)

000550286.b3lyp_6-31g(d).gjf (generated)

000550286.b3lyp_6-31g(d).firefly.inp (generated)

000550286.b3lyp_6-31g(d).smash.inp (generated)

000550286.b3lyp_6-31g(d).nwchem.inp (generated) 000550286.b3lyp_6-31g(d).log.xz 000550286.td-b3lyp_6-31g+(d).inp 000550286.td-b3lyp_6-31g+(d).log.xz

000550286.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550286.td-b3lyp_6-31+g(d).gjf (generated)

000550286.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550286.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550286.mol 000550286.PUBCHEM 000550286.mol (via Jmol)
000550287.b3lyp_6-31g(d).inp

000550287.b3lyp_6-31g(d).qchem.inp (generated)

000550287.b3lyp_6-31g(d).gjf (generated)

000550287.b3lyp_6-31g(d).firefly.inp (generated)

000550287.b3lyp_6-31g(d).smash.inp (generated)

000550287.b3lyp_6-31g(d).nwchem.inp (generated) 000550287.b3lyp_6-31g(d).log.xz 000550287.td-b3lyp_6-31g+(d).inp 000550287.td-b3lyp_6-31g+(d).log.xz

000550287.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550287.td-b3lyp_6-31+g(d).gjf (generated)

000550287.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550287.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550287.mol 000550287.PUBCHEM 000550287.mol (via Jmol)
000550288.b3lyp_6-31g(d).inp

000550288.b3lyp_6-31g(d).qchem.inp (generated)

000550288.b3lyp_6-31g(d).gjf (generated)

000550288.b3lyp_6-31g(d).firefly.inp (generated)

000550288.b3lyp_6-31g(d).smash.inp (generated)

000550288.b3lyp_6-31g(d).nwchem.inp (generated) 000550288.b3lyp_6-31g(d).log.xz 000550288.td-b3lyp_6-31g+(d).inp 000550288.td-b3lyp_6-31g+(d).log.xz

000550288.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550288.td-b3lyp_6-31+g(d).gjf (generated)

000550288.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550288.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550288.mol 000550288.PUBCHEM 000550288.mol (via Jmol)
000550290.b3lyp_6-31g(d).inp

000550290.b3lyp_6-31g(d).qchem.inp (generated)

000550290.b3lyp_6-31g(d).gjf (generated)

000550290.b3lyp_6-31g(d).firefly.inp (generated)

000550290.b3lyp_6-31g(d).smash.inp (generated)

000550290.b3lyp_6-31g(d).nwchem.inp (generated) 000550290.b3lyp_6-31g(d).log.xz 000550290.td-b3lyp_6-31g+(d).inp 000550290.td-b3lyp_6-31g+(d).log.xz

000550290.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550290.td-b3lyp_6-31+g(d).gjf (generated)

000550290.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550290.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550290.mol 000550290.PUBCHEM 000550290.mol (via Jmol)
000550291.b3lyp_6-31g(d).inp

000550291.b3lyp_6-31g(d).qchem.inp (generated)

000550291.b3lyp_6-31g(d).gjf (generated)

000550291.b3lyp_6-31g(d).firefly.inp (generated)

000550291.b3lyp_6-31g(d).smash.inp (generated)

000550291.b3lyp_6-31g(d).nwchem.inp (generated) 000550291.b3lyp_6-31g(d).log.xz 000550291.td-b3lyp_6-31g+(d).inp 000550291.td-b3lyp_6-31g+(d).log.xz

000550291.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550291.td-b3lyp_6-31+g(d).gjf (generated)

000550291.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550291.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550291.mol 000550291.PUBCHEM 000550291.mol (via Jmol)
000550292.b3lyp_6-31g(d).inp

000550292.b3lyp_6-31g(d).qchem.inp (generated)

000550292.b3lyp_6-31g(d).gjf (generated)

000550292.b3lyp_6-31g(d).firefly.inp (generated)

000550292.b3lyp_6-31g(d).smash.inp (generated)

000550292.b3lyp_6-31g(d).nwchem.inp (generated) 000550292.b3lyp_6-31g(d).log.xz 000550292.td-b3lyp_6-31g+(d).inp 000550292.td-b3lyp_6-31g+(d).log.xz

000550292.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550292.td-b3lyp_6-31+g(d).gjf (generated)

000550292.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550292.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550292.mol 000550292.PUBCHEM 000550292.mol (via Jmol)
000550293.b3lyp_6-31g(d).inp

000550293.b3lyp_6-31g(d).qchem.inp (generated)

000550293.b3lyp_6-31g(d).gjf (generated)

000550293.b3lyp_6-31g(d).firefly.inp (generated)

000550293.b3lyp_6-31g(d).smash.inp (generated)

000550293.b3lyp_6-31g(d).nwchem.inp (generated) 000550293.b3lyp_6-31g(d).log.xz 000550293.td-b3lyp_6-31g+(d).inp 000550293.td-b3lyp_6-31g+(d).log.xz

000550293.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550293.td-b3lyp_6-31+g(d).gjf (generated)

000550293.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550293.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550293.mol 000550293.PUBCHEM 000550293.mol (via Jmol)
000550294.b3lyp_6-31g(d).inp

000550294.b3lyp_6-31g(d).qchem.inp (generated)

000550294.b3lyp_6-31g(d).gjf (generated)

000550294.b3lyp_6-31g(d).firefly.inp (generated)

000550294.b3lyp_6-31g(d).smash.inp (generated)

000550294.b3lyp_6-31g(d).nwchem.inp (generated) 000550294.b3lyp_6-31g(d).log.xz 000550294.td-b3lyp_6-31g+(d).inp 000550294.td-b3lyp_6-31g+(d).log.xz

000550294.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550294.td-b3lyp_6-31+g(d).gjf (generated)

000550294.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550294.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550294.mol 000550294.PUBCHEM 000550294.mol (via Jmol)
000550295.b3lyp_6-31g(d).inp

000550295.b3lyp_6-31g(d).qchem.inp (generated)

000550295.b3lyp_6-31g(d).gjf (generated)

000550295.b3lyp_6-31g(d).firefly.inp (generated)

000550295.b3lyp_6-31g(d).smash.inp (generated)

000550295.b3lyp_6-31g(d).nwchem.inp (generated) 000550295.b3lyp_6-31g(d).log.xz 000550295.td-b3lyp_6-31g+(d).inp 000550295.td-b3lyp_6-31g+(d).log.xz

000550295.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550295.td-b3lyp_6-31+g(d).gjf (generated)

000550295.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550295.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550295.mol 000550295.PUBCHEM 000550295.mol (via Jmol)
000550297.b3lyp_6-31g(d).inp

000550297.b3lyp_6-31g(d).qchem.inp (generated)

000550297.b3lyp_6-31g(d).gjf (generated)

000550297.b3lyp_6-31g(d).firefly.inp (generated)

000550297.b3lyp_6-31g(d).smash.inp (generated)

000550297.b3lyp_6-31g(d).nwchem.inp (generated) 000550297.b3lyp_6-31g(d).log.xz 000550297.td-b3lyp_6-31g+(d).inp 000550297.td-b3lyp_6-31g+(d).log.xz

000550297.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550297.td-b3lyp_6-31+g(d).gjf (generated)

000550297.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550297.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550297.mol 000550297.PUBCHEM 000550297.mol (via Jmol)
000550300.b3lyp_6-31g(d).inp

000550300.b3lyp_6-31g(d).qchem.inp (generated)

000550300.b3lyp_6-31g(d).gjf (generated)

000550300.b3lyp_6-31g(d).firefly.inp (generated)

000550300.b3lyp_6-31g(d).smash.inp (generated)

000550300.b3lyp_6-31g(d).nwchem.inp (generated) 000550300.b3lyp_6-31g(d).log.xz 000550300.td-b3lyp_6-31g+(d).inp 000550300.td-b3lyp_6-31g+(d).log.xz

000550300.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550300.td-b3lyp_6-31+g(d).gjf (generated)

000550300.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550300.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550300.mol 000550300.PUBCHEM 000550300.mol (via Jmol)
000550301.b3lyp_6-31g(d).inp

000550301.b3lyp_6-31g(d).qchem.inp (generated)

000550301.b3lyp_6-31g(d).gjf (generated)

000550301.b3lyp_6-31g(d).firefly.inp (generated)

000550301.b3lyp_6-31g(d).smash.inp (generated)

000550301.b3lyp_6-31g(d).nwchem.inp (generated) 000550301.b3lyp_6-31g(d).log.xz 000550301.td-b3lyp_6-31g+(d).inp 000550301.td-b3lyp_6-31g+(d).log.xz

000550301.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550301.td-b3lyp_6-31+g(d).gjf (generated)

000550301.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550301.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550301.mol 000550301.PUBCHEM 000550301.mol (via Jmol)
000550302.b3lyp_6-31g(d).inp

000550302.b3lyp_6-31g(d).qchem.inp (generated)

000550302.b3lyp_6-31g(d).gjf (generated)

000550302.b3lyp_6-31g(d).firefly.inp (generated)

000550302.b3lyp_6-31g(d).smash.inp (generated)

000550302.b3lyp_6-31g(d).nwchem.inp (generated) 000550302.b3lyp_6-31g(d).log.xz 000550302.td-b3lyp_6-31g+(d).inp 000550302.td-b3lyp_6-31g+(d).log.xz

000550302.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550302.td-b3lyp_6-31+g(d).gjf (generated)

000550302.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550302.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550302.mol 000550302.PUBCHEM 000550302.mol (via Jmol)
000550304.b3lyp_6-31g(d).inp

000550304.b3lyp_6-31g(d).qchem.inp (generated)

000550304.b3lyp_6-31g(d).gjf (generated)

000550304.b3lyp_6-31g(d).firefly.inp (generated)

000550304.b3lyp_6-31g(d).smash.inp (generated)

000550304.b3lyp_6-31g(d).nwchem.inp (generated) 000550304.b3lyp_6-31g(d).log.xz 000550304.td-b3lyp_6-31g+(d).inp 000550304.td-b3lyp_6-31g+(d).log.xz

000550304.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550304.td-b3lyp_6-31+g(d).gjf (generated)

000550304.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550304.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550304.mol 000550304.PUBCHEM 000550304.mol (via Jmol)
000550305.b3lyp_6-31g(d).inp

000550305.b3lyp_6-31g(d).qchem.inp (generated)

000550305.b3lyp_6-31g(d).gjf (generated)

000550305.b3lyp_6-31g(d).firefly.inp (generated)

000550305.b3lyp_6-31g(d).smash.inp (generated)

000550305.b3lyp_6-31g(d).nwchem.inp (generated) 000550305.b3lyp_6-31g(d).log.xz 000550305.td-b3lyp_6-31g+(d).inp 000550305.td-b3lyp_6-31g+(d).log.xz

000550305.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550305.td-b3lyp_6-31+g(d).gjf (generated)

000550305.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550305.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550305.mol 000550305.PUBCHEM 000550305.mol (via Jmol)
000550306.b3lyp_6-31g(d).inp

000550306.b3lyp_6-31g(d).qchem.inp (generated)

000550306.b3lyp_6-31g(d).gjf (generated)

000550306.b3lyp_6-31g(d).firefly.inp (generated)

000550306.b3lyp_6-31g(d).smash.inp (generated)

000550306.b3lyp_6-31g(d).nwchem.inp (generated) 000550306.b3lyp_6-31g(d).log.xz 000550306.td-b3lyp_6-31g+(d).inp 000550306.td-b3lyp_6-31g+(d).log.xz

000550306.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550306.td-b3lyp_6-31+g(d).gjf (generated)

000550306.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550306.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550306.mol 000550306.PUBCHEM 000550306.mol (via Jmol)
000550307.b3lyp_6-31g(d).inp

000550307.b3lyp_6-31g(d).qchem.inp (generated)

000550307.b3lyp_6-31g(d).gjf (generated)

000550307.b3lyp_6-31g(d).firefly.inp (generated)

000550307.b3lyp_6-31g(d).smash.inp (generated)

000550307.b3lyp_6-31g(d).nwchem.inp (generated) 000550307.b3lyp_6-31g(d).log.xz 000550307.td-b3lyp_6-31g+(d).inp 000550307.td-b3lyp_6-31g+(d).log.xz

000550307.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550307.td-b3lyp_6-31+g(d).gjf (generated)

000550307.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550307.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550307.mol 000550307.PUBCHEM 000550307.mol (via Jmol)
000550308.b3lyp_6-31g(d).inp

000550308.b3lyp_6-31g(d).qchem.inp (generated)

000550308.b3lyp_6-31g(d).gjf (generated)

000550308.b3lyp_6-31g(d).firefly.inp (generated)

000550308.b3lyp_6-31g(d).smash.inp (generated)

000550308.b3lyp_6-31g(d).nwchem.inp (generated) 000550308.b3lyp_6-31g(d).log.xz 000550308.td-b3lyp_6-31g+(d).inp 000550308.td-b3lyp_6-31g+(d).log.xz

000550308.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550308.td-b3lyp_6-31+g(d).gjf (generated)

000550308.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550308.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550308.mol 000550308.PUBCHEM 000550308.mol (via Jmol)
000550309.b3lyp_6-31g(d).inp

000550309.b3lyp_6-31g(d).qchem.inp (generated)

000550309.b3lyp_6-31g(d).gjf (generated)

000550309.b3lyp_6-31g(d).firefly.inp (generated)

000550309.b3lyp_6-31g(d).smash.inp (generated)

000550309.b3lyp_6-31g(d).nwchem.inp (generated) 000550309.b3lyp_6-31g(d).log.xz 000550309.td-b3lyp_6-31g+(d).inp 000550309.td-b3lyp_6-31g+(d).log.xz

000550309.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550309.td-b3lyp_6-31+g(d).gjf (generated)

000550309.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550309.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550309.mol 000550309.PUBCHEM 000550309.mol (via Jmol)
000550310.b3lyp_6-31g(d).inp

000550310.b3lyp_6-31g(d).qchem.inp (generated)

000550310.b3lyp_6-31g(d).gjf (generated)

000550310.b3lyp_6-31g(d).firefly.inp (generated)

000550310.b3lyp_6-31g(d).smash.inp (generated)

000550310.b3lyp_6-31g(d).nwchem.inp (generated) 000550310.b3lyp_6-31g(d).log.xz 000550310.td-b3lyp_6-31g+(d).inp 000550310.td-b3lyp_6-31g+(d).log.xz

000550310.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550310.td-b3lyp_6-31+g(d).gjf (generated)

000550310.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550310.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550310.mol 000550310.PUBCHEM 000550310.mol (via Jmol)
000550311.b3lyp_6-31g(d).inp

000550311.b3lyp_6-31g(d).qchem.inp (generated)

000550311.b3lyp_6-31g(d).gjf (generated)

000550311.b3lyp_6-31g(d).firefly.inp (generated)

000550311.b3lyp_6-31g(d).smash.inp (generated)

000550311.b3lyp_6-31g(d).nwchem.inp (generated) 000550311.b3lyp_6-31g(d).log.xz 000550311.td-b3lyp_6-31g+(d).inp 000550311.td-b3lyp_6-31g+(d).log.xz

000550311.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550311.td-b3lyp_6-31+g(d).gjf (generated)

000550311.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550311.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550311.mol 000550311.PUBCHEM 000550311.mol (via Jmol)
000550313.b3lyp_6-31g(d).inp

000550313.b3lyp_6-31g(d).qchem.inp (generated)

000550313.b3lyp_6-31g(d).gjf (generated)

000550313.b3lyp_6-31g(d).firefly.inp (generated)

000550313.b3lyp_6-31g(d).smash.inp (generated)

000550313.b3lyp_6-31g(d).nwchem.inp (generated) 000550313.b3lyp_6-31g(d).log.xz 000550313.td-b3lyp_6-31g+(d).inp 000550313.td-b3lyp_6-31g+(d).log.xz

000550313.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550313.td-b3lyp_6-31+g(d).gjf (generated)

000550313.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550313.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550313.mol 000550313.PUBCHEM 000550313.mol (via Jmol)
000550315.b3lyp_6-31g(d).inp

000550315.b3lyp_6-31g(d).qchem.inp (generated)

000550315.b3lyp_6-31g(d).gjf (generated)

000550315.b3lyp_6-31g(d).firefly.inp (generated)

000550315.b3lyp_6-31g(d).smash.inp (generated)

000550315.b3lyp_6-31g(d).nwchem.inp (generated) 000550315.b3lyp_6-31g(d).log.xz 000550315.td-b3lyp_6-31g+(d).inp 000550315.td-b3lyp_6-31g+(d).log.xz

000550315.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550315.td-b3lyp_6-31+g(d).gjf (generated)

000550315.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550315.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550315.mol 000550315.PUBCHEM 000550315.mol (via Jmol)
000550316.b3lyp_6-31g(d).inp

000550316.b3lyp_6-31g(d).qchem.inp (generated)

000550316.b3lyp_6-31g(d).gjf (generated)

000550316.b3lyp_6-31g(d).firefly.inp (generated)

000550316.b3lyp_6-31g(d).smash.inp (generated)

000550316.b3lyp_6-31g(d).nwchem.inp (generated) 000550316.b3lyp_6-31g(d).log.xz 000550316.td-b3lyp_6-31g+(d).inp 000550316.td-b3lyp_6-31g+(d).log.xz

000550316.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550316.td-b3lyp_6-31+g(d).gjf (generated)

000550316.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550316.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550316.mol 000550316.PUBCHEM 000550316.mol (via Jmol)
000550317.b3lyp_6-31g(d).inp

000550317.b3lyp_6-31g(d).qchem.inp (generated)

000550317.b3lyp_6-31g(d).gjf (generated)

000550317.b3lyp_6-31g(d).firefly.inp (generated)

000550317.b3lyp_6-31g(d).smash.inp (generated)

000550317.b3lyp_6-31g(d).nwchem.inp (generated) 000550317.b3lyp_6-31g(d).log.xz 000550317.td-b3lyp_6-31g+(d).inp 000550317.td-b3lyp_6-31g+(d).log.xz

000550317.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550317.td-b3lyp_6-31+g(d).gjf (generated)

000550317.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550317.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550317.mol 000550317.PUBCHEM 000550317.mol (via Jmol)
000550318.b3lyp_6-31g(d).inp

000550318.b3lyp_6-31g(d).qchem.inp (generated)

000550318.b3lyp_6-31g(d).gjf (generated)

000550318.b3lyp_6-31g(d).firefly.inp (generated)

000550318.b3lyp_6-31g(d).smash.inp (generated)

000550318.b3lyp_6-31g(d).nwchem.inp (generated) 000550318.b3lyp_6-31g(d).log.xz 000550318.td-b3lyp_6-31g+(d).inp 000550318.td-b3lyp_6-31g+(d).log.xz

000550318.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550318.td-b3lyp_6-31+g(d).gjf (generated)

000550318.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550318.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550318.mol 000550318.PUBCHEM 000550318.mol (via Jmol)
000550319.b3lyp_6-31g(d).inp

000550319.b3lyp_6-31g(d).qchem.inp (generated)

000550319.b3lyp_6-31g(d).gjf (generated)

000550319.b3lyp_6-31g(d).firefly.inp (generated)

000550319.b3lyp_6-31g(d).smash.inp (generated)

000550319.b3lyp_6-31g(d).nwchem.inp (generated) 000550319.b3lyp_6-31g(d).log.xz 000550319.td-b3lyp_6-31g+(d).inp 000550319.td-b3lyp_6-31g+(d).log.xz

000550319.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550319.td-b3lyp_6-31+g(d).gjf (generated)

000550319.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550319.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550319.mol 000550319.PUBCHEM 000550319.mol (via Jmol)
000550320.b3lyp_6-31g(d).inp

000550320.b3lyp_6-31g(d).qchem.inp (generated)

000550320.b3lyp_6-31g(d).gjf (generated)

000550320.b3lyp_6-31g(d).firefly.inp (generated)

000550320.b3lyp_6-31g(d).smash.inp (generated)

000550320.b3lyp_6-31g(d).nwchem.inp (generated) 000550320.b3lyp_6-31g(d).log.xz 000550320.td-b3lyp_6-31g+(d).inp 000550320.td-b3lyp_6-31g+(d).log.xz

000550320.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550320.td-b3lyp_6-31+g(d).gjf (generated)

000550320.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550320.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550320.mol 000550320.PUBCHEM 000550320.mol (via Jmol)
000550323.b3lyp_6-31g(d).inp

000550323.b3lyp_6-31g(d).qchem.inp (generated)

000550323.b3lyp_6-31g(d).gjf (generated)

000550323.b3lyp_6-31g(d).firefly.inp (generated)

000550323.b3lyp_6-31g(d).smash.inp (generated)

000550323.b3lyp_6-31g(d).nwchem.inp (generated) 000550323.b3lyp_6-31g(d).log.xz 000550323.td-b3lyp_6-31g+(d).inp 000550323.td-b3lyp_6-31g+(d).log.xz

000550323.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550323.td-b3lyp_6-31+g(d).gjf (generated)

000550323.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550323.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550323.mol 000550323.PUBCHEM 000550323.mol (via Jmol)
000550324.b3lyp_6-31g(d).inp

000550324.b3lyp_6-31g(d).qchem.inp (generated)

000550324.b3lyp_6-31g(d).gjf (generated)

000550324.b3lyp_6-31g(d).firefly.inp (generated)

000550324.b3lyp_6-31g(d).smash.inp (generated)

000550324.b3lyp_6-31g(d).nwchem.inp (generated) 000550324.b3lyp_6-31g(d).log.xz 000550324.td-b3lyp_6-31g+(d).inp 000550324.td-b3lyp_6-31g+(d).log.xz

000550324.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550324.td-b3lyp_6-31+g(d).gjf (generated)

000550324.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550324.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550324.mol 000550324.PUBCHEM 000550324.mol (via Jmol)
000550325.b3lyp_6-31g(d).inp

000550325.b3lyp_6-31g(d).qchem.inp (generated)

000550325.b3lyp_6-31g(d).gjf (generated)

000550325.b3lyp_6-31g(d).firefly.inp (generated)

000550325.b3lyp_6-31g(d).smash.inp (generated)

000550325.b3lyp_6-31g(d).nwchem.inp (generated) 000550325.b3lyp_6-31g(d).log.xz 000550325.td-b3lyp_6-31g+(d).inp 000550325.td-b3lyp_6-31g+(d).log.xz

000550325.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550325.td-b3lyp_6-31+g(d).gjf (generated)

000550325.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550325.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550325.mol 000550325.PUBCHEM 000550325.mol (via Jmol)
000550326.b3lyp_6-31g(d).inp

000550326.b3lyp_6-31g(d).qchem.inp (generated)

000550326.b3lyp_6-31g(d).gjf (generated)

000550326.b3lyp_6-31g(d).firefly.inp (generated)

000550326.b3lyp_6-31g(d).smash.inp (generated)

000550326.b3lyp_6-31g(d).nwchem.inp (generated) 000550326.b3lyp_6-31g(d).log.xz 000550326.td-b3lyp_6-31g+(d).inp 000550326.td-b3lyp_6-31g+(d).log.xz

000550326.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550326.td-b3lyp_6-31+g(d).gjf (generated)

000550326.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550326.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550326.mol 000550326.PUBCHEM 000550326.mol (via Jmol)
000550327.b3lyp_6-31g(d).inp

000550327.b3lyp_6-31g(d).qchem.inp (generated)

000550327.b3lyp_6-31g(d).gjf (generated)

000550327.b3lyp_6-31g(d).firefly.inp (generated)

000550327.b3lyp_6-31g(d).smash.inp (generated)

000550327.b3lyp_6-31g(d).nwchem.inp (generated) 000550327.b3lyp_6-31g(d).log.xz 000550327.td-b3lyp_6-31g+(d).inp 000550327.td-b3lyp_6-31g+(d).log.xz

000550327.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550327.td-b3lyp_6-31+g(d).gjf (generated)

000550327.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550327.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550327.mol 000550327.PUBCHEM 000550327.mol (via Jmol)
000550328.b3lyp_6-31g(d).inp

000550328.b3lyp_6-31g(d).qchem.inp (generated)

000550328.b3lyp_6-31g(d).gjf (generated)

000550328.b3lyp_6-31g(d).firefly.inp (generated)

000550328.b3lyp_6-31g(d).smash.inp (generated)

000550328.b3lyp_6-31g(d).nwchem.inp (generated) 000550328.b3lyp_6-31g(d).log.xz 000550328.td-b3lyp_6-31g+(d).inp 000550328.td-b3lyp_6-31g+(d).log.xz

000550328.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550328.td-b3lyp_6-31+g(d).gjf (generated)

000550328.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550328.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550328.mol 000550328.PUBCHEM 000550328.mol (via Jmol)
000550330.b3lyp_6-31g(d).inp

000550330.b3lyp_6-31g(d).qchem.inp (generated)

000550330.b3lyp_6-31g(d).gjf (generated)

000550330.b3lyp_6-31g(d).firefly.inp (generated)

000550330.b3lyp_6-31g(d).smash.inp (generated)

000550330.b3lyp_6-31g(d).nwchem.inp (generated) 000550330.b3lyp_6-31g(d).log.xz 000550330.td-b3lyp_6-31g+(d).inp 000550330.td-b3lyp_6-31g+(d).log.xz

000550330.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550330.td-b3lyp_6-31+g(d).gjf (generated)

000550330.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550330.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550330.mol 000550330.PUBCHEM 000550330.mol (via Jmol)
000550334.b3lyp_6-31g(d).inp

000550334.b3lyp_6-31g(d).qchem.inp (generated)

000550334.b3lyp_6-31g(d).gjf (generated)

000550334.b3lyp_6-31g(d).firefly.inp (generated)

000550334.b3lyp_6-31g(d).smash.inp (generated)

000550334.b3lyp_6-31g(d).nwchem.inp (generated) 000550334.b3lyp_6-31g(d).log.xz 000550334.td-b3lyp_6-31g+(d).inp 000550334.td-b3lyp_6-31g+(d).log.xz

000550334.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550334.td-b3lyp_6-31+g(d).gjf (generated)

000550334.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550334.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550334.mol 000550334.PUBCHEM 000550334.mol (via Jmol)
000550335.b3lyp_6-31g(d).inp

000550335.b3lyp_6-31g(d).qchem.inp (generated)

000550335.b3lyp_6-31g(d).gjf (generated)

000550335.b3lyp_6-31g(d).firefly.inp (generated)

000550335.b3lyp_6-31g(d).smash.inp (generated)

000550335.b3lyp_6-31g(d).nwchem.inp (generated) 000550335.b3lyp_6-31g(d).log.xz 000550335.td-b3lyp_6-31g+(d).inp 000550335.td-b3lyp_6-31g+(d).log.xz

000550335.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550335.td-b3lyp_6-31+g(d).gjf (generated)

000550335.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550335.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550335.mol 000550335.PUBCHEM 000550335.mol (via Jmol)
000550339.b3lyp_6-31g(d).inp

000550339.b3lyp_6-31g(d).qchem.inp (generated)

000550339.b3lyp_6-31g(d).gjf (generated)

000550339.b3lyp_6-31g(d).firefly.inp (generated)

000550339.b3lyp_6-31g(d).smash.inp (generated)

000550339.b3lyp_6-31g(d).nwchem.inp (generated) 000550339.b3lyp_6-31g(d).log.xz 000550339.td-b3lyp_6-31g+(d).inp 000550339.td-b3lyp_6-31g+(d).log.xz

000550339.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550339.td-b3lyp_6-31+g(d).gjf (generated)

000550339.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550339.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550339.mol 000550339.PUBCHEM 000550339.mol (via Jmol)
000550340.b3lyp_6-31g(d).inp

000550340.b3lyp_6-31g(d).qchem.inp (generated)

000550340.b3lyp_6-31g(d).gjf (generated)

000550340.b3lyp_6-31g(d).firefly.inp (generated)

000550340.b3lyp_6-31g(d).smash.inp (generated)

000550340.b3lyp_6-31g(d).nwchem.inp (generated) 000550340.b3lyp_6-31g(d).log.xz 000550340.td-b3lyp_6-31g+(d).inp 000550340.td-b3lyp_6-31g+(d).log.xz

000550340.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550340.td-b3lyp_6-31+g(d).gjf (generated)

000550340.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550340.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550340.mol 000550340.PUBCHEM 000550340.mol (via Jmol)
000550341.b3lyp_6-31g(d).inp

000550341.b3lyp_6-31g(d).qchem.inp (generated)

000550341.b3lyp_6-31g(d).gjf (generated)

000550341.b3lyp_6-31g(d).firefly.inp (generated)

000550341.b3lyp_6-31g(d).smash.inp (generated)

000550341.b3lyp_6-31g(d).nwchem.inp (generated) 000550341.b3lyp_6-31g(d).log.xz 000550341.td-b3lyp_6-31g+(d).inp 000550341.td-b3lyp_6-31g+(d).log.xz

000550341.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550341.td-b3lyp_6-31+g(d).gjf (generated)

000550341.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550341.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550341.mol 000550341.PUBCHEM 000550341.mol (via Jmol)
000550349.b3lyp_6-31g(d).inp

000550349.b3lyp_6-31g(d).qchem.inp (generated)

000550349.b3lyp_6-31g(d).gjf (generated)

000550349.b3lyp_6-31g(d).firefly.inp (generated)

000550349.b3lyp_6-31g(d).smash.inp (generated)

000550349.b3lyp_6-31g(d).nwchem.inp (generated) 000550349.b3lyp_6-31g(d).log.xz 000550349.td-b3lyp_6-31g+(d).inp 000550349.td-b3lyp_6-31g+(d).log.xz

000550349.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550349.td-b3lyp_6-31+g(d).gjf (generated)

000550349.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550349.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550349.mol 000550349.PUBCHEM 000550349.mol (via Jmol)
000550352.b3lyp_6-31g(d).inp

000550352.b3lyp_6-31g(d).qchem.inp (generated)

000550352.b3lyp_6-31g(d).gjf (generated)

000550352.b3lyp_6-31g(d).firefly.inp (generated)

000550352.b3lyp_6-31g(d).smash.inp (generated)

000550352.b3lyp_6-31g(d).nwchem.inp (generated) 000550352.b3lyp_6-31g(d).log.xz 000550352.td-b3lyp_6-31g+(d).inp 000550352.td-b3lyp_6-31g+(d).log.xz

000550352.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550352.td-b3lyp_6-31+g(d).gjf (generated)

000550352.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550352.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550352.mol 000550352.PUBCHEM 000550352.mol (via Jmol)
000550355.b3lyp_6-31g(d).inp

000550355.b3lyp_6-31g(d).qchem.inp (generated)

000550355.b3lyp_6-31g(d).gjf (generated)

000550355.b3lyp_6-31g(d).firefly.inp (generated)

000550355.b3lyp_6-31g(d).smash.inp (generated)

000550355.b3lyp_6-31g(d).nwchem.inp (generated) 000550355.b3lyp_6-31g(d).log.xz 000550355.td-b3lyp_6-31g+(d).inp 000550355.td-b3lyp_6-31g+(d).log.xz

000550355.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550355.td-b3lyp_6-31+g(d).gjf (generated)

000550355.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550355.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550355.mol 000550355.PUBCHEM 000550355.mol (via Jmol)
000550356.b3lyp_6-31g(d).inp

000550356.b3lyp_6-31g(d).qchem.inp (generated)

000550356.b3lyp_6-31g(d).gjf (generated)

000550356.b3lyp_6-31g(d).firefly.inp (generated)

000550356.b3lyp_6-31g(d).smash.inp (generated)

000550356.b3lyp_6-31g(d).nwchem.inp (generated) 000550356.b3lyp_6-31g(d).log.xz 000550356.td-b3lyp_6-31g+(d).inp 000550356.td-b3lyp_6-31g+(d).log.xz

000550356.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550356.td-b3lyp_6-31+g(d).gjf (generated)

000550356.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550356.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550356.mol 000550356.PUBCHEM 000550356.mol (via Jmol)
000550357.b3lyp_6-31g(d).inp

000550357.b3lyp_6-31g(d).qchem.inp (generated)

000550357.b3lyp_6-31g(d).gjf (generated)

000550357.b3lyp_6-31g(d).firefly.inp (generated)

000550357.b3lyp_6-31g(d).smash.inp (generated)

000550357.b3lyp_6-31g(d).nwchem.inp (generated) 000550357.b3lyp_6-31g(d).log.xz 000550357.td-b3lyp_6-31g+(d).inp 000550357.td-b3lyp_6-31g+(d).log.xz

000550357.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550357.td-b3lyp_6-31+g(d).gjf (generated)

000550357.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550357.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550357.mol 000550357.PUBCHEM 000550357.mol (via Jmol)
000550360.b3lyp_6-31g(d).inp

000550360.b3lyp_6-31g(d).qchem.inp (generated)

000550360.b3lyp_6-31g(d).gjf (generated)

000550360.b3lyp_6-31g(d).firefly.inp (generated)

000550360.b3lyp_6-31g(d).smash.inp (generated)

000550360.b3lyp_6-31g(d).nwchem.inp (generated) 000550360.b3lyp_6-31g(d).log.xz 000550360.td-b3lyp_6-31g+(d).inp 000550360.td-b3lyp_6-31g+(d).log.xz

000550360.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550360.td-b3lyp_6-31+g(d).gjf (generated)

000550360.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550360.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550360.mol 000550360.PUBCHEM 000550360.mol (via Jmol)
000550361.b3lyp_6-31g(d).inp

000550361.b3lyp_6-31g(d).qchem.inp (generated)

000550361.b3lyp_6-31g(d).gjf (generated)

000550361.b3lyp_6-31g(d).firefly.inp (generated)

000550361.b3lyp_6-31g(d).smash.inp (generated)

000550361.b3lyp_6-31g(d).nwchem.inp (generated) 000550361.b3lyp_6-31g(d).log.xz 000550361.td-b3lyp_6-31g+(d).inp 000550361.td-b3lyp_6-31g+(d).log.xz

000550361.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550361.td-b3lyp_6-31+g(d).gjf (generated)

000550361.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550361.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550361.mol 000550361.PUBCHEM 000550361.mol (via Jmol)
000550362.b3lyp_6-31g(d).inp

000550362.b3lyp_6-31g(d).qchem.inp (generated)

000550362.b3lyp_6-31g(d).gjf (generated)

000550362.b3lyp_6-31g(d).firefly.inp (generated)

000550362.b3lyp_6-31g(d).smash.inp (generated)

000550362.b3lyp_6-31g(d).nwchem.inp (generated) 000550362.b3lyp_6-31g(d).log.xz 000550362.td-b3lyp_6-31g+(d).inp 000550362.td-b3lyp_6-31g+(d).log.xz

000550362.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550362.td-b3lyp_6-31+g(d).gjf (generated)

000550362.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550362.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550362.mol 000550362.PUBCHEM 000550362.mol (via Jmol)
000550363.b3lyp_6-31g(d).inp

000550363.b3lyp_6-31g(d).qchem.inp (generated)

000550363.b3lyp_6-31g(d).gjf (generated)

000550363.b3lyp_6-31g(d).firefly.inp (generated)

000550363.b3lyp_6-31g(d).smash.inp (generated)

000550363.b3lyp_6-31g(d).nwchem.inp (generated) 000550363.b3lyp_6-31g(d).log.xz 000550363.td-b3lyp_6-31g+(d).inp 000550363.td-b3lyp_6-31g+(d).log.xz

000550363.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550363.td-b3lyp_6-31+g(d).gjf (generated)

000550363.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550363.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550363.mol 000550363.PUBCHEM 000550363.mol (via Jmol)
000550365.b3lyp_6-31g(d).inp

000550365.b3lyp_6-31g(d).qchem.inp (generated)

000550365.b3lyp_6-31g(d).gjf (generated)

000550365.b3lyp_6-31g(d).firefly.inp (generated)

000550365.b3lyp_6-31g(d).smash.inp (generated)

000550365.b3lyp_6-31g(d).nwchem.inp (generated) 000550365.b3lyp_6-31g(d).log.xz 000550365.td-b3lyp_6-31g+(d).inp 000550365.td-b3lyp_6-31g+(d).log.xz

000550365.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550365.td-b3lyp_6-31+g(d).gjf (generated)

000550365.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550365.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550365.mol 000550365.PUBCHEM 000550365.mol (via Jmol)
000550366.b3lyp_6-31g(d).inp

000550366.b3lyp_6-31g(d).qchem.inp (generated)

000550366.b3lyp_6-31g(d).gjf (generated)

000550366.b3lyp_6-31g(d).firefly.inp (generated)

000550366.b3lyp_6-31g(d).smash.inp (generated)

000550366.b3lyp_6-31g(d).nwchem.inp (generated) 000550366.b3lyp_6-31g(d).log.xz 000550366.td-b3lyp_6-31g+(d).inp 000550366.td-b3lyp_6-31g+(d).log.xz

000550366.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550366.td-b3lyp_6-31+g(d).gjf (generated)

000550366.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550366.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550366.mol 000550366.PUBCHEM 000550366.mol (via Jmol)
000550368.b3lyp_6-31g(d).inp

000550368.b3lyp_6-31g(d).qchem.inp (generated)

000550368.b3lyp_6-31g(d).gjf (generated)

000550368.b3lyp_6-31g(d).firefly.inp (generated)

000550368.b3lyp_6-31g(d).smash.inp (generated)

000550368.b3lyp_6-31g(d).nwchem.inp (generated) 000550368.b3lyp_6-31g(d).log.xz 000550368.td-b3lyp_6-31g+(d).inp 000550368.td-b3lyp_6-31g+(d).log.xz

000550368.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550368.td-b3lyp_6-31+g(d).gjf (generated)

000550368.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550368.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550368.mol 000550368.PUBCHEM 000550368.mol (via Jmol)
000550372.b3lyp_6-31g(d).inp

000550372.b3lyp_6-31g(d).qchem.inp (generated)

000550372.b3lyp_6-31g(d).gjf (generated)

000550372.b3lyp_6-31g(d).firefly.inp (generated)

000550372.b3lyp_6-31g(d).smash.inp (generated)

000550372.b3lyp_6-31g(d).nwchem.inp (generated) 000550372.b3lyp_6-31g(d).log.xz 000550372.td-b3lyp_6-31g+(d).inp 000550372.td-b3lyp_6-31g+(d).log.xz

000550372.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550372.td-b3lyp_6-31+g(d).gjf (generated)

000550372.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550372.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550372.mol 000550372.PUBCHEM 000550372.mol (via Jmol)
000550373.b3lyp_6-31g(d).inp

000550373.b3lyp_6-31g(d).qchem.inp (generated)

000550373.b3lyp_6-31g(d).gjf (generated)

000550373.b3lyp_6-31g(d).firefly.inp (generated)

000550373.b3lyp_6-31g(d).smash.inp (generated)

000550373.b3lyp_6-31g(d).nwchem.inp (generated) 000550373.b3lyp_6-31g(d).log.xz 000550373.td-b3lyp_6-31g+(d).inp 000550373.td-b3lyp_6-31g+(d).log.xz

000550373.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550373.td-b3lyp_6-31+g(d).gjf (generated)

000550373.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550373.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550373.mol 000550373.PUBCHEM 000550373.mol (via Jmol)
000550376.b3lyp_6-31g(d).inp

000550376.b3lyp_6-31g(d).qchem.inp (generated)

000550376.b3lyp_6-31g(d).gjf (generated)

000550376.b3lyp_6-31g(d).firefly.inp (generated)

000550376.b3lyp_6-31g(d).smash.inp (generated)

000550376.b3lyp_6-31g(d).nwchem.inp (generated) 000550376.b3lyp_6-31g(d).log.xz 000550376.td-b3lyp_6-31g+(d).inp 000550376.td-b3lyp_6-31g+(d).log.xz

000550376.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550376.td-b3lyp_6-31+g(d).gjf (generated)

000550376.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550376.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550376.mol 000550376.PUBCHEM 000550376.mol (via Jmol)
000550377.b3lyp_6-31g(d).inp

000550377.b3lyp_6-31g(d).qchem.inp (generated)

000550377.b3lyp_6-31g(d).gjf (generated)

000550377.b3lyp_6-31g(d).firefly.inp (generated)

000550377.b3lyp_6-31g(d).smash.inp (generated)

000550377.b3lyp_6-31g(d).nwchem.inp (generated) 000550377.b3lyp_6-31g(d).log.xz 000550377.td-b3lyp_6-31g+(d).inp 000550377.td-b3lyp_6-31g+(d).log.xz

000550377.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550377.td-b3lyp_6-31+g(d).gjf (generated)

000550377.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550377.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550377.mol 000550377.PUBCHEM 000550377.mol (via Jmol)
000550379.b3lyp_6-31g(d).inp

000550379.b3lyp_6-31g(d).qchem.inp (generated)

000550379.b3lyp_6-31g(d).gjf (generated)

000550379.b3lyp_6-31g(d).firefly.inp (generated)

000550379.b3lyp_6-31g(d).smash.inp (generated)

000550379.b3lyp_6-31g(d).nwchem.inp (generated) 000550379.b3lyp_6-31g(d).log.xz 000550379.td-b3lyp_6-31g+(d).inp 000550379.td-b3lyp_6-31g+(d).log.xz

000550379.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550379.td-b3lyp_6-31+g(d).gjf (generated)

000550379.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550379.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550379.mol 000550379.PUBCHEM 000550379.mol (via Jmol)
000550380.b3lyp_6-31g(d).inp

000550380.b3lyp_6-31g(d).qchem.inp (generated)

000550380.b3lyp_6-31g(d).gjf (generated)

000550380.b3lyp_6-31g(d).firefly.inp (generated)

000550380.b3lyp_6-31g(d).smash.inp (generated)

000550380.b3lyp_6-31g(d).nwchem.inp (generated) 000550380.b3lyp_6-31g(d).log.xz 000550380.td-b3lyp_6-31g+(d).inp 000550380.td-b3lyp_6-31g+(d).log.xz

000550380.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550380.td-b3lyp_6-31+g(d).gjf (generated)

000550380.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550380.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550380.mol 000550380.PUBCHEM 000550380.mol (via Jmol)
000550381.b3lyp_6-31g(d).inp

000550381.b3lyp_6-31g(d).qchem.inp (generated)

000550381.b3lyp_6-31g(d).gjf (generated)

000550381.b3lyp_6-31g(d).firefly.inp (generated)

000550381.b3lyp_6-31g(d).smash.inp (generated)

000550381.b3lyp_6-31g(d).nwchem.inp (generated) 000550381.b3lyp_6-31g(d).log.xz 000550381.td-b3lyp_6-31g+(d).inp 000550381.td-b3lyp_6-31g+(d).log.xz

000550381.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550381.td-b3lyp_6-31+g(d).gjf (generated)

000550381.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550381.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550381.mol 000550381.PUBCHEM 000550381.mol (via Jmol)
000550383.b3lyp_6-31g(d).inp

000550383.b3lyp_6-31g(d).qchem.inp (generated)

000550383.b3lyp_6-31g(d).gjf (generated)

000550383.b3lyp_6-31g(d).firefly.inp (generated)

000550383.b3lyp_6-31g(d).smash.inp (generated)

000550383.b3lyp_6-31g(d).nwchem.inp (generated) 000550383.b3lyp_6-31g(d).log.xz 000550383.td-b3lyp_6-31g+(d).inp 000550383.td-b3lyp_6-31g+(d).log.xz

000550383.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550383.td-b3lyp_6-31+g(d).gjf (generated)

000550383.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550383.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550383.mol 000550383.PUBCHEM 000550383.mol (via Jmol)
000550397.b3lyp_6-31g(d).inp

000550397.b3lyp_6-31g(d).qchem.inp (generated)

000550397.b3lyp_6-31g(d).gjf (generated)

000550397.b3lyp_6-31g(d).firefly.inp (generated)

000550397.b3lyp_6-31g(d).smash.inp (generated)

000550397.b3lyp_6-31g(d).nwchem.inp (generated) 000550397.b3lyp_6-31g(d).log.xz 000550397.td-b3lyp_6-31g+(d).inp 000550397.td-b3lyp_6-31g+(d).log.xz

000550397.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550397.td-b3lyp_6-31+g(d).gjf (generated)

000550397.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550397.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550397.mol 000550397.PUBCHEM 000550397.mol (via Jmol)
000550405.b3lyp_6-31g(d).inp

000550405.b3lyp_6-31g(d).qchem.inp (generated)

000550405.b3lyp_6-31g(d).gjf (generated)

000550405.b3lyp_6-31g(d).firefly.inp (generated)

000550405.b3lyp_6-31g(d).smash.inp (generated)

000550405.b3lyp_6-31g(d).nwchem.inp (generated) 000550405.b3lyp_6-31g(d).log.xz 000550405.td-b3lyp_6-31g+(d).inp 000550405.td-b3lyp_6-31g+(d).log.xz

000550405.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550405.td-b3lyp_6-31+g(d).gjf (generated)

000550405.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550405.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550405.mol 000550405.PUBCHEM 000550405.mol (via Jmol)
000550408.b3lyp_6-31g(d).inp

000550408.b3lyp_6-31g(d).qchem.inp (generated)

000550408.b3lyp_6-31g(d).gjf (generated)

000550408.b3lyp_6-31g(d).firefly.inp (generated)

000550408.b3lyp_6-31g(d).smash.inp (generated)

000550408.b3lyp_6-31g(d).nwchem.inp (generated) 000550408.b3lyp_6-31g(d).log.xz 000550408.td-b3lyp_6-31g+(d).inp 000550408.td-b3lyp_6-31g+(d).log.xz

000550408.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550408.td-b3lyp_6-31+g(d).gjf (generated)

000550408.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550408.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550408.mol 000550408.PUBCHEM 000550408.mol (via Jmol)
000550413.b3lyp_6-31g(d).inp

000550413.b3lyp_6-31g(d).qchem.inp (generated)

000550413.b3lyp_6-31g(d).gjf (generated)

000550413.b3lyp_6-31g(d).firefly.inp (generated)

000550413.b3lyp_6-31g(d).smash.inp (generated)

000550413.b3lyp_6-31g(d).nwchem.inp (generated) 000550413.b3lyp_6-31g(d).log.xz 000550413.td-b3lyp_6-31g+(d).inp 000550413.td-b3lyp_6-31g+(d).log.xz

000550413.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550413.td-b3lyp_6-31+g(d).gjf (generated)

000550413.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550413.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550413.mol 000550413.PUBCHEM 000550413.mol (via Jmol)
000550417.b3lyp_6-31g(d).inp

000550417.b3lyp_6-31g(d).qchem.inp (generated)

000550417.b3lyp_6-31g(d).gjf (generated)

000550417.b3lyp_6-31g(d).firefly.inp (generated)

000550417.b3lyp_6-31g(d).smash.inp (generated)

000550417.b3lyp_6-31g(d).nwchem.inp (generated) 000550417.b3lyp_6-31g(d).log.xz 000550417.td-b3lyp_6-31g+(d).inp 000550417.td-b3lyp_6-31g+(d).log.xz

000550417.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550417.td-b3lyp_6-31+g(d).gjf (generated)

000550417.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550417.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550417.mol 000550417.PUBCHEM 000550417.mol (via Jmol)
000550418.b3lyp_6-31g(d).inp

000550418.b3lyp_6-31g(d).qchem.inp (generated)

000550418.b3lyp_6-31g(d).gjf (generated)

000550418.b3lyp_6-31g(d).firefly.inp (generated)

000550418.b3lyp_6-31g(d).smash.inp (generated)

000550418.b3lyp_6-31g(d).nwchem.inp (generated) 000550418.b3lyp_6-31g(d).log.xz 000550418.td-b3lyp_6-31g+(d).inp 000550418.td-b3lyp_6-31g+(d).log.xz

000550418.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550418.td-b3lyp_6-31+g(d).gjf (generated)

000550418.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550418.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550418.mol 000550418.PUBCHEM 000550418.mol (via Jmol)
000550420.b3lyp_6-31g(d).inp

000550420.b3lyp_6-31g(d).qchem.inp (generated)

000550420.b3lyp_6-31g(d).gjf (generated)

000550420.b3lyp_6-31g(d).firefly.inp (generated)

000550420.b3lyp_6-31g(d).smash.inp (generated)

000550420.b3lyp_6-31g(d).nwchem.inp (generated) 000550420.b3lyp_6-31g(d).log.xz 000550420.td-b3lyp_6-31g+(d).inp 000550420.td-b3lyp_6-31g+(d).log.xz

000550420.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550420.td-b3lyp_6-31+g(d).gjf (generated)

000550420.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550420.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550420.mol 000550420.PUBCHEM 000550420.mol (via Jmol)
000550426.b3lyp_6-31g(d).inp

000550426.b3lyp_6-31g(d).qchem.inp (generated)

000550426.b3lyp_6-31g(d).gjf (generated)

000550426.b3lyp_6-31g(d).firefly.inp (generated)

000550426.b3lyp_6-31g(d).smash.inp (generated)

000550426.b3lyp_6-31g(d).nwchem.inp (generated) 000550426.b3lyp_6-31g(d).log.xz 000550426.td-b3lyp_6-31g+(d).inp 000550426.td-b3lyp_6-31g+(d).log.xz

000550426.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550426.td-b3lyp_6-31+g(d).gjf (generated)

000550426.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550426.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550426.mol 000550426.PUBCHEM 000550426.mol (via Jmol)
000550428.b3lyp_6-31g(d).inp

000550428.b3lyp_6-31g(d).qchem.inp (generated)

000550428.b3lyp_6-31g(d).gjf (generated)

000550428.b3lyp_6-31g(d).firefly.inp (generated)

000550428.b3lyp_6-31g(d).smash.inp (generated)

000550428.b3lyp_6-31g(d).nwchem.inp (generated) 000550428.b3lyp_6-31g(d).log.xz 000550428.td-b3lyp_6-31g+(d).inp 000550428.td-b3lyp_6-31g+(d).log.xz

000550428.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550428.td-b3lyp_6-31+g(d).gjf (generated)

000550428.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550428.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550428.mol 000550428.PUBCHEM 000550428.mol (via Jmol)
000550429.b3lyp_6-31g(d).inp

000550429.b3lyp_6-31g(d).qchem.inp (generated)

000550429.b3lyp_6-31g(d).gjf (generated)

000550429.b3lyp_6-31g(d).firefly.inp (generated)

000550429.b3lyp_6-31g(d).smash.inp (generated)

000550429.b3lyp_6-31g(d).nwchem.inp (generated) 000550429.b3lyp_6-31g(d).log.xz 000550429.td-b3lyp_6-31g+(d).inp 000550429.td-b3lyp_6-31g+(d).log.xz

000550429.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550429.td-b3lyp_6-31+g(d).gjf (generated)

000550429.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550429.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550429.mol 000550429.PUBCHEM 000550429.mol (via Jmol)
000550430.b3lyp_6-31g(d).inp

000550430.b3lyp_6-31g(d).qchem.inp (generated)

000550430.b3lyp_6-31g(d).gjf (generated)

000550430.b3lyp_6-31g(d).firefly.inp (generated)

000550430.b3lyp_6-31g(d).smash.inp (generated)

000550430.b3lyp_6-31g(d).nwchem.inp (generated) 000550430.b3lyp_6-31g(d).log.xz 000550430.td-b3lyp_6-31g+(d).inp 000550430.td-b3lyp_6-31g+(d).log.xz

000550430.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550430.td-b3lyp_6-31+g(d).gjf (generated)

000550430.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550430.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550430.mol 000550430.PUBCHEM 000550430.mol (via Jmol)
000550431.b3lyp_6-31g(d).inp

000550431.b3lyp_6-31g(d).qchem.inp (generated)

000550431.b3lyp_6-31g(d).gjf (generated)

000550431.b3lyp_6-31g(d).firefly.inp (generated)

000550431.b3lyp_6-31g(d).smash.inp (generated)

000550431.b3lyp_6-31g(d).nwchem.inp (generated) 000550431.b3lyp_6-31g(d).log.xz 000550431.td-b3lyp_6-31g+(d).inp 000550431.td-b3lyp_6-31g+(d).log.xz

000550431.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550431.td-b3lyp_6-31+g(d).gjf (generated)

000550431.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550431.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550431.mol 000550431.PUBCHEM 000550431.mol (via Jmol)
000550437.b3lyp_6-31g(d).inp

000550437.b3lyp_6-31g(d).qchem.inp (generated)

000550437.b3lyp_6-31g(d).gjf (generated)

000550437.b3lyp_6-31g(d).firefly.inp (generated)

000550437.b3lyp_6-31g(d).smash.inp (generated)

000550437.b3lyp_6-31g(d).nwchem.inp (generated) 000550437.b3lyp_6-31g(d).log.xz 000550437.td-b3lyp_6-31g+(d).inp 000550437.td-b3lyp_6-31g+(d).log.xz

000550437.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550437.td-b3lyp_6-31+g(d).gjf (generated)

000550437.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550437.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550437.mol 000550437.PUBCHEM 000550437.mol (via Jmol)
000550445.b3lyp_6-31g(d).inp

000550445.b3lyp_6-31g(d).qchem.inp (generated)

000550445.b3lyp_6-31g(d).gjf (generated)

000550445.b3lyp_6-31g(d).firefly.inp (generated)

000550445.b3lyp_6-31g(d).smash.inp (generated)

000550445.b3lyp_6-31g(d).nwchem.inp (generated) 000550445.b3lyp_6-31g(d).log.xz 000550445.td-b3lyp_6-31g+(d).inp 000550445.td-b3lyp_6-31g+(d).log.xz

000550445.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550445.td-b3lyp_6-31+g(d).gjf (generated)

000550445.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550445.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550445.mol 000550445.PUBCHEM 000550445.mol (via Jmol)
000550452.b3lyp_6-31g(d).inp

000550452.b3lyp_6-31g(d).qchem.inp (generated)

000550452.b3lyp_6-31g(d).gjf (generated)

000550452.b3lyp_6-31g(d).firefly.inp (generated)

000550452.b3lyp_6-31g(d).smash.inp (generated)

000550452.b3lyp_6-31g(d).nwchem.inp (generated) 000550452.b3lyp_6-31g(d).log.xz 000550452.td-b3lyp_6-31g+(d).inp 000550452.td-b3lyp_6-31g+(d).log.xz

000550452.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550452.td-b3lyp_6-31+g(d).gjf (generated)

000550452.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550452.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550452.mol 000550452.PUBCHEM 000550452.mol (via Jmol)
000550453.b3lyp_6-31g(d).inp

000550453.b3lyp_6-31g(d).qchem.inp (generated)

000550453.b3lyp_6-31g(d).gjf (generated)

000550453.b3lyp_6-31g(d).firefly.inp (generated)

000550453.b3lyp_6-31g(d).smash.inp (generated)

000550453.b3lyp_6-31g(d).nwchem.inp (generated) 000550453.b3lyp_6-31g(d).log.xz 000550453.td-b3lyp_6-31g+(d).inp 000550453.td-b3lyp_6-31g+(d).log.xz

000550453.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550453.td-b3lyp_6-31+g(d).gjf (generated)

000550453.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550453.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550453.mol 000550453.PUBCHEM 000550453.mol (via Jmol)
000550454.b3lyp_6-31g(d).inp

000550454.b3lyp_6-31g(d).qchem.inp (generated)

000550454.b3lyp_6-31g(d).gjf (generated)

000550454.b3lyp_6-31g(d).firefly.inp (generated)

000550454.b3lyp_6-31g(d).smash.inp (generated)

000550454.b3lyp_6-31g(d).nwchem.inp (generated) 000550454.b3lyp_6-31g(d).log.xz 000550454.td-b3lyp_6-31g+(d).inp 000550454.td-b3lyp_6-31g+(d).log.xz

000550454.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550454.td-b3lyp_6-31+g(d).gjf (generated)

000550454.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550454.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550454.mol 000550454.PUBCHEM 000550454.mol (via Jmol)
000550455.b3lyp_6-31g(d).inp

000550455.b3lyp_6-31g(d).qchem.inp (generated)

000550455.b3lyp_6-31g(d).gjf (generated)

000550455.b3lyp_6-31g(d).firefly.inp (generated)

000550455.b3lyp_6-31g(d).smash.inp (generated)

000550455.b3lyp_6-31g(d).nwchem.inp (generated) 000550455.b3lyp_6-31g(d).log.xz 000550455.td-b3lyp_6-31g+(d).inp 000550455.td-b3lyp_6-31g+(d).log.xz

000550455.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550455.td-b3lyp_6-31+g(d).gjf (generated)

000550455.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550455.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550455.mol 000550455.PUBCHEM 000550455.mol (via Jmol)
000550463.b3lyp_6-31g(d).inp

000550463.b3lyp_6-31g(d).qchem.inp (generated)

000550463.b3lyp_6-31g(d).gjf (generated)

000550463.b3lyp_6-31g(d).firefly.inp (generated)

000550463.b3lyp_6-31g(d).smash.inp (generated)

000550463.b3lyp_6-31g(d).nwchem.inp (generated) 000550463.b3lyp_6-31g(d).log.xz 000550463.td-b3lyp_6-31g+(d).inp 000550463.td-b3lyp_6-31g+(d).log.xz

000550463.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550463.td-b3lyp_6-31+g(d).gjf (generated)

000550463.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550463.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550463.mol 000550463.PUBCHEM 000550463.mol (via Jmol)
000550475.b3lyp_6-31g(d).inp

000550475.b3lyp_6-31g(d).qchem.inp (generated)

000550475.b3lyp_6-31g(d).gjf (generated)

000550475.b3lyp_6-31g(d).firefly.inp (generated)

000550475.b3lyp_6-31g(d).smash.inp (generated)

000550475.b3lyp_6-31g(d).nwchem.inp (generated) 000550475.b3lyp_6-31g(d).log.xz 000550475.td-b3lyp_6-31g+(d).inp 000550475.td-b3lyp_6-31g+(d).log.xz

000550475.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550475.td-b3lyp_6-31+g(d).gjf (generated)

000550475.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550475.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550475.mol 000550475.PUBCHEM 000550475.mol (via Jmol)
000550486.b3lyp_6-31g(d).inp

000550486.b3lyp_6-31g(d).qchem.inp (generated)

000550486.b3lyp_6-31g(d).gjf (generated)

000550486.b3lyp_6-31g(d).firefly.inp (generated)

000550486.b3lyp_6-31g(d).smash.inp (generated)

000550486.b3lyp_6-31g(d).nwchem.inp (generated) 000550486.b3lyp_6-31g(d).log.xz 000550486.td-b3lyp_6-31g+(d).inp 000550486.td-b3lyp_6-31g+(d).log.xz

000550486.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550486.td-b3lyp_6-31+g(d).gjf (generated)

000550486.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550486.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550486.mol 000550486.PUBCHEM 000550486.mol (via Jmol)
000550487.b3lyp_6-31g(d).inp

000550487.b3lyp_6-31g(d).qchem.inp (generated)

000550487.b3lyp_6-31g(d).gjf (generated)

000550487.b3lyp_6-31g(d).firefly.inp (generated)

000550487.b3lyp_6-31g(d).smash.inp (generated)

000550487.b3lyp_6-31g(d).nwchem.inp (generated) 000550487.b3lyp_6-31g(d).log.xz 000550487.td-b3lyp_6-31g+(d).inp 000550487.td-b3lyp_6-31g+(d).log.xz

000550487.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550487.td-b3lyp_6-31+g(d).gjf (generated)

000550487.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550487.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550487.mol 000550487.PUBCHEM 000550487.mol (via Jmol)
000550488.b3lyp_6-31g(d).inp

000550488.b3lyp_6-31g(d).qchem.inp (generated)

000550488.b3lyp_6-31g(d).gjf (generated)

000550488.b3lyp_6-31g(d).firefly.inp (generated)

000550488.b3lyp_6-31g(d).smash.inp (generated)

000550488.b3lyp_6-31g(d).nwchem.inp (generated) 000550488.b3lyp_6-31g(d).log.xz 000550488.td-b3lyp_6-31g+(d).inp 000550488.td-b3lyp_6-31g+(d).log.xz

000550488.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550488.td-b3lyp_6-31+g(d).gjf (generated)

000550488.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550488.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550488.mol 000550488.PUBCHEM 000550488.mol (via Jmol)
000550489.b3lyp_6-31g(d).inp

000550489.b3lyp_6-31g(d).qchem.inp (generated)

000550489.b3lyp_6-31g(d).gjf (generated)

000550489.b3lyp_6-31g(d).firefly.inp (generated)

000550489.b3lyp_6-31g(d).smash.inp (generated)

000550489.b3lyp_6-31g(d).nwchem.inp (generated) 000550489.b3lyp_6-31g(d).log.xz 000550489.td-b3lyp_6-31g+(d).inp 000550489.td-b3lyp_6-31g+(d).log.xz

000550489.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550489.td-b3lyp_6-31+g(d).gjf (generated)

000550489.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550489.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550489.mol 000550489.PUBCHEM 000550489.mol (via Jmol)
000550490.b3lyp_6-31g(d).inp

000550490.b3lyp_6-31g(d).qchem.inp (generated)

000550490.b3lyp_6-31g(d).gjf (generated)

000550490.b3lyp_6-31g(d).firefly.inp (generated)

000550490.b3lyp_6-31g(d).smash.inp (generated)

000550490.b3lyp_6-31g(d).nwchem.inp (generated) 000550490.b3lyp_6-31g(d).log.xz 000550490.td-b3lyp_6-31g+(d).inp 000550490.td-b3lyp_6-31g+(d).log.xz

000550490.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550490.td-b3lyp_6-31+g(d).gjf (generated)

000550490.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550490.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550490.mol 000550490.PUBCHEM 000550490.mol (via Jmol)
000550491.b3lyp_6-31g(d).inp

000550491.b3lyp_6-31g(d).qchem.inp (generated)

000550491.b3lyp_6-31g(d).gjf (generated)

000550491.b3lyp_6-31g(d).firefly.inp (generated)

000550491.b3lyp_6-31g(d).smash.inp (generated)

000550491.b3lyp_6-31g(d).nwchem.inp (generated) 000550491.b3lyp_6-31g(d).log.xz 000550491.td-b3lyp_6-31g+(d).inp 000550491.td-b3lyp_6-31g+(d).log.xz

000550491.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550491.td-b3lyp_6-31+g(d).gjf (generated)

000550491.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550491.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550491.mol 000550491.PUBCHEM 000550491.mol (via Jmol)
000550498.b3lyp_6-31g(d).inp

000550498.b3lyp_6-31g(d).qchem.inp (generated)

000550498.b3lyp_6-31g(d).gjf (generated)

000550498.b3lyp_6-31g(d).firefly.inp (generated)

000550498.b3lyp_6-31g(d).smash.inp (generated)

000550498.b3lyp_6-31g(d).nwchem.inp (generated) 000550498.b3lyp_6-31g(d).log.xz 000550498.td-b3lyp_6-31g+(d).inp 000550498.td-b3lyp_6-31g+(d).log.xz

000550498.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550498.td-b3lyp_6-31+g(d).gjf (generated)

000550498.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550498.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550498.mol 000550498.PUBCHEM 000550498.mol (via Jmol)
000550499.b3lyp_6-31g(d).inp

000550499.b3lyp_6-31g(d).qchem.inp (generated)

000550499.b3lyp_6-31g(d).gjf (generated)

000550499.b3lyp_6-31g(d).firefly.inp (generated)

000550499.b3lyp_6-31g(d).smash.inp (generated)

000550499.b3lyp_6-31g(d).nwchem.inp (generated) 000550499.b3lyp_6-31g(d).log.xz 000550499.td-b3lyp_6-31g+(d).inp 000550499.td-b3lyp_6-31g+(d).log.xz

000550499.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550499.td-b3lyp_6-31+g(d).gjf (generated)

000550499.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550499.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550499.mol 000550499.PUBCHEM 000550499.mol (via Jmol)
000550500.b3lyp_6-31g(d).inp

000550500.b3lyp_6-31g(d).qchem.inp (generated)

000550500.b3lyp_6-31g(d).gjf (generated)

000550500.b3lyp_6-31g(d).firefly.inp (generated)

000550500.b3lyp_6-31g(d).smash.inp (generated)

000550500.b3lyp_6-31g(d).nwchem.inp (generated) 000550500.b3lyp_6-31g(d).log.xz 000550500.td-b3lyp_6-31g+(d).inp 000550500.td-b3lyp_6-31g+(d).log.xz

000550500.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550500.td-b3lyp_6-31+g(d).gjf (generated)

000550500.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550500.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550500.mol 000550500.PUBCHEM 000550500.mol (via Jmol)
000550509.b3lyp_6-31g(d).inp

000550509.b3lyp_6-31g(d).qchem.inp (generated)

000550509.b3lyp_6-31g(d).gjf (generated)

000550509.b3lyp_6-31g(d).firefly.inp (generated)

000550509.b3lyp_6-31g(d).smash.inp (generated)

000550509.b3lyp_6-31g(d).nwchem.inp (generated) 000550509.b3lyp_6-31g(d).log.xz 000550509.td-b3lyp_6-31g+(d).inp 000550509.td-b3lyp_6-31g+(d).log.xz

000550509.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550509.td-b3lyp_6-31+g(d).gjf (generated)

000550509.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550509.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550509.mol 000550509.PUBCHEM 000550509.mol (via Jmol)
000550511.b3lyp_6-31g(d).inp

000550511.b3lyp_6-31g(d).qchem.inp (generated)

000550511.b3lyp_6-31g(d).gjf (generated)

000550511.b3lyp_6-31g(d).firefly.inp (generated)

000550511.b3lyp_6-31g(d).smash.inp (generated)

000550511.b3lyp_6-31g(d).nwchem.inp (generated) 000550511.b3lyp_6-31g(d).log.xz 000550511.td-b3lyp_6-31g+(d).inp 000550511.td-b3lyp_6-31g+(d).log.xz

000550511.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550511.td-b3lyp_6-31+g(d).gjf (generated)

000550511.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550511.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550511.mol 000550511.PUBCHEM 000550511.mol (via Jmol)
000550512.b3lyp_6-31g(d).inp

000550512.b3lyp_6-31g(d).qchem.inp (generated)

000550512.b3lyp_6-31g(d).gjf (generated)

000550512.b3lyp_6-31g(d).firefly.inp (generated)

000550512.b3lyp_6-31g(d).smash.inp (generated)

000550512.b3lyp_6-31g(d).nwchem.inp (generated) 000550512.b3lyp_6-31g(d).log.xz 000550512.td-b3lyp_6-31g+(d).inp 000550512.td-b3lyp_6-31g+(d).log.xz

000550512.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550512.td-b3lyp_6-31+g(d).gjf (generated)

000550512.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550512.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550512.mol 000550512.PUBCHEM 000550512.mol (via Jmol)
000550513.b3lyp_6-31g(d).inp

000550513.b3lyp_6-31g(d).qchem.inp (generated)

000550513.b3lyp_6-31g(d).gjf (generated)

000550513.b3lyp_6-31g(d).firefly.inp (generated)

000550513.b3lyp_6-31g(d).smash.inp (generated)

000550513.b3lyp_6-31g(d).nwchem.inp (generated) 000550513.b3lyp_6-31g(d).log.xz 000550513.td-b3lyp_6-31g+(d).inp 000550513.td-b3lyp_6-31g+(d).log.xz

000550513.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550513.td-b3lyp_6-31+g(d).gjf (generated)

000550513.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550513.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550513.mol 000550513.PUBCHEM 000550513.mol (via Jmol)
000550518.b3lyp_6-31g(d).inp

000550518.b3lyp_6-31g(d).qchem.inp (generated)

000550518.b3lyp_6-31g(d).gjf (generated)

000550518.b3lyp_6-31g(d).firefly.inp (generated)

000550518.b3lyp_6-31g(d).smash.inp (generated)

000550518.b3lyp_6-31g(d).nwchem.inp (generated) 000550518.b3lyp_6-31g(d).log.xz 000550518.td-b3lyp_6-31g+(d).inp 000550518.td-b3lyp_6-31g+(d).log.xz

000550518.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550518.td-b3lyp_6-31+g(d).gjf (generated)

000550518.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550518.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550518.mol 000550518.PUBCHEM 000550518.mol (via Jmol)
000550519.b3lyp_6-31g(d).inp

000550519.b3lyp_6-31g(d).qchem.inp (generated)

000550519.b3lyp_6-31g(d).gjf (generated)

000550519.b3lyp_6-31g(d).firefly.inp (generated)

000550519.b3lyp_6-31g(d).smash.inp (generated)

000550519.b3lyp_6-31g(d).nwchem.inp (generated) 000550519.b3lyp_6-31g(d).log.xz 000550519.td-b3lyp_6-31g+(d).inp 000550519.td-b3lyp_6-31g+(d).log.xz

000550519.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550519.td-b3lyp_6-31+g(d).gjf (generated)

000550519.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550519.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550519.mol 000550519.PUBCHEM 000550519.mol (via Jmol)
000550527.b3lyp_6-31g(d).inp

000550527.b3lyp_6-31g(d).qchem.inp (generated)

000550527.b3lyp_6-31g(d).gjf (generated)

000550527.b3lyp_6-31g(d).firefly.inp (generated)

000550527.b3lyp_6-31g(d).smash.inp (generated)

000550527.b3lyp_6-31g(d).nwchem.inp (generated) 000550527.b3lyp_6-31g(d).log.xz 000550527.td-b3lyp_6-31g+(d).inp 000550527.td-b3lyp_6-31g+(d).log.xz

000550527.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550527.td-b3lyp_6-31+g(d).gjf (generated)

000550527.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550527.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550527.mol 000550527.PUBCHEM 000550527.mol (via Jmol)
000550542.b3lyp_6-31g(d).inp

000550542.b3lyp_6-31g(d).qchem.inp (generated)

000550542.b3lyp_6-31g(d).gjf (generated)

000550542.b3lyp_6-31g(d).firefly.inp (generated)

000550542.b3lyp_6-31g(d).smash.inp (generated)

000550542.b3lyp_6-31g(d).nwchem.inp (generated) 000550542.b3lyp_6-31g(d).log.xz 000550542.td-b3lyp_6-31g+(d).inp 000550542.td-b3lyp_6-31g+(d).log.xz

000550542.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550542.td-b3lyp_6-31+g(d).gjf (generated)

000550542.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550542.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550542.mol 000550542.PUBCHEM 000550542.mol (via Jmol)
000550546.b3lyp_6-31g(d).inp

000550546.b3lyp_6-31g(d).qchem.inp (generated)

000550546.b3lyp_6-31g(d).gjf (generated)

000550546.b3lyp_6-31g(d).firefly.inp (generated)

000550546.b3lyp_6-31g(d).smash.inp (generated)

000550546.b3lyp_6-31g(d).nwchem.inp (generated) 000550546.b3lyp_6-31g(d).log.xz 000550546.td-b3lyp_6-31g+(d).inp 000550546.td-b3lyp_6-31g+(d).log.xz

000550546.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550546.td-b3lyp_6-31+g(d).gjf (generated)

000550546.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550546.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550546.mol 000550546.PUBCHEM 000550546.mol (via Jmol)
000550550.b3lyp_6-31g(d).inp

000550550.b3lyp_6-31g(d).qchem.inp (generated)

000550550.b3lyp_6-31g(d).gjf (generated)

000550550.b3lyp_6-31g(d).firefly.inp (generated)

000550550.b3lyp_6-31g(d).smash.inp (generated)

000550550.b3lyp_6-31g(d).nwchem.inp (generated) 000550550.b3lyp_6-31g(d).log.xz 000550550.td-b3lyp_6-31g+(d).inp 000550550.td-b3lyp_6-31g+(d).log.xz

000550550.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550550.td-b3lyp_6-31+g(d).gjf (generated)

000550550.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550550.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550550.mol 000550550.PUBCHEM 000550550.mol (via Jmol)
000550554.b3lyp_6-31g(d).inp

000550554.b3lyp_6-31g(d).qchem.inp (generated)

000550554.b3lyp_6-31g(d).gjf (generated)

000550554.b3lyp_6-31g(d).firefly.inp (generated)

000550554.b3lyp_6-31g(d).smash.inp (generated)

000550554.b3lyp_6-31g(d).nwchem.inp (generated) 000550554.b3lyp_6-31g(d).log.xz 000550554.td-b3lyp_6-31g+(d).inp 000550554.td-b3lyp_6-31g+(d).log.xz

000550554.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550554.td-b3lyp_6-31+g(d).gjf (generated)

000550554.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550554.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550554.mol 000550554.PUBCHEM 000550554.mol (via Jmol)
000550557.b3lyp_6-31g(d).inp

000550557.b3lyp_6-31g(d).qchem.inp (generated)

000550557.b3lyp_6-31g(d).gjf (generated)

000550557.b3lyp_6-31g(d).firefly.inp (generated)

000550557.b3lyp_6-31g(d).smash.inp (generated)

000550557.b3lyp_6-31g(d).nwchem.inp (generated) 000550557.b3lyp_6-31g(d).log.xz 000550557.td-b3lyp_6-31g+(d).inp 000550557.td-b3lyp_6-31g+(d).log.xz

000550557.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550557.td-b3lyp_6-31+g(d).gjf (generated)

000550557.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550557.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550557.mol 000550557.PUBCHEM 000550557.mol (via Jmol)
000550566.b3lyp_6-31g(d).inp

000550566.b3lyp_6-31g(d).qchem.inp (generated)

000550566.b3lyp_6-31g(d).gjf (generated)

000550566.b3lyp_6-31g(d).firefly.inp (generated)

000550566.b3lyp_6-31g(d).smash.inp (generated)

000550566.b3lyp_6-31g(d).nwchem.inp (generated) 000550566.b3lyp_6-31g(d).log.xz 000550566.td-b3lyp_6-31g+(d).inp 000550566.td-b3lyp_6-31g+(d).log.xz

000550566.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550566.td-b3lyp_6-31+g(d).gjf (generated)

000550566.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550566.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550566.mol 000550566.PUBCHEM 000550566.mol (via Jmol)
000550567.b3lyp_6-31g(d).inp

000550567.b3lyp_6-31g(d).qchem.inp (generated)

000550567.b3lyp_6-31g(d).gjf (generated)

000550567.b3lyp_6-31g(d).firefly.inp (generated)

000550567.b3lyp_6-31g(d).smash.inp (generated)

000550567.b3lyp_6-31g(d).nwchem.inp (generated) 000550567.b3lyp_6-31g(d).log.xz 000550567.td-b3lyp_6-31g+(d).inp 000550567.td-b3lyp_6-31g+(d).log.xz

000550567.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550567.td-b3lyp_6-31+g(d).gjf (generated)

000550567.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550567.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550567.mol 000550567.PUBCHEM 000550567.mol (via Jmol)
000550571.b3lyp_6-31g(d).inp

000550571.b3lyp_6-31g(d).qchem.inp (generated)

000550571.b3lyp_6-31g(d).gjf (generated)

000550571.b3lyp_6-31g(d).firefly.inp (generated)

000550571.b3lyp_6-31g(d).smash.inp (generated)

000550571.b3lyp_6-31g(d).nwchem.inp (generated) 000550571.b3lyp_6-31g(d).log.xz 000550571.td-b3lyp_6-31g+(d).inp 000550571.td-b3lyp_6-31g+(d).log.xz

000550571.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550571.td-b3lyp_6-31+g(d).gjf (generated)

000550571.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550571.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550571.mol 000550571.PUBCHEM 000550571.mol (via Jmol)
000550573.b3lyp_6-31g(d).inp

000550573.b3lyp_6-31g(d).qchem.inp (generated)

000550573.b3lyp_6-31g(d).gjf (generated)

000550573.b3lyp_6-31g(d).firefly.inp (generated)

000550573.b3lyp_6-31g(d).smash.inp (generated)

000550573.b3lyp_6-31g(d).nwchem.inp (generated) 000550573.b3lyp_6-31g(d).log.xz 000550573.td-b3lyp_6-31g+(d).inp 000550573.td-b3lyp_6-31g+(d).log.xz

000550573.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550573.td-b3lyp_6-31+g(d).gjf (generated)

000550573.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550573.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550573.mol 000550573.PUBCHEM 000550573.mol (via Jmol)
000550642.b3lyp_6-31g(d).inp

000550642.b3lyp_6-31g(d).qchem.inp (generated)

000550642.b3lyp_6-31g(d).gjf (generated)

000550642.b3lyp_6-31g(d).firefly.inp (generated)

000550642.b3lyp_6-31g(d).smash.inp (generated)

000550642.b3lyp_6-31g(d).nwchem.inp (generated) 000550642.b3lyp_6-31g(d).log.xz 000550642.td-b3lyp_6-31g+(d).inp 000550642.td-b3lyp_6-31g+(d).log.xz

000550642.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550642.td-b3lyp_6-31+g(d).gjf (generated)

000550642.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550642.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550642.mol 000550642.PUBCHEM 000550642.mol (via Jmol)
000550643.b3lyp_6-31g(d).inp

000550643.b3lyp_6-31g(d).qchem.inp (generated)

000550643.b3lyp_6-31g(d).gjf (generated)

000550643.b3lyp_6-31g(d).firefly.inp (generated)

000550643.b3lyp_6-31g(d).smash.inp (generated)

000550643.b3lyp_6-31g(d).nwchem.inp (generated) 000550643.b3lyp_6-31g(d).log.xz 000550643.td-b3lyp_6-31g+(d).inp 000550643.td-b3lyp_6-31g+(d).log.xz

000550643.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550643.td-b3lyp_6-31+g(d).gjf (generated)

000550643.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550643.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550643.mol 000550643.PUBCHEM 000550643.mol (via Jmol)
000550644.b3lyp_6-31g(d).inp

000550644.b3lyp_6-31g(d).qchem.inp (generated)

000550644.b3lyp_6-31g(d).gjf (generated)

000550644.b3lyp_6-31g(d).firefly.inp (generated)

000550644.b3lyp_6-31g(d).smash.inp (generated)

000550644.b3lyp_6-31g(d).nwchem.inp (generated) 000550644.b3lyp_6-31g(d).log.xz 000550644.td-b3lyp_6-31g+(d).inp 000550644.td-b3lyp_6-31g+(d).log.xz

000550644.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550644.td-b3lyp_6-31+g(d).gjf (generated)

000550644.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550644.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550644.mol 000550644.PUBCHEM 000550644.mol (via Jmol)
000550645.b3lyp_6-31g(d).inp

000550645.b3lyp_6-31g(d).qchem.inp (generated)

000550645.b3lyp_6-31g(d).gjf (generated)

000550645.b3lyp_6-31g(d).firefly.inp (generated)

000550645.b3lyp_6-31g(d).smash.inp (generated)

000550645.b3lyp_6-31g(d).nwchem.inp (generated) 000550645.b3lyp_6-31g(d).log.xz 000550645.td-b3lyp_6-31g+(d).inp 000550645.td-b3lyp_6-31g+(d).log.xz

000550645.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550645.td-b3lyp_6-31+g(d).gjf (generated)

000550645.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550645.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550645.mol 000550645.PUBCHEM 000550645.mol (via Jmol)
000550646.b3lyp_6-31g(d).inp

000550646.b3lyp_6-31g(d).qchem.inp (generated)

000550646.b3lyp_6-31g(d).gjf (generated)

000550646.b3lyp_6-31g(d).firefly.inp (generated)

000550646.b3lyp_6-31g(d).smash.inp (generated)

000550646.b3lyp_6-31g(d).nwchem.inp (generated) 000550646.b3lyp_6-31g(d).log.xz 000550646.td-b3lyp_6-31g+(d).inp 000550646.td-b3lyp_6-31g+(d).log.xz

000550646.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550646.td-b3lyp_6-31+g(d).gjf (generated)

000550646.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550646.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550646.mol 000550646.PUBCHEM 000550646.mol (via Jmol)
000550647.b3lyp_6-31g(d).inp

000550647.b3lyp_6-31g(d).qchem.inp (generated)

000550647.b3lyp_6-31g(d).gjf (generated)

000550647.b3lyp_6-31g(d).firefly.inp (generated)

000550647.b3lyp_6-31g(d).smash.inp (generated)

000550647.b3lyp_6-31g(d).nwchem.inp (generated) 000550647.b3lyp_6-31g(d).log.xz 000550647.td-b3lyp_6-31g+(d).inp 000550647.td-b3lyp_6-31g+(d).log.xz

000550647.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550647.td-b3lyp_6-31+g(d).gjf (generated)

000550647.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550647.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550647.mol 000550647.PUBCHEM 000550647.mol (via Jmol)
000550649.b3lyp_6-31g(d).inp

000550649.b3lyp_6-31g(d).qchem.inp (generated)

000550649.b3lyp_6-31g(d).gjf (generated)

000550649.b3lyp_6-31g(d).firefly.inp (generated)

000550649.b3lyp_6-31g(d).smash.inp (generated)

000550649.b3lyp_6-31g(d).nwchem.inp (generated) 000550649.b3lyp_6-31g(d).log.xz 000550649.td-b3lyp_6-31g+(d).inp 000550649.td-b3lyp_6-31g+(d).log.xz

000550649.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550649.td-b3lyp_6-31+g(d).gjf (generated)

000550649.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550649.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550649.mol 000550649.PUBCHEM 000550649.mol (via Jmol)
000550650.b3lyp_6-31g(d).inp

000550650.b3lyp_6-31g(d).qchem.inp (generated)

000550650.b3lyp_6-31g(d).gjf (generated)

000550650.b3lyp_6-31g(d).firefly.inp (generated)

000550650.b3lyp_6-31g(d).smash.inp (generated)

000550650.b3lyp_6-31g(d).nwchem.inp (generated) 000550650.b3lyp_6-31g(d).log.xz 000550650.td-b3lyp_6-31g+(d).inp 000550650.td-b3lyp_6-31g+(d).log.xz

000550650.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550650.td-b3lyp_6-31+g(d).gjf (generated)

000550650.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550650.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550650.mol 000550650.PUBCHEM 000550650.mol (via Jmol)
000550652.b3lyp_6-31g(d).inp

000550652.b3lyp_6-31g(d).qchem.inp (generated)

000550652.b3lyp_6-31g(d).gjf (generated)

000550652.b3lyp_6-31g(d).firefly.inp (generated)

000550652.b3lyp_6-31g(d).smash.inp (generated)

000550652.b3lyp_6-31g(d).nwchem.inp (generated) 000550652.b3lyp_6-31g(d).log.xz 000550652.td-b3lyp_6-31g+(d).inp 000550652.td-b3lyp_6-31g+(d).log.xz

000550652.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550652.td-b3lyp_6-31+g(d).gjf (generated)

000550652.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550652.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550652.mol 000550652.PUBCHEM 000550652.mol (via Jmol)
000550653.b3lyp_6-31g(d).inp

000550653.b3lyp_6-31g(d).qchem.inp (generated)

000550653.b3lyp_6-31g(d).gjf (generated)

000550653.b3lyp_6-31g(d).firefly.inp (generated)

000550653.b3lyp_6-31g(d).smash.inp (generated)

000550653.b3lyp_6-31g(d).nwchem.inp (generated) 000550653.b3lyp_6-31g(d).log.xz 000550653.td-b3lyp_6-31g+(d).inp 000550653.td-b3lyp_6-31g+(d).log.xz

000550653.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550653.td-b3lyp_6-31+g(d).gjf (generated)

000550653.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550653.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550653.mol 000550653.PUBCHEM 000550653.mol (via Jmol)
000550654.b3lyp_6-31g(d).inp

000550654.b3lyp_6-31g(d).qchem.inp (generated)

000550654.b3lyp_6-31g(d).gjf (generated)

000550654.b3lyp_6-31g(d).firefly.inp (generated)

000550654.b3lyp_6-31g(d).smash.inp (generated)

000550654.b3lyp_6-31g(d).nwchem.inp (generated) 000550654.b3lyp_6-31g(d).log.xz 000550654.td-b3lyp_6-31g+(d).inp 000550654.td-b3lyp_6-31g+(d).log.xz

000550654.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550654.td-b3lyp_6-31+g(d).gjf (generated)

000550654.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550654.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550654.mol 000550654.PUBCHEM 000550654.mol (via Jmol)
000550655.b3lyp_6-31g(d).inp

000550655.b3lyp_6-31g(d).qchem.inp (generated)

000550655.b3lyp_6-31g(d).gjf (generated)

000550655.b3lyp_6-31g(d).firefly.inp (generated)

000550655.b3lyp_6-31g(d).smash.inp (generated)

000550655.b3lyp_6-31g(d).nwchem.inp (generated) 000550655.b3lyp_6-31g(d).log.xz 000550655.td-b3lyp_6-31g+(d).inp 000550655.td-b3lyp_6-31g+(d).log.xz

000550655.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550655.td-b3lyp_6-31+g(d).gjf (generated)

000550655.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550655.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550655.mol 000550655.PUBCHEM 000550655.mol (via Jmol)
000550656.b3lyp_6-31g(d).inp

000550656.b3lyp_6-31g(d).qchem.inp (generated)

000550656.b3lyp_6-31g(d).gjf (generated)

000550656.b3lyp_6-31g(d).firefly.inp (generated)

000550656.b3lyp_6-31g(d).smash.inp (generated)

000550656.b3lyp_6-31g(d).nwchem.inp (generated) 000550656.b3lyp_6-31g(d).log.xz 000550656.td-b3lyp_6-31g+(d).inp 000550656.td-b3lyp_6-31g+(d).log.xz

000550656.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550656.td-b3lyp_6-31+g(d).gjf (generated)

000550656.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550656.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550656.mol 000550656.PUBCHEM 000550656.mol (via Jmol)
000550659.b3lyp_6-31g(d).inp

000550659.b3lyp_6-31g(d).qchem.inp (generated)

000550659.b3lyp_6-31g(d).gjf (generated)

000550659.b3lyp_6-31g(d).firefly.inp (generated)

000550659.b3lyp_6-31g(d).smash.inp (generated)

000550659.b3lyp_6-31g(d).nwchem.inp (generated) 000550659.b3lyp_6-31g(d).log.xz 000550659.td-b3lyp_6-31g+(d).inp 000550659.td-b3lyp_6-31g+(d).log.xz

000550659.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550659.td-b3lyp_6-31+g(d).gjf (generated)

000550659.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550659.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550659.mol 000550659.PUBCHEM 000550659.mol (via Jmol)
000550662.b3lyp_6-31g(d).inp

000550662.b3lyp_6-31g(d).qchem.inp (generated)

000550662.b3lyp_6-31g(d).gjf (generated)

000550662.b3lyp_6-31g(d).firefly.inp (generated)

000550662.b3lyp_6-31g(d).smash.inp (generated)

000550662.b3lyp_6-31g(d).nwchem.inp (generated) 000550662.b3lyp_6-31g(d).log.xz 000550662.td-b3lyp_6-31g+(d).inp 000550662.td-b3lyp_6-31g+(d).log.xz

000550662.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550662.td-b3lyp_6-31+g(d).gjf (generated)

000550662.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550662.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550662.mol 000550662.PUBCHEM 000550662.mol (via Jmol)
000550664.b3lyp_6-31g(d).inp

000550664.b3lyp_6-31g(d).qchem.inp (generated)

000550664.b3lyp_6-31g(d).gjf (generated)

000550664.b3lyp_6-31g(d).firefly.inp (generated)

000550664.b3lyp_6-31g(d).smash.inp (generated)

000550664.b3lyp_6-31g(d).nwchem.inp (generated) 000550664.b3lyp_6-31g(d).log.xz 000550664.td-b3lyp_6-31g+(d).inp 000550664.td-b3lyp_6-31g+(d).log.xz

000550664.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550664.td-b3lyp_6-31+g(d).gjf (generated)

000550664.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550664.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550664.mol 000550664.PUBCHEM 000550664.mol (via Jmol)
000550666.b3lyp_6-31g(d).inp

000550666.b3lyp_6-31g(d).qchem.inp (generated)

000550666.b3lyp_6-31g(d).gjf (generated)

000550666.b3lyp_6-31g(d).firefly.inp (generated)

000550666.b3lyp_6-31g(d).smash.inp (generated)

000550666.b3lyp_6-31g(d).nwchem.inp (generated) 000550666.b3lyp_6-31g(d).log.xz 000550666.td-b3lyp_6-31g+(d).inp 000550666.td-b3lyp_6-31g+(d).log.xz

000550666.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550666.td-b3lyp_6-31+g(d).gjf (generated)

000550666.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550666.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550666.mol 000550666.PUBCHEM 000550666.mol (via Jmol)
000550668.b3lyp_6-31g(d).inp

000550668.b3lyp_6-31g(d).qchem.inp (generated)

000550668.b3lyp_6-31g(d).gjf (generated)

000550668.b3lyp_6-31g(d).firefly.inp (generated)

000550668.b3lyp_6-31g(d).smash.inp (generated)

000550668.b3lyp_6-31g(d).nwchem.inp (generated) 000550668.b3lyp_6-31g(d).log.xz 000550668.td-b3lyp_6-31g+(d).inp 000550668.td-b3lyp_6-31g+(d).log.xz

000550668.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550668.td-b3lyp_6-31+g(d).gjf (generated)

000550668.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550668.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550668.mol 000550668.PUBCHEM 000550668.mol (via Jmol)
000550669.b3lyp_6-31g(d).inp

000550669.b3lyp_6-31g(d).qchem.inp (generated)

000550669.b3lyp_6-31g(d).gjf (generated)

000550669.b3lyp_6-31g(d).firefly.inp (generated)

000550669.b3lyp_6-31g(d).smash.inp (generated)

000550669.b3lyp_6-31g(d).nwchem.inp (generated) 000550669.b3lyp_6-31g(d).log.xz 000550669.td-b3lyp_6-31g+(d).inp 000550669.td-b3lyp_6-31g+(d).log.xz

000550669.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550669.td-b3lyp_6-31+g(d).gjf (generated)

000550669.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550669.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550669.mol 000550669.PUBCHEM 000550669.mol (via Jmol)
000550670.b3lyp_6-31g(d).inp

000550670.b3lyp_6-31g(d).qchem.inp (generated)

000550670.b3lyp_6-31g(d).gjf (generated)

000550670.b3lyp_6-31g(d).firefly.inp (generated)

000550670.b3lyp_6-31g(d).smash.inp (generated)

000550670.b3lyp_6-31g(d).nwchem.inp (generated) 000550670.b3lyp_6-31g(d).log.xz 000550670.td-b3lyp_6-31g+(d).inp 000550670.td-b3lyp_6-31g+(d).log.xz

000550670.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550670.td-b3lyp_6-31+g(d).gjf (generated)

000550670.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550670.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550670.mol 000550670.PUBCHEM 000550670.mol (via Jmol)
000550671.b3lyp_6-31g(d).inp

000550671.b3lyp_6-31g(d).qchem.inp (generated)

000550671.b3lyp_6-31g(d).gjf (generated)

000550671.b3lyp_6-31g(d).firefly.inp (generated)

000550671.b3lyp_6-31g(d).smash.inp (generated)

000550671.b3lyp_6-31g(d).nwchem.inp (generated) 000550671.b3lyp_6-31g(d).log.xz 000550671.td-b3lyp_6-31g+(d).inp 000550671.td-b3lyp_6-31g+(d).log.xz

000550671.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550671.td-b3lyp_6-31+g(d).gjf (generated)

000550671.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550671.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550671.mol 000550671.PUBCHEM 000550671.mol (via Jmol)
000550672.b3lyp_6-31g(d).inp

000550672.b3lyp_6-31g(d).qchem.inp (generated)

000550672.b3lyp_6-31g(d).gjf (generated)

000550672.b3lyp_6-31g(d).firefly.inp (generated)

000550672.b3lyp_6-31g(d).smash.inp (generated)

000550672.b3lyp_6-31g(d).nwchem.inp (generated) 000550672.b3lyp_6-31g(d).log.xz 000550672.td-b3lyp_6-31g+(d).inp 000550672.td-b3lyp_6-31g+(d).log.xz

000550672.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550672.td-b3lyp_6-31+g(d).gjf (generated)

000550672.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550672.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550672.mol 000550672.PUBCHEM 000550672.mol (via Jmol)
000550673.b3lyp_6-31g(d).inp

000550673.b3lyp_6-31g(d).qchem.inp (generated)

000550673.b3lyp_6-31g(d).gjf (generated)

000550673.b3lyp_6-31g(d).firefly.inp (generated)

000550673.b3lyp_6-31g(d).smash.inp (generated)

000550673.b3lyp_6-31g(d).nwchem.inp (generated) 000550673.b3lyp_6-31g(d).log.xz 000550673.td-b3lyp_6-31g+(d).inp 000550673.td-b3lyp_6-31g+(d).log.xz

000550673.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550673.td-b3lyp_6-31+g(d).gjf (generated)

000550673.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550673.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550673.mol 000550673.PUBCHEM 000550673.mol (via Jmol)
000550676.b3lyp_6-31g(d).inp

000550676.b3lyp_6-31g(d).qchem.inp (generated)

000550676.b3lyp_6-31g(d).gjf (generated)

000550676.b3lyp_6-31g(d).firefly.inp (generated)

000550676.b3lyp_6-31g(d).smash.inp (generated)

000550676.b3lyp_6-31g(d).nwchem.inp (generated) 000550676.b3lyp_6-31g(d).log.xz 000550676.td-b3lyp_6-31g+(d).inp 000550676.td-b3lyp_6-31g+(d).log.xz

000550676.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550676.td-b3lyp_6-31+g(d).gjf (generated)

000550676.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550676.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550676.mol 000550676.PUBCHEM 000550676.mol (via Jmol)
000550677.b3lyp_6-31g(d).inp

000550677.b3lyp_6-31g(d).qchem.inp (generated)

000550677.b3lyp_6-31g(d).gjf (generated)

000550677.b3lyp_6-31g(d).firefly.inp (generated)

000550677.b3lyp_6-31g(d).smash.inp (generated)

000550677.b3lyp_6-31g(d).nwchem.inp (generated) 000550677.b3lyp_6-31g(d).log.xz 000550677.td-b3lyp_6-31g+(d).inp 000550677.td-b3lyp_6-31g+(d).log.xz

000550677.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550677.td-b3lyp_6-31+g(d).gjf (generated)

000550677.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550677.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550677.mol 000550677.PUBCHEM 000550677.mol (via Jmol)
000550679.b3lyp_6-31g(d).inp

000550679.b3lyp_6-31g(d).qchem.inp (generated)

000550679.b3lyp_6-31g(d).gjf (generated)

000550679.b3lyp_6-31g(d).firefly.inp (generated)

000550679.b3lyp_6-31g(d).smash.inp (generated)

000550679.b3lyp_6-31g(d).nwchem.inp (generated) 000550679.b3lyp_6-31g(d).log.xz 000550679.td-b3lyp_6-31g+(d).inp 000550679.td-b3lyp_6-31g+(d).log.xz

000550679.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550679.td-b3lyp_6-31+g(d).gjf (generated)

000550679.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550679.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550679.mol 000550679.PUBCHEM 000550679.mol (via Jmol)
000550680.b3lyp_6-31g(d).inp

000550680.b3lyp_6-31g(d).qchem.inp (generated)

000550680.b3lyp_6-31g(d).gjf (generated)

000550680.b3lyp_6-31g(d).firefly.inp (generated)

000550680.b3lyp_6-31g(d).smash.inp (generated)

000550680.b3lyp_6-31g(d).nwchem.inp (generated) 000550680.b3lyp_6-31g(d).log.xz 000550680.td-b3lyp_6-31g+(d).inp 000550680.td-b3lyp_6-31g+(d).log.xz

000550680.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550680.td-b3lyp_6-31+g(d).gjf (generated)

000550680.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550680.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550680.mol 000550680.PUBCHEM 000550680.mol (via Jmol)
000550681.b3lyp_6-31g(d).inp

000550681.b3lyp_6-31g(d).qchem.inp (generated)

000550681.b3lyp_6-31g(d).gjf (generated)

000550681.b3lyp_6-31g(d).firefly.inp (generated)

000550681.b3lyp_6-31g(d).smash.inp (generated)

000550681.b3lyp_6-31g(d).nwchem.inp (generated) 000550681.b3lyp_6-31g(d).log.xz 000550681.td-b3lyp_6-31g+(d).inp 000550681.td-b3lyp_6-31g+(d).log.xz

000550681.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550681.td-b3lyp_6-31+g(d).gjf (generated)

000550681.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550681.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550681.mol 000550681.PUBCHEM 000550681.mol (via Jmol)
000550682.b3lyp_6-31g(d).inp

000550682.b3lyp_6-31g(d).qchem.inp (generated)

000550682.b3lyp_6-31g(d).gjf (generated)

000550682.b3lyp_6-31g(d).firefly.inp (generated)

000550682.b3lyp_6-31g(d).smash.inp (generated)

000550682.b3lyp_6-31g(d).nwchem.inp (generated) 000550682.b3lyp_6-31g(d).log.xz 000550682.td-b3lyp_6-31g+(d).inp 000550682.td-b3lyp_6-31g+(d).log.xz

000550682.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550682.td-b3lyp_6-31+g(d).gjf (generated)

000550682.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550682.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550682.mol 000550682.PUBCHEM 000550682.mol (via Jmol)
000550686.b3lyp_6-31g(d).inp

000550686.b3lyp_6-31g(d).qchem.inp (generated)

000550686.b3lyp_6-31g(d).gjf (generated)

000550686.b3lyp_6-31g(d).firefly.inp (generated)

000550686.b3lyp_6-31g(d).smash.inp (generated)

000550686.b3lyp_6-31g(d).nwchem.inp (generated) 000550686.b3lyp_6-31g(d).log.xz 000550686.td-b3lyp_6-31g+(d).inp 000550686.td-b3lyp_6-31g+(d).log.xz

000550686.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550686.td-b3lyp_6-31+g(d).gjf (generated)

000550686.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550686.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550686.mol 000550686.PUBCHEM 000550686.mol (via Jmol)
000550687.b3lyp_6-31g(d).inp

000550687.b3lyp_6-31g(d).qchem.inp (generated)

000550687.b3lyp_6-31g(d).gjf (generated)

000550687.b3lyp_6-31g(d).firefly.inp (generated)

000550687.b3lyp_6-31g(d).smash.inp (generated)

000550687.b3lyp_6-31g(d).nwchem.inp (generated) 000550687.b3lyp_6-31g(d).log.xz 000550687.td-b3lyp_6-31g+(d).inp 000550687.td-b3lyp_6-31g+(d).log.xz

000550687.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550687.td-b3lyp_6-31+g(d).gjf (generated)

000550687.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550687.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550687.mol 000550687.PUBCHEM 000550687.mol (via Jmol)
000550688.b3lyp_6-31g(d).inp

000550688.b3lyp_6-31g(d).qchem.inp (generated)

000550688.b3lyp_6-31g(d).gjf (generated)

000550688.b3lyp_6-31g(d).firefly.inp (generated)

000550688.b3lyp_6-31g(d).smash.inp (generated)

000550688.b3lyp_6-31g(d).nwchem.inp (generated) 000550688.b3lyp_6-31g(d).log.xz 000550688.td-b3lyp_6-31g+(d).inp 000550688.td-b3lyp_6-31g+(d).log.xz

000550688.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550688.td-b3lyp_6-31+g(d).gjf (generated)

000550688.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550688.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550688.mol 000550688.PUBCHEM 000550688.mol (via Jmol)
000550689.b3lyp_6-31g(d).inp

000550689.b3lyp_6-31g(d).qchem.inp (generated)

000550689.b3lyp_6-31g(d).gjf (generated)

000550689.b3lyp_6-31g(d).firefly.inp (generated)

000550689.b3lyp_6-31g(d).smash.inp (generated)

000550689.b3lyp_6-31g(d).nwchem.inp (generated) 000550689.b3lyp_6-31g(d).log.xz 000550689.td-b3lyp_6-31g+(d).inp 000550689.td-b3lyp_6-31g+(d).log.xz

000550689.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550689.td-b3lyp_6-31+g(d).gjf (generated)

000550689.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550689.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550689.mol 000550689.PUBCHEM 000550689.mol (via Jmol)
000550690.b3lyp_6-31g(d).inp

000550690.b3lyp_6-31g(d).qchem.inp (generated)

000550690.b3lyp_6-31g(d).gjf (generated)

000550690.b3lyp_6-31g(d).firefly.inp (generated)

000550690.b3lyp_6-31g(d).smash.inp (generated)

000550690.b3lyp_6-31g(d).nwchem.inp (generated) 000550690.b3lyp_6-31g(d).log.xz 000550690.td-b3lyp_6-31g+(d).inp 000550690.td-b3lyp_6-31g+(d).log.xz

000550690.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550690.td-b3lyp_6-31+g(d).gjf (generated)

000550690.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550690.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550690.mol 000550690.PUBCHEM 000550690.mol (via Jmol)
000550692.b3lyp_6-31g(d).inp

000550692.b3lyp_6-31g(d).qchem.inp (generated)

000550692.b3lyp_6-31g(d).gjf (generated)

000550692.b3lyp_6-31g(d).firefly.inp (generated)

000550692.b3lyp_6-31g(d).smash.inp (generated)

000550692.b3lyp_6-31g(d).nwchem.inp (generated) 000550692.b3lyp_6-31g(d).log.xz 000550692.td-b3lyp_6-31g+(d).inp 000550692.td-b3lyp_6-31g+(d).log.xz

000550692.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550692.td-b3lyp_6-31+g(d).gjf (generated)

000550692.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550692.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550692.mol 000550692.PUBCHEM 000550692.mol (via Jmol)
000550695.b3lyp_6-31g(d).inp

000550695.b3lyp_6-31g(d).qchem.inp (generated)

000550695.b3lyp_6-31g(d).gjf (generated)

000550695.b3lyp_6-31g(d).firefly.inp (generated)

000550695.b3lyp_6-31g(d).smash.inp (generated)

000550695.b3lyp_6-31g(d).nwchem.inp (generated) 000550695.b3lyp_6-31g(d).log.xz 000550695.td-b3lyp_6-31g+(d).inp 000550695.td-b3lyp_6-31g+(d).log.xz

000550695.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550695.td-b3lyp_6-31+g(d).gjf (generated)

000550695.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550695.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550695.mol 000550695.PUBCHEM 000550695.mol (via Jmol)
000550697.b3lyp_6-31g(d).inp

000550697.b3lyp_6-31g(d).qchem.inp (generated)

000550697.b3lyp_6-31g(d).gjf (generated)

000550697.b3lyp_6-31g(d).firefly.inp (generated)

000550697.b3lyp_6-31g(d).smash.inp (generated)

000550697.b3lyp_6-31g(d).nwchem.inp (generated) 000550697.b3lyp_6-31g(d).log.xz 000550697.td-b3lyp_6-31g+(d).inp 000550697.td-b3lyp_6-31g+(d).log.xz

000550697.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550697.td-b3lyp_6-31+g(d).gjf (generated)

000550697.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550697.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550697.mol 000550697.PUBCHEM 000550697.mol (via Jmol)
000550699.b3lyp_6-31g(d).inp

000550699.b3lyp_6-31g(d).qchem.inp (generated)

000550699.b3lyp_6-31g(d).gjf (generated)

000550699.b3lyp_6-31g(d).firefly.inp (generated)

000550699.b3lyp_6-31g(d).smash.inp (generated)

000550699.b3lyp_6-31g(d).nwchem.inp (generated) 000550699.b3lyp_6-31g(d).log.xz 000550699.td-b3lyp_6-31g+(d).inp 000550699.td-b3lyp_6-31g+(d).log.xz

000550699.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550699.td-b3lyp_6-31+g(d).gjf (generated)

000550699.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550699.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550699.mol 000550699.PUBCHEM 000550699.mol (via Jmol)
000550700.b3lyp_6-31g(d).inp

000550700.b3lyp_6-31g(d).qchem.inp (generated)

000550700.b3lyp_6-31g(d).gjf (generated)

000550700.b3lyp_6-31g(d).firefly.inp (generated)

000550700.b3lyp_6-31g(d).smash.inp (generated)

000550700.b3lyp_6-31g(d).nwchem.inp (generated) 000550700.b3lyp_6-31g(d).log.xz 000550700.td-b3lyp_6-31g+(d).inp 000550700.td-b3lyp_6-31g+(d).log.xz

000550700.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550700.td-b3lyp_6-31+g(d).gjf (generated)

000550700.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550700.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550700.mol 000550700.PUBCHEM 000550700.mol (via Jmol)
000550706.b3lyp_6-31g(d).inp

000550706.b3lyp_6-31g(d).qchem.inp (generated)

000550706.b3lyp_6-31g(d).gjf (generated)

000550706.b3lyp_6-31g(d).firefly.inp (generated)

000550706.b3lyp_6-31g(d).smash.inp (generated)

000550706.b3lyp_6-31g(d).nwchem.inp (generated) 000550706.b3lyp_6-31g(d).log.xz 000550706.td-b3lyp_6-31g+(d).inp 000550706.td-b3lyp_6-31g+(d).log.xz

000550706.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550706.td-b3lyp_6-31+g(d).gjf (generated)

000550706.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550706.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550706.mol 000550706.PUBCHEM 000550706.mol (via Jmol)
000550707.b3lyp_6-31g(d).inp

000550707.b3lyp_6-31g(d).qchem.inp (generated)

000550707.b3lyp_6-31g(d).gjf (generated)

000550707.b3lyp_6-31g(d).firefly.inp (generated)

000550707.b3lyp_6-31g(d).smash.inp (generated)

000550707.b3lyp_6-31g(d).nwchem.inp (generated) 000550707.b3lyp_6-31g(d).log.xz 000550707.td-b3lyp_6-31g+(d).inp 000550707.td-b3lyp_6-31g+(d).log.xz

000550707.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550707.td-b3lyp_6-31+g(d).gjf (generated)

000550707.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550707.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550707.mol 000550707.PUBCHEM 000550707.mol (via Jmol)
000550708.b3lyp_6-31g(d).inp

000550708.b3lyp_6-31g(d).qchem.inp (generated)

000550708.b3lyp_6-31g(d).gjf (generated)

000550708.b3lyp_6-31g(d).firefly.inp (generated)

000550708.b3lyp_6-31g(d).smash.inp (generated)

000550708.b3lyp_6-31g(d).nwchem.inp (generated) 000550708.b3lyp_6-31g(d).log.xz 000550708.td-b3lyp_6-31g+(d).inp 000550708.td-b3lyp_6-31g+(d).log.xz

000550708.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550708.td-b3lyp_6-31+g(d).gjf (generated)

000550708.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550708.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550708.mol 000550708.PUBCHEM 000550708.mol (via Jmol)
000550710.b3lyp_6-31g(d).inp

000550710.b3lyp_6-31g(d).qchem.inp (generated)

000550710.b3lyp_6-31g(d).gjf (generated)

000550710.b3lyp_6-31g(d).firefly.inp (generated)

000550710.b3lyp_6-31g(d).smash.inp (generated)

000550710.b3lyp_6-31g(d).nwchem.inp (generated) 000550710.b3lyp_6-31g(d).log.xz 000550710.td-b3lyp_6-31g+(d).inp 000550710.td-b3lyp_6-31g+(d).log.xz

000550710.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550710.td-b3lyp_6-31+g(d).gjf (generated)

000550710.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550710.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550710.mol 000550710.PUBCHEM 000550710.mol (via Jmol)
000550711.b3lyp_6-31g(d).inp

000550711.b3lyp_6-31g(d).qchem.inp (generated)

000550711.b3lyp_6-31g(d).gjf (generated)

000550711.b3lyp_6-31g(d).firefly.inp (generated)

000550711.b3lyp_6-31g(d).smash.inp (generated)

000550711.b3lyp_6-31g(d).nwchem.inp (generated) 000550711.b3lyp_6-31g(d).log.xz 000550711.td-b3lyp_6-31g+(d).inp 000550711.td-b3lyp_6-31g+(d).log.xz

000550711.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550711.td-b3lyp_6-31+g(d).gjf (generated)

000550711.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550711.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550711.mol 000550711.PUBCHEM 000550711.mol (via Jmol)
000550712.b3lyp_6-31g(d).inp

000550712.b3lyp_6-31g(d).qchem.inp (generated)

000550712.b3lyp_6-31g(d).gjf (generated)

000550712.b3lyp_6-31g(d).firefly.inp (generated)

000550712.b3lyp_6-31g(d).smash.inp (generated)

000550712.b3lyp_6-31g(d).nwchem.inp (generated) 000550712.b3lyp_6-31g(d).log.xz 000550712.td-b3lyp_6-31g+(d).inp 000550712.td-b3lyp_6-31g+(d).log.xz

000550712.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550712.td-b3lyp_6-31+g(d).gjf (generated)

000550712.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550712.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550712.mol 000550712.PUBCHEM 000550712.mol (via Jmol)
000550715.b3lyp_6-31g(d).inp

000550715.b3lyp_6-31g(d).qchem.inp (generated)

000550715.b3lyp_6-31g(d).gjf (generated)

000550715.b3lyp_6-31g(d).firefly.inp (generated)

000550715.b3lyp_6-31g(d).smash.inp (generated)

000550715.b3lyp_6-31g(d).nwchem.inp (generated) 000550715.b3lyp_6-31g(d).log.xz 000550715.td-b3lyp_6-31g+(d).inp 000550715.td-b3lyp_6-31g+(d).log.xz

000550715.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550715.td-b3lyp_6-31+g(d).gjf (generated)

000550715.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550715.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550715.mol 000550715.PUBCHEM 000550715.mol (via Jmol)
000550718.b3lyp_6-31g(d).inp

000550718.b3lyp_6-31g(d).qchem.inp (generated)

000550718.b3lyp_6-31g(d).gjf (generated)

000550718.b3lyp_6-31g(d).firefly.inp (generated)

000550718.b3lyp_6-31g(d).smash.inp (generated)

000550718.b3lyp_6-31g(d).nwchem.inp (generated) 000550718.b3lyp_6-31g(d).log.xz 000550718.td-b3lyp_6-31g+(d).inp 000550718.td-b3lyp_6-31g+(d).log.xz

000550718.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550718.td-b3lyp_6-31+g(d).gjf (generated)

000550718.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550718.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550718.mol 000550718.PUBCHEM 000550718.mol (via Jmol)
000550719.b3lyp_6-31g(d).inp

000550719.b3lyp_6-31g(d).qchem.inp (generated)

000550719.b3lyp_6-31g(d).gjf (generated)

000550719.b3lyp_6-31g(d).firefly.inp (generated)

000550719.b3lyp_6-31g(d).smash.inp (generated)

000550719.b3lyp_6-31g(d).nwchem.inp (generated) 000550719.b3lyp_6-31g(d).log.xz 000550719.td-b3lyp_6-31g+(d).inp 000550719.td-b3lyp_6-31g+(d).log.xz

000550719.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550719.td-b3lyp_6-31+g(d).gjf (generated)

000550719.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550719.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550719.mol 000550719.PUBCHEM 000550719.mol (via Jmol)
000550721.b3lyp_6-31g(d).inp

000550721.b3lyp_6-31g(d).qchem.inp (generated)

000550721.b3lyp_6-31g(d).gjf (generated)

000550721.b3lyp_6-31g(d).firefly.inp (generated)

000550721.b3lyp_6-31g(d).smash.inp (generated)

000550721.b3lyp_6-31g(d).nwchem.inp (generated) 000550721.b3lyp_6-31g(d).log.xz 000550721.td-b3lyp_6-31g+(d).inp 000550721.td-b3lyp_6-31g+(d).log.xz

000550721.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550721.td-b3lyp_6-31+g(d).gjf (generated)

000550721.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550721.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550721.mol 000550721.PUBCHEM 000550721.mol (via Jmol)
000550722.b3lyp_6-31g(d).inp

000550722.b3lyp_6-31g(d).qchem.inp (generated)

000550722.b3lyp_6-31g(d).gjf (generated)

000550722.b3lyp_6-31g(d).firefly.inp (generated)

000550722.b3lyp_6-31g(d).smash.inp (generated)

000550722.b3lyp_6-31g(d).nwchem.inp (generated) 000550722.b3lyp_6-31g(d).log.xz 000550722.td-b3lyp_6-31g+(d).inp 000550722.td-b3lyp_6-31g+(d).log.xz

000550722.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550722.td-b3lyp_6-31+g(d).gjf (generated)

000550722.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550722.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550722.mol 000550722.PUBCHEM 000550722.mol (via Jmol)
000550723.b3lyp_6-31g(d).inp

000550723.b3lyp_6-31g(d).qchem.inp (generated)

000550723.b3lyp_6-31g(d).gjf (generated)

000550723.b3lyp_6-31g(d).firefly.inp (generated)

000550723.b3lyp_6-31g(d).smash.inp (generated)

000550723.b3lyp_6-31g(d).nwchem.inp (generated) 000550723.b3lyp_6-31g(d).log.xz 000550723.td-b3lyp_6-31g+(d).inp 000550723.td-b3lyp_6-31g+(d).log.xz

000550723.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550723.td-b3lyp_6-31+g(d).gjf (generated)

000550723.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550723.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550723.mol 000550723.PUBCHEM 000550723.mol (via Jmol)
000550724.b3lyp_6-31g(d).inp

000550724.b3lyp_6-31g(d).qchem.inp (generated)

000550724.b3lyp_6-31g(d).gjf (generated)

000550724.b3lyp_6-31g(d).firefly.inp (generated)

000550724.b3lyp_6-31g(d).smash.inp (generated)

000550724.b3lyp_6-31g(d).nwchem.inp (generated) 000550724.b3lyp_6-31g(d).log.xz 000550724.td-b3lyp_6-31g+(d).inp 000550724.td-b3lyp_6-31g+(d).log.xz

000550724.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550724.td-b3lyp_6-31+g(d).gjf (generated)

000550724.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550724.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550724.mol 000550724.PUBCHEM 000550724.mol (via Jmol)
000550727.b3lyp_6-31g(d).inp

000550727.b3lyp_6-31g(d).qchem.inp (generated)

000550727.b3lyp_6-31g(d).gjf (generated)

000550727.b3lyp_6-31g(d).firefly.inp (generated)

000550727.b3lyp_6-31g(d).smash.inp (generated)

000550727.b3lyp_6-31g(d).nwchem.inp (generated) 000550727.b3lyp_6-31g(d).log.xz 000550727.td-b3lyp_6-31g+(d).inp 000550727.td-b3lyp_6-31g+(d).log.xz

000550727.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550727.td-b3lyp_6-31+g(d).gjf (generated)

000550727.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550727.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550727.mol 000550727.PUBCHEM 000550727.mol (via Jmol)
000550728.b3lyp_6-31g(d).inp

000550728.b3lyp_6-31g(d).qchem.inp (generated)

000550728.b3lyp_6-31g(d).gjf (generated)

000550728.b3lyp_6-31g(d).firefly.inp (generated)

000550728.b3lyp_6-31g(d).smash.inp (generated)

000550728.b3lyp_6-31g(d).nwchem.inp (generated) 000550728.b3lyp_6-31g(d).log.xz 000550728.td-b3lyp_6-31g+(d).inp 000550728.td-b3lyp_6-31g+(d).log.xz

000550728.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550728.td-b3lyp_6-31+g(d).gjf (generated)

000550728.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550728.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550728.mol 000550728.PUBCHEM 000550728.mol (via Jmol)
000550729.b3lyp_6-31g(d).inp

000550729.b3lyp_6-31g(d).qchem.inp (generated)

000550729.b3lyp_6-31g(d).gjf (generated)

000550729.b3lyp_6-31g(d).firefly.inp (generated)

000550729.b3lyp_6-31g(d).smash.inp (generated)

000550729.b3lyp_6-31g(d).nwchem.inp (generated) 000550729.b3lyp_6-31g(d).log.xz 000550729.td-b3lyp_6-31g+(d).inp 000550729.td-b3lyp_6-31g+(d).log.xz

000550729.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550729.td-b3lyp_6-31+g(d).gjf (generated)

000550729.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550729.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550729.mol 000550729.PUBCHEM 000550729.mol (via Jmol)
000550730.b3lyp_6-31g(d).inp

000550730.b3lyp_6-31g(d).qchem.inp (generated)

000550730.b3lyp_6-31g(d).gjf (generated)

000550730.b3lyp_6-31g(d).firefly.inp (generated)

000550730.b3lyp_6-31g(d).smash.inp (generated)

000550730.b3lyp_6-31g(d).nwchem.inp (generated) 000550730.b3lyp_6-31g(d).log.xz 000550730.td-b3lyp_6-31g+(d).inp 000550730.td-b3lyp_6-31g+(d).log.xz

000550730.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550730.td-b3lyp_6-31+g(d).gjf (generated)

000550730.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550730.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550730.mol 000550730.PUBCHEM 000550730.mol (via Jmol)
000550732.b3lyp_6-31g(d).inp

000550732.b3lyp_6-31g(d).qchem.inp (generated)

000550732.b3lyp_6-31g(d).gjf (generated)

000550732.b3lyp_6-31g(d).firefly.inp (generated)

000550732.b3lyp_6-31g(d).smash.inp (generated)

000550732.b3lyp_6-31g(d).nwchem.inp (generated) 000550732.b3lyp_6-31g(d).log.xz 000550732.td-b3lyp_6-31g+(d).inp 000550732.td-b3lyp_6-31g+(d).log.xz

000550732.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550732.td-b3lyp_6-31+g(d).gjf (generated)

000550732.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550732.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550732.mol 000550732.PUBCHEM 000550732.mol (via Jmol)
000550733.b3lyp_6-31g(d).inp

000550733.b3lyp_6-31g(d).qchem.inp (generated)

000550733.b3lyp_6-31g(d).gjf (generated)

000550733.b3lyp_6-31g(d).firefly.inp (generated)

000550733.b3lyp_6-31g(d).smash.inp (generated)

000550733.b3lyp_6-31g(d).nwchem.inp (generated) 000550733.b3lyp_6-31g(d).log.xz 000550733.td-b3lyp_6-31g+(d).inp 000550733.td-b3lyp_6-31g+(d).log.xz

000550733.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550733.td-b3lyp_6-31+g(d).gjf (generated)

000550733.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550733.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550733.mol 000550733.PUBCHEM 000550733.mol (via Jmol)
000550735.b3lyp_6-31g(d).inp

000550735.b3lyp_6-31g(d).qchem.inp (generated)

000550735.b3lyp_6-31g(d).gjf (generated)

000550735.b3lyp_6-31g(d).firefly.inp (generated)

000550735.b3lyp_6-31g(d).smash.inp (generated)

000550735.b3lyp_6-31g(d).nwchem.inp (generated) 000550735.b3lyp_6-31g(d).log.xz 000550735.td-b3lyp_6-31g+(d).inp 000550735.td-b3lyp_6-31g+(d).log.xz

000550735.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550735.td-b3lyp_6-31+g(d).gjf (generated)

000550735.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550735.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550735.mol 000550735.PUBCHEM 000550735.mol (via Jmol)
000550737.b3lyp_6-31g(d).inp

000550737.b3lyp_6-31g(d).qchem.inp (generated)

000550737.b3lyp_6-31g(d).gjf (generated)

000550737.b3lyp_6-31g(d).firefly.inp (generated)

000550737.b3lyp_6-31g(d).smash.inp (generated)

000550737.b3lyp_6-31g(d).nwchem.inp (generated) 000550737.b3lyp_6-31g(d).log.xz 000550737.td-b3lyp_6-31g+(d).inp 000550737.td-b3lyp_6-31g+(d).log.xz

000550737.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550737.td-b3lyp_6-31+g(d).gjf (generated)

000550737.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550737.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550737.mol 000550737.PUBCHEM 000550737.mol (via Jmol)
000550739.b3lyp_6-31g(d).inp

000550739.b3lyp_6-31g(d).qchem.inp (generated)

000550739.b3lyp_6-31g(d).gjf (generated)

000550739.b3lyp_6-31g(d).firefly.inp (generated)

000550739.b3lyp_6-31g(d).smash.inp (generated)

000550739.b3lyp_6-31g(d).nwchem.inp (generated) 000550739.b3lyp_6-31g(d).log.xz 000550739.td-b3lyp_6-31g+(d).inp 000550739.td-b3lyp_6-31g+(d).log.xz

000550739.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550739.td-b3lyp_6-31+g(d).gjf (generated)

000550739.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550739.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550739.mol 000550739.PUBCHEM 000550739.mol (via Jmol)
000550740.b3lyp_6-31g(d).inp

000550740.b3lyp_6-31g(d).qchem.inp (generated)

000550740.b3lyp_6-31g(d).gjf (generated)

000550740.b3lyp_6-31g(d).firefly.inp (generated)

000550740.b3lyp_6-31g(d).smash.inp (generated)

000550740.b3lyp_6-31g(d).nwchem.inp (generated) 000550740.b3lyp_6-31g(d).log.xz 000550740.td-b3lyp_6-31g+(d).inp 000550740.td-b3lyp_6-31g+(d).log.xz

000550740.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550740.td-b3lyp_6-31+g(d).gjf (generated)

000550740.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550740.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550740.mol 000550740.PUBCHEM 000550740.mol (via Jmol)
000550741.b3lyp_6-31g(d).inp

000550741.b3lyp_6-31g(d).qchem.inp (generated)

000550741.b3lyp_6-31g(d).gjf (generated)

000550741.b3lyp_6-31g(d).firefly.inp (generated)

000550741.b3lyp_6-31g(d).smash.inp (generated)

000550741.b3lyp_6-31g(d).nwchem.inp (generated) 000550741.b3lyp_6-31g(d).log.xz 000550741.td-b3lyp_6-31g+(d).inp 000550741.td-b3lyp_6-31g+(d).log.xz

000550741.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550741.td-b3lyp_6-31+g(d).gjf (generated)

000550741.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550741.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550741.mol 000550741.PUBCHEM 000550741.mol (via Jmol)
000550743.b3lyp_6-31g(d).inp

000550743.b3lyp_6-31g(d).qchem.inp (generated)

000550743.b3lyp_6-31g(d).gjf (generated)

000550743.b3lyp_6-31g(d).firefly.inp (generated)

000550743.b3lyp_6-31g(d).smash.inp (generated)

000550743.b3lyp_6-31g(d).nwchem.inp (generated) 000550743.b3lyp_6-31g(d).log.xz 000550743.td-b3lyp_6-31g+(d).inp 000550743.td-b3lyp_6-31g+(d).log.xz

000550743.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550743.td-b3lyp_6-31+g(d).gjf (generated)

000550743.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550743.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550743.mol 000550743.PUBCHEM 000550743.mol (via Jmol)
000550744.b3lyp_6-31g(d).inp

000550744.b3lyp_6-31g(d).qchem.inp (generated)

000550744.b3lyp_6-31g(d).gjf (generated)

000550744.b3lyp_6-31g(d).firefly.inp (generated)

000550744.b3lyp_6-31g(d).smash.inp (generated)

000550744.b3lyp_6-31g(d).nwchem.inp (generated) 000550744.b3lyp_6-31g(d).log.xz 000550744.td-b3lyp_6-31g+(d).inp 000550744.td-b3lyp_6-31g+(d).log.xz

000550744.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550744.td-b3lyp_6-31+g(d).gjf (generated)

000550744.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550744.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550744.mol 000550744.PUBCHEM 000550744.mol (via Jmol)
000550745.b3lyp_6-31g(d).inp

000550745.b3lyp_6-31g(d).qchem.inp (generated)

000550745.b3lyp_6-31g(d).gjf (generated)

000550745.b3lyp_6-31g(d).firefly.inp (generated)

000550745.b3lyp_6-31g(d).smash.inp (generated)

000550745.b3lyp_6-31g(d).nwchem.inp (generated) 000550745.b3lyp_6-31g(d).log.xz 000550745.td-b3lyp_6-31g+(d).inp 000550745.td-b3lyp_6-31g+(d).log.xz

000550745.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550745.td-b3lyp_6-31+g(d).gjf (generated)

000550745.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550745.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550745.mol 000550745.PUBCHEM 000550745.mol (via Jmol)
000550746.b3lyp_6-31g(d).inp

000550746.b3lyp_6-31g(d).qchem.inp (generated)

000550746.b3lyp_6-31g(d).gjf (generated)

000550746.b3lyp_6-31g(d).firefly.inp (generated)

000550746.b3lyp_6-31g(d).smash.inp (generated)

000550746.b3lyp_6-31g(d).nwchem.inp (generated) 000550746.b3lyp_6-31g(d).log.xz 000550746.td-b3lyp_6-31g+(d).inp 000550746.td-b3lyp_6-31g+(d).log.xz

000550746.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550746.td-b3lyp_6-31+g(d).gjf (generated)

000550746.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550746.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550746.mol 000550746.PUBCHEM 000550746.mol (via Jmol)
000550747.b3lyp_6-31g(d).inp

000550747.b3lyp_6-31g(d).qchem.inp (generated)

000550747.b3lyp_6-31g(d).gjf (generated)

000550747.b3lyp_6-31g(d).firefly.inp (generated)

000550747.b3lyp_6-31g(d).smash.inp (generated)

000550747.b3lyp_6-31g(d).nwchem.inp (generated) 000550747.b3lyp_6-31g(d).log.xz 000550747.td-b3lyp_6-31g+(d).inp 000550747.td-b3lyp_6-31g+(d).log.xz

000550747.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550747.td-b3lyp_6-31+g(d).gjf (generated)

000550747.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550747.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550747.mol 000550747.PUBCHEM 000550747.mol (via Jmol)
000550748.b3lyp_6-31g(d).inp

000550748.b3lyp_6-31g(d).qchem.inp (generated)

000550748.b3lyp_6-31g(d).gjf (generated)

000550748.b3lyp_6-31g(d).firefly.inp (generated)

000550748.b3lyp_6-31g(d).smash.inp (generated)

000550748.b3lyp_6-31g(d).nwchem.inp (generated) 000550748.b3lyp_6-31g(d).log.xz 000550748.td-b3lyp_6-31g+(d).inp 000550748.td-b3lyp_6-31g+(d).log.xz

000550748.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550748.td-b3lyp_6-31+g(d).gjf (generated)

000550748.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550748.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550748.mol 000550748.PUBCHEM 000550748.mol (via Jmol)
000550749.b3lyp_6-31g(d).inp

000550749.b3lyp_6-31g(d).qchem.inp (generated)

000550749.b3lyp_6-31g(d).gjf (generated)

000550749.b3lyp_6-31g(d).firefly.inp (generated)

000550749.b3lyp_6-31g(d).smash.inp (generated)

000550749.b3lyp_6-31g(d).nwchem.inp (generated) 000550749.b3lyp_6-31g(d).log.xz 000550749.td-b3lyp_6-31g+(d).inp 000550749.td-b3lyp_6-31g+(d).log.xz

000550749.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550749.td-b3lyp_6-31+g(d).gjf (generated)

000550749.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550749.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550749.mol 000550749.PUBCHEM 000550749.mol (via Jmol)
000550750.b3lyp_6-31g(d).inp

000550750.b3lyp_6-31g(d).qchem.inp (generated)

000550750.b3lyp_6-31g(d).gjf (generated)

000550750.b3lyp_6-31g(d).firefly.inp (generated)

000550750.b3lyp_6-31g(d).smash.inp (generated)

000550750.b3lyp_6-31g(d).nwchem.inp (generated) 000550750.b3lyp_6-31g(d).log.xz 000550750.td-b3lyp_6-31g+(d).inp 000550750.td-b3lyp_6-31g+(d).log.xz

000550750.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550750.td-b3lyp_6-31+g(d).gjf (generated)

000550750.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550750.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550750.mol 000550750.PUBCHEM 000550750.mol (via Jmol)
000550751.b3lyp_6-31g(d).inp

000550751.b3lyp_6-31g(d).qchem.inp (generated)

000550751.b3lyp_6-31g(d).gjf (generated)

000550751.b3lyp_6-31g(d).firefly.inp (generated)

000550751.b3lyp_6-31g(d).smash.inp (generated)

000550751.b3lyp_6-31g(d).nwchem.inp (generated) 000550751.b3lyp_6-31g(d).log.xz 000550751.td-b3lyp_6-31g+(d).inp 000550751.td-b3lyp_6-31g+(d).log.xz

000550751.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550751.td-b3lyp_6-31+g(d).gjf (generated)

000550751.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550751.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550751.mol 000550751.PUBCHEM 000550751.mol (via Jmol)
000550752.b3lyp_6-31g(d).inp

000550752.b3lyp_6-31g(d).qchem.inp (generated)

000550752.b3lyp_6-31g(d).gjf (generated)

000550752.b3lyp_6-31g(d).firefly.inp (generated)

000550752.b3lyp_6-31g(d).smash.inp (generated)

000550752.b3lyp_6-31g(d).nwchem.inp (generated) 000550752.b3lyp_6-31g(d).log.xz 000550752.td-b3lyp_6-31g+(d).inp 000550752.td-b3lyp_6-31g+(d).log.xz

000550752.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550752.td-b3lyp_6-31+g(d).gjf (generated)

000550752.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550752.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550752.mol 000550752.PUBCHEM 000550752.mol (via Jmol)
000550753.b3lyp_6-31g(d).inp

000550753.b3lyp_6-31g(d).qchem.inp (generated)

000550753.b3lyp_6-31g(d).gjf (generated)

000550753.b3lyp_6-31g(d).firefly.inp (generated)

000550753.b3lyp_6-31g(d).smash.inp (generated)

000550753.b3lyp_6-31g(d).nwchem.inp (generated) 000550753.b3lyp_6-31g(d).log.xz 000550753.td-b3lyp_6-31g+(d).inp 000550753.td-b3lyp_6-31g+(d).log.xz

000550753.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550753.td-b3lyp_6-31+g(d).gjf (generated)

000550753.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550753.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550753.mol 000550753.PUBCHEM 000550753.mol (via Jmol)
000550754.b3lyp_6-31g(d).inp

000550754.b3lyp_6-31g(d).qchem.inp (generated)

000550754.b3lyp_6-31g(d).gjf (generated)

000550754.b3lyp_6-31g(d).firefly.inp (generated)

000550754.b3lyp_6-31g(d).smash.inp (generated)

000550754.b3lyp_6-31g(d).nwchem.inp (generated) 000550754.b3lyp_6-31g(d).log.xz 000550754.td-b3lyp_6-31g+(d).inp 000550754.td-b3lyp_6-31g+(d).log.xz

000550754.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550754.td-b3lyp_6-31+g(d).gjf (generated)

000550754.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550754.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550754.mol 000550754.PUBCHEM 000550754.mol (via Jmol)
000550757.b3lyp_6-31g(d).inp

000550757.b3lyp_6-31g(d).qchem.inp (generated)

000550757.b3lyp_6-31g(d).gjf (generated)

000550757.b3lyp_6-31g(d).firefly.inp (generated)

000550757.b3lyp_6-31g(d).smash.inp (generated)

000550757.b3lyp_6-31g(d).nwchem.inp (generated) 000550757.b3lyp_6-31g(d).log.xz 000550757.td-b3lyp_6-31g+(d).inp 000550757.td-b3lyp_6-31g+(d).log.xz

000550757.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550757.td-b3lyp_6-31+g(d).gjf (generated)

000550757.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550757.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550757.mol 000550757.PUBCHEM 000550757.mol (via Jmol)
000550758.b3lyp_6-31g(d).inp

000550758.b3lyp_6-31g(d).qchem.inp (generated)

000550758.b3lyp_6-31g(d).gjf (generated)

000550758.b3lyp_6-31g(d).firefly.inp (generated)

000550758.b3lyp_6-31g(d).smash.inp (generated)

000550758.b3lyp_6-31g(d).nwchem.inp (generated) 000550758.b3lyp_6-31g(d).log.xz 000550758.td-b3lyp_6-31g+(d).inp 000550758.td-b3lyp_6-31g+(d).log.xz

000550758.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550758.td-b3lyp_6-31+g(d).gjf (generated)

000550758.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550758.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550758.mol 000550758.PUBCHEM 000550758.mol (via Jmol)
000550760.b3lyp_6-31g(d).inp

000550760.b3lyp_6-31g(d).qchem.inp (generated)

000550760.b3lyp_6-31g(d).gjf (generated)

000550760.b3lyp_6-31g(d).firefly.inp (generated)

000550760.b3lyp_6-31g(d).smash.inp (generated)

000550760.b3lyp_6-31g(d).nwchem.inp (generated) 000550760.b3lyp_6-31g(d).log.xz 000550760.td-b3lyp_6-31g+(d).inp 000550760.td-b3lyp_6-31g+(d).log.xz

000550760.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550760.td-b3lyp_6-31+g(d).gjf (generated)

000550760.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550760.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550760.mol 000550760.PUBCHEM 000550760.mol (via Jmol)
000550761.b3lyp_6-31g(d).inp

000550761.b3lyp_6-31g(d).qchem.inp (generated)

000550761.b3lyp_6-31g(d).gjf (generated)

000550761.b3lyp_6-31g(d).firefly.inp (generated)

000550761.b3lyp_6-31g(d).smash.inp (generated)

000550761.b3lyp_6-31g(d).nwchem.inp (generated) 000550761.b3lyp_6-31g(d).log.xz 000550761.td-b3lyp_6-31g+(d).inp 000550761.td-b3lyp_6-31g+(d).log.xz

000550761.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550761.td-b3lyp_6-31+g(d).gjf (generated)

000550761.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550761.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550761.mol 000550761.PUBCHEM 000550761.mol (via Jmol)
000550763.b3lyp_6-31g(d).inp

000550763.b3lyp_6-31g(d).qchem.inp (generated)

000550763.b3lyp_6-31g(d).gjf (generated)

000550763.b3lyp_6-31g(d).firefly.inp (generated)

000550763.b3lyp_6-31g(d).smash.inp (generated)

000550763.b3lyp_6-31g(d).nwchem.inp (generated) 000550763.b3lyp_6-31g(d).log.xz 000550763.td-b3lyp_6-31g+(d).inp 000550763.td-b3lyp_6-31g+(d).log.xz

000550763.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550763.td-b3lyp_6-31+g(d).gjf (generated)

000550763.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550763.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550763.mol 000550763.PUBCHEM 000550763.mol (via Jmol)
000550766.b3lyp_6-31g(d).inp

000550766.b3lyp_6-31g(d).qchem.inp (generated)

000550766.b3lyp_6-31g(d).gjf (generated)

000550766.b3lyp_6-31g(d).firefly.inp (generated)

000550766.b3lyp_6-31g(d).smash.inp (generated)

000550766.b3lyp_6-31g(d).nwchem.inp (generated) 000550766.b3lyp_6-31g(d).log.xz 000550766.td-b3lyp_6-31g+(d).inp 000550766.td-b3lyp_6-31g+(d).log.xz

000550766.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550766.td-b3lyp_6-31+g(d).gjf (generated)

000550766.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550766.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550766.mol 000550766.PUBCHEM 000550766.mol (via Jmol)
000550767.b3lyp_6-31g(d).inp

000550767.b3lyp_6-31g(d).qchem.inp (generated)

000550767.b3lyp_6-31g(d).gjf (generated)

000550767.b3lyp_6-31g(d).firefly.inp (generated)

000550767.b3lyp_6-31g(d).smash.inp (generated)

000550767.b3lyp_6-31g(d).nwchem.inp (generated) 000550767.b3lyp_6-31g(d).log.xz 000550767.td-b3lyp_6-31g+(d).inp 000550767.td-b3lyp_6-31g+(d).log.xz

000550767.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550767.td-b3lyp_6-31+g(d).gjf (generated)

000550767.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550767.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550767.mol 000550767.PUBCHEM 000550767.mol (via Jmol)
000550768.b3lyp_6-31g(d).inp

000550768.b3lyp_6-31g(d).qchem.inp (generated)

000550768.b3lyp_6-31g(d).gjf (generated)

000550768.b3lyp_6-31g(d).firefly.inp (generated)

000550768.b3lyp_6-31g(d).smash.inp (generated)

000550768.b3lyp_6-31g(d).nwchem.inp (generated) 000550768.b3lyp_6-31g(d).log.xz 000550768.td-b3lyp_6-31g+(d).inp 000550768.td-b3lyp_6-31g+(d).log.xz

000550768.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550768.td-b3lyp_6-31+g(d).gjf (generated)

000550768.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550768.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550768.mol 000550768.PUBCHEM 000550768.mol (via Jmol)
000550771.b3lyp_6-31g(d).inp

000550771.b3lyp_6-31g(d).qchem.inp (generated)

000550771.b3lyp_6-31g(d).gjf (generated)

000550771.b3lyp_6-31g(d).firefly.inp (generated)

000550771.b3lyp_6-31g(d).smash.inp (generated)

000550771.b3lyp_6-31g(d).nwchem.inp (generated) 000550771.b3lyp_6-31g(d).log.xz 000550771.td-b3lyp_6-31g+(d).inp 000550771.td-b3lyp_6-31g+(d).log.xz

000550771.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550771.td-b3lyp_6-31+g(d).gjf (generated)

000550771.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550771.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550771.mol 000550771.PUBCHEM 000550771.mol (via Jmol)
000550774.b3lyp_6-31g(d).inp

000550774.b3lyp_6-31g(d).qchem.inp (generated)

000550774.b3lyp_6-31g(d).gjf (generated)

000550774.b3lyp_6-31g(d).firefly.inp (generated)

000550774.b3lyp_6-31g(d).smash.inp (generated)

000550774.b3lyp_6-31g(d).nwchem.inp (generated) 000550774.b3lyp_6-31g(d).log.xz 000550774.td-b3lyp_6-31g+(d).inp 000550774.td-b3lyp_6-31g+(d).log.xz

000550774.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550774.td-b3lyp_6-31+g(d).gjf (generated)

000550774.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550774.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550774.mol 000550774.PUBCHEM 000550774.mol (via Jmol)
000550776.b3lyp_6-31g(d).inp

000550776.b3lyp_6-31g(d).qchem.inp (generated)

000550776.b3lyp_6-31g(d).gjf (generated)

000550776.b3lyp_6-31g(d).firefly.inp (generated)

000550776.b3lyp_6-31g(d).smash.inp (generated)

000550776.b3lyp_6-31g(d).nwchem.inp (generated) 000550776.b3lyp_6-31g(d).log.xz 000550776.td-b3lyp_6-31g+(d).inp 000550776.td-b3lyp_6-31g+(d).log.xz

000550776.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550776.td-b3lyp_6-31+g(d).gjf (generated)

000550776.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550776.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550776.mol 000550776.PUBCHEM 000550776.mol (via Jmol)
000550777.b3lyp_6-31g(d).inp

000550777.b3lyp_6-31g(d).qchem.inp (generated)

000550777.b3lyp_6-31g(d).gjf (generated)

000550777.b3lyp_6-31g(d).firefly.inp (generated)

000550777.b3lyp_6-31g(d).smash.inp (generated)

000550777.b3lyp_6-31g(d).nwchem.inp (generated) 000550777.b3lyp_6-31g(d).log.xz 000550777.td-b3lyp_6-31g+(d).inp 000550777.td-b3lyp_6-31g+(d).log.xz

000550777.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550777.td-b3lyp_6-31+g(d).gjf (generated)

000550777.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550777.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550777.mol 000550777.PUBCHEM 000550777.mol (via Jmol)
000550779.b3lyp_6-31g(d).inp

000550779.b3lyp_6-31g(d).qchem.inp (generated)

000550779.b3lyp_6-31g(d).gjf (generated)

000550779.b3lyp_6-31g(d).firefly.inp (generated)

000550779.b3lyp_6-31g(d).smash.inp (generated)

000550779.b3lyp_6-31g(d).nwchem.inp (generated) 000550779.b3lyp_6-31g(d).log.xz 000550779.td-b3lyp_6-31g+(d).inp 000550779.td-b3lyp_6-31g+(d).log.xz

000550779.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550779.td-b3lyp_6-31+g(d).gjf (generated)

000550779.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550779.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550779.mol 000550779.PUBCHEM 000550779.mol (via Jmol)
000550780.b3lyp_6-31g(d).inp

000550780.b3lyp_6-31g(d).qchem.inp (generated)

000550780.b3lyp_6-31g(d).gjf (generated)

000550780.b3lyp_6-31g(d).firefly.inp (generated)

000550780.b3lyp_6-31g(d).smash.inp (generated)

000550780.b3lyp_6-31g(d).nwchem.inp (generated) 000550780.b3lyp_6-31g(d).log.xz 000550780.td-b3lyp_6-31g+(d).inp 000550780.td-b3lyp_6-31g+(d).log.xz

000550780.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550780.td-b3lyp_6-31+g(d).gjf (generated)

000550780.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550780.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550780.mol 000550780.PUBCHEM 000550780.mol (via Jmol)
000550781.b3lyp_6-31g(d).inp

000550781.b3lyp_6-31g(d).qchem.inp (generated)

000550781.b3lyp_6-31g(d).gjf (generated)

000550781.b3lyp_6-31g(d).firefly.inp (generated)

000550781.b3lyp_6-31g(d).smash.inp (generated)

000550781.b3lyp_6-31g(d).nwchem.inp (generated) 000550781.b3lyp_6-31g(d).log.xz 000550781.td-b3lyp_6-31g+(d).inp 000550781.td-b3lyp_6-31g+(d).log.xz

000550781.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550781.td-b3lyp_6-31+g(d).gjf (generated)

000550781.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550781.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550781.mol 000550781.PUBCHEM 000550781.mol (via Jmol)
000550785.b3lyp_6-31g(d).inp

000550785.b3lyp_6-31g(d).qchem.inp (generated)

000550785.b3lyp_6-31g(d).gjf (generated)

000550785.b3lyp_6-31g(d).firefly.inp (generated)

000550785.b3lyp_6-31g(d).smash.inp (generated)

000550785.b3lyp_6-31g(d).nwchem.inp (generated) 000550785.b3lyp_6-31g(d).log.xz 000550785.td-b3lyp_6-31g+(d).inp 000550785.td-b3lyp_6-31g+(d).log.xz

000550785.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550785.td-b3lyp_6-31+g(d).gjf (generated)

000550785.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550785.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550785.mol 000550785.PUBCHEM 000550785.mol (via Jmol)
000550787.b3lyp_6-31g(d).inp

000550787.b3lyp_6-31g(d).qchem.inp (generated)

000550787.b3lyp_6-31g(d).gjf (generated)

000550787.b3lyp_6-31g(d).firefly.inp (generated)

000550787.b3lyp_6-31g(d).smash.inp (generated)

000550787.b3lyp_6-31g(d).nwchem.inp (generated) 000550787.b3lyp_6-31g(d).log.xz 000550787.td-b3lyp_6-31g+(d).inp 000550787.td-b3lyp_6-31g+(d).log.xz

000550787.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550787.td-b3lyp_6-31+g(d).gjf (generated)

000550787.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550787.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550787.mol 000550787.PUBCHEM 000550787.mol (via Jmol)
000550788.b3lyp_6-31g(d).inp

000550788.b3lyp_6-31g(d).qchem.inp (generated)

000550788.b3lyp_6-31g(d).gjf (generated)

000550788.b3lyp_6-31g(d).firefly.inp (generated)

000550788.b3lyp_6-31g(d).smash.inp (generated)

000550788.b3lyp_6-31g(d).nwchem.inp (generated) 000550788.b3lyp_6-31g(d).log.xz 000550788.td-b3lyp_6-31g+(d).inp 000550788.td-b3lyp_6-31g+(d).log.xz

000550788.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550788.td-b3lyp_6-31+g(d).gjf (generated)

000550788.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550788.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550788.mol 000550788.PUBCHEM 000550788.mol (via Jmol)
000550789.b3lyp_6-31g(d).inp

000550789.b3lyp_6-31g(d).qchem.inp (generated)

000550789.b3lyp_6-31g(d).gjf (generated)

000550789.b3lyp_6-31g(d).firefly.inp (generated)

000550789.b3lyp_6-31g(d).smash.inp (generated)

000550789.b3lyp_6-31g(d).nwchem.inp (generated) 000550789.b3lyp_6-31g(d).log.xz 000550789.td-b3lyp_6-31g+(d).inp 000550789.td-b3lyp_6-31g+(d).log.xz

000550789.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550789.td-b3lyp_6-31+g(d).gjf (generated)

000550789.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550789.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550789.mol 000550789.PUBCHEM 000550789.mol (via Jmol)
000550790.b3lyp_6-31g(d).inp

000550790.b3lyp_6-31g(d).qchem.inp (generated)

000550790.b3lyp_6-31g(d).gjf (generated)

000550790.b3lyp_6-31g(d).firefly.inp (generated)

000550790.b3lyp_6-31g(d).smash.inp (generated)

000550790.b3lyp_6-31g(d).nwchem.inp (generated) 000550790.b3lyp_6-31g(d).log.xz 000550790.td-b3lyp_6-31g+(d).inp 000550790.td-b3lyp_6-31g+(d).log.xz

000550790.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550790.td-b3lyp_6-31+g(d).gjf (generated)

000550790.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550790.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550790.mol 000550790.PUBCHEM 000550790.mol (via Jmol)
000550792.b3lyp_6-31g(d).inp

000550792.b3lyp_6-31g(d).qchem.inp (generated)

000550792.b3lyp_6-31g(d).gjf (generated)

000550792.b3lyp_6-31g(d).firefly.inp (generated)

000550792.b3lyp_6-31g(d).smash.inp (generated)

000550792.b3lyp_6-31g(d).nwchem.inp (generated) 000550792.b3lyp_6-31g(d).log.xz 000550792.td-b3lyp_6-31g+(d).inp 000550792.td-b3lyp_6-31g+(d).log.xz

000550792.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550792.td-b3lyp_6-31+g(d).gjf (generated)

000550792.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550792.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550792.mol 000550792.PUBCHEM 000550792.mol (via Jmol)
000550795.b3lyp_6-31g(d).inp

000550795.b3lyp_6-31g(d).qchem.inp (generated)

000550795.b3lyp_6-31g(d).gjf (generated)

000550795.b3lyp_6-31g(d).firefly.inp (generated)

000550795.b3lyp_6-31g(d).smash.inp (generated)

000550795.b3lyp_6-31g(d).nwchem.inp (generated) 000550795.b3lyp_6-31g(d).log.xz 000550795.td-b3lyp_6-31g+(d).inp 000550795.td-b3lyp_6-31g+(d).log.xz

000550795.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550795.td-b3lyp_6-31+g(d).gjf (generated)

000550795.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550795.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550795.mol 000550795.PUBCHEM 000550795.mol (via Jmol)
000550796.b3lyp_6-31g(d).inp

000550796.b3lyp_6-31g(d).qchem.inp (generated)

000550796.b3lyp_6-31g(d).gjf (generated)

000550796.b3lyp_6-31g(d).firefly.inp (generated)

000550796.b3lyp_6-31g(d).smash.inp (generated)

000550796.b3lyp_6-31g(d).nwchem.inp (generated) 000550796.b3lyp_6-31g(d).log.xz 000550796.td-b3lyp_6-31g+(d).inp 000550796.td-b3lyp_6-31g+(d).log.xz

000550796.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550796.td-b3lyp_6-31+g(d).gjf (generated)

000550796.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550796.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550796.mol 000550796.PUBCHEM 000550796.mol (via Jmol)
000550797.b3lyp_6-31g(d).inp

000550797.b3lyp_6-31g(d).qchem.inp (generated)

000550797.b3lyp_6-31g(d).gjf (generated)

000550797.b3lyp_6-31g(d).firefly.inp (generated)

000550797.b3lyp_6-31g(d).smash.inp (generated)

000550797.b3lyp_6-31g(d).nwchem.inp (generated) 000550797.b3lyp_6-31g(d).log.xz 000550797.td-b3lyp_6-31g+(d).inp 000550797.td-b3lyp_6-31g+(d).log.xz

000550797.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550797.td-b3lyp_6-31+g(d).gjf (generated)

000550797.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550797.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550797.mol 000550797.PUBCHEM 000550797.mol (via Jmol)
000550798.b3lyp_6-31g(d).inp

000550798.b3lyp_6-31g(d).qchem.inp (generated)

000550798.b3lyp_6-31g(d).gjf (generated)

000550798.b3lyp_6-31g(d).firefly.inp (generated)

000550798.b3lyp_6-31g(d).smash.inp (generated)

000550798.b3lyp_6-31g(d).nwchem.inp (generated) 000550798.b3lyp_6-31g(d).log.xz 000550798.td-b3lyp_6-31g+(d).inp 000550798.td-b3lyp_6-31g+(d).log.xz

000550798.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550798.td-b3lyp_6-31+g(d).gjf (generated)

000550798.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550798.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550798.mol 000550798.PUBCHEM 000550798.mol (via Jmol)
000550799.b3lyp_6-31g(d).inp

000550799.b3lyp_6-31g(d).qchem.inp (generated)

000550799.b3lyp_6-31g(d).gjf (generated)

000550799.b3lyp_6-31g(d).firefly.inp (generated)

000550799.b3lyp_6-31g(d).smash.inp (generated)

000550799.b3lyp_6-31g(d).nwchem.inp (generated) 000550799.b3lyp_6-31g(d).log.xz 000550799.td-b3lyp_6-31g+(d).inp 000550799.td-b3lyp_6-31g+(d).log.xz

000550799.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550799.td-b3lyp_6-31+g(d).gjf (generated)

000550799.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550799.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550799.mol 000550799.PUBCHEM 000550799.mol (via Jmol)
000550800.b3lyp_6-31g(d).inp

000550800.b3lyp_6-31g(d).qchem.inp (generated)

000550800.b3lyp_6-31g(d).gjf (generated)

000550800.b3lyp_6-31g(d).firefly.inp (generated)

000550800.b3lyp_6-31g(d).smash.inp (generated)

000550800.b3lyp_6-31g(d).nwchem.inp (generated) 000550800.b3lyp_6-31g(d).log.xz 000550800.td-b3lyp_6-31g+(d).inp 000550800.td-b3lyp_6-31g+(d).log.xz

000550800.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550800.td-b3lyp_6-31+g(d).gjf (generated)

000550800.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550800.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550800.mol 000550800.PUBCHEM 000550800.mol (via Jmol)
000550801.b3lyp_6-31g(d).inp

000550801.b3lyp_6-31g(d).qchem.inp (generated)

000550801.b3lyp_6-31g(d).gjf (generated)

000550801.b3lyp_6-31g(d).firefly.inp (generated)

000550801.b3lyp_6-31g(d).smash.inp (generated)

000550801.b3lyp_6-31g(d).nwchem.inp (generated) 000550801.b3lyp_6-31g(d).log.xz 000550801.td-b3lyp_6-31g+(d).inp 000550801.td-b3lyp_6-31g+(d).log.xz

000550801.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550801.td-b3lyp_6-31+g(d).gjf (generated)

000550801.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550801.mol 000550801.PUBCHEM 000550801.mol (via Jmol)
000550802.b3lyp_6-31g(d).inp

000550802.b3lyp_6-31g(d).qchem.inp (generated)

000550802.b3lyp_6-31g(d).gjf (generated)

000550802.b3lyp_6-31g(d).firefly.inp (generated)

000550802.b3lyp_6-31g(d).smash.inp (generated)

000550802.b3lyp_6-31g(d).nwchem.inp (generated) 000550802.b3lyp_6-31g(d).log.xz 000550802.td-b3lyp_6-31g+(d).inp 000550802.td-b3lyp_6-31g+(d).log.xz

000550802.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550802.td-b3lyp_6-31+g(d).gjf (generated)

000550802.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550802.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550802.mol 000550802.PUBCHEM 000550802.mol (via Jmol)
000550803.b3lyp_6-31g(d).inp

000550803.b3lyp_6-31g(d).qchem.inp (generated)

000550803.b3lyp_6-31g(d).gjf (generated)

000550803.b3lyp_6-31g(d).firefly.inp (generated)

000550803.b3lyp_6-31g(d).smash.inp (generated)

000550803.b3lyp_6-31g(d).nwchem.inp (generated) 000550803.b3lyp_6-31g(d).log.xz 000550803.td-b3lyp_6-31g+(d).inp 000550803.td-b3lyp_6-31g+(d).log.xz

000550803.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550803.td-b3lyp_6-31+g(d).gjf (generated)

000550803.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550803.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550803.mol 000550803.PUBCHEM 000550803.mol (via Jmol)
000550804.b3lyp_6-31g(d).inp

000550804.b3lyp_6-31g(d).qchem.inp (generated)

000550804.b3lyp_6-31g(d).gjf (generated)

000550804.b3lyp_6-31g(d).firefly.inp (generated)

000550804.b3lyp_6-31g(d).smash.inp (generated)

000550804.b3lyp_6-31g(d).nwchem.inp (generated) 000550804.b3lyp_6-31g(d).log.xz 000550804.td-b3lyp_6-31g+(d).inp 000550804.td-b3lyp_6-31g+(d).log.xz

000550804.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550804.td-b3lyp_6-31+g(d).gjf (generated)

000550804.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550804.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550804.mol 000550804.PUBCHEM 000550804.mol (via Jmol)
000550805.b3lyp_6-31g(d).inp

000550805.b3lyp_6-31g(d).qchem.inp (generated)

000550805.b3lyp_6-31g(d).gjf (generated)

000550805.b3lyp_6-31g(d).firefly.inp (generated)

000550805.b3lyp_6-31g(d).smash.inp (generated)

000550805.b3lyp_6-31g(d).nwchem.inp (generated) 000550805.b3lyp_6-31g(d).log.xz 000550805.td-b3lyp_6-31g+(d).inp 000550805.td-b3lyp_6-31g+(d).log.xz

000550805.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550805.td-b3lyp_6-31+g(d).gjf (generated)

000550805.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550805.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550805.mol 000550805.PUBCHEM 000550805.mol (via Jmol)
000550807.b3lyp_6-31g(d).inp

000550807.b3lyp_6-31g(d).qchem.inp (generated)

000550807.b3lyp_6-31g(d).gjf (generated)

000550807.b3lyp_6-31g(d).firefly.inp (generated)

000550807.b3lyp_6-31g(d).smash.inp (generated)

000550807.b3lyp_6-31g(d).nwchem.inp (generated) 000550807.b3lyp_6-31g(d).log.xz 000550807.td-b3lyp_6-31g+(d).inp 000550807.td-b3lyp_6-31g+(d).log.xz

000550807.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550807.td-b3lyp_6-31+g(d).gjf (generated)

000550807.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550807.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550807.mol 000550807.PUBCHEM 000550807.mol (via Jmol)
000550808.b3lyp_6-31g(d).inp

000550808.b3lyp_6-31g(d).qchem.inp (generated)

000550808.b3lyp_6-31g(d).gjf (generated)

000550808.b3lyp_6-31g(d).firefly.inp (generated)

000550808.b3lyp_6-31g(d).smash.inp (generated)

000550808.b3lyp_6-31g(d).nwchem.inp (generated) 000550808.b3lyp_6-31g(d).log.xz 000550808.td-b3lyp_6-31g+(d).inp 000550808.td-b3lyp_6-31g+(d).log.xz

000550808.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550808.td-b3lyp_6-31+g(d).gjf (generated)

000550808.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550808.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550808.mol 000550808.PUBCHEM 000550808.mol (via Jmol)
000550809.b3lyp_6-31g(d).inp

000550809.b3lyp_6-31g(d).qchem.inp (generated)

000550809.b3lyp_6-31g(d).gjf (generated)

000550809.b3lyp_6-31g(d).firefly.inp (generated)

000550809.b3lyp_6-31g(d).smash.inp (generated)

000550809.b3lyp_6-31g(d).nwchem.inp (generated) 000550809.b3lyp_6-31g(d).log.xz 000550809.td-b3lyp_6-31g+(d).inp 000550809.td-b3lyp_6-31g+(d).log.xz

000550809.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550809.td-b3lyp_6-31+g(d).gjf (generated)

000550809.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550809.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550809.mol 000550809.PUBCHEM 000550809.mol (via Jmol)
000550810.b3lyp_6-31g(d).inp

000550810.b3lyp_6-31g(d).qchem.inp (generated)

000550810.b3lyp_6-31g(d).gjf (generated)

000550810.b3lyp_6-31g(d).firefly.inp (generated)

000550810.b3lyp_6-31g(d).smash.inp (generated)

000550810.b3lyp_6-31g(d).nwchem.inp (generated) 000550810.b3lyp_6-31g(d).log.xz 000550810.td-b3lyp_6-31g+(d).inp 000550810.td-b3lyp_6-31g+(d).log.xz

000550810.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550810.td-b3lyp_6-31+g(d).gjf (generated)

000550810.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550810.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550810.mol 000550810.PUBCHEM 000550810.mol (via Jmol)
000550811.b3lyp_6-31g(d).inp

000550811.b3lyp_6-31g(d).qchem.inp (generated)

000550811.b3lyp_6-31g(d).gjf (generated)

000550811.b3lyp_6-31g(d).firefly.inp (generated)

000550811.b3lyp_6-31g(d).smash.inp (generated)

000550811.b3lyp_6-31g(d).nwchem.inp (generated) 000550811.b3lyp_6-31g(d).log.xz 000550811.td-b3lyp_6-31g+(d).inp 000550811.td-b3lyp_6-31g+(d).log.xz

000550811.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550811.td-b3lyp_6-31+g(d).gjf (generated)

000550811.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550811.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550811.mol 000550811.PUBCHEM 000550811.mol (via Jmol)
000550812.b3lyp_6-31g(d).inp

000550812.b3lyp_6-31g(d).qchem.inp (generated)

000550812.b3lyp_6-31g(d).gjf (generated)

000550812.b3lyp_6-31g(d).firefly.inp (generated)

000550812.b3lyp_6-31g(d).smash.inp (generated)

000550812.b3lyp_6-31g(d).nwchem.inp (generated) 000550812.b3lyp_6-31g(d).log.xz 000550812.td-b3lyp_6-31g+(d).inp 000550812.td-b3lyp_6-31g+(d).log.xz

000550812.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550812.td-b3lyp_6-31+g(d).gjf (generated)

000550812.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550812.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550812.mol 000550812.PUBCHEM 000550812.mol (via Jmol)
000550813.b3lyp_6-31g(d).inp

000550813.b3lyp_6-31g(d).qchem.inp (generated)

000550813.b3lyp_6-31g(d).gjf (generated)

000550813.b3lyp_6-31g(d).firefly.inp (generated)

000550813.b3lyp_6-31g(d).smash.inp (generated)

000550813.b3lyp_6-31g(d).nwchem.inp (generated) 000550813.b3lyp_6-31g(d).log.xz 000550813.td-b3lyp_6-31g+(d).inp 000550813.td-b3lyp_6-31g+(d).log.xz

000550813.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550813.td-b3lyp_6-31+g(d).gjf (generated)

000550813.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550813.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550813.mol 000550813.PUBCHEM 000550813.mol (via Jmol)
000550814.b3lyp_6-31g(d).inp

000550814.b3lyp_6-31g(d).qchem.inp (generated)

000550814.b3lyp_6-31g(d).gjf (generated)

000550814.b3lyp_6-31g(d).firefly.inp (generated)

000550814.b3lyp_6-31g(d).smash.inp (generated)

000550814.b3lyp_6-31g(d).nwchem.inp (generated) 000550814.b3lyp_6-31g(d).log.xz 000550814.td-b3lyp_6-31g+(d).inp 000550814.td-b3lyp_6-31g+(d).log.xz

000550814.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550814.td-b3lyp_6-31+g(d).gjf (generated)

000550814.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550814.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550814.mol 000550814.PUBCHEM 000550814.mol (via Jmol)
000550815.b3lyp_6-31g(d).inp

000550815.b3lyp_6-31g(d).qchem.inp (generated)

000550815.b3lyp_6-31g(d).gjf (generated)

000550815.b3lyp_6-31g(d).firefly.inp (generated)

000550815.b3lyp_6-31g(d).smash.inp (generated)

000550815.b3lyp_6-31g(d).nwchem.inp (generated) 000550815.b3lyp_6-31g(d).log.xz 000550815.td-b3lyp_6-31g+(d).inp 000550815.td-b3lyp_6-31g+(d).log.xz

000550815.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550815.td-b3lyp_6-31+g(d).gjf (generated)

000550815.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550815.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550815.mol 000550815.PUBCHEM 000550815.mol (via Jmol)
000550816.b3lyp_6-31g(d).inp

000550816.b3lyp_6-31g(d).qchem.inp (generated)

000550816.b3lyp_6-31g(d).gjf (generated)

000550816.b3lyp_6-31g(d).firefly.inp (generated)

000550816.b3lyp_6-31g(d).smash.inp (generated)

000550816.b3lyp_6-31g(d).nwchem.inp (generated) 000550816.b3lyp_6-31g(d).log.xz 000550816.td-b3lyp_6-31g+(d).inp 000550816.td-b3lyp_6-31g+(d).log.xz

000550816.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550816.td-b3lyp_6-31+g(d).gjf (generated)

000550816.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550816.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550816.mol 000550816.PUBCHEM 000550816.mol (via Jmol)
000550817.b3lyp_6-31g(d).inp

000550817.b3lyp_6-31g(d).qchem.inp (generated)

000550817.b3lyp_6-31g(d).gjf (generated)

000550817.b3lyp_6-31g(d).firefly.inp (generated)

000550817.b3lyp_6-31g(d).smash.inp (generated)

000550817.b3lyp_6-31g(d).nwchem.inp (generated) 000550817.b3lyp_6-31g(d).log.xz 000550817.td-b3lyp_6-31g+(d).inp 000550817.td-b3lyp_6-31g+(d).log.xz

000550817.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550817.td-b3lyp_6-31+g(d).gjf (generated)

000550817.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550817.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550817.mol 000550817.PUBCHEM 000550817.mol (via Jmol)
000550819.b3lyp_6-31g(d).inp

000550819.b3lyp_6-31g(d).qchem.inp (generated)

000550819.b3lyp_6-31g(d).gjf (generated)

000550819.b3lyp_6-31g(d).firefly.inp (generated)

000550819.b3lyp_6-31g(d).smash.inp (generated)

000550819.b3lyp_6-31g(d).nwchem.inp (generated) 000550819.b3lyp_6-31g(d).log.xz 000550819.td-b3lyp_6-31g+(d).inp 000550819.td-b3lyp_6-31g+(d).log.xz

000550819.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550819.td-b3lyp_6-31+g(d).gjf (generated)

000550819.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550819.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550819.mol 000550819.PUBCHEM 000550819.mol (via Jmol)
000550820.b3lyp_6-31g(d).inp

000550820.b3lyp_6-31g(d).qchem.inp (generated)

000550820.b3lyp_6-31g(d).gjf (generated)

000550820.b3lyp_6-31g(d).firefly.inp (generated)

000550820.b3lyp_6-31g(d).smash.inp (generated)

000550820.b3lyp_6-31g(d).nwchem.inp (generated) 000550820.b3lyp_6-31g(d).log.xz 000550820.td-b3lyp_6-31g+(d).inp 000550820.td-b3lyp_6-31g+(d).log.xz

000550820.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550820.td-b3lyp_6-31+g(d).gjf (generated)

000550820.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550820.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550820.mol 000550820.PUBCHEM 000550820.mol (via Jmol)
000550821.b3lyp_6-31g(d).inp

000550821.b3lyp_6-31g(d).qchem.inp (generated)

000550821.b3lyp_6-31g(d).gjf (generated)

000550821.b3lyp_6-31g(d).firefly.inp (generated)

000550821.b3lyp_6-31g(d).smash.inp (generated)

000550821.b3lyp_6-31g(d).nwchem.inp (generated) 000550821.b3lyp_6-31g(d).log.xz 000550821.td-b3lyp_6-31g+(d).inp 000550821.td-b3lyp_6-31g+(d).log.xz

000550821.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550821.td-b3lyp_6-31+g(d).gjf (generated)

000550821.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550821.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550821.mol 000550821.PUBCHEM 000550821.mol (via Jmol)
000550822.b3lyp_6-31g(d).inp

000550822.b3lyp_6-31g(d).qchem.inp (generated)

000550822.b3lyp_6-31g(d).gjf (generated)

000550822.b3lyp_6-31g(d).firefly.inp (generated)

000550822.b3lyp_6-31g(d).smash.inp (generated)

000550822.b3lyp_6-31g(d).nwchem.inp (generated) 000550822.b3lyp_6-31g(d).log.xz 000550822.td-b3lyp_6-31g+(d).inp 000550822.td-b3lyp_6-31g+(d).log.xz

000550822.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550822.td-b3lyp_6-31+g(d).gjf (generated)

000550822.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550822.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550822.mol 000550822.PUBCHEM 000550822.mol (via Jmol)
000550823.b3lyp_6-31g(d).inp

000550823.b3lyp_6-31g(d).qchem.inp (generated)

000550823.b3lyp_6-31g(d).gjf (generated)

000550823.b3lyp_6-31g(d).firefly.inp (generated)

000550823.b3lyp_6-31g(d).smash.inp (generated)

000550823.b3lyp_6-31g(d).nwchem.inp (generated) 000550823.b3lyp_6-31g(d).log.xz 000550823.td-b3lyp_6-31g+(d).inp 000550823.td-b3lyp_6-31g+(d).log.xz

000550823.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550823.td-b3lyp_6-31+g(d).gjf (generated)

000550823.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550823.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550823.mol 000550823.PUBCHEM 000550823.mol (via Jmol)
000550825.b3lyp_6-31g(d).inp

000550825.b3lyp_6-31g(d).qchem.inp (generated)

000550825.b3lyp_6-31g(d).gjf (generated)

000550825.b3lyp_6-31g(d).firefly.inp (generated)

000550825.b3lyp_6-31g(d).smash.inp (generated)

000550825.b3lyp_6-31g(d).nwchem.inp (generated) 000550825.b3lyp_6-31g(d).log.xz 000550825.td-b3lyp_6-31g+(d).inp 000550825.td-b3lyp_6-31g+(d).log.xz

000550825.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550825.td-b3lyp_6-31+g(d).gjf (generated)

000550825.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550825.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550825.mol 000550825.PUBCHEM 000550825.mol (via Jmol)
000550826.b3lyp_6-31g(d).inp

000550826.b3lyp_6-31g(d).qchem.inp (generated)

000550826.b3lyp_6-31g(d).gjf (generated)

000550826.b3lyp_6-31g(d).firefly.inp (generated)

000550826.b3lyp_6-31g(d).smash.inp (generated)

000550826.b3lyp_6-31g(d).nwchem.inp (generated) 000550826.b3lyp_6-31g(d).log.xz 000550826.td-b3lyp_6-31g+(d).inp 000550826.td-b3lyp_6-31g+(d).log.xz

000550826.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550826.td-b3lyp_6-31+g(d).gjf (generated)

000550826.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550826.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550826.mol 000550826.PUBCHEM 000550826.mol (via Jmol)
000550828.b3lyp_6-31g(d).inp

000550828.b3lyp_6-31g(d).qchem.inp (generated)

000550828.b3lyp_6-31g(d).gjf (generated)

000550828.b3lyp_6-31g(d).firefly.inp (generated)

000550828.b3lyp_6-31g(d).smash.inp (generated)

000550828.b3lyp_6-31g(d).nwchem.inp (generated) 000550828.b3lyp_6-31g(d).log.xz 000550828.td-b3lyp_6-31g+(d).inp 000550828.td-b3lyp_6-31g+(d).log.xz

000550828.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550828.td-b3lyp_6-31+g(d).gjf (generated)

000550828.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550828.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550828.mol 000550828.PUBCHEM 000550828.mol (via Jmol)
000550829.b3lyp_6-31g(d).inp

000550829.b3lyp_6-31g(d).qchem.inp (generated)

000550829.b3lyp_6-31g(d).gjf (generated)

000550829.b3lyp_6-31g(d).firefly.inp (generated)

000550829.b3lyp_6-31g(d).smash.inp (generated)

000550829.b3lyp_6-31g(d).nwchem.inp (generated) 000550829.b3lyp_6-31g(d).log.xz 000550829.td-b3lyp_6-31g+(d).inp 000550829.td-b3lyp_6-31g+(d).log.xz

000550829.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550829.td-b3lyp_6-31+g(d).gjf (generated)

000550829.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550829.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550829.mol 000550829.PUBCHEM 000550829.mol (via Jmol)
000550830.b3lyp_6-31g(d).inp

000550830.b3lyp_6-31g(d).qchem.inp (generated)

000550830.b3lyp_6-31g(d).gjf (generated)

000550830.b3lyp_6-31g(d).firefly.inp (generated)

000550830.b3lyp_6-31g(d).smash.inp (generated)

000550830.b3lyp_6-31g(d).nwchem.inp (generated) 000550830.b3lyp_6-31g(d).log.xz 000550830.td-b3lyp_6-31g+(d).inp 000550830.td-b3lyp_6-31g+(d).log.xz

000550830.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550830.td-b3lyp_6-31+g(d).gjf (generated)

000550830.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550830.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550830.mol 000550830.PUBCHEM 000550830.mol (via Jmol)
000550831.b3lyp_6-31g(d).inp

000550831.b3lyp_6-31g(d).qchem.inp (generated)

000550831.b3lyp_6-31g(d).gjf (generated)

000550831.b3lyp_6-31g(d).firefly.inp (generated)

000550831.b3lyp_6-31g(d).smash.inp (generated)

000550831.b3lyp_6-31g(d).nwchem.inp (generated) 000550831.b3lyp_6-31g(d).log.xz 000550831.td-b3lyp_6-31g+(d).inp 000550831.td-b3lyp_6-31g+(d).log.xz

000550831.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550831.td-b3lyp_6-31+g(d).gjf (generated)

000550831.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550831.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550831.mol 000550831.PUBCHEM 000550831.mol (via Jmol)
000550833.b3lyp_6-31g(d).inp

000550833.b3lyp_6-31g(d).qchem.inp (generated)

000550833.b3lyp_6-31g(d).gjf (generated)

000550833.b3lyp_6-31g(d).firefly.inp (generated)

000550833.b3lyp_6-31g(d).smash.inp (generated)

000550833.b3lyp_6-31g(d).nwchem.inp (generated) 000550833.b3lyp_6-31g(d).log.xz 000550833.td-b3lyp_6-31g+(d).inp 000550833.td-b3lyp_6-31g+(d).log.xz

000550833.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550833.td-b3lyp_6-31+g(d).gjf (generated)

000550833.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550833.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550833.mol 000550833.PUBCHEM 000550833.mol (via Jmol)
000550834.b3lyp_6-31g(d).inp

000550834.b3lyp_6-31g(d).qchem.inp (generated)

000550834.b3lyp_6-31g(d).gjf (generated)

000550834.b3lyp_6-31g(d).firefly.inp (generated)

000550834.b3lyp_6-31g(d).smash.inp (generated)

000550834.b3lyp_6-31g(d).nwchem.inp (generated) 000550834.b3lyp_6-31g(d).log.xz 000550834.td-b3lyp_6-31g+(d).inp 000550834.td-b3lyp_6-31g+(d).log.xz

000550834.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550834.td-b3lyp_6-31+g(d).gjf (generated)

000550834.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550834.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550834.mol 000550834.PUBCHEM 000550834.mol (via Jmol)
000550836.b3lyp_6-31g(d).inp

000550836.b3lyp_6-31g(d).qchem.inp (generated)

000550836.b3lyp_6-31g(d).gjf (generated)

000550836.b3lyp_6-31g(d).firefly.inp (generated)

000550836.b3lyp_6-31g(d).smash.inp (generated)

000550836.b3lyp_6-31g(d).nwchem.inp (generated) 000550836.b3lyp_6-31g(d).log.xz 000550836.td-b3lyp_6-31g+(d).inp 000550836.td-b3lyp_6-31g+(d).log.xz

000550836.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550836.td-b3lyp_6-31+g(d).gjf (generated)

000550836.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550836.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550836.mol 000550836.PUBCHEM 000550836.mol (via Jmol)
000550837.b3lyp_6-31g(d).inp

000550837.b3lyp_6-31g(d).qchem.inp (generated)

000550837.b3lyp_6-31g(d).gjf (generated)

000550837.b3lyp_6-31g(d).firefly.inp (generated)

000550837.b3lyp_6-31g(d).smash.inp (generated)

000550837.b3lyp_6-31g(d).nwchem.inp (generated) 000550837.b3lyp_6-31g(d).log.xz 000550837.td-b3lyp_6-31g+(d).inp 000550837.td-b3lyp_6-31g+(d).log.xz

000550837.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550837.td-b3lyp_6-31+g(d).gjf (generated)

000550837.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550837.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550837.mol 000550837.PUBCHEM 000550837.mol (via Jmol)
000550838.b3lyp_6-31g(d).inp

000550838.b3lyp_6-31g(d).qchem.inp (generated)

000550838.b3lyp_6-31g(d).gjf (generated)

000550838.b3lyp_6-31g(d).firefly.inp (generated)

000550838.b3lyp_6-31g(d).smash.inp (generated)

000550838.b3lyp_6-31g(d).nwchem.inp (generated) 000550838.b3lyp_6-31g(d).log.xz 000550838.td-b3lyp_6-31g+(d).inp 000550838.td-b3lyp_6-31g+(d).log.xz

000550838.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550838.td-b3lyp_6-31+g(d).gjf (generated)

000550838.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550838.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550838.mol 000550838.PUBCHEM 000550838.mol (via Jmol)
000550840.b3lyp_6-31g(d).inp

000550840.b3lyp_6-31g(d).qchem.inp (generated)

000550840.b3lyp_6-31g(d).gjf (generated)

000550840.b3lyp_6-31g(d).firefly.inp (generated)

000550840.b3lyp_6-31g(d).smash.inp (generated)

000550840.b3lyp_6-31g(d).nwchem.inp (generated) 000550840.b3lyp_6-31g(d).log.xz 000550840.td-b3lyp_6-31g+(d).inp 000550840.td-b3lyp_6-31g+(d).log.xz

000550840.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550840.td-b3lyp_6-31+g(d).gjf (generated)

000550840.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550840.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550840.mol 000550840.PUBCHEM 000550840.mol (via Jmol)
000550844.b3lyp_6-31g(d).inp

000550844.b3lyp_6-31g(d).qchem.inp (generated)

000550844.b3lyp_6-31g(d).gjf (generated)

000550844.b3lyp_6-31g(d).firefly.inp (generated)

000550844.b3lyp_6-31g(d).smash.inp (generated)

000550844.b3lyp_6-31g(d).nwchem.inp (generated) 000550844.b3lyp_6-31g(d).log.xz 000550844.td-b3lyp_6-31g+(d).inp 000550844.td-b3lyp_6-31g+(d).log.xz

000550844.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550844.td-b3lyp_6-31+g(d).gjf (generated)

000550844.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550844.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550844.mol 000550844.PUBCHEM 000550844.mol (via Jmol)
000550845.b3lyp_6-31g(d).inp

000550845.b3lyp_6-31g(d).qchem.inp (generated)

000550845.b3lyp_6-31g(d).gjf (generated)

000550845.b3lyp_6-31g(d).firefly.inp (generated)

000550845.b3lyp_6-31g(d).smash.inp (generated)

000550845.b3lyp_6-31g(d).nwchem.inp (generated) 000550845.b3lyp_6-31g(d).log.xz 000550845.td-b3lyp_6-31g+(d).inp 000550845.td-b3lyp_6-31g+(d).log.xz

000550845.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550845.td-b3lyp_6-31+g(d).gjf (generated)

000550845.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550845.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550845.mol 000550845.PUBCHEM 000550845.mol (via Jmol)
000550846.b3lyp_6-31g(d).inp

000550846.b3lyp_6-31g(d).qchem.inp (generated)

000550846.b3lyp_6-31g(d).gjf (generated)

000550846.b3lyp_6-31g(d).firefly.inp (generated)

000550846.b3lyp_6-31g(d).smash.inp (generated)

000550846.b3lyp_6-31g(d).nwchem.inp (generated) 000550846.b3lyp_6-31g(d).log.xz 000550846.td-b3lyp_6-31g+(d).inp 000550846.td-b3lyp_6-31g+(d).log.xz

000550846.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550846.td-b3lyp_6-31+g(d).gjf (generated)

000550846.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550846.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550846.mol 000550846.PUBCHEM 000550846.mol (via Jmol)
000550847.b3lyp_6-31g(d).inp

000550847.b3lyp_6-31g(d).qchem.inp (generated)

000550847.b3lyp_6-31g(d).gjf (generated)

000550847.b3lyp_6-31g(d).firefly.inp (generated)

000550847.b3lyp_6-31g(d).smash.inp (generated)

000550847.b3lyp_6-31g(d).nwchem.inp (generated) 000550847.b3lyp_6-31g(d).log.xz 000550847.td-b3lyp_6-31g+(d).inp 000550847.td-b3lyp_6-31g+(d).log.xz

000550847.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550847.td-b3lyp_6-31+g(d).gjf (generated)

000550847.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550847.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550847.mol 000550847.PUBCHEM 000550847.mol (via Jmol)
000550848.b3lyp_6-31g(d).inp

000550848.b3lyp_6-31g(d).qchem.inp (generated)

000550848.b3lyp_6-31g(d).gjf (generated)

000550848.b3lyp_6-31g(d).firefly.inp (generated)

000550848.b3lyp_6-31g(d).smash.inp (generated)

000550848.b3lyp_6-31g(d).nwchem.inp (generated) 000550848.b3lyp_6-31g(d).log.xz 000550848.td-b3lyp_6-31g+(d).inp 000550848.td-b3lyp_6-31g+(d).log.xz

000550848.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550848.td-b3lyp_6-31+g(d).gjf (generated)

000550848.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550848.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550848.mol 000550848.PUBCHEM 000550848.mol (via Jmol)
000550849.b3lyp_6-31g(d).inp

000550849.b3lyp_6-31g(d).qchem.inp (generated)

000550849.b3lyp_6-31g(d).gjf (generated)

000550849.b3lyp_6-31g(d).firefly.inp (generated)

000550849.b3lyp_6-31g(d).smash.inp (generated)

000550849.b3lyp_6-31g(d).nwchem.inp (generated) 000550849.b3lyp_6-31g(d).log.xz 000550849.td-b3lyp_6-31g+(d).inp 000550849.td-b3lyp_6-31g+(d).log.xz

000550849.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550849.td-b3lyp_6-31+g(d).gjf (generated)

000550849.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550849.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550849.mol 000550849.PUBCHEM 000550849.mol (via Jmol)
000550850.b3lyp_6-31g(d).inp

000550850.b3lyp_6-31g(d).qchem.inp (generated)

000550850.b3lyp_6-31g(d).gjf (generated)

000550850.b3lyp_6-31g(d).firefly.inp (generated)

000550850.b3lyp_6-31g(d).smash.inp (generated)

000550850.b3lyp_6-31g(d).nwchem.inp (generated) 000550850.b3lyp_6-31g(d).log.xz 000550850.td-b3lyp_6-31g+(d).inp 000550850.td-b3lyp_6-31g+(d).log.xz

000550850.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550850.td-b3lyp_6-31+g(d).gjf (generated)

000550850.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550850.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550850.mol 000550850.PUBCHEM 000550850.mol (via Jmol)
000550851.b3lyp_6-31g(d).inp

000550851.b3lyp_6-31g(d).qchem.inp (generated)

000550851.b3lyp_6-31g(d).gjf (generated)

000550851.b3lyp_6-31g(d).firefly.inp (generated)

000550851.b3lyp_6-31g(d).smash.inp (generated)

000550851.b3lyp_6-31g(d).nwchem.inp (generated) 000550851.b3lyp_6-31g(d).log.xz 000550851.td-b3lyp_6-31g+(d).inp 000550851.td-b3lyp_6-31g+(d).log.xz

000550851.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550851.td-b3lyp_6-31+g(d).gjf (generated)

000550851.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550851.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550851.mol 000550851.PUBCHEM 000550851.mol (via Jmol)
000550852.b3lyp_6-31g(d).inp

000550852.b3lyp_6-31g(d).qchem.inp (generated)

000550852.b3lyp_6-31g(d).gjf (generated)

000550852.b3lyp_6-31g(d).firefly.inp (generated)

000550852.b3lyp_6-31g(d).smash.inp (generated)

000550852.b3lyp_6-31g(d).nwchem.inp (generated) 000550852.b3lyp_6-31g(d).log.xz 000550852.td-b3lyp_6-31g+(d).inp 000550852.td-b3lyp_6-31g+(d).log.xz

000550852.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550852.td-b3lyp_6-31+g(d).gjf (generated)

000550852.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550852.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550852.mol 000550852.PUBCHEM 000550852.mol (via Jmol)
000550853.b3lyp_6-31g(d).inp

000550853.b3lyp_6-31g(d).qchem.inp (generated)

000550853.b3lyp_6-31g(d).gjf (generated)

000550853.b3lyp_6-31g(d).firefly.inp (generated)

000550853.b3lyp_6-31g(d).smash.inp (generated)

000550853.b3lyp_6-31g(d).nwchem.inp (generated) 000550853.b3lyp_6-31g(d).log.xz 000550853.td-b3lyp_6-31g+(d).inp 000550853.td-b3lyp_6-31g+(d).log.xz

000550853.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550853.td-b3lyp_6-31+g(d).gjf (generated)

000550853.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550853.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550853.mol 000550853.PUBCHEM 000550853.mol (via Jmol)
000550855.b3lyp_6-31g(d).inp

000550855.b3lyp_6-31g(d).qchem.inp (generated)

000550855.b3lyp_6-31g(d).gjf (generated)

000550855.b3lyp_6-31g(d).firefly.inp (generated)

000550855.b3lyp_6-31g(d).smash.inp (generated)

000550855.b3lyp_6-31g(d).nwchem.inp (generated) 000550855.b3lyp_6-31g(d).log.xz 000550855.td-b3lyp_6-31g+(d).inp 000550855.td-b3lyp_6-31g+(d).log.xz

000550855.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550855.td-b3lyp_6-31+g(d).gjf (generated)

000550855.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550855.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550855.mol 000550855.PUBCHEM 000550855.mol (via Jmol)
000550859.b3lyp_6-31g(d).inp

000550859.b3lyp_6-31g(d).qchem.inp (generated)

000550859.b3lyp_6-31g(d).gjf (generated)

000550859.b3lyp_6-31g(d).firefly.inp (generated)

000550859.b3lyp_6-31g(d).smash.inp (generated)

000550859.b3lyp_6-31g(d).nwchem.inp (generated) 000550859.b3lyp_6-31g(d).log.xz 000550859.td-b3lyp_6-31g+(d).inp 000550859.td-b3lyp_6-31g+(d).log.xz

000550859.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550859.td-b3lyp_6-31+g(d).gjf (generated)

000550859.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550859.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550859.mol 000550859.PUBCHEM 000550859.mol (via Jmol)
000550862.b3lyp_6-31g(d).inp

000550862.b3lyp_6-31g(d).qchem.inp (generated)

000550862.b3lyp_6-31g(d).gjf (generated)

000550862.b3lyp_6-31g(d).firefly.inp (generated)

000550862.b3lyp_6-31g(d).smash.inp (generated)

000550862.b3lyp_6-31g(d).nwchem.inp (generated) 000550862.b3lyp_6-31g(d).log.xz 000550862.td-b3lyp_6-31g+(d).inp 000550862.td-b3lyp_6-31g+(d).log.xz

000550862.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550862.td-b3lyp_6-31+g(d).gjf (generated)

000550862.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550862.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550862.mol 000550862.PUBCHEM 000550862.mol (via Jmol)
000550863.b3lyp_6-31g(d).inp

000550863.b3lyp_6-31g(d).qchem.inp (generated)

000550863.b3lyp_6-31g(d).gjf (generated)

000550863.b3lyp_6-31g(d).firefly.inp (generated)

000550863.b3lyp_6-31g(d).smash.inp (generated)

000550863.b3lyp_6-31g(d).nwchem.inp (generated) 000550863.b3lyp_6-31g(d).log.xz 000550863.td-b3lyp_6-31g+(d).inp 000550863.td-b3lyp_6-31g+(d).log.xz

000550863.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550863.td-b3lyp_6-31+g(d).gjf (generated)

000550863.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550863.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550863.mol 000550863.PUBCHEM 000550863.mol (via Jmol)
000550865.b3lyp_6-31g(d).inp

000550865.b3lyp_6-31g(d).qchem.inp (generated)

000550865.b3lyp_6-31g(d).gjf (generated)

000550865.b3lyp_6-31g(d).firefly.inp (generated)

000550865.b3lyp_6-31g(d).smash.inp (generated)

000550865.b3lyp_6-31g(d).nwchem.inp (generated) 000550865.b3lyp_6-31g(d).log.xz 000550865.td-b3lyp_6-31g+(d).inp 000550865.td-b3lyp_6-31g+(d).log.xz

000550865.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550865.td-b3lyp_6-31+g(d).gjf (generated)

000550865.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550865.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550865.mol 000550865.PUBCHEM 000550865.mol (via Jmol)
000550866.b3lyp_6-31g(d).inp

000550866.b3lyp_6-31g(d).qchem.inp (generated)

000550866.b3lyp_6-31g(d).gjf (generated)

000550866.b3lyp_6-31g(d).firefly.inp (generated)

000550866.b3lyp_6-31g(d).smash.inp (generated)

000550866.b3lyp_6-31g(d).nwchem.inp (generated) 000550866.b3lyp_6-31g(d).log.xz 000550866.td-b3lyp_6-31g+(d).inp 000550866.td-b3lyp_6-31g+(d).log.xz

000550866.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550866.td-b3lyp_6-31+g(d).gjf (generated)

000550866.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550866.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550866.mol 000550866.PUBCHEM 000550866.mol (via Jmol)
000550869.b3lyp_6-31g(d).inp

000550869.b3lyp_6-31g(d).qchem.inp (generated)

000550869.b3lyp_6-31g(d).gjf (generated)

000550869.b3lyp_6-31g(d).firefly.inp (generated)

000550869.b3lyp_6-31g(d).smash.inp (generated)

000550869.b3lyp_6-31g(d).nwchem.inp (generated) 000550869.b3lyp_6-31g(d).log.xz 000550869.td-b3lyp_6-31g+(d).inp 000550869.td-b3lyp_6-31g+(d).log.xz

000550869.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550869.td-b3lyp_6-31+g(d).gjf (generated)

000550869.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550869.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550869.mol 000550869.PUBCHEM 000550869.mol (via Jmol)
000550870.b3lyp_6-31g(d).inp

000550870.b3lyp_6-31g(d).qchem.inp (generated)

000550870.b3lyp_6-31g(d).gjf (generated)

000550870.b3lyp_6-31g(d).firefly.inp (generated)

000550870.b3lyp_6-31g(d).smash.inp (generated)

000550870.b3lyp_6-31g(d).nwchem.inp (generated) 000550870.b3lyp_6-31g(d).log.xz 000550870.td-b3lyp_6-31g+(d).inp 000550870.td-b3lyp_6-31g+(d).log.xz

000550870.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550870.td-b3lyp_6-31+g(d).gjf (generated)

000550870.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550870.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550870.mol 000550870.PUBCHEM 000550870.mol (via Jmol)
000550876.b3lyp_6-31g(d).inp

000550876.b3lyp_6-31g(d).qchem.inp (generated)

000550876.b3lyp_6-31g(d).gjf (generated)

000550876.b3lyp_6-31g(d).firefly.inp (generated)

000550876.b3lyp_6-31g(d).smash.inp (generated)

000550876.b3lyp_6-31g(d).nwchem.inp (generated) 000550876.b3lyp_6-31g(d).log.xz 000550876.td-b3lyp_6-31g+(d).inp 000550876.td-b3lyp_6-31g+(d).log.xz

000550876.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550876.td-b3lyp_6-31+g(d).gjf (generated)

000550876.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550876.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550876.mol 000550876.PUBCHEM 000550876.mol (via Jmol)
000550878.b3lyp_6-31g(d).inp

000550878.b3lyp_6-31g(d).qchem.inp (generated)

000550878.b3lyp_6-31g(d).gjf (generated)

000550878.b3lyp_6-31g(d).firefly.inp (generated)

000550878.b3lyp_6-31g(d).smash.inp (generated)

000550878.b3lyp_6-31g(d).nwchem.inp (generated) 000550878.b3lyp_6-31g(d).log.xz 000550878.td-b3lyp_6-31g+(d).inp 000550878.td-b3lyp_6-31g+(d).log.xz

000550878.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550878.td-b3lyp_6-31+g(d).gjf (generated)

000550878.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550878.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550878.mol 000550878.PUBCHEM 000550878.mol (via Jmol)
000550880.b3lyp_6-31g(d).inp

000550880.b3lyp_6-31g(d).qchem.inp (generated)

000550880.b3lyp_6-31g(d).gjf (generated)

000550880.b3lyp_6-31g(d).firefly.inp (generated)

000550880.b3lyp_6-31g(d).smash.inp (generated)

000550880.b3lyp_6-31g(d).nwchem.inp (generated) 000550880.b3lyp_6-31g(d).log.xz 000550880.td-b3lyp_6-31g+(d).inp 000550880.td-b3lyp_6-31g+(d).log.xz

000550880.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550880.td-b3lyp_6-31+g(d).gjf (generated)

000550880.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550880.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550880.mol 000550880.PUBCHEM 000550880.mol (via Jmol)
000550881.b3lyp_6-31g(d).inp

000550881.b3lyp_6-31g(d).qchem.inp (generated)

000550881.b3lyp_6-31g(d).gjf (generated)

000550881.b3lyp_6-31g(d).firefly.inp (generated)

000550881.b3lyp_6-31g(d).smash.inp (generated)

000550881.b3lyp_6-31g(d).nwchem.inp (generated) 000550881.b3lyp_6-31g(d).log.xz 000550881.td-b3lyp_6-31g+(d).inp 000550881.td-b3lyp_6-31g+(d).log.xz

000550881.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550881.td-b3lyp_6-31+g(d).gjf (generated)

000550881.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550881.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550881.mol 000550881.PUBCHEM 000550881.mol (via Jmol)
000550882.b3lyp_6-31g(d).inp

000550882.b3lyp_6-31g(d).qchem.inp (generated)

000550882.b3lyp_6-31g(d).gjf (generated)

000550882.b3lyp_6-31g(d).firefly.inp (generated)

000550882.b3lyp_6-31g(d).smash.inp (generated)

000550882.b3lyp_6-31g(d).nwchem.inp (generated) 000550882.b3lyp_6-31g(d).log.xz 000550882.td-b3lyp_6-31g+(d).inp 000550882.td-b3lyp_6-31g+(d).log.xz

000550882.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550882.td-b3lyp_6-31+g(d).gjf (generated)

000550882.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550882.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550882.mol 000550882.PUBCHEM 000550882.mol (via Jmol)
000550886.b3lyp_6-31g(d).inp

000550886.b3lyp_6-31g(d).qchem.inp (generated)

000550886.b3lyp_6-31g(d).gjf (generated)

000550886.b3lyp_6-31g(d).firefly.inp (generated)

000550886.b3lyp_6-31g(d).smash.inp (generated)

000550886.b3lyp_6-31g(d).nwchem.inp (generated) 000550886.b3lyp_6-31g(d).log.xz 000550886.td-b3lyp_6-31g+(d).inp 000550886.td-b3lyp_6-31g+(d).log.xz

000550886.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550886.td-b3lyp_6-31+g(d).gjf (generated)

000550886.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550886.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550886.mol 000550886.PUBCHEM 000550886.mol (via Jmol)
000550888.b3lyp_6-31g(d).inp

000550888.b3lyp_6-31g(d).qchem.inp (generated)

000550888.b3lyp_6-31g(d).gjf (generated)

000550888.b3lyp_6-31g(d).firefly.inp (generated)

000550888.b3lyp_6-31g(d).smash.inp (generated)

000550888.b3lyp_6-31g(d).nwchem.inp (generated) 000550888.b3lyp_6-31g(d).log.xz 000550888.td-b3lyp_6-31g+(d).inp 000550888.td-b3lyp_6-31g+(d).log.xz

000550888.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550888.td-b3lyp_6-31+g(d).gjf (generated)

000550888.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550888.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550888.mol 000550888.PUBCHEM 000550888.mol (via Jmol)
000550889.b3lyp_6-31g(d).inp

000550889.b3lyp_6-31g(d).qchem.inp (generated)

000550889.b3lyp_6-31g(d).gjf (generated)

000550889.b3lyp_6-31g(d).firefly.inp (generated)

000550889.b3lyp_6-31g(d).smash.inp (generated)

000550889.b3lyp_6-31g(d).nwchem.inp (generated) 000550889.b3lyp_6-31g(d).log.xz 000550889.td-b3lyp_6-31g+(d).inp 000550889.td-b3lyp_6-31g+(d).log.xz

000550889.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550889.td-b3lyp_6-31+g(d).gjf (generated)

000550889.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550889.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550889.mol 000550889.PUBCHEM 000550889.mol (via Jmol)
000550893.b3lyp_6-31g(d).inp

000550893.b3lyp_6-31g(d).qchem.inp (generated)

000550893.b3lyp_6-31g(d).gjf (generated)

000550893.b3lyp_6-31g(d).firefly.inp (generated)

000550893.b3lyp_6-31g(d).smash.inp (generated)

000550893.b3lyp_6-31g(d).nwchem.inp (generated) 000550893.b3lyp_6-31g(d).log.xz 000550893.td-b3lyp_6-31g+(d).inp 000550893.td-b3lyp_6-31g+(d).log.xz

000550893.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550893.td-b3lyp_6-31+g(d).gjf (generated)

000550893.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550893.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550893.mol 000550893.PUBCHEM 000550893.mol (via Jmol)
000550894.b3lyp_6-31g(d).inp

000550894.b3lyp_6-31g(d).qchem.inp (generated)

000550894.b3lyp_6-31g(d).gjf (generated)

000550894.b3lyp_6-31g(d).firefly.inp (generated)

000550894.b3lyp_6-31g(d).smash.inp (generated)

000550894.b3lyp_6-31g(d).nwchem.inp (generated) 000550894.b3lyp_6-31g(d).log.xz 000550894.td-b3lyp_6-31g+(d).inp 000550894.td-b3lyp_6-31g+(d).log.xz

000550894.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550894.td-b3lyp_6-31+g(d).gjf (generated)

000550894.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550894.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550894.mol 000550894.PUBCHEM 000550894.mol (via Jmol)
000550896.b3lyp_6-31g(d).inp

000550896.b3lyp_6-31g(d).qchem.inp (generated)

000550896.b3lyp_6-31g(d).gjf (generated)

000550896.b3lyp_6-31g(d).firefly.inp (generated)

000550896.b3lyp_6-31g(d).smash.inp (generated)

000550896.b3lyp_6-31g(d).nwchem.inp (generated) 000550896.b3lyp_6-31g(d).log.xz 000550896.td-b3lyp_6-31g+(d).inp 000550896.td-b3lyp_6-31g+(d).log.xz

000550896.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550896.td-b3lyp_6-31+g(d).gjf (generated)

000550896.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550896.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550896.mol 000550896.PUBCHEM 000550896.mol (via Jmol)
000550897.b3lyp_6-31g(d).inp

000550897.b3lyp_6-31g(d).qchem.inp (generated)

000550897.b3lyp_6-31g(d).gjf (generated)

000550897.b3lyp_6-31g(d).firefly.inp (generated)

000550897.b3lyp_6-31g(d).smash.inp (generated)

000550897.b3lyp_6-31g(d).nwchem.inp (generated) 000550897.b3lyp_6-31g(d).log.xz 000550897.td-b3lyp_6-31g+(d).inp 000550897.td-b3lyp_6-31g+(d).log.xz

000550897.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550897.td-b3lyp_6-31+g(d).gjf (generated)

000550897.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550897.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550897.mol 000550897.PUBCHEM 000550897.mol (via Jmol)
000550901.b3lyp_6-31g(d).inp

000550901.b3lyp_6-31g(d).qchem.inp (generated)

000550901.b3lyp_6-31g(d).gjf (generated)

000550901.b3lyp_6-31g(d).firefly.inp (generated)

000550901.b3lyp_6-31g(d).smash.inp (generated)

000550901.b3lyp_6-31g(d).nwchem.inp (generated) 000550901.b3lyp_6-31g(d).log.xz 000550901.td-b3lyp_6-31g+(d).inp 000550901.td-b3lyp_6-31g+(d).log.xz

000550901.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550901.td-b3lyp_6-31+g(d).gjf (generated)

000550901.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550901.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550901.mol 000550901.PUBCHEM 000550901.mol (via Jmol)
000550902.b3lyp_6-31g(d).inp

000550902.b3lyp_6-31g(d).qchem.inp (generated)

000550902.b3lyp_6-31g(d).gjf (generated)

000550902.b3lyp_6-31g(d).firefly.inp (generated)

000550902.b3lyp_6-31g(d).smash.inp (generated)

000550902.b3lyp_6-31g(d).nwchem.inp (generated) 000550902.b3lyp_6-31g(d).log.xz 000550902.td-b3lyp_6-31g+(d).inp 000550902.td-b3lyp_6-31g+(d).log.xz

000550902.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550902.td-b3lyp_6-31+g(d).gjf (generated)

000550902.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550902.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550902.mol 000550902.PUBCHEM 000550902.mol (via Jmol)
000550903.b3lyp_6-31g(d).inp

000550903.b3lyp_6-31g(d).qchem.inp (generated)

000550903.b3lyp_6-31g(d).gjf (generated)

000550903.b3lyp_6-31g(d).firefly.inp (generated)

000550903.b3lyp_6-31g(d).smash.inp (generated)

000550903.b3lyp_6-31g(d).nwchem.inp (generated) 000550903.b3lyp_6-31g(d).log.xz 000550903.td-b3lyp_6-31g+(d).inp 000550903.td-b3lyp_6-31g+(d).log.xz

000550903.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550903.td-b3lyp_6-31+g(d).gjf (generated)

000550903.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550903.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550903.mol 000550903.PUBCHEM 000550903.mol (via Jmol)
000550904.b3lyp_6-31g(d).inp

000550904.b3lyp_6-31g(d).qchem.inp (generated)

000550904.b3lyp_6-31g(d).gjf (generated)

000550904.b3lyp_6-31g(d).firefly.inp (generated)

000550904.b3lyp_6-31g(d).smash.inp (generated)

000550904.b3lyp_6-31g(d).nwchem.inp (generated) 000550904.b3lyp_6-31g(d).log.xz 000550904.td-b3lyp_6-31g+(d).inp 000550904.td-b3lyp_6-31g+(d).log.xz

000550904.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550904.td-b3lyp_6-31+g(d).gjf (generated)

000550904.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550904.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550904.mol 000550904.PUBCHEM 000550904.mol (via Jmol)
000550905.b3lyp_6-31g(d).inp

000550905.b3lyp_6-31g(d).qchem.inp (generated)

000550905.b3lyp_6-31g(d).gjf (generated)

000550905.b3lyp_6-31g(d).firefly.inp (generated)

000550905.b3lyp_6-31g(d).smash.inp (generated)

000550905.b3lyp_6-31g(d).nwchem.inp (generated) 000550905.b3lyp_6-31g(d).log.xz 000550905.td-b3lyp_6-31g+(d).inp 000550905.td-b3lyp_6-31g+(d).log.xz

000550905.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550905.td-b3lyp_6-31+g(d).gjf (generated)

000550905.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550905.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550905.mol 000550905.PUBCHEM 000550905.mol (via Jmol)
000550907.b3lyp_6-31g(d).inp

000550907.b3lyp_6-31g(d).qchem.inp (generated)

000550907.b3lyp_6-31g(d).gjf (generated)

000550907.b3lyp_6-31g(d).firefly.inp (generated)

000550907.b3lyp_6-31g(d).smash.inp (generated)

000550907.b3lyp_6-31g(d).nwchem.inp (generated) 000550907.b3lyp_6-31g(d).log.xz 000550907.td-b3lyp_6-31g+(d).inp 000550907.td-b3lyp_6-31g+(d).log.xz

000550907.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550907.td-b3lyp_6-31+g(d).gjf (generated)

000550907.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550907.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550907.mol 000550907.PUBCHEM 000550907.mol (via Jmol)
000550908.b3lyp_6-31g(d).inp

000550908.b3lyp_6-31g(d).qchem.inp (generated)

000550908.b3lyp_6-31g(d).gjf (generated)

000550908.b3lyp_6-31g(d).firefly.inp (generated)

000550908.b3lyp_6-31g(d).smash.inp (generated)

000550908.b3lyp_6-31g(d).nwchem.inp (generated) 000550908.b3lyp_6-31g(d).log.xz 000550908.td-b3lyp_6-31g+(d).inp 000550908.td-b3lyp_6-31g+(d).log.xz

000550908.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550908.td-b3lyp_6-31+g(d).gjf (generated)

000550908.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550908.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550908.mol 000550908.PUBCHEM 000550908.mol (via Jmol)
000550910.b3lyp_6-31g(d).inp

000550910.b3lyp_6-31g(d).qchem.inp (generated)

000550910.b3lyp_6-31g(d).gjf (generated)

000550910.b3lyp_6-31g(d).firefly.inp (generated)

000550910.b3lyp_6-31g(d).smash.inp (generated)

000550910.b3lyp_6-31g(d).nwchem.inp (generated) 000550910.b3lyp_6-31g(d).log.xz 000550910.td-b3lyp_6-31g+(d).inp 000550910.td-b3lyp_6-31g+(d).log.xz

000550910.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550910.td-b3lyp_6-31+g(d).gjf (generated)

000550910.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550910.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550910.mol 000550910.PUBCHEM 000550910.mol (via Jmol)
000550911.b3lyp_6-31g(d).inp

000550911.b3lyp_6-31g(d).qchem.inp (generated)

000550911.b3lyp_6-31g(d).gjf (generated)

000550911.b3lyp_6-31g(d).firefly.inp (generated)

000550911.b3lyp_6-31g(d).smash.inp (generated)

000550911.b3lyp_6-31g(d).nwchem.inp (generated) 000550911.b3lyp_6-31g(d).log.xz 000550911.td-b3lyp_6-31g+(d).inp 000550911.td-b3lyp_6-31g+(d).log.xz

000550911.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550911.td-b3lyp_6-31+g(d).gjf (generated)

000550911.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550911.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550911.mol 000550911.PUBCHEM 000550911.mol (via Jmol)
000550915.b3lyp_6-31g(d).inp

000550915.b3lyp_6-31g(d).qchem.inp (generated)

000550915.b3lyp_6-31g(d).gjf (generated)

000550915.b3lyp_6-31g(d).firefly.inp (generated)

000550915.b3lyp_6-31g(d).smash.inp (generated)

000550915.b3lyp_6-31g(d).nwchem.inp (generated) 000550915.b3lyp_6-31g(d).log.xz 000550915.td-b3lyp_6-31g+(d).inp 000550915.td-b3lyp_6-31g+(d).log.xz

000550915.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550915.td-b3lyp_6-31+g(d).gjf (generated)

000550915.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550915.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550915.mol 000550915.PUBCHEM 000550915.mol (via Jmol)
000550918.b3lyp_6-31g(d).inp

000550918.b3lyp_6-31g(d).qchem.inp (generated)

000550918.b3lyp_6-31g(d).gjf (generated)

000550918.b3lyp_6-31g(d).firefly.inp (generated)

000550918.b3lyp_6-31g(d).smash.inp (generated)

000550918.b3lyp_6-31g(d).nwchem.inp (generated) 000550918.b3lyp_6-31g(d).log.xz 000550918.td-b3lyp_6-31g+(d).inp 000550918.td-b3lyp_6-31g+(d).log.xz

000550918.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550918.td-b3lyp_6-31+g(d).gjf (generated)

000550918.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550918.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550918.mol 000550918.PUBCHEM 000550918.mol (via Jmol)
000550919.b3lyp_6-31g(d).inp

000550919.b3lyp_6-31g(d).qchem.inp (generated)

000550919.b3lyp_6-31g(d).gjf (generated)

000550919.b3lyp_6-31g(d).firefly.inp (generated)

000550919.b3lyp_6-31g(d).smash.inp (generated)

000550919.b3lyp_6-31g(d).nwchem.inp (generated) 000550919.b3lyp_6-31g(d).log.xz 000550919.td-b3lyp_6-31g+(d).inp 000550919.td-b3lyp_6-31g+(d).log.xz

000550919.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550919.td-b3lyp_6-31+g(d).gjf (generated)

000550919.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550919.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550919.mol 000550919.PUBCHEM 000550919.mol (via Jmol)
000550920.b3lyp_6-31g(d).inp

000550920.b3lyp_6-31g(d).qchem.inp (generated)

000550920.b3lyp_6-31g(d).gjf (generated)

000550920.b3lyp_6-31g(d).firefly.inp (generated)

000550920.b3lyp_6-31g(d).smash.inp (generated)

000550920.b3lyp_6-31g(d).nwchem.inp (generated) 000550920.b3lyp_6-31g(d).log.xz 000550920.td-b3lyp_6-31g+(d).inp 000550920.td-b3lyp_6-31g+(d).log.xz

000550920.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550920.td-b3lyp_6-31+g(d).gjf (generated)

000550920.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550920.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550920.mol 000550920.PUBCHEM 000550920.mol (via Jmol)
000550922.b3lyp_6-31g(d).inp

000550922.b3lyp_6-31g(d).qchem.inp (generated)

000550922.b3lyp_6-31g(d).gjf (generated)

000550922.b3lyp_6-31g(d).firefly.inp (generated)

000550922.b3lyp_6-31g(d).smash.inp (generated)

000550922.b3lyp_6-31g(d).nwchem.inp (generated) 000550922.b3lyp_6-31g(d).log.xz 000550922.td-b3lyp_6-31g+(d).inp 000550922.td-b3lyp_6-31g+(d).log.xz

000550922.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550922.td-b3lyp_6-31+g(d).gjf (generated)

000550922.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550922.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550922.mol 000550922.PUBCHEM 000550922.mol (via Jmol)
000550924.b3lyp_6-31g(d).inp

000550924.b3lyp_6-31g(d).qchem.inp (generated)

000550924.b3lyp_6-31g(d).gjf (generated)

000550924.b3lyp_6-31g(d).firefly.inp (generated)

000550924.b3lyp_6-31g(d).smash.inp (generated)

000550924.b3lyp_6-31g(d).nwchem.inp (generated) 000550924.b3lyp_6-31g(d).log.xz 000550924.td-b3lyp_6-31g+(d).inp 000550924.td-b3lyp_6-31g+(d).log.xz

000550924.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550924.td-b3lyp_6-31+g(d).gjf (generated)

000550924.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550924.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550924.mol 000550924.PUBCHEM 000550924.mol (via Jmol)
000550925.b3lyp_6-31g(d).inp

000550925.b3lyp_6-31g(d).qchem.inp (generated)

000550925.b3lyp_6-31g(d).gjf (generated)

000550925.b3lyp_6-31g(d).firefly.inp (generated)

000550925.b3lyp_6-31g(d).smash.inp (generated)

000550925.b3lyp_6-31g(d).nwchem.inp (generated) 000550925.b3lyp_6-31g(d).log.xz 000550925.td-b3lyp_6-31g+(d).inp 000550925.td-b3lyp_6-31g+(d).log.xz

000550925.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550925.td-b3lyp_6-31+g(d).gjf (generated)

000550925.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550925.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550925.mol 000550925.PUBCHEM 000550925.mol (via Jmol)
000550931.b3lyp_6-31g(d).inp

000550931.b3lyp_6-31g(d).qchem.inp (generated)

000550931.b3lyp_6-31g(d).gjf (generated)

000550931.b3lyp_6-31g(d).firefly.inp (generated)

000550931.b3lyp_6-31g(d).smash.inp (generated)

000550931.b3lyp_6-31g(d).nwchem.inp (generated) 000550931.b3lyp_6-31g(d).log.xz 000550931.td-b3lyp_6-31g+(d).inp 000550931.td-b3lyp_6-31g+(d).log.xz

000550931.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550931.td-b3lyp_6-31+g(d).gjf (generated)

000550931.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550931.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550931.mol 000550931.PUBCHEM 000550931.mol (via Jmol)
000550934.b3lyp_6-31g(d).inp

000550934.b3lyp_6-31g(d).qchem.inp (generated)

000550934.b3lyp_6-31g(d).gjf (generated)

000550934.b3lyp_6-31g(d).firefly.inp (generated)

000550934.b3lyp_6-31g(d).smash.inp (generated)

000550934.b3lyp_6-31g(d).nwchem.inp (generated) 000550934.b3lyp_6-31g(d).log.xz 000550934.td-b3lyp_6-31g+(d).inp 000550934.td-b3lyp_6-31g+(d).log.xz

000550934.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550934.td-b3lyp_6-31+g(d).gjf (generated)

000550934.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550934.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550934.mol 000550934.PUBCHEM 000550934.mol (via Jmol)
000550937.b3lyp_6-31g(d).inp

000550937.b3lyp_6-31g(d).qchem.inp (generated)

000550937.b3lyp_6-31g(d).gjf (generated)

000550937.b3lyp_6-31g(d).firefly.inp (generated)

000550937.b3lyp_6-31g(d).smash.inp (generated)

000550937.b3lyp_6-31g(d).nwchem.inp (generated) 000550937.b3lyp_6-31g(d).log.xz 000550937.td-b3lyp_6-31g+(d).inp 000550937.td-b3lyp_6-31g+(d).log.xz

000550937.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550937.td-b3lyp_6-31+g(d).gjf (generated)

000550937.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550937.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550937.mol 000550937.PUBCHEM 000550937.mol (via Jmol)
000550940.b3lyp_6-31g(d).inp

000550940.b3lyp_6-31g(d).qchem.inp (generated)

000550940.b3lyp_6-31g(d).gjf (generated)

000550940.b3lyp_6-31g(d).firefly.inp (generated)

000550940.b3lyp_6-31g(d).smash.inp (generated)

000550940.b3lyp_6-31g(d).nwchem.inp (generated) 000550940.b3lyp_6-31g(d).log.xz 000550940.td-b3lyp_6-31g+(d).inp 000550940.td-b3lyp_6-31g+(d).log.xz

000550940.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550940.td-b3lyp_6-31+g(d).gjf (generated)

000550940.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550940.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550940.mol 000550940.PUBCHEM 000550940.mol (via Jmol)
000550941.b3lyp_6-31g(d).inp

000550941.b3lyp_6-31g(d).qchem.inp (generated)

000550941.b3lyp_6-31g(d).gjf (generated)

000550941.b3lyp_6-31g(d).firefly.inp (generated)

000550941.b3lyp_6-31g(d).smash.inp (generated)

000550941.b3lyp_6-31g(d).nwchem.inp (generated) 000550941.b3lyp_6-31g(d).log.xz 000550941.td-b3lyp_6-31g+(d).inp 000550941.td-b3lyp_6-31g+(d).log.xz

000550941.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550941.td-b3lyp_6-31+g(d).gjf (generated)

000550941.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550941.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550941.mol 000550941.PUBCHEM 000550941.mol (via Jmol)
000550942.b3lyp_6-31g(d).inp

000550942.b3lyp_6-31g(d).qchem.inp (generated)

000550942.b3lyp_6-31g(d).gjf (generated)

000550942.b3lyp_6-31g(d).firefly.inp (generated)

000550942.b3lyp_6-31g(d).smash.inp (generated)

000550942.b3lyp_6-31g(d).nwchem.inp (generated) 000550942.b3lyp_6-31g(d).log.xz 000550942.td-b3lyp_6-31g+(d).inp 000550942.td-b3lyp_6-31g+(d).log.xz

000550942.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550942.td-b3lyp_6-31+g(d).gjf (generated)

000550942.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550942.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550942.mol 000550942.PUBCHEM 000550942.mol (via Jmol)
000550943.b3lyp_6-31g(d).inp

000550943.b3lyp_6-31g(d).qchem.inp (generated)

000550943.b3lyp_6-31g(d).gjf (generated)

000550943.b3lyp_6-31g(d).firefly.inp (generated)

000550943.b3lyp_6-31g(d).smash.inp (generated)

000550943.b3lyp_6-31g(d).nwchem.inp (generated) 000550943.b3lyp_6-31g(d).log.xz 000550943.td-b3lyp_6-31g+(d).inp 000550943.td-b3lyp_6-31g+(d).log.xz

000550943.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550943.td-b3lyp_6-31+g(d).gjf (generated)

000550943.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550943.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550943.mol 000550943.PUBCHEM 000550943.mol (via Jmol)
000550945.b3lyp_6-31g(d).inp

000550945.b3lyp_6-31g(d).qchem.inp (generated)

000550945.b3lyp_6-31g(d).gjf (generated)

000550945.b3lyp_6-31g(d).firefly.inp (generated)

000550945.b3lyp_6-31g(d).smash.inp (generated)

000550945.b3lyp_6-31g(d).nwchem.inp (generated) 000550945.b3lyp_6-31g(d).log.xz 000550945.td-b3lyp_6-31g+(d).inp 000550945.td-b3lyp_6-31g+(d).log.xz

000550945.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550945.td-b3lyp_6-31+g(d).gjf (generated)

000550945.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550945.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550945.mol 000550945.PUBCHEM 000550945.mol (via Jmol)
000550947.b3lyp_6-31g(d).inp

000550947.b3lyp_6-31g(d).qchem.inp (generated)

000550947.b3lyp_6-31g(d).gjf (generated)

000550947.b3lyp_6-31g(d).firefly.inp (generated)

000550947.b3lyp_6-31g(d).smash.inp (generated)

000550947.b3lyp_6-31g(d).nwchem.inp (generated) 000550947.b3lyp_6-31g(d).log.xz 000550947.td-b3lyp_6-31g+(d).inp 000550947.td-b3lyp_6-31g+(d).log.xz

000550947.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550947.td-b3lyp_6-31+g(d).gjf (generated)

000550947.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550947.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550947.mol 000550947.PUBCHEM 000550947.mol (via Jmol)
000550949.b3lyp_6-31g(d).inp

000550949.b3lyp_6-31g(d).qchem.inp (generated)

000550949.b3lyp_6-31g(d).gjf (generated)

000550949.b3lyp_6-31g(d).firefly.inp (generated)

000550949.b3lyp_6-31g(d).smash.inp (generated)

000550949.b3lyp_6-31g(d).nwchem.inp (generated) 000550949.b3lyp_6-31g(d).log.xz 000550949.td-b3lyp_6-31g+(d).inp 000550949.td-b3lyp_6-31g+(d).log.xz

000550949.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550949.td-b3lyp_6-31+g(d).gjf (generated)

000550949.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550949.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550949.mol 000550949.PUBCHEM 000550949.mol (via Jmol)
000550950.b3lyp_6-31g(d).inp

000550950.b3lyp_6-31g(d).qchem.inp (generated)

000550950.b3lyp_6-31g(d).gjf (generated)

000550950.b3lyp_6-31g(d).firefly.inp (generated)

000550950.b3lyp_6-31g(d).smash.inp (generated)

000550950.b3lyp_6-31g(d).nwchem.inp (generated) 000550950.b3lyp_6-31g(d).log.xz 000550950.td-b3lyp_6-31g+(d).inp 000550950.td-b3lyp_6-31g+(d).log.xz

000550950.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550950.td-b3lyp_6-31+g(d).gjf (generated)

000550950.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550950.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550950.mol 000550950.PUBCHEM 000550950.mol (via Jmol)
000550952.b3lyp_6-31g(d).inp

000550952.b3lyp_6-31g(d).qchem.inp (generated)

000550952.b3lyp_6-31g(d).gjf (generated)

000550952.b3lyp_6-31g(d).firefly.inp (generated)

000550952.b3lyp_6-31g(d).smash.inp (generated)

000550952.b3lyp_6-31g(d).nwchem.inp (generated) 000550952.b3lyp_6-31g(d).log.xz 000550952.td-b3lyp_6-31g+(d).inp 000550952.td-b3lyp_6-31g+(d).log.xz

000550952.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550952.td-b3lyp_6-31+g(d).gjf (generated)

000550952.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550952.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550952.mol 000550952.PUBCHEM 000550952.mol (via Jmol)
000550959.b3lyp_6-31g(d).inp

000550959.b3lyp_6-31g(d).qchem.inp (generated)

000550959.b3lyp_6-31g(d).gjf (generated)

000550959.b3lyp_6-31g(d).firefly.inp (generated)

000550959.b3lyp_6-31g(d).smash.inp (generated)

000550959.b3lyp_6-31g(d).nwchem.inp (generated) 000550959.b3lyp_6-31g(d).log.xz 000550959.td-b3lyp_6-31g+(d).inp 000550959.td-b3lyp_6-31g+(d).log.xz

000550959.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550959.td-b3lyp_6-31+g(d).gjf (generated)

000550959.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550959.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550959.mol 000550959.PUBCHEM 000550959.mol (via Jmol)
000550962.b3lyp_6-31g(d).inp

000550962.b3lyp_6-31g(d).qchem.inp (generated)

000550962.b3lyp_6-31g(d).gjf (generated)

000550962.b3lyp_6-31g(d).firefly.inp (generated)

000550962.b3lyp_6-31g(d).smash.inp (generated)

000550962.b3lyp_6-31g(d).nwchem.inp (generated) 000550962.b3lyp_6-31g(d).log.xz 000550962.td-b3lyp_6-31g+(d).inp 000550962.td-b3lyp_6-31g+(d).log.xz

000550962.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550962.td-b3lyp_6-31+g(d).gjf (generated)

000550962.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550962.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550962.mol 000550962.PUBCHEM 000550962.mol (via Jmol)
000550963.b3lyp_6-31g(d).inp

000550963.b3lyp_6-31g(d).qchem.inp (generated)

000550963.b3lyp_6-31g(d).gjf (generated)

000550963.b3lyp_6-31g(d).firefly.inp (generated)

000550963.b3lyp_6-31g(d).smash.inp (generated)

000550963.b3lyp_6-31g(d).nwchem.inp (generated) 000550963.b3lyp_6-31g(d).log.xz 000550963.td-b3lyp_6-31g+(d).inp 000550963.td-b3lyp_6-31g+(d).log.xz

000550963.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550963.td-b3lyp_6-31+g(d).gjf (generated)

000550963.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550963.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550963.mol 000550963.PUBCHEM 000550963.mol (via Jmol)
000550964.b3lyp_6-31g(d).inp

000550964.b3lyp_6-31g(d).qchem.inp (generated)

000550964.b3lyp_6-31g(d).gjf (generated)

000550964.b3lyp_6-31g(d).firefly.inp (generated)

000550964.b3lyp_6-31g(d).smash.inp (generated)

000550964.b3lyp_6-31g(d).nwchem.inp (generated) 000550964.b3lyp_6-31g(d).log.xz 000550964.td-b3lyp_6-31g+(d).inp 000550964.td-b3lyp_6-31g+(d).log.xz

000550964.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550964.td-b3lyp_6-31+g(d).gjf (generated)

000550964.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550964.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550964.mol 000550964.PUBCHEM 000550964.mol (via Jmol)
000550965.b3lyp_6-31g(d).inp

000550965.b3lyp_6-31g(d).qchem.inp (generated)

000550965.b3lyp_6-31g(d).gjf (generated)

000550965.b3lyp_6-31g(d).firefly.inp (generated)

000550965.b3lyp_6-31g(d).smash.inp (generated)

000550965.b3lyp_6-31g(d).nwchem.inp (generated) 000550965.b3lyp_6-31g(d).log.xz 000550965.td-b3lyp_6-31g+(d).inp 000550965.td-b3lyp_6-31g+(d).log.xz

000550965.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550965.td-b3lyp_6-31+g(d).gjf (generated)

000550965.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550965.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550965.mol 000550965.PUBCHEM 000550965.mol (via Jmol)
000550966.b3lyp_6-31g(d).inp

000550966.b3lyp_6-31g(d).qchem.inp (generated)

000550966.b3lyp_6-31g(d).gjf (generated)

000550966.b3lyp_6-31g(d).firefly.inp (generated)

000550966.b3lyp_6-31g(d).smash.inp (generated)

000550966.b3lyp_6-31g(d).nwchem.inp (generated) 000550966.b3lyp_6-31g(d).log.xz 000550966.td-b3lyp_6-31g+(d).inp 000550966.td-b3lyp_6-31g+(d).log.xz

000550966.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550966.td-b3lyp_6-31+g(d).gjf (generated)

000550966.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550966.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550966.mol 000550966.PUBCHEM 000550966.mol (via Jmol)
000550967.b3lyp_6-31g(d).inp

000550967.b3lyp_6-31g(d).qchem.inp (generated)

000550967.b3lyp_6-31g(d).gjf (generated)

000550967.b3lyp_6-31g(d).firefly.inp (generated)

000550967.b3lyp_6-31g(d).smash.inp (generated)

000550967.b3lyp_6-31g(d).nwchem.inp (generated) 000550967.b3lyp_6-31g(d).log.xz 000550967.td-b3lyp_6-31g+(d).inp 000550967.td-b3lyp_6-31g+(d).log.xz

000550967.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550967.td-b3lyp_6-31+g(d).gjf (generated)

000550967.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550967.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550967.mol 000550967.PUBCHEM 000550967.mol (via Jmol)
000550968.b3lyp_6-31g(d).inp

000550968.b3lyp_6-31g(d).qchem.inp (generated)

000550968.b3lyp_6-31g(d).gjf (generated)

000550968.b3lyp_6-31g(d).firefly.inp (generated)

000550968.b3lyp_6-31g(d).smash.inp (generated)

000550968.b3lyp_6-31g(d).nwchem.inp (generated) 000550968.b3lyp_6-31g(d).log.xz 000550968.td-b3lyp_6-31g+(d).inp 000550968.td-b3lyp_6-31g+(d).log.xz

000550968.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550968.td-b3lyp_6-31+g(d).gjf (generated)

000550968.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550968.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550968.mol 000550968.PUBCHEM 000550968.mol (via Jmol)
000550970.b3lyp_6-31g(d).inp

000550970.b3lyp_6-31g(d).qchem.inp (generated)

000550970.b3lyp_6-31g(d).gjf (generated)

000550970.b3lyp_6-31g(d).firefly.inp (generated)

000550970.b3lyp_6-31g(d).smash.inp (generated)

000550970.b3lyp_6-31g(d).nwchem.inp (generated) 000550970.b3lyp_6-31g(d).log.xz 000550970.td-b3lyp_6-31g+(d).inp 000550970.td-b3lyp_6-31g+(d).log.xz

000550970.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550970.td-b3lyp_6-31+g(d).gjf (generated)

000550970.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550970.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550970.mol 000550970.PUBCHEM 000550970.mol (via Jmol)
000550971.b3lyp_6-31g(d).inp

000550971.b3lyp_6-31g(d).qchem.inp (generated)

000550971.b3lyp_6-31g(d).gjf (generated)

000550971.b3lyp_6-31g(d).firefly.inp (generated)

000550971.b3lyp_6-31g(d).smash.inp (generated)

000550971.b3lyp_6-31g(d).nwchem.inp (generated) 000550971.b3lyp_6-31g(d).log.xz 000550971.td-b3lyp_6-31g+(d).inp 000550971.td-b3lyp_6-31g+(d).log.xz

000550971.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550971.td-b3lyp_6-31+g(d).gjf (generated)

000550971.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550971.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550971.mol 000550971.PUBCHEM 000550971.mol (via Jmol)
000550974.b3lyp_6-31g(d).inp

000550974.b3lyp_6-31g(d).qchem.inp (generated)

000550974.b3lyp_6-31g(d).gjf (generated)

000550974.b3lyp_6-31g(d).firefly.inp (generated)

000550974.b3lyp_6-31g(d).smash.inp (generated)

000550974.b3lyp_6-31g(d).nwchem.inp (generated) 000550974.b3lyp_6-31g(d).log.xz 000550974.td-b3lyp_6-31g+(d).inp 000550974.td-b3lyp_6-31g+(d).log.xz

000550974.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550974.td-b3lyp_6-31+g(d).gjf (generated)

000550974.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550974.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550974.mol 000550974.PUBCHEM 000550974.mol (via Jmol)
000550975.b3lyp_6-31g(d).inp

000550975.b3lyp_6-31g(d).qchem.inp (generated)

000550975.b3lyp_6-31g(d).gjf (generated)

000550975.b3lyp_6-31g(d).firefly.inp (generated)

000550975.b3lyp_6-31g(d).smash.inp (generated)

000550975.b3lyp_6-31g(d).nwchem.inp (generated) 000550975.b3lyp_6-31g(d).log.xz 000550975.td-b3lyp_6-31g+(d).inp 000550975.td-b3lyp_6-31g+(d).log.xz

000550975.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550975.td-b3lyp_6-31+g(d).gjf (generated)

000550975.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550975.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550975.mol 000550975.PUBCHEM 000550975.mol (via Jmol)
000550977.b3lyp_6-31g(d).inp

000550977.b3lyp_6-31g(d).qchem.inp (generated)

000550977.b3lyp_6-31g(d).gjf (generated)

000550977.b3lyp_6-31g(d).firefly.inp (generated)

000550977.b3lyp_6-31g(d).smash.inp (generated)

000550977.b3lyp_6-31g(d).nwchem.inp (generated) 000550977.b3lyp_6-31g(d).log.xz 000550977.td-b3lyp_6-31g+(d).inp 000550977.td-b3lyp_6-31g+(d).log.xz

000550977.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550977.td-b3lyp_6-31+g(d).gjf (generated)

000550977.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550977.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550977.mol 000550977.PUBCHEM 000550977.mol (via Jmol)
000550982.b3lyp_6-31g(d).inp

000550982.b3lyp_6-31g(d).qchem.inp (generated)

000550982.b3lyp_6-31g(d).gjf (generated)

000550982.b3lyp_6-31g(d).firefly.inp (generated)

000550982.b3lyp_6-31g(d).smash.inp (generated)

000550982.b3lyp_6-31g(d).nwchem.inp (generated) 000550982.b3lyp_6-31g(d).log.xz 000550982.td-b3lyp_6-31g+(d).inp 000550982.td-b3lyp_6-31g+(d).log.xz

000550982.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550982.td-b3lyp_6-31+g(d).gjf (generated)

000550982.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550982.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550982.mol 000550982.PUBCHEM 000550982.mol (via Jmol)
000550984.b3lyp_6-31g(d).inp

000550984.b3lyp_6-31g(d).qchem.inp (generated)

000550984.b3lyp_6-31g(d).gjf (generated)

000550984.b3lyp_6-31g(d).firefly.inp (generated)

000550984.b3lyp_6-31g(d).smash.inp (generated)

000550984.b3lyp_6-31g(d).nwchem.inp (generated) 000550984.b3lyp_6-31g(d).log.xz 000550984.td-b3lyp_6-31g+(d).inp 000550984.td-b3lyp_6-31g+(d).log.xz

000550984.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550984.td-b3lyp_6-31+g(d).gjf (generated)

000550984.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550984.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550984.mol 000550984.PUBCHEM 000550984.mol (via Jmol)
000550985.b3lyp_6-31g(d).inp

000550985.b3lyp_6-31g(d).qchem.inp (generated)

000550985.b3lyp_6-31g(d).gjf (generated)

000550985.b3lyp_6-31g(d).firefly.inp (generated)

000550985.b3lyp_6-31g(d).smash.inp (generated)

000550985.b3lyp_6-31g(d).nwchem.inp (generated) 000550985.b3lyp_6-31g(d).log.xz 000550985.td-b3lyp_6-31g+(d).inp 000550985.td-b3lyp_6-31g+(d).log.xz

000550985.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550985.td-b3lyp_6-31+g(d).gjf (generated)

000550985.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550985.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550985.mol 000550985.PUBCHEM 000550985.mol (via Jmol)
000550987.b3lyp_6-31g(d).inp

000550987.b3lyp_6-31g(d).qchem.inp (generated)

000550987.b3lyp_6-31g(d).gjf (generated)

000550987.b3lyp_6-31g(d).firefly.inp (generated)

000550987.b3lyp_6-31g(d).smash.inp (generated)

000550987.b3lyp_6-31g(d).nwchem.inp (generated) 000550987.b3lyp_6-31g(d).log.xz 000550987.td-b3lyp_6-31g+(d).inp 000550987.td-b3lyp_6-31g+(d).log.xz

000550987.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550987.td-b3lyp_6-31+g(d).gjf (generated)

000550987.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550987.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550987.mol 000550987.PUBCHEM 000550987.mol (via Jmol)
000550988.b3lyp_6-31g(d).inp

000550988.b3lyp_6-31g(d).qchem.inp (generated)

000550988.b3lyp_6-31g(d).gjf (generated)

000550988.b3lyp_6-31g(d).firefly.inp (generated)

000550988.b3lyp_6-31g(d).smash.inp (generated)

000550988.b3lyp_6-31g(d).nwchem.inp (generated) 000550988.b3lyp_6-31g(d).log.xz 000550988.td-b3lyp_6-31g+(d).inp 000550988.td-b3lyp_6-31g+(d).log.xz

000550988.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550988.td-b3lyp_6-31+g(d).gjf (generated)

000550988.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550988.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550988.mol 000550988.PUBCHEM 000550988.mol (via Jmol)
000550989.b3lyp_6-31g(d).inp

000550989.b3lyp_6-31g(d).qchem.inp (generated)

000550989.b3lyp_6-31g(d).gjf (generated)

000550989.b3lyp_6-31g(d).firefly.inp (generated)

000550989.b3lyp_6-31g(d).smash.inp (generated)

000550989.b3lyp_6-31g(d).nwchem.inp (generated) 000550989.b3lyp_6-31g(d).log.xz 000550989.td-b3lyp_6-31g+(d).inp 000550989.td-b3lyp_6-31g+(d).log.xz

000550989.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550989.td-b3lyp_6-31+g(d).gjf (generated)

000550989.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550989.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550989.mol 000550989.PUBCHEM 000550989.mol (via Jmol)
000550990.b3lyp_6-31g(d).inp

000550990.b3lyp_6-31g(d).qchem.inp (generated)

000550990.b3lyp_6-31g(d).gjf (generated)

000550990.b3lyp_6-31g(d).firefly.inp (generated)

000550990.b3lyp_6-31g(d).smash.inp (generated)

000550990.b3lyp_6-31g(d).nwchem.inp (generated) 000550990.b3lyp_6-31g(d).log.xz 000550990.td-b3lyp_6-31g+(d).inp 000550990.td-b3lyp_6-31g+(d).log.xz

000550990.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550990.td-b3lyp_6-31+g(d).gjf (generated)

000550990.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550990.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550990.mol 000550990.PUBCHEM 000550990.mol (via Jmol)
000550991.b3lyp_6-31g(d).inp

000550991.b3lyp_6-31g(d).qchem.inp (generated)

000550991.b3lyp_6-31g(d).gjf (generated)

000550991.b3lyp_6-31g(d).firefly.inp (generated)

000550991.b3lyp_6-31g(d).smash.inp (generated)

000550991.b3lyp_6-31g(d).nwchem.inp (generated) 000550991.b3lyp_6-31g(d).log.xz 000550991.td-b3lyp_6-31g+(d).inp 000550991.td-b3lyp_6-31g+(d).log.xz

000550991.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550991.td-b3lyp_6-31+g(d).gjf (generated)

000550991.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550991.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550991.mol 000550991.PUBCHEM 000550991.mol (via Jmol)
000550995.b3lyp_6-31g(d).inp

000550995.b3lyp_6-31g(d).qchem.inp (generated)

000550995.b3lyp_6-31g(d).gjf (generated)

000550995.b3lyp_6-31g(d).firefly.inp (generated)

000550995.b3lyp_6-31g(d).smash.inp (generated)

000550995.b3lyp_6-31g(d).nwchem.inp (generated) 000550995.b3lyp_6-31g(d).log.xz 000550995.td-b3lyp_6-31g+(d).inp 000550995.td-b3lyp_6-31g+(d).log.xz

000550995.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550995.td-b3lyp_6-31+g(d).gjf (generated)

000550995.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550995.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550995.mol 000550995.PUBCHEM 000550995.mol (via Jmol)
000550996.b3lyp_6-31g(d).inp

000550996.b3lyp_6-31g(d).qchem.inp (generated)

000550996.b3lyp_6-31g(d).gjf (generated)

000550996.b3lyp_6-31g(d).firefly.inp (generated)

000550996.b3lyp_6-31g(d).smash.inp (generated)

000550996.b3lyp_6-31g(d).nwchem.inp (generated) 000550996.b3lyp_6-31g(d).log.xz 000550996.td-b3lyp_6-31g+(d).inp 000550996.td-b3lyp_6-31g+(d).log.xz

000550996.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550996.td-b3lyp_6-31+g(d).gjf (generated)

000550996.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550996.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550996.mol 000550996.PUBCHEM 000550996.mol (via Jmol)
000550997.b3lyp_6-31g(d).inp

000550997.b3lyp_6-31g(d).qchem.inp (generated)

000550997.b3lyp_6-31g(d).gjf (generated)

000550997.b3lyp_6-31g(d).firefly.inp (generated)

000550997.b3lyp_6-31g(d).smash.inp (generated)

000550997.b3lyp_6-31g(d).nwchem.inp (generated) 000550997.b3lyp_6-31g(d).log.xz 000550997.td-b3lyp_6-31g+(d).inp 000550997.td-b3lyp_6-31g+(d).log.xz

000550997.td-b3lyp_6-31+g(d).qchem.inp (generated)

000550997.td-b3lyp_6-31+g(d).gjf (generated)

000550997.td-b3lyp_6-31+g(d).firefly.inp (generated)

000550997.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000550997.mol 000550997.PUBCHEM 000550997.mol (via Jmol)