Index of

Last updated : Thu Feb 23 01:59:54 JST 2017
Total : 3835 (3426) in this page
000175002.b3lyp_6-31g(d).inp

000175002.b3lyp_6-31g(d).qchem.inp (generated)

000175002.b3lyp_6-31g(d).gjf (generated)

000175002.b3lyp_6-31g(d).firefly.inp (generated)

000175002.b3lyp_6-31g(d).smash.inp (generated)

000175002.b3lyp_6-31g(d).nwchem.inp (generated) 000175002.b3lyp_6-31g(d).log.xz 000175002.td-b3lyp_6-31g+(d).inp 000175002.td-b3lyp_6-31g+(d).log.xz

000175002.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175002.td-b3lyp_6-31+g(d).gjf (generated)

000175002.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175002.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175002.mol 000175002.PUBCHEM 000175002.mol (via Jmol)
000175005.b3lyp_6-31g(d).inp

000175005.b3lyp_6-31g(d).qchem.inp (generated)

000175005.b3lyp_6-31g(d).gjf (generated)

000175005.b3lyp_6-31g(d).firefly.inp (generated)

000175005.b3lyp_6-31g(d).smash.inp (generated)

000175005.b3lyp_6-31g(d).nwchem.inp (generated) 000175005.b3lyp_6-31g(d).log.xz 000175005.td-b3lyp_6-31g+(d).inp 000175005.td-b3lyp_6-31g+(d).log.xz

000175005.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175005.td-b3lyp_6-31+g(d).gjf (generated)

000175005.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175005.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175005.mol 000175005.PUBCHEM 000175005.mol (via Jmol)
000175029.b3lyp_6-31g(d).inp

000175029.b3lyp_6-31g(d).qchem.inp (generated)

000175029.b3lyp_6-31g(d).gjf (generated)

000175029.b3lyp_6-31g(d).firefly.inp (generated)

000175029.b3lyp_6-31g(d).smash.inp (generated)

000175029.b3lyp_6-31g(d).nwchem.inp (generated) 000175029.b3lyp_6-31g(d).log.xz 000175029.td-b3lyp_6-31g+(d).inp 000175029.td-b3lyp_6-31g+(d).log.xz

000175029.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175029.td-b3lyp_6-31+g(d).gjf (generated)

000175029.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175029.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175029.mol 000175029.PUBCHEM 000175029.mol (via Jmol)
000175039.b3lyp_6-31g(d).inp

000175039.b3lyp_6-31g(d).qchem.inp (generated)

000175039.b3lyp_6-31g(d).gjf (generated)

000175039.b3lyp_6-31g(d).firefly.inp (generated)

000175039.b3lyp_6-31g(d).smash.inp (generated)

000175039.b3lyp_6-31g(d).nwchem.inp (generated) 000175039.b3lyp_6-31g(d).log.xz 000175039.td-b3lyp_6-31g+(d).inp 000175039.td-b3lyp_6-31g+(d).log.xz

000175039.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175039.td-b3lyp_6-31+g(d).gjf (generated)

000175039.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175039.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175039.mol 000175039.PUBCHEM 000175039.mol (via Jmol)
000175056.b3lyp_6-31g(d).inp

000175056.b3lyp_6-31g(d).qchem.inp (generated)

000175056.b3lyp_6-31g(d).gjf (generated)

000175056.b3lyp_6-31g(d).firefly.inp (generated)

000175056.b3lyp_6-31g(d).smash.inp (generated)

000175056.b3lyp_6-31g(d).nwchem.inp (generated) 000175056.b3lyp_6-31g(d).log.xz 000175056.mol 000175056.PUBCHEM 000175056.mol (via Jmol)
000175061.b3lyp_6-31g(d).inp

000175061.b3lyp_6-31g(d).qchem.inp (generated)

000175061.b3lyp_6-31g(d).gjf (generated)

000175061.b3lyp_6-31g(d).firefly.inp (generated)

000175061.b3lyp_6-31g(d).smash.inp (generated)

000175061.b3lyp_6-31g(d).nwchem.inp (generated) 000175061.b3lyp_6-31g(d).log.xz 000175061.td-b3lyp_6-31g+(d).inp 000175061.td-b3lyp_6-31g+(d).log.xz

000175061.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175061.td-b3lyp_6-31+g(d).gjf (generated)

000175061.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175061.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175061.mol 000175061.PUBCHEM 000175061.mol (via Jmol)
000175084.b3lyp_6-31g(d).inp

000175084.b3lyp_6-31g(d).qchem.inp (generated)

000175084.b3lyp_6-31g(d).gjf (generated)

000175084.b3lyp_6-31g(d).firefly.inp (generated)

000175084.b3lyp_6-31g(d).smash.inp (generated)

000175084.b3lyp_6-31g(d).nwchem.inp (generated) 000175084.b3lyp_6-31g(d).log.xz 000175084.td-b3lyp_6-31g+(d).inp 000175084.td-b3lyp_6-31g+(d).log.xz

000175084.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175084.td-b3lyp_6-31+g(d).gjf (generated)

000175084.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175084.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175084.mol 000175084.PUBCHEM 000175084.mol (via Jmol)
000175118.b3lyp_6-31g(d).inp

000175118.b3lyp_6-31g(d).qchem.inp (generated)

000175118.b3lyp_6-31g(d).gjf (generated)

000175118.b3lyp_6-31g(d).firefly.inp (generated)

000175118.b3lyp_6-31g(d).smash.inp (generated)

000175118.b3lyp_6-31g(d).nwchem.inp (generated) 000175118.b3lyp_6-31g(d).log.xz 000175118.td-b3lyp_6-31g+(d).inp 000175118.td-b3lyp_6-31g+(d).log.xz

000175118.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175118.td-b3lyp_6-31+g(d).gjf (generated)

000175118.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175118.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175118.mol 000175118.PUBCHEM 000175118.mol (via Jmol)
000175123.b3lyp_6-31g(d).inp

000175123.b3lyp_6-31g(d).qchem.inp (generated)

000175123.b3lyp_6-31g(d).gjf (generated)

000175123.b3lyp_6-31g(d).firefly.inp (generated)

000175123.b3lyp_6-31g(d).smash.inp (generated)

000175123.b3lyp_6-31g(d).nwchem.inp (generated) 000175123.b3lyp_6-31g(d).log.xz 000175123.td-b3lyp_6-31g+(d).inp 000175123.td-b3lyp_6-31g+(d).log.xz

000175123.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175123.td-b3lyp_6-31+g(d).gjf (generated)

000175123.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175123.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175123.mol 000175123.PUBCHEM 000175123.mol (via Jmol)
000175124.b3lyp_6-31g(d).inp

000175124.b3lyp_6-31g(d).qchem.inp (generated)

000175124.b3lyp_6-31g(d).gjf (generated)

000175124.b3lyp_6-31g(d).firefly.inp (generated)

000175124.b3lyp_6-31g(d).smash.inp (generated)

000175124.b3lyp_6-31g(d).nwchem.inp (generated) 000175124.b3lyp_6-31g(d).log.xz 000175124.td-b3lyp_6-31g+(d).inp 000175124.td-b3lyp_6-31g+(d).log.xz

000175124.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175124.td-b3lyp_6-31+g(d).gjf (generated)

000175124.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175124.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175124.mol 000175124.PUBCHEM 000175124.mol (via Jmol)
000175125.b3lyp_6-31g(d).inp

000175125.b3lyp_6-31g(d).qchem.inp (generated)

000175125.b3lyp_6-31g(d).gjf (generated)

000175125.b3lyp_6-31g(d).firefly.inp (generated)

000175125.b3lyp_6-31g(d).smash.inp (generated)

000175125.b3lyp_6-31g(d).nwchem.inp (generated) 000175125.b3lyp_6-31g(d).log.xz 000175125.td-b3lyp_6-31g+(d).inp 000175125.td-b3lyp_6-31g+(d).log.xz

000175125.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175125.td-b3lyp_6-31+g(d).gjf (generated)

000175125.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175125.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175125.mol 000175125.PUBCHEM 000175125.mol (via Jmol)
000175126.b3lyp_6-31g(d).inp

000175126.b3lyp_6-31g(d).qchem.inp (generated)

000175126.b3lyp_6-31g(d).gjf (generated)

000175126.b3lyp_6-31g(d).firefly.inp (generated)

000175126.b3lyp_6-31g(d).smash.inp (generated)

000175126.b3lyp_6-31g(d).nwchem.inp (generated) 000175126.b3lyp_6-31g(d).log.xz 000175126.mol 000175126.PUBCHEM 000175126.mol (via Jmol)
000175128.b3lyp_6-31g(d).inp

000175128.b3lyp_6-31g(d).qchem.inp (generated)

000175128.b3lyp_6-31g(d).gjf (generated)

000175128.b3lyp_6-31g(d).firefly.inp (generated)

000175128.b3lyp_6-31g(d).smash.inp (generated)

000175128.b3lyp_6-31g(d).nwchem.inp (generated) 000175128.b3lyp_6-31g(d).log.xz 000175128.td-b3lyp_6-31g+(d).inp 000175128.td-b3lyp_6-31g+(d).log.xz

000175128.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175128.td-b3lyp_6-31+g(d).gjf (generated)

000175128.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175128.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175128.mol 000175128.PUBCHEM 000175128.mol (via Jmol)
000175129.b3lyp_6-31g(d).inp

000175129.b3lyp_6-31g(d).qchem.inp (generated)

000175129.b3lyp_6-31g(d).gjf (generated)

000175129.b3lyp_6-31g(d).firefly.inp (generated)

000175129.b3lyp_6-31g(d).smash.inp (generated)

000175129.b3lyp_6-31g(d).nwchem.inp (generated) 000175129.b3lyp_6-31g(d).log.xz 000175129.td-b3lyp_6-31g+(d).inp 000175129.td-b3lyp_6-31g+(d).log.xz

000175129.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175129.td-b3lyp_6-31+g(d).gjf (generated)

000175129.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175129.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175129.mol 000175129.PUBCHEM 000175129.mol (via Jmol)
000175130.b3lyp_6-31g(d).inp

000175130.b3lyp_6-31g(d).qchem.inp (generated)

000175130.b3lyp_6-31g(d).gjf (generated)

000175130.b3lyp_6-31g(d).firefly.inp (generated)

000175130.b3lyp_6-31g(d).smash.inp (generated)

000175130.b3lyp_6-31g(d).nwchem.inp (generated) 000175130.b3lyp_6-31g(d).log.xz 000175130.td-b3lyp_6-31g+(d).inp 000175130.td-b3lyp_6-31g+(d).log.xz

000175130.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175130.td-b3lyp_6-31+g(d).gjf (generated)

000175130.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175130.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175130.mol 000175130.PUBCHEM 000175130.mol (via Jmol)
000175131.b3lyp_6-31g(d).inp

000175131.b3lyp_6-31g(d).qchem.inp (generated)

000175131.b3lyp_6-31g(d).gjf (generated)

000175131.b3lyp_6-31g(d).firefly.inp (generated)

000175131.b3lyp_6-31g(d).smash.inp (generated)

000175131.b3lyp_6-31g(d).nwchem.inp (generated) 000175131.b3lyp_6-31g(d).log.xz 000175131.td-b3lyp_6-31g+(d).inp 000175131.td-b3lyp_6-31g+(d).log.xz

000175131.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175131.td-b3lyp_6-31+g(d).gjf (generated)

000175131.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175131.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175131.mol 000175131.PUBCHEM 000175131.mol (via Jmol)
000175135.b3lyp_6-31g(d).inp

000175135.b3lyp_6-31g(d).qchem.inp (generated)

000175135.b3lyp_6-31g(d).gjf (generated)

000175135.b3lyp_6-31g(d).firefly.inp (generated)

000175135.b3lyp_6-31g(d).smash.inp (generated)

000175135.b3lyp_6-31g(d).nwchem.inp (generated) 000175135.b3lyp_6-31g(d).log.xz 000175135.td-b3lyp_6-31g+(d).inp 000175135.td-b3lyp_6-31g+(d).log.xz

000175135.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175135.td-b3lyp_6-31+g(d).gjf (generated)

000175135.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175135.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175135.mol 000175135.PUBCHEM 000175135.mol (via Jmol)
000175155.b3lyp_6-31g(d).inp

000175155.b3lyp_6-31g(d).qchem.inp (generated)

000175155.b3lyp_6-31g(d).gjf (generated)

000175155.b3lyp_6-31g(d).firefly.inp (generated)

000175155.b3lyp_6-31g(d).smash.inp (generated)

000175155.b3lyp_6-31g(d).nwchem.inp (generated) 000175155.b3lyp_6-31g(d).log.xz 000175155.td-b3lyp_6-31g+(d).inp 000175155.td-b3lyp_6-31g+(d).log.xz

000175155.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175155.td-b3lyp_6-31+g(d).gjf (generated)

000175155.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175155.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175155.mol 000175155.PUBCHEM 000175155.mol (via Jmol)
000175158.b3lyp_6-31g(d).inp

000175158.b3lyp_6-31g(d).qchem.inp (generated)

000175158.b3lyp_6-31g(d).gjf (generated)

000175158.b3lyp_6-31g(d).firefly.inp (generated)

000175158.b3lyp_6-31g(d).smash.inp (generated)

000175158.b3lyp_6-31g(d).nwchem.inp (generated) 000175158.b3lyp_6-31g(d).log.xz 000175158.mol 000175158.PUBCHEM 000175158.mol (via Jmol)
000175159.b3lyp_6-31g(d).inp

000175159.b3lyp_6-31g(d).qchem.inp (generated)

000175159.b3lyp_6-31g(d).gjf (generated)

000175159.b3lyp_6-31g(d).firefly.inp (generated)

000175159.b3lyp_6-31g(d).smash.inp (generated)

000175159.b3lyp_6-31g(d).nwchem.inp (generated) 000175159.b3lyp_6-31g(d).log.xz 000175159.td-b3lyp_6-31g+(d).inp 000175159.td-b3lyp_6-31g+(d).log.xz

000175159.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175159.td-b3lyp_6-31+g(d).gjf (generated)

000175159.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175159.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175159.mol 000175159.PUBCHEM 000175159.mol (via Jmol)
000175170.b3lyp_6-31g(d).inp

000175170.b3lyp_6-31g(d).qchem.inp (generated)

000175170.b3lyp_6-31g(d).gjf (generated)

000175170.b3lyp_6-31g(d).firefly.inp (generated)

000175170.b3lyp_6-31g(d).smash.inp (generated)

000175170.b3lyp_6-31g(d).nwchem.inp (generated) 000175170.b3lyp_6-31g(d).log.xz 000175170.td-b3lyp_6-31g+(d).inp 000175170.td-b3lyp_6-31g+(d).log.xz

000175170.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175170.td-b3lyp_6-31+g(d).gjf (generated)

000175170.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175170.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175170.mol 000175170.PUBCHEM 000175170.mol (via Jmol)
000175173.b3lyp_6-31g(d).inp

000175173.b3lyp_6-31g(d).qchem.inp (generated)

000175173.b3lyp_6-31g(d).gjf (generated)

000175173.b3lyp_6-31g(d).firefly.inp (generated)

000175173.b3lyp_6-31g(d).smash.inp (generated)

000175173.b3lyp_6-31g(d).nwchem.inp (generated) 000175173.b3lyp_6-31g(d).log.xz 000175173.td-b3lyp_6-31g+(d).inp 000175173.td-b3lyp_6-31g+(d).log.xz

000175173.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175173.td-b3lyp_6-31+g(d).gjf (generated)

000175173.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175173.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175173.mol 000175173.PUBCHEM 000175173.mol (via Jmol)
000175211.b3lyp_6-31g(d).inp

000175211.b3lyp_6-31g(d).qchem.inp (generated)

000175211.b3lyp_6-31g(d).gjf (generated)

000175211.b3lyp_6-31g(d).firefly.inp (generated)

000175211.b3lyp_6-31g(d).smash.inp (generated)

000175211.b3lyp_6-31g(d).nwchem.inp (generated) 000175211.b3lyp_6-31g(d).log.xz 000175211.td-b3lyp_6-31g+(d).inp 000175211.td-b3lyp_6-31g+(d).log.xz

000175211.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175211.td-b3lyp_6-31+g(d).gjf (generated)

000175211.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175211.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175211.mol 000175211.PUBCHEM 000175211.mol (via Jmol)
000175212.b3lyp_6-31g(d).inp

000175212.b3lyp_6-31g(d).qchem.inp (generated)

000175212.b3lyp_6-31g(d).gjf (generated)

000175212.b3lyp_6-31g(d).firefly.inp (generated)

000175212.b3lyp_6-31g(d).smash.inp (generated)

000175212.b3lyp_6-31g(d).nwchem.inp (generated) 000175212.b3lyp_6-31g(d).log.xz 000175212.td-b3lyp_6-31g+(d).inp 000175212.td-b3lyp_6-31g+(d).log.xz

000175212.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175212.td-b3lyp_6-31+g(d).gjf (generated)

000175212.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175212.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175212.mol 000175212.PUBCHEM 000175212.mol (via Jmol)
000175213.b3lyp_6-31g(d).inp

000175213.b3lyp_6-31g(d).qchem.inp (generated)

000175213.b3lyp_6-31g(d).gjf (generated)

000175213.b3lyp_6-31g(d).firefly.inp (generated)

000175213.b3lyp_6-31g(d).smash.inp (generated)

000175213.b3lyp_6-31g(d).nwchem.inp (generated) 000175213.b3lyp_6-31g(d).log.xz 000175213.td-b3lyp_6-31g+(d).inp 000175213.td-b3lyp_6-31g+(d).log.xz

000175213.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175213.td-b3lyp_6-31+g(d).gjf (generated)

000175213.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175213.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175213.mol 000175213.PUBCHEM 000175213.mol (via Jmol)
000175215.b3lyp_6-31g(d).inp

000175215.b3lyp_6-31g(d).qchem.inp (generated)

000175215.b3lyp_6-31g(d).gjf (generated)

000175215.b3lyp_6-31g(d).firefly.inp (generated)

000175215.b3lyp_6-31g(d).smash.inp (generated)

000175215.b3lyp_6-31g(d).nwchem.inp (generated) 000175215.b3lyp_6-31g(d).log.xz 000175215.mol 000175215.PUBCHEM 000175215.mol (via Jmol)
000175216.b3lyp_6-31g(d).inp

000175216.b3lyp_6-31g(d).qchem.inp (generated)

000175216.b3lyp_6-31g(d).gjf (generated)

000175216.b3lyp_6-31g(d).firefly.inp (generated)

000175216.b3lyp_6-31g(d).smash.inp (generated)

000175216.b3lyp_6-31g(d).nwchem.inp (generated) 000175216.b3lyp_6-31g(d).log.xz 000175216.td-b3lyp_6-31g+(d).inp 000175216.td-b3lyp_6-31g+(d).log.xz

000175216.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175216.td-b3lyp_6-31+g(d).gjf (generated)

000175216.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175216.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175216.mol 000175216.PUBCHEM 000175216.mol (via Jmol)
000175220.b3lyp_6-31g(d).inp

000175220.b3lyp_6-31g(d).qchem.inp (generated)

000175220.b3lyp_6-31g(d).gjf (generated)

000175220.b3lyp_6-31g(d).firefly.inp (generated)

000175220.b3lyp_6-31g(d).smash.inp (generated)

000175220.b3lyp_6-31g(d).nwchem.inp (generated) 000175220.b3lyp_6-31g(d).log.xz 000175220.td-b3lyp_6-31g+(d).inp 000175220.td-b3lyp_6-31g+(d).log.xz

000175220.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175220.td-b3lyp_6-31+g(d).gjf (generated)

000175220.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175220.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175220.mol 000175220.PUBCHEM 000175220.mol (via Jmol)
000175230.b3lyp_6-31g(d).inp

000175230.b3lyp_6-31g(d).qchem.inp (generated)

000175230.b3lyp_6-31g(d).gjf (generated)

000175230.b3lyp_6-31g(d).firefly.inp (generated)

000175230.b3lyp_6-31g(d).smash.inp (generated)

000175230.b3lyp_6-31g(d).nwchem.inp (generated) 000175230.b3lyp_6-31g(d).log.xz 000175230.td-b3lyp_6-31g+(d).inp 000175230.td-b3lyp_6-31g+(d).log.xz

000175230.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175230.td-b3lyp_6-31+g(d).gjf (generated)

000175230.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175230.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175230.mol 000175230.PUBCHEM 000175230.mol (via Jmol)
000175266.b3lyp_6-31g(d).inp

000175266.b3lyp_6-31g(d).qchem.inp (generated)

000175266.b3lyp_6-31g(d).gjf (generated)

000175266.b3lyp_6-31g(d).firefly.inp (generated)

000175266.b3lyp_6-31g(d).smash.inp (generated)

000175266.b3lyp_6-31g(d).nwchem.inp (generated) 000175266.b3lyp_6-31g(d).log.xz 000175266.td-b3lyp_6-31g+(d).inp 000175266.td-b3lyp_6-31g+(d).log.xz

000175266.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175266.td-b3lyp_6-31+g(d).gjf (generated)

000175266.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175266.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175266.mol 000175266.PUBCHEM 000175266.mol (via Jmol)
000175272.b3lyp_6-31g(d).inp

000175272.b3lyp_6-31g(d).qchem.inp (generated)

000175272.b3lyp_6-31g(d).gjf (generated)

000175272.b3lyp_6-31g(d).firefly.inp (generated)

000175272.b3lyp_6-31g(d).smash.inp (generated)

000175272.b3lyp_6-31g(d).nwchem.inp (generated) 000175272.b3lyp_6-31g(d).log.xz 000175272.td-b3lyp_6-31g+(d).inp 000175272.td-b3lyp_6-31g+(d).log.xz

000175272.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175272.td-b3lyp_6-31+g(d).gjf (generated)

000175272.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175272.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175272.mol 000175272.PUBCHEM 000175272.mol (via Jmol)
000175273.b3lyp_6-31g(d).inp

000175273.b3lyp_6-31g(d).qchem.inp (generated)

000175273.b3lyp_6-31g(d).gjf (generated)

000175273.b3lyp_6-31g(d).firefly.inp (generated)

000175273.b3lyp_6-31g(d).smash.inp (generated)

000175273.b3lyp_6-31g(d).nwchem.inp (generated) 000175273.b3lyp_6-31g(d).log.xz 000175273.td-b3lyp_6-31g+(d).inp 000175273.td-b3lyp_6-31g+(d).log.xz

000175273.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175273.td-b3lyp_6-31+g(d).gjf (generated)

000175273.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175273.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175273.mol 000175273.PUBCHEM 000175273.mol (via Jmol)
000175282.b3lyp_6-31g(d).inp

000175282.b3lyp_6-31g(d).qchem.inp (generated)

000175282.b3lyp_6-31g(d).gjf (generated)

000175282.b3lyp_6-31g(d).firefly.inp (generated)

000175282.b3lyp_6-31g(d).smash.inp (generated)

000175282.b3lyp_6-31g(d).nwchem.inp (generated) 000175282.b3lyp_6-31g(d).log.xz 000175282.td-b3lyp_6-31g+(d).inp 000175282.td-b3lyp_6-31g+(d).log.xz

000175282.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175282.td-b3lyp_6-31+g(d).gjf (generated)

000175282.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175282.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175282.mol 000175282.PUBCHEM 000175282.mol (via Jmol)
000175285.b3lyp_6-31g(d).inp

000175285.b3lyp_6-31g(d).qchem.inp (generated)

000175285.b3lyp_6-31g(d).gjf (generated)

000175285.b3lyp_6-31g(d).firefly.inp (generated)

000175285.b3lyp_6-31g(d).smash.inp (generated)

000175285.b3lyp_6-31g(d).nwchem.inp (generated) 000175285.b3lyp_6-31g(d).log.xz 000175285.td-b3lyp_6-31g+(d).inp 000175285.td-b3lyp_6-31g+(d).log.xz

000175285.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175285.td-b3lyp_6-31+g(d).gjf (generated)

000175285.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175285.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175285.mol 000175285.PUBCHEM 000175285.mol (via Jmol)
000175286.b3lyp_6-31g(d).inp

000175286.b3lyp_6-31g(d).qchem.inp (generated)

000175286.b3lyp_6-31g(d).gjf (generated)

000175286.b3lyp_6-31g(d).firefly.inp (generated)

000175286.b3lyp_6-31g(d).smash.inp (generated)

000175286.b3lyp_6-31g(d).nwchem.inp (generated) 000175286.b3lyp_6-31g(d).log.xz 000175286.td-b3lyp_6-31g+(d).inp 000175286.td-b3lyp_6-31g+(d).log.xz

000175286.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175286.td-b3lyp_6-31+g(d).gjf (generated)

000175286.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175286.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175286.mol 000175286.PUBCHEM 000175286.mol (via Jmol)
000175289.b3lyp_6-31g(d).inp

000175289.b3lyp_6-31g(d).qchem.inp (generated)

000175289.b3lyp_6-31g(d).gjf (generated)

000175289.b3lyp_6-31g(d).firefly.inp (generated)

000175289.b3lyp_6-31g(d).smash.inp (generated)

000175289.b3lyp_6-31g(d).nwchem.inp (generated) 000175289.b3lyp_6-31g(d).log.xz 000175289.td-b3lyp_6-31g+(d).inp 000175289.td-b3lyp_6-31g+(d).log.xz

000175289.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175289.td-b3lyp_6-31+g(d).gjf (generated)

000175289.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175289.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175289.mol 000175289.PUBCHEM 000175289.mol (via Jmol)
000175290.b3lyp_6-31g(d).inp

000175290.b3lyp_6-31g(d).qchem.inp (generated)

000175290.b3lyp_6-31g(d).gjf (generated)

000175290.b3lyp_6-31g(d).firefly.inp (generated)

000175290.b3lyp_6-31g(d).smash.inp (generated)

000175290.b3lyp_6-31g(d).nwchem.inp (generated) 000175290.b3lyp_6-31g(d).log.xz 000175290.td-b3lyp_6-31g+(d).inp 000175290.td-b3lyp_6-31g+(d).log.xz

000175290.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175290.td-b3lyp_6-31+g(d).gjf (generated)

000175290.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175290.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175290.mol 000175290.PUBCHEM 000175290.mol (via Jmol)
000175291.b3lyp_6-31g(d).inp

000175291.b3lyp_6-31g(d).qchem.inp (generated)

000175291.b3lyp_6-31g(d).gjf (generated)

000175291.b3lyp_6-31g(d).firefly.inp (generated)

000175291.b3lyp_6-31g(d).smash.inp (generated)

000175291.b3lyp_6-31g(d).nwchem.inp (generated) 000175291.b3lyp_6-31g(d).log.xz 000175291.td-b3lyp_6-31g+(d).inp 000175291.td-b3lyp_6-31g+(d).log.xz

000175291.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175291.td-b3lyp_6-31+g(d).gjf (generated)

000175291.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175291.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175291.mol 000175291.PUBCHEM 000175291.mol (via Jmol)
000175292.b3lyp_6-31g(d).inp

000175292.b3lyp_6-31g(d).qchem.inp (generated)

000175292.b3lyp_6-31g(d).gjf (generated)

000175292.b3lyp_6-31g(d).firefly.inp (generated)

000175292.b3lyp_6-31g(d).smash.inp (generated)

000175292.b3lyp_6-31g(d).nwchem.inp (generated) 000175292.b3lyp_6-31g(d).log.xz 000175292.td-b3lyp_6-31g+(d).inp 000175292.td-b3lyp_6-31g+(d).log.xz

000175292.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175292.td-b3lyp_6-31+g(d).gjf (generated)

000175292.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175292.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175292.mol 000175292.PUBCHEM 000175292.mol (via Jmol)
000175296.b3lyp_6-31g(d).inp

000175296.b3lyp_6-31g(d).qchem.inp (generated)

000175296.b3lyp_6-31g(d).gjf (generated)

000175296.b3lyp_6-31g(d).firefly.inp (generated)

000175296.b3lyp_6-31g(d).smash.inp (generated)

000175296.b3lyp_6-31g(d).nwchem.inp (generated) 000175296.b3lyp_6-31g(d).log.xz 000175296.td-b3lyp_6-31g+(d).inp 000175296.td-b3lyp_6-31g+(d).log.xz

000175296.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175296.td-b3lyp_6-31+g(d).gjf (generated)

000175296.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175296.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175296.mol 000175296.PUBCHEM 000175296.mol (via Jmol)
000175297.b3lyp_6-31g(d).inp

000175297.b3lyp_6-31g(d).qchem.inp (generated)

000175297.b3lyp_6-31g(d).gjf (generated)

000175297.b3lyp_6-31g(d).firefly.inp (generated)

000175297.b3lyp_6-31g(d).smash.inp (generated)

000175297.b3lyp_6-31g(d).nwchem.inp (generated) 000175297.b3lyp_6-31g(d).log.xz 000175297.td-b3lyp_6-31g+(d).inp 000175297.td-b3lyp_6-31g+(d).log.xz

000175297.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175297.td-b3lyp_6-31+g(d).gjf (generated)

000175297.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175297.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175297.mol 000175297.PUBCHEM 000175297.mol (via Jmol)
000175299.b3lyp_6-31g(d).inp

000175299.b3lyp_6-31g(d).qchem.inp (generated)

000175299.b3lyp_6-31g(d).gjf (generated)

000175299.b3lyp_6-31g(d).firefly.inp (generated)

000175299.b3lyp_6-31g(d).smash.inp (generated)

000175299.b3lyp_6-31g(d).nwchem.inp (generated) 000175299.b3lyp_6-31g(d).log.xz 000175299.td-b3lyp_6-31g+(d).inp 000175299.td-b3lyp_6-31g+(d).log.xz

000175299.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175299.td-b3lyp_6-31+g(d).gjf (generated)

000175299.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175299.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175299.mol 000175299.PUBCHEM 000175299.mol (via Jmol)
000175300.b3lyp_6-31g(d).inp

000175300.b3lyp_6-31g(d).qchem.inp (generated)

000175300.b3lyp_6-31g(d).gjf (generated)

000175300.b3lyp_6-31g(d).firefly.inp (generated)

000175300.b3lyp_6-31g(d).smash.inp (generated)

000175300.b3lyp_6-31g(d).nwchem.inp (generated) 000175300.b3lyp_6-31g(d).log.xz 000175300.td-b3lyp_6-31g+(d).inp 000175300.td-b3lyp_6-31g+(d).log.xz

000175300.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175300.td-b3lyp_6-31+g(d).gjf (generated)

000175300.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175300.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175300.mol 000175300.PUBCHEM 000175300.mol (via Jmol)
000175301.b3lyp_6-31g(d).inp

000175301.b3lyp_6-31g(d).qchem.inp (generated)

000175301.b3lyp_6-31g(d).gjf (generated)

000175301.b3lyp_6-31g(d).firefly.inp (generated)

000175301.b3lyp_6-31g(d).smash.inp (generated)

000175301.b3lyp_6-31g(d).nwchem.inp (generated) 000175301.b3lyp_6-31g(d).log.xz 000175301.td-b3lyp_6-31g+(d).inp 000175301.td-b3lyp_6-31g+(d).log.xz

000175301.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175301.td-b3lyp_6-31+g(d).gjf (generated)

000175301.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175301.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175301.mol 000175301.PUBCHEM 000175301.mol (via Jmol)
000175305.b3lyp_6-31g(d).inp

000175305.b3lyp_6-31g(d).qchem.inp (generated)

000175305.b3lyp_6-31g(d).gjf (generated)

000175305.b3lyp_6-31g(d).firefly.inp (generated)

000175305.b3lyp_6-31g(d).smash.inp (generated)

000175305.b3lyp_6-31g(d).nwchem.inp (generated) 000175305.b3lyp_6-31g(d).log.xz 000175305.td-b3lyp_6-31g+(d).inp 000175305.td-b3lyp_6-31g+(d).log.xz

000175305.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175305.td-b3lyp_6-31+g(d).gjf (generated)

000175305.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175305.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175305.mol 000175305.PUBCHEM 000175305.mol (via Jmol)
000175306.b3lyp_6-31g(d).inp

000175306.b3lyp_6-31g(d).qchem.inp (generated)

000175306.b3lyp_6-31g(d).gjf (generated)

000175306.b3lyp_6-31g(d).firefly.inp (generated)

000175306.b3lyp_6-31g(d).smash.inp (generated)

000175306.b3lyp_6-31g(d).nwchem.inp (generated) 000175306.b3lyp_6-31g(d).log.xz 000175306.td-b3lyp_6-31g+(d).inp 000175306.td-b3lyp_6-31g+(d).log.xz

000175306.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175306.td-b3lyp_6-31+g(d).gjf (generated)

000175306.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175306.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175306.mol 000175306.PUBCHEM 000175306.mol (via Jmol)
000175307.b3lyp_6-31g(d).inp

000175307.b3lyp_6-31g(d).qchem.inp (generated)

000175307.b3lyp_6-31g(d).gjf (generated)

000175307.b3lyp_6-31g(d).firefly.inp (generated)

000175307.b3lyp_6-31g(d).smash.inp (generated)

000175307.b3lyp_6-31g(d).nwchem.inp (generated) 000175307.b3lyp_6-31g(d).log.xz 000175307.td-b3lyp_6-31g+(d).inp 000175307.td-b3lyp_6-31g+(d).log.xz

000175307.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175307.td-b3lyp_6-31+g(d).gjf (generated)

000175307.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175307.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175307.mol 000175307.PUBCHEM 000175307.mol (via Jmol)
000175328.b3lyp_6-31g(d).inp

000175328.b3lyp_6-31g(d).qchem.inp (generated)

000175328.b3lyp_6-31g(d).gjf (generated)

000175328.b3lyp_6-31g(d).firefly.inp (generated)

000175328.b3lyp_6-31g(d).smash.inp (generated)

000175328.b3lyp_6-31g(d).nwchem.inp (generated) 000175328.b3lyp_6-31g(d).log.xz 000175328.td-b3lyp_6-31g+(d).inp 000175328.td-b3lyp_6-31g+(d).log.xz

000175328.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175328.td-b3lyp_6-31+g(d).gjf (generated)

000175328.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175328.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175328.mol 000175328.PUBCHEM 000175328.mol (via Jmol)
000175347.b3lyp_6-31g(d).inp

000175347.b3lyp_6-31g(d).qchem.inp (generated)

000175347.b3lyp_6-31g(d).gjf (generated)

000175347.b3lyp_6-31g(d).firefly.inp (generated)

000175347.b3lyp_6-31g(d).smash.inp (generated)

000175347.b3lyp_6-31g(d).nwchem.inp (generated) 000175347.b3lyp_6-31g(d).log.xz 000175347.td-b3lyp_6-31g+(d).inp 000175347.td-b3lyp_6-31g+(d).log.xz

000175347.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175347.td-b3lyp_6-31+g(d).gjf (generated)

000175347.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175347.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175347.mol 000175347.PUBCHEM 000175347.mol (via Jmol)
000175359.b3lyp_6-31g(d).inp

000175359.b3lyp_6-31g(d).qchem.inp (generated)

000175359.b3lyp_6-31g(d).gjf (generated)

000175359.b3lyp_6-31g(d).firefly.inp (generated)

000175359.b3lyp_6-31g(d).smash.inp (generated)

000175359.b3lyp_6-31g(d).nwchem.inp (generated) 000175359.b3lyp_6-31g(d).log.xz 000175359.td-b3lyp_6-31g+(d).inp 000175359.td-b3lyp_6-31g+(d).log.xz

000175359.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175359.td-b3lyp_6-31+g(d).gjf (generated)

000175359.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175359.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175359.mol 000175359.PUBCHEM 000175359.mol (via Jmol)
000175363.b3lyp_6-31g(d).inp

000175363.b3lyp_6-31g(d).qchem.inp (generated)

000175363.b3lyp_6-31g(d).gjf (generated)

000175363.b3lyp_6-31g(d).firefly.inp (generated)

000175363.b3lyp_6-31g(d).smash.inp (generated)

000175363.b3lyp_6-31g(d).nwchem.inp (generated) 000175363.b3lyp_6-31g(d).log.xz 000175363.td-b3lyp_6-31g+(d).inp 000175363.td-b3lyp_6-31g+(d).log.xz

000175363.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175363.td-b3lyp_6-31+g(d).gjf (generated)

000175363.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175363.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175363.mol 000175363.PUBCHEM 000175363.mol (via Jmol)
000175364.b3lyp_6-31g(d).inp

000175364.b3lyp_6-31g(d).qchem.inp (generated)

000175364.b3lyp_6-31g(d).gjf (generated)

000175364.b3lyp_6-31g(d).firefly.inp (generated)

000175364.b3lyp_6-31g(d).smash.inp (generated)

000175364.b3lyp_6-31g(d).nwchem.inp (generated) 000175364.b3lyp_6-31g(d).log.xz 000175364.td-b3lyp_6-31g+(d).inp 000175364.td-b3lyp_6-31g+(d).log.xz

000175364.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175364.td-b3lyp_6-31+g(d).gjf (generated)

000175364.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175364.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175364.mol 000175364.PUBCHEM 000175364.mol (via Jmol)
000175365.b3lyp_6-31g(d).inp

000175365.b3lyp_6-31g(d).qchem.inp (generated)

000175365.b3lyp_6-31g(d).gjf (generated)

000175365.b3lyp_6-31g(d).firefly.inp (generated)

000175365.b3lyp_6-31g(d).smash.inp (generated)

000175365.b3lyp_6-31g(d).nwchem.inp (generated) 000175365.b3lyp_6-31g(d).log.xz 000175365.td-b3lyp_6-31g+(d).inp 000175365.td-b3lyp_6-31g+(d).log.xz

000175365.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175365.td-b3lyp_6-31+g(d).gjf (generated)

000175365.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175365.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175365.mol 000175365.PUBCHEM 000175365.mol (via Jmol)
000175366.b3lyp_6-31g(d).inp

000175366.b3lyp_6-31g(d).qchem.inp (generated)

000175366.b3lyp_6-31g(d).gjf (generated)

000175366.b3lyp_6-31g(d).firefly.inp (generated)

000175366.b3lyp_6-31g(d).smash.inp (generated)

000175366.b3lyp_6-31g(d).nwchem.inp (generated) 000175366.b3lyp_6-31g(d).log.xz 000175366.td-b3lyp_6-31g+(d).inp 000175366.td-b3lyp_6-31g+(d).log.xz

000175366.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175366.td-b3lyp_6-31+g(d).gjf (generated)

000175366.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175366.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175366.mol 000175366.PUBCHEM 000175366.mol (via Jmol)
000175372.b3lyp_6-31g(d).inp

000175372.b3lyp_6-31g(d).qchem.inp (generated)

000175372.b3lyp_6-31g(d).gjf (generated)

000175372.b3lyp_6-31g(d).firefly.inp (generated)

000175372.b3lyp_6-31g(d).smash.inp (generated)

000175372.b3lyp_6-31g(d).nwchem.inp (generated) 000175372.b3lyp_6-31g(d).log.xz 000175372.td-b3lyp_6-31g+(d).inp 000175372.td-b3lyp_6-31g+(d).log.xz

000175372.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175372.td-b3lyp_6-31+g(d).gjf (generated)

000175372.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175372.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175372.mol 000175372.PUBCHEM 000175372.mol (via Jmol)
000175394.b3lyp_6-31g(d).inp

000175394.b3lyp_6-31g(d).qchem.inp (generated)

000175394.b3lyp_6-31g(d).gjf (generated)

000175394.b3lyp_6-31g(d).firefly.inp (generated)

000175394.b3lyp_6-31g(d).smash.inp (generated)

000175394.b3lyp_6-31g(d).nwchem.inp (generated) 000175394.b3lyp_6-31g(d).log.xz 000175394.td-b3lyp_6-31g+(d).inp 000175394.td-b3lyp_6-31g+(d).log.xz

000175394.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175394.td-b3lyp_6-31+g(d).gjf (generated)

000175394.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175394.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175394.mol 000175394.PUBCHEM 000175394.mol (via Jmol)
000175400.b3lyp_6-31g(d).inp

000175400.b3lyp_6-31g(d).qchem.inp (generated)

000175400.b3lyp_6-31g(d).gjf (generated)

000175400.b3lyp_6-31g(d).firefly.inp (generated)

000175400.b3lyp_6-31g(d).smash.inp (generated)

000175400.b3lyp_6-31g(d).nwchem.inp (generated) 000175400.b3lyp_6-31g(d).log.xz 000175400.td-b3lyp_6-31g+(d).inp 000175400.td-b3lyp_6-31g+(d).log.xz

000175400.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175400.td-b3lyp_6-31+g(d).gjf (generated)

000175400.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175400.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175400.mol 000175400.PUBCHEM 000175400.mol (via Jmol)
000175445.b3lyp_6-31g(d).inp

000175445.b3lyp_6-31g(d).qchem.inp (generated)

000175445.b3lyp_6-31g(d).gjf (generated)

000175445.b3lyp_6-31g(d).firefly.inp (generated)

000175445.b3lyp_6-31g(d).smash.inp (generated)

000175445.b3lyp_6-31g(d).nwchem.inp (generated) 000175445.b3lyp_6-31g(d).log.xz 000175445.td-b3lyp_6-31g+(d).inp 000175445.td-b3lyp_6-31g+(d).log.xz

000175445.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175445.td-b3lyp_6-31+g(d).gjf (generated)

000175445.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175445.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175445.mol 000175445.PUBCHEM 000175445.mol (via Jmol)
000175460.b3lyp_6-31g(d).inp

000175460.b3lyp_6-31g(d).qchem.inp (generated)

000175460.b3lyp_6-31g(d).gjf (generated)

000175460.b3lyp_6-31g(d).firefly.inp (generated)

000175460.b3lyp_6-31g(d).smash.inp (generated)

000175460.b3lyp_6-31g(d).nwchem.inp (generated) 000175460.b3lyp_6-31g(d).log.xz 000175460.td-b3lyp_6-31g+(d).inp 000175460.td-b3lyp_6-31g+(d).log.xz

000175460.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175460.td-b3lyp_6-31+g(d).gjf (generated)

000175460.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175460.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175460.mol 000175460.PUBCHEM 000175460.mol (via Jmol)
000175477.b3lyp_6-31g(d).inp

000175477.b3lyp_6-31g(d).qchem.inp (generated)

000175477.b3lyp_6-31g(d).gjf (generated)

000175477.b3lyp_6-31g(d).firefly.inp (generated)

000175477.b3lyp_6-31g(d).smash.inp (generated)

000175477.b3lyp_6-31g(d).nwchem.inp (generated) 000175477.b3lyp_6-31g(d).log.xz 000175477.td-b3lyp_6-31g+(d).inp 000175477.td-b3lyp_6-31g+(d).log.xz

000175477.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175477.td-b3lyp_6-31+g(d).gjf (generated)

000175477.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175477.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175477.mol 000175477.PUBCHEM 000175477.mol (via Jmol)
000175482.b3lyp_6-31g(d).inp

000175482.b3lyp_6-31g(d).qchem.inp (generated)

000175482.b3lyp_6-31g(d).gjf (generated)

000175482.b3lyp_6-31g(d).firefly.inp (generated)

000175482.b3lyp_6-31g(d).smash.inp (generated)

000175482.b3lyp_6-31g(d).nwchem.inp (generated) 000175482.b3lyp_6-31g(d).log.xz 000175482.td-b3lyp_6-31g+(d).inp 000175482.td-b3lyp_6-31g+(d).log.xz

000175482.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175482.td-b3lyp_6-31+g(d).gjf (generated)

000175482.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175482.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175482.mol 000175482.PUBCHEM 000175482.mol (via Jmol)
000175483.b3lyp_6-31g(d).inp

000175483.b3lyp_6-31g(d).qchem.inp (generated)

000175483.b3lyp_6-31g(d).gjf (generated)

000175483.b3lyp_6-31g(d).firefly.inp (generated)

000175483.b3lyp_6-31g(d).smash.inp (generated)

000175483.b3lyp_6-31g(d).nwchem.inp (generated) 000175483.b3lyp_6-31g(d).log.xz 000175483.mol 000175483.PUBCHEM 000175483.mol (via Jmol)
000175484.b3lyp_6-31g(d).inp

000175484.b3lyp_6-31g(d).qchem.inp (generated)

000175484.b3lyp_6-31g(d).gjf (generated)

000175484.b3lyp_6-31g(d).firefly.inp (generated)

000175484.b3lyp_6-31g(d).smash.inp (generated)

000175484.b3lyp_6-31g(d).nwchem.inp (generated) 000175484.b3lyp_6-31g(d).log.xz 000175484.mol 000175484.PUBCHEM 000175484.mol (via Jmol)
000175496.b3lyp_6-31g(d).inp

000175496.b3lyp_6-31g(d).qchem.inp (generated)

000175496.b3lyp_6-31g(d).gjf (generated)

000175496.b3lyp_6-31g(d).firefly.inp (generated)

000175496.b3lyp_6-31g(d).smash.inp (generated)

000175496.b3lyp_6-31g(d).nwchem.inp (generated) 000175496.b3lyp_6-31g(d).log.xz 000175496.td-b3lyp_6-31g+(d).inp 000175496.td-b3lyp_6-31g+(d).log.xz

000175496.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175496.td-b3lyp_6-31+g(d).gjf (generated)

000175496.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175496.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175496.mol 000175496.PUBCHEM 000175496.mol (via Jmol)
000175515.b3lyp_6-31g(d).inp

000175515.b3lyp_6-31g(d).qchem.inp (generated)

000175515.b3lyp_6-31g(d).gjf (generated)

000175515.b3lyp_6-31g(d).firefly.inp (generated)

000175515.b3lyp_6-31g(d).smash.inp (generated)

000175515.b3lyp_6-31g(d).nwchem.inp (generated) 000175515.b3lyp_6-31g(d).log.xz 000175515.mol 000175515.PUBCHEM 000175515.mol (via Jmol)
000175522.b3lyp_6-31g(d).inp

000175522.b3lyp_6-31g(d).qchem.inp (generated)

000175522.b3lyp_6-31g(d).gjf (generated)

000175522.b3lyp_6-31g(d).firefly.inp (generated)

000175522.b3lyp_6-31g(d).smash.inp (generated)

000175522.b3lyp_6-31g(d).nwchem.inp (generated) 000175522.b3lyp_6-31g(d).log.xz 000175522.td-b3lyp_6-31g+(d).inp 000175522.td-b3lyp_6-31g+(d).log.xz

000175522.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175522.td-b3lyp_6-31+g(d).gjf (generated)

000175522.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175522.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175522.mol 000175522.PUBCHEM 000175522.mol (via Jmol)
000175535.b3lyp_6-31g(d).inp

000175535.b3lyp_6-31g(d).qchem.inp (generated)

000175535.b3lyp_6-31g(d).gjf (generated)

000175535.b3lyp_6-31g(d).firefly.inp (generated)

000175535.b3lyp_6-31g(d).smash.inp (generated)

000175535.b3lyp_6-31g(d).nwchem.inp (generated) 000175535.b3lyp_6-31g(d).log.xz 000175535.mol 000175535.PUBCHEM 000175535.mol (via Jmol)
000175538.b3lyp_6-31g(d).inp

000175538.b3lyp_6-31g(d).qchem.inp (generated)

000175538.b3lyp_6-31g(d).gjf (generated)

000175538.b3lyp_6-31g(d).firefly.inp (generated)

000175538.b3lyp_6-31g(d).smash.inp (generated)

000175538.b3lyp_6-31g(d).nwchem.inp (generated) 000175538.b3lyp_6-31g(d).log.xz 000175538.td-b3lyp_6-31g+(d).inp 000175538.td-b3lyp_6-31g+(d).log.xz

000175538.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175538.td-b3lyp_6-31+g(d).gjf (generated)

000175538.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175538.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175538.mol 000175538.PUBCHEM 000175538.mol (via Jmol)
000175549.b3lyp_6-31g(d).inp

000175549.b3lyp_6-31g(d).qchem.inp (generated)

000175549.b3lyp_6-31g(d).gjf (generated)

000175549.b3lyp_6-31g(d).firefly.inp (generated)

000175549.b3lyp_6-31g(d).smash.inp (generated)

000175549.b3lyp_6-31g(d).nwchem.inp (generated) 000175549.b3lyp_6-31g(d).log.xz 000175549.td-b3lyp_6-31g+(d).inp 000175549.td-b3lyp_6-31g+(d).log.xz

000175549.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175549.td-b3lyp_6-31+g(d).gjf (generated)

000175549.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175549.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175549.mol 000175549.PUBCHEM 000175549.mol (via Jmol)
000175560.b3lyp_6-31g(d).inp

000175560.b3lyp_6-31g(d).qchem.inp (generated)

000175560.b3lyp_6-31g(d).gjf (generated)

000175560.b3lyp_6-31g(d).firefly.inp (generated)

000175560.b3lyp_6-31g(d).smash.inp (generated)

000175560.b3lyp_6-31g(d).nwchem.inp (generated) 000175560.b3lyp_6-31g(d).log.xz 000175560.td-b3lyp_6-31g+(d).inp 000175560.td-b3lyp_6-31g+(d).log.xz

000175560.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175560.td-b3lyp_6-31+g(d).gjf (generated)

000175560.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175560.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175560.mol 000175560.PUBCHEM 000175560.mol (via Jmol)
000175562.b3lyp_6-31g(d).inp

000175562.b3lyp_6-31g(d).qchem.inp (generated)

000175562.b3lyp_6-31g(d).gjf (generated)

000175562.b3lyp_6-31g(d).firefly.inp (generated)

000175562.b3lyp_6-31g(d).smash.inp (generated)

000175562.b3lyp_6-31g(d).nwchem.inp (generated) 000175562.b3lyp_6-31g(d).log.xz 000175562.td-b3lyp_6-31g+(d).inp 000175562.td-b3lyp_6-31g+(d).log.xz

000175562.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175562.td-b3lyp_6-31+g(d).gjf (generated)

000175562.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175562.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175562.mol 000175562.PUBCHEM 000175562.mol (via Jmol)
000175572.b3lyp_6-31g(d).inp

000175572.b3lyp_6-31g(d).qchem.inp (generated)

000175572.b3lyp_6-31g(d).gjf (generated)

000175572.b3lyp_6-31g(d).firefly.inp (generated)

000175572.b3lyp_6-31g(d).smash.inp (generated)

000175572.b3lyp_6-31g(d).nwchem.inp (generated) 000175572.b3lyp_6-31g(d).log.xz 000175572.td-b3lyp_6-31g+(d).inp 000175572.td-b3lyp_6-31g+(d).log.xz

000175572.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175572.td-b3lyp_6-31+g(d).gjf (generated)

000175572.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175572.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175572.mol 000175572.PUBCHEM 000175572.mol (via Jmol)
000175576.b3lyp_6-31g(d).inp

000175576.b3lyp_6-31g(d).qchem.inp (generated)

000175576.b3lyp_6-31g(d).gjf (generated)

000175576.b3lyp_6-31g(d).firefly.inp (generated)

000175576.b3lyp_6-31g(d).smash.inp (generated)

000175576.b3lyp_6-31g(d).nwchem.inp (generated) 000175576.b3lyp_6-31g(d).log.xz 000175576.td-b3lyp_6-31g+(d).inp 000175576.td-b3lyp_6-31g+(d).log.xz

000175576.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175576.td-b3lyp_6-31+g(d).gjf (generated)

000175576.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175576.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175576.mol 000175576.PUBCHEM 000175576.mol (via Jmol)
000175577.b3lyp_6-31g(d).inp

000175577.b3lyp_6-31g(d).qchem.inp (generated)

000175577.b3lyp_6-31g(d).gjf (generated)

000175577.b3lyp_6-31g(d).firefly.inp (generated)

000175577.b3lyp_6-31g(d).smash.inp (generated)

000175577.b3lyp_6-31g(d).nwchem.inp (generated) 000175577.b3lyp_6-31g(d).log.xz 000175577.td-b3lyp_6-31g+(d).inp 000175577.td-b3lyp_6-31g+(d).log.xz

000175577.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175577.td-b3lyp_6-31+g(d).gjf (generated)

000175577.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175577.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175577.mol 000175577.PUBCHEM 000175577.mol (via Jmol)
000175589.b3lyp_6-31g(d).inp

000175589.b3lyp_6-31g(d).qchem.inp (generated)

000175589.b3lyp_6-31g(d).gjf (generated)

000175589.b3lyp_6-31g(d).firefly.inp (generated)

000175589.b3lyp_6-31g(d).smash.inp (generated)

000175589.b3lyp_6-31g(d).nwchem.inp (generated) 000175589.b3lyp_6-31g(d).log.xz 000175589.td-b3lyp_6-31g+(d).inp 000175589.td-b3lyp_6-31g+(d).log.xz

000175589.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175589.td-b3lyp_6-31+g(d).gjf (generated)

000175589.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175589.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175589.mol 000175589.PUBCHEM 000175589.mol (via Jmol)
000175593.b3lyp_6-31g(d).inp

000175593.b3lyp_6-31g(d).qchem.inp (generated)

000175593.b3lyp_6-31g(d).gjf (generated)

000175593.b3lyp_6-31g(d).firefly.inp (generated)

000175593.b3lyp_6-31g(d).smash.inp (generated)

000175593.b3lyp_6-31g(d).nwchem.inp (generated) 000175593.b3lyp_6-31g(d).log.xz 000175593.td-b3lyp_6-31g+(d).inp 000175593.td-b3lyp_6-31g+(d).log.xz

000175593.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175593.td-b3lyp_6-31+g(d).gjf (generated)

000175593.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175593.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175593.mol 000175593.PUBCHEM 000175593.mol (via Jmol)
000175596.b3lyp_6-31g(d).inp

000175596.b3lyp_6-31g(d).qchem.inp (generated)

000175596.b3lyp_6-31g(d).gjf (generated)

000175596.b3lyp_6-31g(d).firefly.inp (generated)

000175596.b3lyp_6-31g(d).smash.inp (generated)

000175596.b3lyp_6-31g(d).nwchem.inp (generated) 000175596.b3lyp_6-31g(d).log.xz 000175596.td-b3lyp_6-31g+(d).inp 000175596.td-b3lyp_6-31g+(d).log.xz

000175596.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175596.td-b3lyp_6-31+g(d).gjf (generated)

000175596.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175596.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175596.mol 000175596.PUBCHEM 000175596.mol (via Jmol)
000175597.b3lyp_6-31g(d).inp

000175597.b3lyp_6-31g(d).qchem.inp (generated)

000175597.b3lyp_6-31g(d).gjf (generated)

000175597.b3lyp_6-31g(d).firefly.inp (generated)

000175597.b3lyp_6-31g(d).smash.inp (generated)

000175597.b3lyp_6-31g(d).nwchem.inp (generated) 000175597.b3lyp_6-31g(d).log.xz 000175597.mol 000175597.PUBCHEM 000175597.mol (via Jmol)
000175605.b3lyp_6-31g(d).inp

000175605.b3lyp_6-31g(d).qchem.inp (generated)

000175605.b3lyp_6-31g(d).gjf (generated)

000175605.b3lyp_6-31g(d).firefly.inp (generated)

000175605.b3lyp_6-31g(d).smash.inp (generated)

000175605.b3lyp_6-31g(d).nwchem.inp (generated) 000175605.b3lyp_6-31g(d).log.xz 000175605.td-b3lyp_6-31g+(d).inp 000175605.td-b3lyp_6-31g+(d).log.xz

000175605.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175605.td-b3lyp_6-31+g(d).gjf (generated)

000175605.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175605.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175605.mol 000175605.PUBCHEM 000175605.mol (via Jmol)
000175609.b3lyp_6-31g(d).inp

000175609.b3lyp_6-31g(d).qchem.inp (generated)

000175609.b3lyp_6-31g(d).gjf (generated)

000175609.b3lyp_6-31g(d).firefly.inp (generated)

000175609.b3lyp_6-31g(d).smash.inp (generated)

000175609.b3lyp_6-31g(d).nwchem.inp (generated) 000175609.b3lyp_6-31g(d).log.xz 000175609.mol 000175609.PUBCHEM 000175609.mol (via Jmol)
000175610.b3lyp_6-31g(d).inp

000175610.b3lyp_6-31g(d).qchem.inp (generated)

000175610.b3lyp_6-31g(d).gjf (generated)

000175610.b3lyp_6-31g(d).firefly.inp (generated)

000175610.b3lyp_6-31g(d).smash.inp (generated)

000175610.b3lyp_6-31g(d).nwchem.inp (generated) 000175610.b3lyp_6-31g(d).log.xz 000175610.mol 000175610.PUBCHEM 000175610.mol (via Jmol)
000175612.b3lyp_6-31g(d).inp

000175612.b3lyp_6-31g(d).qchem.inp (generated)

000175612.b3lyp_6-31g(d).gjf (generated)

000175612.b3lyp_6-31g(d).firefly.inp (generated)

000175612.b3lyp_6-31g(d).smash.inp (generated)

000175612.b3lyp_6-31g(d).nwchem.inp (generated) 000175612.b3lyp_6-31g(d).log.xz 000175612.td-b3lyp_6-31g+(d).inp 000175612.td-b3lyp_6-31g+(d).log.xz

000175612.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175612.td-b3lyp_6-31+g(d).gjf (generated)

000175612.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175612.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175612.mol 000175612.PUBCHEM 000175612.mol (via Jmol)
000175643.b3lyp_6-31g(d).inp

000175643.b3lyp_6-31g(d).qchem.inp (generated)

000175643.b3lyp_6-31g(d).gjf (generated)

000175643.b3lyp_6-31g(d).firefly.inp (generated)

000175643.b3lyp_6-31g(d).smash.inp (generated)

000175643.b3lyp_6-31g(d).nwchem.inp (generated) 000175643.b3lyp_6-31g(d).log.xz 000175643.td-b3lyp_6-31g+(d).inp 000175643.td-b3lyp_6-31g+(d).log.xz

000175643.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175643.td-b3lyp_6-31+g(d).gjf (generated)

000175643.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175643.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175643.mol 000175643.PUBCHEM 000175643.mol (via Jmol)
000175661.b3lyp_6-31g(d).inp

000175661.b3lyp_6-31g(d).qchem.inp (generated)

000175661.b3lyp_6-31g(d).gjf (generated)

000175661.b3lyp_6-31g(d).firefly.inp (generated)

000175661.b3lyp_6-31g(d).smash.inp (generated)

000175661.b3lyp_6-31g(d).nwchem.inp (generated) 000175661.b3lyp_6-31g(d).log.xz 000175661.mol 000175661.PUBCHEM 000175661.mol (via Jmol)
000175664.b3lyp_6-31g(d).inp

000175664.b3lyp_6-31g(d).qchem.inp (generated)

000175664.b3lyp_6-31g(d).gjf (generated)

000175664.b3lyp_6-31g(d).firefly.inp (generated)

000175664.b3lyp_6-31g(d).smash.inp (generated)

000175664.b3lyp_6-31g(d).nwchem.inp (generated) 000175664.b3lyp_6-31g(d).log.xz 000175664.td-b3lyp_6-31g+(d).inp 000175664.td-b3lyp_6-31g+(d).log.xz

000175664.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175664.td-b3lyp_6-31+g(d).gjf (generated)

000175664.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175664.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175664.mol 000175664.PUBCHEM 000175664.mol (via Jmol)
000175694.b3lyp_6-31g(d).inp

000175694.b3lyp_6-31g(d).qchem.inp (generated)

000175694.b3lyp_6-31g(d).gjf (generated)

000175694.b3lyp_6-31g(d).firefly.inp (generated)

000175694.b3lyp_6-31g(d).smash.inp (generated)

000175694.b3lyp_6-31g(d).nwchem.inp (generated) 000175694.b3lyp_6-31g(d).log.xz 000175694.td-b3lyp_6-31g+(d).inp 000175694.td-b3lyp_6-31g+(d).log.xz

000175694.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175694.td-b3lyp_6-31+g(d).gjf (generated)

000175694.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175694.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175694.mol 000175694.PUBCHEM 000175694.mol (via Jmol)
000175749.b3lyp_6-31g(d).inp

000175749.b3lyp_6-31g(d).qchem.inp (generated)

000175749.b3lyp_6-31g(d).gjf (generated)

000175749.b3lyp_6-31g(d).firefly.inp (generated)

000175749.b3lyp_6-31g(d).smash.inp (generated)

000175749.b3lyp_6-31g(d).nwchem.inp (generated) 000175749.b3lyp_6-31g(d).log.xz 000175749.td-b3lyp_6-31g+(d).inp 000175749.td-b3lyp_6-31g+(d).log.xz

000175749.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175749.td-b3lyp_6-31+g(d).gjf (generated)

000175749.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175749.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175749.mol 000175749.PUBCHEM 000175749.mol (via Jmol)
000175753.b3lyp_6-31g(d).inp

000175753.b3lyp_6-31g(d).qchem.inp (generated)

000175753.b3lyp_6-31g(d).gjf (generated)

000175753.b3lyp_6-31g(d).firefly.inp (generated)

000175753.b3lyp_6-31g(d).smash.inp (generated)

000175753.b3lyp_6-31g(d).nwchem.inp (generated) 000175753.b3lyp_6-31g(d).log.xz 000175753.td-b3lyp_6-31g+(d).inp 000175753.td-b3lyp_6-31g+(d).log.xz

000175753.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175753.td-b3lyp_6-31+g(d).gjf (generated)

000175753.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175753.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175753.mol 000175753.PUBCHEM 000175753.mol (via Jmol)
000175754.b3lyp_6-31g(d).inp

000175754.b3lyp_6-31g(d).qchem.inp (generated)

000175754.b3lyp_6-31g(d).gjf (generated)

000175754.b3lyp_6-31g(d).firefly.inp (generated)

000175754.b3lyp_6-31g(d).smash.inp (generated)

000175754.b3lyp_6-31g(d).nwchem.inp (generated) 000175754.b3lyp_6-31g(d).log.xz 000175754.td-b3lyp_6-31g+(d).inp 000175754.td-b3lyp_6-31g+(d).log.xz

000175754.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175754.td-b3lyp_6-31+g(d).gjf (generated)

000175754.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175754.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175754.mol 000175754.PUBCHEM 000175754.mol (via Jmol)
000175756.b3lyp_6-31g(d).inp

000175756.b3lyp_6-31g(d).qchem.inp (generated)

000175756.b3lyp_6-31g(d).gjf (generated)

000175756.b3lyp_6-31g(d).firefly.inp (generated)

000175756.b3lyp_6-31g(d).smash.inp (generated)

000175756.b3lyp_6-31g(d).nwchem.inp (generated) 000175756.b3lyp_6-31g(d).log.xz 000175756.td-b3lyp_6-31g+(d).inp 000175756.td-b3lyp_6-31g+(d).log.xz

000175756.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175756.td-b3lyp_6-31+g(d).gjf (generated)

000175756.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175756.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175756.mol 000175756.PUBCHEM 000175756.mol (via Jmol)
000175760.b3lyp_6-31g(d).inp

000175760.b3lyp_6-31g(d).qchem.inp (generated)

000175760.b3lyp_6-31g(d).gjf (generated)

000175760.b3lyp_6-31g(d).firefly.inp (generated)

000175760.b3lyp_6-31g(d).smash.inp (generated)

000175760.b3lyp_6-31g(d).nwchem.inp (generated) 000175760.b3lyp_6-31g(d).log.xz 000175760.td-b3lyp_6-31g+(d).inp 000175760.td-b3lyp_6-31g+(d).log.xz

000175760.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175760.td-b3lyp_6-31+g(d).gjf (generated)

000175760.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175760.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175760.mol 000175760.PUBCHEM 000175760.mol (via Jmol)
000175761.b3lyp_6-31g(d).inp

000175761.b3lyp_6-31g(d).qchem.inp (generated)

000175761.b3lyp_6-31g(d).gjf (generated)

000175761.b3lyp_6-31g(d).firefly.inp (generated)

000175761.b3lyp_6-31g(d).smash.inp (generated)

000175761.b3lyp_6-31g(d).nwchem.inp (generated) 000175761.b3lyp_6-31g(d).log.xz 000175761.td-b3lyp_6-31g+(d).inp 000175761.td-b3lyp_6-31g+(d).log.xz

000175761.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175761.td-b3lyp_6-31+g(d).gjf (generated)

000175761.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175761.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175761.mol 000175761.PUBCHEM 000175761.mol (via Jmol)
000175762.b3lyp_6-31g(d).inp

000175762.b3lyp_6-31g(d).qchem.inp (generated)

000175762.b3lyp_6-31g(d).gjf (generated)

000175762.b3lyp_6-31g(d).firefly.inp (generated)

000175762.b3lyp_6-31g(d).smash.inp (generated)

000175762.b3lyp_6-31g(d).nwchem.inp (generated) 000175762.b3lyp_6-31g(d).log.xz 000175762.td-b3lyp_6-31g+(d).inp 000175762.td-b3lyp_6-31g+(d).log.xz

000175762.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175762.td-b3lyp_6-31+g(d).gjf (generated)

000175762.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175762.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175762.mol 000175762.PUBCHEM 000175762.mol (via Jmol)
000175768.b3lyp_6-31g(d).inp

000175768.b3lyp_6-31g(d).qchem.inp (generated)

000175768.b3lyp_6-31g(d).gjf (generated)

000175768.b3lyp_6-31g(d).firefly.inp (generated)

000175768.b3lyp_6-31g(d).smash.inp (generated)

000175768.b3lyp_6-31g(d).nwchem.inp (generated) 000175768.b3lyp_6-31g(d).log.xz 000175768.td-b3lyp_6-31g+(d).inp 000175768.td-b3lyp_6-31g+(d).log.xz

000175768.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175768.td-b3lyp_6-31+g(d).gjf (generated)

000175768.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175768.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175768.mol 000175768.PUBCHEM 000175768.mol (via Jmol)
000175787.b3lyp_6-31g(d).inp

000175787.b3lyp_6-31g(d).qchem.inp (generated)

000175787.b3lyp_6-31g(d).gjf (generated)

000175787.b3lyp_6-31g(d).firefly.inp (generated)

000175787.b3lyp_6-31g(d).smash.inp (generated)

000175787.b3lyp_6-31g(d).nwchem.inp (generated) 000175787.b3lyp_6-31g(d).log.xz 000175787.td-b3lyp_6-31g+(d).inp 000175787.td-b3lyp_6-31g+(d).log.xz

000175787.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175787.td-b3lyp_6-31+g(d).gjf (generated)

000175787.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175787.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175787.mol 000175787.PUBCHEM 000175787.mol (via Jmol)
000175791.b3lyp_6-31g(d).inp

000175791.b3lyp_6-31g(d).qchem.inp (generated)

000175791.b3lyp_6-31g(d).gjf (generated)

000175791.b3lyp_6-31g(d).firefly.inp (generated)

000175791.b3lyp_6-31g(d).smash.inp (generated)

000175791.b3lyp_6-31g(d).nwchem.inp (generated) 000175791.b3lyp_6-31g(d).log.xz 000175791.mol 000175791.PUBCHEM 000175791.mol (via Jmol)
000175792.b3lyp_6-31g(d).inp

000175792.b3lyp_6-31g(d).qchem.inp (generated)

000175792.b3lyp_6-31g(d).gjf (generated)

000175792.b3lyp_6-31g(d).firefly.inp (generated)

000175792.b3lyp_6-31g(d).smash.inp (generated)

000175792.b3lyp_6-31g(d).nwchem.inp (generated) 000175792.b3lyp_6-31g(d).log.xz 000175792.mol 000175792.PUBCHEM 000175792.mol (via Jmol)
000175799.b3lyp_6-31g(d).inp

000175799.b3lyp_6-31g(d).qchem.inp (generated)

000175799.b3lyp_6-31g(d).gjf (generated)

000175799.b3lyp_6-31g(d).firefly.inp (generated)

000175799.b3lyp_6-31g(d).smash.inp (generated)

000175799.b3lyp_6-31g(d).nwchem.inp (generated) 000175799.b3lyp_6-31g(d).log.xz 000175799.td-b3lyp_6-31g+(d).inp 000175799.td-b3lyp_6-31g+(d).log.xz

000175799.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175799.td-b3lyp_6-31+g(d).gjf (generated)

000175799.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175799.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175799.mol 000175799.PUBCHEM 000175799.mol (via Jmol)
000175801.b3lyp_6-31g(d).inp

000175801.b3lyp_6-31g(d).qchem.inp (generated)

000175801.b3lyp_6-31g(d).gjf (generated)

000175801.b3lyp_6-31g(d).firefly.inp (generated)

000175801.b3lyp_6-31g(d).smash.inp (generated)

000175801.b3lyp_6-31g(d).nwchem.inp (generated) 000175801.b3lyp_6-31g(d).log.xz 000175801.td-b3lyp_6-31g+(d).inp 000175801.td-b3lyp_6-31g+(d).log.xz

000175801.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175801.td-b3lyp_6-31+g(d).gjf (generated)

000175801.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175801.mol 000175801.PUBCHEM 000175801.mol (via Jmol)
000175803.b3lyp_6-31g(d).inp

000175803.b3lyp_6-31g(d).qchem.inp (generated)

000175803.b3lyp_6-31g(d).gjf (generated)

000175803.b3lyp_6-31g(d).firefly.inp (generated)

000175803.b3lyp_6-31g(d).smash.inp (generated)

000175803.b3lyp_6-31g(d).nwchem.inp (generated) 000175803.b3lyp_6-31g(d).log.xz 000175803.td-b3lyp_6-31g+(d).inp 000175803.td-b3lyp_6-31g+(d).log.xz

000175803.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175803.td-b3lyp_6-31+g(d).gjf (generated)

000175803.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175803.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175803.mol 000175803.PUBCHEM 000175803.mol (via Jmol)
000175815.b3lyp_6-31g(d).inp

000175815.b3lyp_6-31g(d).qchem.inp (generated)

000175815.b3lyp_6-31g(d).gjf (generated)

000175815.b3lyp_6-31g(d).firefly.inp (generated)

000175815.b3lyp_6-31g(d).smash.inp (generated)

000175815.b3lyp_6-31g(d).nwchem.inp (generated) 000175815.b3lyp_6-31g(d).log.xz 000175815.td-b3lyp_6-31g+(d).inp 000175815.td-b3lyp_6-31g+(d).log.xz

000175815.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175815.td-b3lyp_6-31+g(d).gjf (generated)

000175815.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175815.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175815.mol 000175815.PUBCHEM 000175815.mol (via Jmol)
000175839.b3lyp_6-31g(d).inp

000175839.b3lyp_6-31g(d).qchem.inp (generated)

000175839.b3lyp_6-31g(d).gjf (generated)

000175839.b3lyp_6-31g(d).firefly.inp (generated)

000175839.b3lyp_6-31g(d).smash.inp (generated)

000175839.b3lyp_6-31g(d).nwchem.inp (generated) 000175839.b3lyp_6-31g(d).log.xz 000175839.td-b3lyp_6-31g+(d).inp 000175839.td-b3lyp_6-31g+(d).log.xz

000175839.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175839.td-b3lyp_6-31+g(d).gjf (generated)

000175839.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175839.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175839.mol 000175839.PUBCHEM 000175839.mol (via Jmol)
000175843.b3lyp_6-31g(d).inp

000175843.b3lyp_6-31g(d).qchem.inp (generated)

000175843.b3lyp_6-31g(d).gjf (generated)

000175843.b3lyp_6-31g(d).firefly.inp (generated)

000175843.b3lyp_6-31g(d).smash.inp (generated)

000175843.b3lyp_6-31g(d).nwchem.inp (generated) 000175843.b3lyp_6-31g(d).log.xz 000175843.td-b3lyp_6-31g+(d).inp 000175843.td-b3lyp_6-31g+(d).log.xz

000175843.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175843.td-b3lyp_6-31+g(d).gjf (generated)

000175843.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175843.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175843.mol 000175843.PUBCHEM 000175843.mol (via Jmol)
000175848.b3lyp_6-31g(d).inp

000175848.b3lyp_6-31g(d).qchem.inp (generated)

000175848.b3lyp_6-31g(d).gjf (generated)

000175848.b3lyp_6-31g(d).firefly.inp (generated)

000175848.b3lyp_6-31g(d).smash.inp (generated)

000175848.b3lyp_6-31g(d).nwchem.inp (generated) 000175848.b3lyp_6-31g(d).log.xz 000175848.td-b3lyp_6-31g+(d).inp 000175848.td-b3lyp_6-31g+(d).log.xz

000175848.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175848.td-b3lyp_6-31+g(d).gjf (generated)

000175848.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175848.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175848.mol 000175848.PUBCHEM 000175848.mol (via Jmol)
000175854.b3lyp_6-31g(d).inp

000175854.b3lyp_6-31g(d).qchem.inp (generated)

000175854.b3lyp_6-31g(d).gjf (generated)

000175854.b3lyp_6-31g(d).firefly.inp (generated)

000175854.b3lyp_6-31g(d).smash.inp (generated)

000175854.b3lyp_6-31g(d).nwchem.inp (generated) 000175854.b3lyp_6-31g(d).log.xz 000175854.td-b3lyp_6-31g+(d).inp 000175854.td-b3lyp_6-31g+(d).log.xz

000175854.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175854.td-b3lyp_6-31+g(d).gjf (generated)

000175854.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175854.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175854.mol 000175854.PUBCHEM 000175854.mol (via Jmol)
000175868.b3lyp_6-31g(d).inp

000175868.b3lyp_6-31g(d).qchem.inp (generated)

000175868.b3lyp_6-31g(d).gjf (generated)

000175868.b3lyp_6-31g(d).firefly.inp (generated)

000175868.b3lyp_6-31g(d).smash.inp (generated)

000175868.b3lyp_6-31g(d).nwchem.inp (generated) 000175868.b3lyp_6-31g(d).log.xz 000175868.td-b3lyp_6-31g+(d).inp 000175868.td-b3lyp_6-31g+(d).log.xz

000175868.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175868.td-b3lyp_6-31+g(d).gjf (generated)

000175868.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175868.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175868.mol 000175868.PUBCHEM 000175868.mol (via Jmol)
000175948.b3lyp_6-31g(d).inp

000175948.b3lyp_6-31g(d).qchem.inp (generated)

000175948.b3lyp_6-31g(d).gjf (generated)

000175948.b3lyp_6-31g(d).firefly.inp (generated)

000175948.b3lyp_6-31g(d).smash.inp (generated)

000175948.b3lyp_6-31g(d).nwchem.inp (generated) 000175948.b3lyp_6-31g(d).log.xz 000175948.td-b3lyp_6-31g+(d).inp 000175948.td-b3lyp_6-31g+(d).log.xz

000175948.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175948.td-b3lyp_6-31+g(d).gjf (generated)

000175948.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175948.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175948.mol 000175948.PUBCHEM 000175948.mol (via Jmol)
000175956.b3lyp_6-31g(d).inp

000175956.b3lyp_6-31g(d).qchem.inp (generated)

000175956.b3lyp_6-31g(d).gjf (generated)

000175956.b3lyp_6-31g(d).firefly.inp (generated)

000175956.b3lyp_6-31g(d).smash.inp (generated)

000175956.b3lyp_6-31g(d).nwchem.inp (generated) 000175956.b3lyp_6-31g(d).log.xz 000175956.td-b3lyp_6-31g+(d).inp 000175956.td-b3lyp_6-31g+(d).log.xz

000175956.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175956.td-b3lyp_6-31+g(d).gjf (generated)

000175956.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175956.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175956.mol 000175956.PUBCHEM 000175956.mol (via Jmol)
000175998.b3lyp_6-31g(d).inp

000175998.b3lyp_6-31g(d).qchem.inp (generated)

000175998.b3lyp_6-31g(d).gjf (generated)

000175998.b3lyp_6-31g(d).firefly.inp (generated)

000175998.b3lyp_6-31g(d).smash.inp (generated)

000175998.b3lyp_6-31g(d).nwchem.inp (generated) 000175998.b3lyp_6-31g(d).log.xz 000175998.td-b3lyp_6-31g+(d).inp 000175998.td-b3lyp_6-31g+(d).log.xz

000175998.td-b3lyp_6-31+g(d).qchem.inp (generated)

000175998.td-b3lyp_6-31+g(d).gjf (generated)

000175998.td-b3lyp_6-31+g(d).firefly.inp (generated)

000175998.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000175998.mol 000175998.PUBCHEM 000175998.mol (via Jmol)
000176000.b3lyp_6-31g(d).inp

000176000.b3lyp_6-31g(d).qchem.inp (generated)

000176000.b3lyp_6-31g(d).gjf (generated)

000176000.b3lyp_6-31g(d).firefly.inp (generated)

000176000.b3lyp_6-31g(d).smash.inp (generated)

000176000.b3lyp_6-31g(d).nwchem.inp (generated) 000176000.b3lyp_6-31g(d).log.xz 000176000.td-b3lyp_6-31g+(d).inp 000176000.td-b3lyp_6-31g+(d).log.xz

000176000.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176000.td-b3lyp_6-31+g(d).gjf (generated)

000176000.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176000.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176000.mol 000176000.PUBCHEM 000176000.mol (via Jmol)
000176003.b3lyp_6-31g(d).inp

000176003.b3lyp_6-31g(d).qchem.inp (generated)

000176003.b3lyp_6-31g(d).gjf (generated)

000176003.b3lyp_6-31g(d).firefly.inp (generated)

000176003.b3lyp_6-31g(d).smash.inp (generated)

000176003.b3lyp_6-31g(d).nwchem.inp (generated) 000176003.b3lyp_6-31g(d).log.xz 000176003.td-b3lyp_6-31g+(d).inp 000176003.td-b3lyp_6-31g+(d).log.xz

000176003.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176003.td-b3lyp_6-31+g(d).gjf (generated)

000176003.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176003.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176003.mol 000176003.PUBCHEM 000176003.mol (via Jmol)
000176006.b3lyp_6-31g(d).inp

000176006.b3lyp_6-31g(d).qchem.inp (generated)

000176006.b3lyp_6-31g(d).gjf (generated)

000176006.b3lyp_6-31g(d).firefly.inp (generated)

000176006.b3lyp_6-31g(d).smash.inp (generated)

000176006.b3lyp_6-31g(d).nwchem.inp (generated) 000176006.b3lyp_6-31g(d).log.xz 000176006.td-b3lyp_6-31g+(d).inp 000176006.td-b3lyp_6-31g+(d).log.xz

000176006.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176006.td-b3lyp_6-31+g(d).gjf (generated)

000176006.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176006.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176006.mol 000176006.PUBCHEM 000176006.mol (via Jmol)
000176021.b3lyp_6-31g(d).inp

000176021.b3lyp_6-31g(d).qchem.inp (generated)

000176021.b3lyp_6-31g(d).gjf (generated)

000176021.b3lyp_6-31g(d).firefly.inp (generated)

000176021.b3lyp_6-31g(d).smash.inp (generated)

000176021.b3lyp_6-31g(d).nwchem.inp (generated) 000176021.b3lyp_6-31g(d).log.xz 000176021.mol 000176021.PUBCHEM 000176021.mol (via Jmol)
000176040.b3lyp_6-31g(d).inp

000176040.b3lyp_6-31g(d).qchem.inp (generated)

000176040.b3lyp_6-31g(d).gjf (generated)

000176040.b3lyp_6-31g(d).firefly.inp (generated)

000176040.b3lyp_6-31g(d).smash.inp (generated)

000176040.b3lyp_6-31g(d).nwchem.inp (generated) 000176040.b3lyp_6-31g(d).log.xz 000176040.td-b3lyp_6-31g+(d).inp 000176040.td-b3lyp_6-31g+(d).log.xz

000176040.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176040.td-b3lyp_6-31+g(d).gjf (generated)

000176040.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176040.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176040.mol 000176040.PUBCHEM 000176040.mol (via Jmol)
000176041.b3lyp_6-31g(d).inp

000176041.b3lyp_6-31g(d).qchem.inp (generated)

000176041.b3lyp_6-31g(d).gjf (generated)

000176041.b3lyp_6-31g(d).firefly.inp (generated)

000176041.b3lyp_6-31g(d).smash.inp (generated)

000176041.b3lyp_6-31g(d).nwchem.inp (generated) 000176041.b3lyp_6-31g(d).log.xz 000176041.td-b3lyp_6-31g+(d).inp 000176041.td-b3lyp_6-31g+(d).log.xz

000176041.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176041.td-b3lyp_6-31+g(d).gjf (generated)

000176041.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176041.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176041.mol 000176041.PUBCHEM 000176041.mol (via Jmol)
000176077.b3lyp_6-31g(d).inp

000176077.b3lyp_6-31g(d).qchem.inp (generated)

000176077.b3lyp_6-31g(d).gjf (generated)

000176077.b3lyp_6-31g(d).firefly.inp (generated)

000176077.b3lyp_6-31g(d).smash.inp (generated)

000176077.b3lyp_6-31g(d).nwchem.inp (generated) 000176077.b3lyp_6-31g(d).log.xz 000176077.td-b3lyp_6-31g+(d).inp 000176077.td-b3lyp_6-31g+(d).log.xz

000176077.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176077.td-b3lyp_6-31+g(d).gjf (generated)

000176077.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176077.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176077.mol 000176077.PUBCHEM 000176077.mol (via Jmol)
000176083.b3lyp_6-31g(d).inp

000176083.b3lyp_6-31g(d).qchem.inp (generated)

000176083.b3lyp_6-31g(d).gjf (generated)

000176083.b3lyp_6-31g(d).firefly.inp (generated)

000176083.b3lyp_6-31g(d).smash.inp (generated)

000176083.b3lyp_6-31g(d).nwchem.inp (generated) 000176083.b3lyp_6-31g(d).log.xz 000176083.td-b3lyp_6-31g+(d).inp 000176083.td-b3lyp_6-31g+(d).log.xz

000176083.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176083.td-b3lyp_6-31+g(d).gjf (generated)

000176083.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176083.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176083.mol 000176083.PUBCHEM 000176083.mol (via Jmol)
000176108.b3lyp_6-31g(d).inp

000176108.b3lyp_6-31g(d).qchem.inp (generated)

000176108.b3lyp_6-31g(d).gjf (generated)

000176108.b3lyp_6-31g(d).firefly.inp (generated)

000176108.b3lyp_6-31g(d).smash.inp (generated)

000176108.b3lyp_6-31g(d).nwchem.inp (generated) 000176108.b3lyp_6-31g(d).log.xz 000176108.td-b3lyp_6-31g+(d).inp 000176108.td-b3lyp_6-31g+(d).log.xz

000176108.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176108.td-b3lyp_6-31+g(d).gjf (generated)

000176108.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176108.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176108.mol 000176108.PUBCHEM 000176108.mol (via Jmol)
000176115.b3lyp_6-31g(d).inp

000176115.b3lyp_6-31g(d).qchem.inp (generated)

000176115.b3lyp_6-31g(d).gjf (generated)

000176115.b3lyp_6-31g(d).firefly.inp (generated)

000176115.b3lyp_6-31g(d).smash.inp (generated)

000176115.b3lyp_6-31g(d).nwchem.inp (generated) 000176115.b3lyp_6-31g(d).log.xz 000176115.td-b3lyp_6-31g+(d).inp 000176115.td-b3lyp_6-31g+(d).log.xz

000176115.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176115.td-b3lyp_6-31+g(d).gjf (generated)

000176115.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176115.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176115.mol 000176115.PUBCHEM 000176115.mol (via Jmol)
000176116.b3lyp_6-31g(d).inp

000176116.b3lyp_6-31g(d).qchem.inp (generated)

000176116.b3lyp_6-31g(d).gjf (generated)

000176116.b3lyp_6-31g(d).firefly.inp (generated)

000176116.b3lyp_6-31g(d).smash.inp (generated)

000176116.b3lyp_6-31g(d).nwchem.inp (generated) 000176116.b3lyp_6-31g(d).log.xz 000176116.td-b3lyp_6-31g+(d).inp 000176116.td-b3lyp_6-31g+(d).log.xz

000176116.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176116.td-b3lyp_6-31+g(d).gjf (generated)

000176116.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176116.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176116.mol 000176116.PUBCHEM 000176116.mol (via Jmol)
000176121.b3lyp_6-31g(d).inp

000176121.b3lyp_6-31g(d).qchem.inp (generated)

000176121.b3lyp_6-31g(d).gjf (generated)

000176121.b3lyp_6-31g(d).firefly.inp (generated)

000176121.b3lyp_6-31g(d).smash.inp (generated)

000176121.b3lyp_6-31g(d).nwchem.inp (generated) 000176121.b3lyp_6-31g(d).log.xz 000176121.td-b3lyp_6-31g+(d).inp 000176121.td-b3lyp_6-31g+(d).log.xz

000176121.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176121.td-b3lyp_6-31+g(d).gjf (generated)

000176121.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176121.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176121.mol 000176121.PUBCHEM 000176121.mol (via Jmol)
000176153.b3lyp_6-31g(d).inp

000176153.b3lyp_6-31g(d).qchem.inp (generated)

000176153.b3lyp_6-31g(d).gjf (generated)

000176153.b3lyp_6-31g(d).firefly.inp (generated)

000176153.b3lyp_6-31g(d).smash.inp (generated)

000176153.b3lyp_6-31g(d).nwchem.inp (generated) 000176153.b3lyp_6-31g(d).log.xz 000176153.td-b3lyp_6-31g+(d).inp 000176153.td-b3lyp_6-31g+(d).log.xz

000176153.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176153.td-b3lyp_6-31+g(d).gjf (generated)

000176153.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176153.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176153.mol 000176153.PUBCHEM 000176153.mol (via Jmol)
000176217.b3lyp_6-31g(d).inp

000176217.b3lyp_6-31g(d).qchem.inp (generated)

000176217.b3lyp_6-31g(d).gjf (generated)

000176217.b3lyp_6-31g(d).firefly.inp (generated)

000176217.b3lyp_6-31g(d).smash.inp (generated)

000176217.b3lyp_6-31g(d).nwchem.inp (generated) 000176217.b3lyp_6-31g(d).log.xz 000176217.td-b3lyp_6-31g+(d).inp 000176217.td-b3lyp_6-31g+(d).log.xz

000176217.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176217.td-b3lyp_6-31+g(d).gjf (generated)

000176217.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176217.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176217.mol 000176217.PUBCHEM 000176217.mol (via Jmol)
000176243.b3lyp_6-31g(d).inp

000176243.b3lyp_6-31g(d).qchem.inp (generated)

000176243.b3lyp_6-31g(d).gjf (generated)

000176243.b3lyp_6-31g(d).firefly.inp (generated)

000176243.b3lyp_6-31g(d).smash.inp (generated)

000176243.b3lyp_6-31g(d).nwchem.inp (generated) 000176243.b3lyp_6-31g(d).log.xz 000176243.td-b3lyp_6-31g+(d).inp 000176243.td-b3lyp_6-31g+(d).log.xz

000176243.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176243.td-b3lyp_6-31+g(d).gjf (generated)

000176243.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176243.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176243.mol 000176243.PUBCHEM 000176243.mol (via Jmol)
000176398.b3lyp_6-31g(d).inp

000176398.b3lyp_6-31g(d).qchem.inp (generated)

000176398.b3lyp_6-31g(d).gjf (generated)

000176398.b3lyp_6-31g(d).firefly.inp (generated)

000176398.b3lyp_6-31g(d).smash.inp (generated)

000176398.b3lyp_6-31g(d).nwchem.inp (generated) 000176398.b3lyp_6-31g(d).log.xz 000176398.td-b3lyp_6-31g+(d).inp 000176398.td-b3lyp_6-31g+(d).log.xz

000176398.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176398.td-b3lyp_6-31+g(d).gjf (generated)

000176398.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176398.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176398.mol 000176398.PUBCHEM 000176398.mol (via Jmol)
000176409.b3lyp_6-31g(d).inp

000176409.b3lyp_6-31g(d).qchem.inp (generated)

000176409.b3lyp_6-31g(d).gjf (generated)

000176409.b3lyp_6-31g(d).firefly.inp (generated)

000176409.b3lyp_6-31g(d).smash.inp (generated)

000176409.b3lyp_6-31g(d).nwchem.inp (generated) 000176409.b3lyp_6-31g(d).log.xz 000176409.td-b3lyp_6-31g+(d).inp 000176409.td-b3lyp_6-31g+(d).log.xz

000176409.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176409.td-b3lyp_6-31+g(d).gjf (generated)

000176409.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176409.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176409.mol 000176409.PUBCHEM 000176409.mol (via Jmol)
000176411.b3lyp_6-31g(d).inp

000176411.b3lyp_6-31g(d).qchem.inp (generated)

000176411.b3lyp_6-31g(d).gjf (generated)

000176411.b3lyp_6-31g(d).firefly.inp (generated)

000176411.b3lyp_6-31g(d).smash.inp (generated)

000176411.b3lyp_6-31g(d).nwchem.inp (generated) 000176411.b3lyp_6-31g(d).log.xz 000176411.td-b3lyp_6-31g+(d).inp 000176411.td-b3lyp_6-31g+(d).log.xz

000176411.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176411.td-b3lyp_6-31+g(d).gjf (generated)

000176411.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176411.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176411.mol 000176411.PUBCHEM 000176411.mol (via Jmol)
000176413.b3lyp_6-31g(d).inp

000176413.b3lyp_6-31g(d).qchem.inp (generated)

000176413.b3lyp_6-31g(d).gjf (generated)

000176413.b3lyp_6-31g(d).firefly.inp (generated)

000176413.b3lyp_6-31g(d).smash.inp (generated)

000176413.b3lyp_6-31g(d).nwchem.inp (generated) 000176413.b3lyp_6-31g(d).log.xz 000176413.td-b3lyp_6-31g+(d).inp 000176413.td-b3lyp_6-31g+(d).log.xz

000176413.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176413.td-b3lyp_6-31+g(d).gjf (generated)

000176413.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176413.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176413.mol 000176413.PUBCHEM 000176413.mol (via Jmol)
000176418.b3lyp_6-31g(d).inp

000176418.b3lyp_6-31g(d).qchem.inp (generated)

000176418.b3lyp_6-31g(d).gjf (generated)

000176418.b3lyp_6-31g(d).firefly.inp (generated)

000176418.b3lyp_6-31g(d).smash.inp (generated)

000176418.b3lyp_6-31g(d).nwchem.inp (generated) 000176418.b3lyp_6-31g(d).log.xz 000176418.td-b3lyp_6-31g+(d).inp 000176418.td-b3lyp_6-31g+(d).log.xz

000176418.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176418.td-b3lyp_6-31+g(d).gjf (generated)

000176418.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176418.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176418.mol 000176418.PUBCHEM 000176418.mol (via Jmol)
000176419.b3lyp_6-31g(d).inp

000176419.b3lyp_6-31g(d).qchem.inp (generated)

000176419.b3lyp_6-31g(d).gjf (generated)

000176419.b3lyp_6-31g(d).firefly.inp (generated)

000176419.b3lyp_6-31g(d).smash.inp (generated)

000176419.b3lyp_6-31g(d).nwchem.inp (generated) 000176419.b3lyp_6-31g(d).log.xz 000176419.td-b3lyp_6-31g+(d).inp 000176419.td-b3lyp_6-31g+(d).log.xz

000176419.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176419.td-b3lyp_6-31+g(d).gjf (generated)

000176419.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176419.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176419.mol 000176419.PUBCHEM 000176419.mol (via Jmol)
000176425.b3lyp_6-31g(d).inp

000176425.b3lyp_6-31g(d).qchem.inp (generated)

000176425.b3lyp_6-31g(d).gjf (generated)

000176425.b3lyp_6-31g(d).firefly.inp (generated)

000176425.b3lyp_6-31g(d).smash.inp (generated)

000176425.b3lyp_6-31g(d).nwchem.inp (generated) 000176425.b3lyp_6-31g(d).log.xz 000176425.td-b3lyp_6-31g+(d).inp 000176425.td-b3lyp_6-31g+(d).log.xz

000176425.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176425.td-b3lyp_6-31+g(d).gjf (generated)

000176425.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176425.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176425.mol 000176425.PUBCHEM 000176425.mol (via Jmol)
000176427.b3lyp_6-31g(d).inp

000176427.b3lyp_6-31g(d).qchem.inp (generated)

000176427.b3lyp_6-31g(d).gjf (generated)

000176427.b3lyp_6-31g(d).firefly.inp (generated)

000176427.b3lyp_6-31g(d).smash.inp (generated)

000176427.b3lyp_6-31g(d).nwchem.inp (generated) 000176427.b3lyp_6-31g(d).log.xz 000176427.td-b3lyp_6-31g+(d).inp 000176427.td-b3lyp_6-31g+(d).log.xz

000176427.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176427.td-b3lyp_6-31+g(d).gjf (generated)

000176427.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176427.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176427.mol 000176427.PUBCHEM 000176427.mol (via Jmol)
000176432.b3lyp_6-31g(d).inp

000176432.b3lyp_6-31g(d).qchem.inp (generated)

000176432.b3lyp_6-31g(d).gjf (generated)

000176432.b3lyp_6-31g(d).firefly.inp (generated)

000176432.b3lyp_6-31g(d).smash.inp (generated)

000176432.b3lyp_6-31g(d).nwchem.inp (generated) 000176432.b3lyp_6-31g(d).log.xz 000176432.td-b3lyp_6-31g+(d).inp 000176432.td-b3lyp_6-31g+(d).log.xz

000176432.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176432.td-b3lyp_6-31+g(d).gjf (generated)

000176432.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176432.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176432.mol 000176432.PUBCHEM 000176432.mol (via Jmol)
000176436.b3lyp_6-31g(d).inp

000176436.b3lyp_6-31g(d).qchem.inp (generated)

000176436.b3lyp_6-31g(d).gjf (generated)

000176436.b3lyp_6-31g(d).firefly.inp (generated)

000176436.b3lyp_6-31g(d).smash.inp (generated)

000176436.b3lyp_6-31g(d).nwchem.inp (generated) 000176436.b3lyp_6-31g(d).log.xz 000176436.td-b3lyp_6-31g+(d).inp 000176436.td-b3lyp_6-31g+(d).log.xz

000176436.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176436.td-b3lyp_6-31+g(d).gjf (generated)

000176436.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176436.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176436.mol 000176436.PUBCHEM 000176436.mol (via Jmol)
000176437.b3lyp_6-31g(d).inp

000176437.b3lyp_6-31g(d).qchem.inp (generated)

000176437.b3lyp_6-31g(d).gjf (generated)

000176437.b3lyp_6-31g(d).firefly.inp (generated)

000176437.b3lyp_6-31g(d).smash.inp (generated)

000176437.b3lyp_6-31g(d).nwchem.inp (generated) 000176437.b3lyp_6-31g(d).log.xz 000176437.td-b3lyp_6-31g+(d).inp 000176437.td-b3lyp_6-31g+(d).log.xz

000176437.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176437.td-b3lyp_6-31+g(d).gjf (generated)

000176437.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176437.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176437.mol 000176437.PUBCHEM 000176437.mol (via Jmol)
000176439.b3lyp_6-31g(d).inp

000176439.b3lyp_6-31g(d).qchem.inp (generated)

000176439.b3lyp_6-31g(d).gjf (generated)

000176439.b3lyp_6-31g(d).firefly.inp (generated)

000176439.b3lyp_6-31g(d).smash.inp (generated)

000176439.b3lyp_6-31g(d).nwchem.inp (generated) 000176439.b3lyp_6-31g(d).log.xz 000176439.td-b3lyp_6-31g+(d).inp 000176439.td-b3lyp_6-31g+(d).log.xz

000176439.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176439.td-b3lyp_6-31+g(d).gjf (generated)

000176439.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176439.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176439.mol 000176439.PUBCHEM 000176439.mol (via Jmol)
000176442.b3lyp_6-31g(d).inp

000176442.b3lyp_6-31g(d).qchem.inp (generated)

000176442.b3lyp_6-31g(d).gjf (generated)

000176442.b3lyp_6-31g(d).firefly.inp (generated)

000176442.b3lyp_6-31g(d).smash.inp (generated)

000176442.b3lyp_6-31g(d).nwchem.inp (generated) 000176442.b3lyp_6-31g(d).log.xz 000176442.td-b3lyp_6-31g+(d).inp 000176442.td-b3lyp_6-31g+(d).log.xz

000176442.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176442.td-b3lyp_6-31+g(d).gjf (generated)

000176442.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176442.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176442.mol 000176442.PUBCHEM 000176442.mol (via Jmol)
000176443.b3lyp_6-31g(d).inp

000176443.b3lyp_6-31g(d).qchem.inp (generated)

000176443.b3lyp_6-31g(d).gjf (generated)

000176443.b3lyp_6-31g(d).firefly.inp (generated)

000176443.b3lyp_6-31g(d).smash.inp (generated)

000176443.b3lyp_6-31g(d).nwchem.inp (generated) 000176443.b3lyp_6-31g(d).log.xz 000176443.td-b3lyp_6-31g+(d).inp 000176443.td-b3lyp_6-31g+(d).log.xz

000176443.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176443.td-b3lyp_6-31+g(d).gjf (generated)

000176443.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176443.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176443.mol 000176443.PUBCHEM 000176443.mol (via Jmol)
000176444.b3lyp_6-31g(d).inp

000176444.b3lyp_6-31g(d).qchem.inp (generated)

000176444.b3lyp_6-31g(d).gjf (generated)

000176444.b3lyp_6-31g(d).firefly.inp (generated)

000176444.b3lyp_6-31g(d).smash.inp (generated)

000176444.b3lyp_6-31g(d).nwchem.inp (generated) 000176444.b3lyp_6-31g(d).log.xz 000176444.td-b3lyp_6-31g+(d).inp 000176444.td-b3lyp_6-31g+(d).log.xz

000176444.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176444.td-b3lyp_6-31+g(d).gjf (generated)

000176444.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176444.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176444.mol 000176444.PUBCHEM 000176444.mol (via Jmol)
000176445.b3lyp_6-31g(d).inp

000176445.b3lyp_6-31g(d).qchem.inp (generated)

000176445.b3lyp_6-31g(d).gjf (generated)

000176445.b3lyp_6-31g(d).firefly.inp (generated)

000176445.b3lyp_6-31g(d).smash.inp (generated)

000176445.b3lyp_6-31g(d).nwchem.inp (generated) 000176445.b3lyp_6-31g(d).log.xz 000176445.td-b3lyp_6-31g+(d).inp 000176445.td-b3lyp_6-31g+(d).log.xz

000176445.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176445.td-b3lyp_6-31+g(d).gjf (generated)

000176445.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176445.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176445.mol 000176445.PUBCHEM 000176445.mol (via Jmol)
000176448.b3lyp_6-31g(d).inp

000176448.b3lyp_6-31g(d).qchem.inp (generated)

000176448.b3lyp_6-31g(d).gjf (generated)

000176448.b3lyp_6-31g(d).firefly.inp (generated)

000176448.b3lyp_6-31g(d).smash.inp (generated)

000176448.b3lyp_6-31g(d).nwchem.inp (generated) 000176448.b3lyp_6-31g(d).log.xz 000176448.td-b3lyp_6-31g+(d).inp 000176448.td-b3lyp_6-31g+(d).log.xz

000176448.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176448.td-b3lyp_6-31+g(d).gjf (generated)

000176448.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176448.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176448.mol 000176448.PUBCHEM 000176448.mol (via Jmol)
000176454.b3lyp_6-31g(d).inp

000176454.b3lyp_6-31g(d).qchem.inp (generated)

000176454.b3lyp_6-31g(d).gjf (generated)

000176454.b3lyp_6-31g(d).firefly.inp (generated)

000176454.b3lyp_6-31g(d).smash.inp (generated)

000176454.b3lyp_6-31g(d).nwchem.inp (generated) 000176454.b3lyp_6-31g(d).log.xz 000176454.mol 000176454.PUBCHEM 000176454.mol (via Jmol)
000176460.b3lyp_6-31g(d).inp

000176460.b3lyp_6-31g(d).qchem.inp (generated)

000176460.b3lyp_6-31g(d).gjf (generated)

000176460.b3lyp_6-31g(d).firefly.inp (generated)

000176460.b3lyp_6-31g(d).smash.inp (generated)

000176460.b3lyp_6-31g(d).nwchem.inp (generated) 000176460.b3lyp_6-31g(d).log.xz 000176460.td-b3lyp_6-31g+(d).inp 000176460.td-b3lyp_6-31g+(d).log.xz

000176460.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176460.td-b3lyp_6-31+g(d).gjf (generated)

000176460.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176460.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176460.mol 000176460.PUBCHEM 000176460.mol (via Jmol)
000176464.b3lyp_6-31g(d).inp

000176464.b3lyp_6-31g(d).qchem.inp (generated)

000176464.b3lyp_6-31g(d).gjf (generated)

000176464.b3lyp_6-31g(d).firefly.inp (generated)

000176464.b3lyp_6-31g(d).smash.inp (generated)

000176464.b3lyp_6-31g(d).nwchem.inp (generated) 000176464.b3lyp_6-31g(d).log.xz 000176464.td-b3lyp_6-31g+(d).inp 000176464.td-b3lyp_6-31g+(d).log.xz

000176464.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176464.td-b3lyp_6-31+g(d).gjf (generated)

000176464.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176464.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176464.mol 000176464.PUBCHEM 000176464.mol (via Jmol)
000176465.b3lyp_6-31g(d).inp

000176465.b3lyp_6-31g(d).qchem.inp (generated)

000176465.b3lyp_6-31g(d).gjf (generated)

000176465.b3lyp_6-31g(d).firefly.inp (generated)

000176465.b3lyp_6-31g(d).smash.inp (generated)

000176465.b3lyp_6-31g(d).nwchem.inp (generated) 000176465.b3lyp_6-31g(d).log.xz 000176465.td-b3lyp_6-31g+(d).inp 000176465.td-b3lyp_6-31g+(d).log.xz

000176465.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176465.td-b3lyp_6-31+g(d).gjf (generated)

000176465.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176465.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176465.mol 000176465.PUBCHEM 000176465.mol (via Jmol)
000176468.b3lyp_6-31g(d).inp

000176468.b3lyp_6-31g(d).qchem.inp (generated)

000176468.b3lyp_6-31g(d).gjf (generated)

000176468.b3lyp_6-31g(d).firefly.inp (generated)

000176468.b3lyp_6-31g(d).smash.inp (generated)

000176468.b3lyp_6-31g(d).nwchem.inp (generated) 000176468.b3lyp_6-31g(d).log.xz 000176468.td-b3lyp_6-31g+(d).inp 000176468.td-b3lyp_6-31g+(d).log.xz

000176468.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176468.td-b3lyp_6-31+g(d).gjf (generated)

000176468.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176468.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176468.mol 000176468.PUBCHEM 000176468.mol (via Jmol)
000176469.b3lyp_6-31g(d).inp

000176469.b3lyp_6-31g(d).qchem.inp (generated)

000176469.b3lyp_6-31g(d).gjf (generated)

000176469.b3lyp_6-31g(d).firefly.inp (generated)

000176469.b3lyp_6-31g(d).smash.inp (generated)

000176469.b3lyp_6-31g(d).nwchem.inp (generated) 000176469.b3lyp_6-31g(d).log.xz 000176469.td-b3lyp_6-31g+(d).inp 000176469.td-b3lyp_6-31g+(d).log.xz

000176469.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176469.td-b3lyp_6-31+g(d).gjf (generated)

000176469.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176469.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176469.mol 000176469.PUBCHEM 000176469.mol (via Jmol)
000176472.b3lyp_6-31g(d).inp

000176472.b3lyp_6-31g(d).qchem.inp (generated)

000176472.b3lyp_6-31g(d).gjf (generated)

000176472.b3lyp_6-31g(d).firefly.inp (generated)

000176472.b3lyp_6-31g(d).smash.inp (generated)

000176472.b3lyp_6-31g(d).nwchem.inp (generated) 000176472.b3lyp_6-31g(d).log.xz 000176472.td-b3lyp_6-31g+(d).inp 000176472.td-b3lyp_6-31g+(d).log.xz

000176472.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176472.td-b3lyp_6-31+g(d).gjf (generated)

000176472.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176472.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176472.mol 000176472.PUBCHEM 000176472.mol (via Jmol)
000176480.b3lyp_6-31g(d).inp

000176480.b3lyp_6-31g(d).qchem.inp (generated)

000176480.b3lyp_6-31g(d).gjf (generated)

000176480.b3lyp_6-31g(d).firefly.inp (generated)

000176480.b3lyp_6-31g(d).smash.inp (generated)

000176480.b3lyp_6-31g(d).nwchem.inp (generated) 000176480.b3lyp_6-31g(d).log.xz 000176480.td-b3lyp_6-31g+(d).inp 000176480.td-b3lyp_6-31g+(d).log.xz

000176480.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176480.td-b3lyp_6-31+g(d).gjf (generated)

000176480.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176480.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176480.mol 000176480.PUBCHEM 000176480.mol (via Jmol)
000176481.b3lyp_6-31g(d).inp

000176481.b3lyp_6-31g(d).qchem.inp (generated)

000176481.b3lyp_6-31g(d).gjf (generated)

000176481.b3lyp_6-31g(d).firefly.inp (generated)

000176481.b3lyp_6-31g(d).smash.inp (generated)

000176481.b3lyp_6-31g(d).nwchem.inp (generated) 000176481.b3lyp_6-31g(d).log.xz 000176481.mol 000176481.PUBCHEM 000176481.mol (via Jmol)
000176484.b3lyp_6-31g(d).inp

000176484.b3lyp_6-31g(d).qchem.inp (generated)

000176484.b3lyp_6-31g(d).gjf (generated)

000176484.b3lyp_6-31g(d).firefly.inp (generated)

000176484.b3lyp_6-31g(d).smash.inp (generated)

000176484.b3lyp_6-31g(d).nwchem.inp (generated) 000176484.b3lyp_6-31g(d).log.xz 000176484.mol 000176484.PUBCHEM 000176484.mol (via Jmol)
000176485.b3lyp_6-31g(d).inp

000176485.b3lyp_6-31g(d).qchem.inp (generated)

000176485.b3lyp_6-31g(d).gjf (generated)

000176485.b3lyp_6-31g(d).firefly.inp (generated)

000176485.b3lyp_6-31g(d).smash.inp (generated)

000176485.b3lyp_6-31g(d).nwchem.inp (generated) 000176485.b3lyp_6-31g(d).log.xz 000176485.mol 000176485.PUBCHEM 000176485.mol (via Jmol)
000176486.b3lyp_6-31g(d).inp

000176486.b3lyp_6-31g(d).qchem.inp (generated)

000176486.b3lyp_6-31g(d).gjf (generated)

000176486.b3lyp_6-31g(d).firefly.inp (generated)

000176486.b3lyp_6-31g(d).smash.inp (generated)

000176486.b3lyp_6-31g(d).nwchem.inp (generated) 000176486.b3lyp_6-31g(d).log.xz 000176486.mol 000176486.PUBCHEM 000176486.mol (via Jmol)
000176490.b3lyp_6-31g(d).inp

000176490.b3lyp_6-31g(d).qchem.inp (generated)

000176490.b3lyp_6-31g(d).gjf (generated)

000176490.b3lyp_6-31g(d).firefly.inp (generated)

000176490.b3lyp_6-31g(d).smash.inp (generated)

000176490.b3lyp_6-31g(d).nwchem.inp (generated) 000176490.b3lyp_6-31g(d).log.xz 000176490.td-b3lyp_6-31g+(d).inp 000176490.td-b3lyp_6-31g+(d).log.xz

000176490.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176490.td-b3lyp_6-31+g(d).gjf (generated)

000176490.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176490.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176490.mol 000176490.PUBCHEM 000176490.mol (via Jmol)
000176501.b3lyp_6-31g(d).inp

000176501.b3lyp_6-31g(d).qchem.inp (generated)

000176501.b3lyp_6-31g(d).gjf (generated)

000176501.b3lyp_6-31g(d).firefly.inp (generated)

000176501.b3lyp_6-31g(d).smash.inp (generated)

000176501.b3lyp_6-31g(d).nwchem.inp (generated) 000176501.b3lyp_6-31g(d).log.xz 000176501.td-b3lyp_6-31g+(d).inp 000176501.td-b3lyp_6-31g+(d).log.xz

000176501.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176501.td-b3lyp_6-31+g(d).gjf (generated)

000176501.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176501.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176501.mol 000176501.PUBCHEM 000176501.mol (via Jmol)
000176503.b3lyp_6-31g(d).inp

000176503.b3lyp_6-31g(d).qchem.inp (generated)

000176503.b3lyp_6-31g(d).gjf (generated)

000176503.b3lyp_6-31g(d).firefly.inp (generated)

000176503.b3lyp_6-31g(d).smash.inp (generated)

000176503.b3lyp_6-31g(d).nwchem.inp (generated) 000176503.b3lyp_6-31g(d).log.xz 000176503.td-b3lyp_6-31g+(d).inp 000176503.td-b3lyp_6-31g+(d).log.xz

000176503.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176503.td-b3lyp_6-31+g(d).gjf (generated)

000176503.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176503.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176503.mol 000176503.PUBCHEM 000176503.mol (via Jmol)
000176504.b3lyp_6-31g(d).inp

000176504.b3lyp_6-31g(d).qchem.inp (generated)

000176504.b3lyp_6-31g(d).gjf (generated)

000176504.b3lyp_6-31g(d).firefly.inp (generated)

000176504.b3lyp_6-31g(d).smash.inp (generated)

000176504.b3lyp_6-31g(d).nwchem.inp (generated) 000176504.b3lyp_6-31g(d).log.xz 000176504.td-b3lyp_6-31g+(d).inp 000176504.td-b3lyp_6-31g+(d).log.xz

000176504.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176504.td-b3lyp_6-31+g(d).gjf (generated)

000176504.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176504.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176504.mol 000176504.PUBCHEM 000176504.mol (via Jmol)
000176505.b3lyp_6-31g(d).inp

000176505.b3lyp_6-31g(d).qchem.inp (generated)

000176505.b3lyp_6-31g(d).gjf (generated)

000176505.b3lyp_6-31g(d).firefly.inp (generated)

000176505.b3lyp_6-31g(d).smash.inp (generated)

000176505.b3lyp_6-31g(d).nwchem.inp (generated) 000176505.b3lyp_6-31g(d).log.xz 000176505.td-b3lyp_6-31g+(d).inp 000176505.td-b3lyp_6-31g+(d).log.xz

000176505.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176505.td-b3lyp_6-31+g(d).gjf (generated)

000176505.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176505.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176505.mol 000176505.PUBCHEM 000176505.mol (via Jmol)
000176507.b3lyp_6-31g(d).inp

000176507.b3lyp_6-31g(d).qchem.inp (generated)

000176507.b3lyp_6-31g(d).gjf (generated)

000176507.b3lyp_6-31g(d).firefly.inp (generated)

000176507.b3lyp_6-31g(d).smash.inp (generated)

000176507.b3lyp_6-31g(d).nwchem.inp (generated) 000176507.b3lyp_6-31g(d).log.xz 000176507.td-b3lyp_6-31g+(d).inp 000176507.td-b3lyp_6-31g+(d).log.xz

000176507.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176507.td-b3lyp_6-31+g(d).gjf (generated)

000176507.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176507.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176507.mol 000176507.PUBCHEM 000176507.mol (via Jmol)
000176513.b3lyp_6-31g(d).inp

000176513.b3lyp_6-31g(d).qchem.inp (generated)

000176513.b3lyp_6-31g(d).gjf (generated)

000176513.b3lyp_6-31g(d).firefly.inp (generated)

000176513.b3lyp_6-31g(d).smash.inp (generated)

000176513.b3lyp_6-31g(d).nwchem.inp (generated) 000176513.b3lyp_6-31g(d).log.xz 000176513.mol 000176513.PUBCHEM 000176513.mol (via Jmol)
000176544.b3lyp_6-31g(d).inp

000176544.b3lyp_6-31g(d).qchem.inp (generated)

000176544.b3lyp_6-31g(d).gjf (generated)

000176544.b3lyp_6-31g(d).firefly.inp (generated)

000176544.b3lyp_6-31g(d).smash.inp (generated)

000176544.b3lyp_6-31g(d).nwchem.inp (generated) 000176544.b3lyp_6-31g(d).log.xz 000176544.td-b3lyp_6-31g+(d).inp 000176544.td-b3lyp_6-31g+(d).log.xz

000176544.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176544.td-b3lyp_6-31+g(d).gjf (generated)

000176544.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176544.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176544.mol 000176544.PUBCHEM 000176544.mol (via Jmol)
000176548.b3lyp_6-31g(d).inp

000176548.b3lyp_6-31g(d).qchem.inp (generated)

000176548.b3lyp_6-31g(d).gjf (generated)

000176548.b3lyp_6-31g(d).firefly.inp (generated)

000176548.b3lyp_6-31g(d).smash.inp (generated)

000176548.b3lyp_6-31g(d).nwchem.inp (generated) 000176548.b3lyp_6-31g(d).log.xz 000176548.td-b3lyp_6-31g+(d).inp 000176548.td-b3lyp_6-31g+(d).log.xz

000176548.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176548.td-b3lyp_6-31+g(d).gjf (generated)

000176548.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176548.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176548.mol 000176548.PUBCHEM 000176548.mol (via Jmol)
000176558.b3lyp_6-31g(d).inp

000176558.b3lyp_6-31g(d).qchem.inp (generated)

000176558.b3lyp_6-31g(d).gjf (generated)

000176558.b3lyp_6-31g(d).firefly.inp (generated)

000176558.b3lyp_6-31g(d).smash.inp (generated)

000176558.b3lyp_6-31g(d).nwchem.inp (generated) 000176558.b3lyp_6-31g(d).log.xz 000176558.td-b3lyp_6-31g+(d).inp 000176558.td-b3lyp_6-31g+(d).log.xz

000176558.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176558.td-b3lyp_6-31+g(d).gjf (generated)

000176558.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176558.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176558.mol 000176558.PUBCHEM 000176558.mol (via Jmol)
000176602.b3lyp_6-31g(d).inp

000176602.b3lyp_6-31g(d).qchem.inp (generated)

000176602.b3lyp_6-31g(d).gjf (generated)

000176602.b3lyp_6-31g(d).firefly.inp (generated)

000176602.b3lyp_6-31g(d).smash.inp (generated)

000176602.b3lyp_6-31g(d).nwchem.inp (generated) 000176602.b3lyp_6-31g(d).log.xz 000176602.td-b3lyp_6-31g+(d).inp 000176602.td-b3lyp_6-31g+(d).log.xz

000176602.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176602.td-b3lyp_6-31+g(d).gjf (generated)

000176602.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176602.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176602.mol 000176602.PUBCHEM 000176602.mol (via Jmol)
000176609.b3lyp_6-31g(d).inp

000176609.b3lyp_6-31g(d).qchem.inp (generated)

000176609.b3lyp_6-31g(d).gjf (generated)

000176609.b3lyp_6-31g(d).firefly.inp (generated)

000176609.b3lyp_6-31g(d).smash.inp (generated)

000176609.b3lyp_6-31g(d).nwchem.inp (generated) 000176609.b3lyp_6-31g(d).log.xz 000176609.mol 000176609.PUBCHEM 000176609.mol (via Jmol)
000176615.b3lyp_6-31g(d).inp

000176615.b3lyp_6-31g(d).qchem.inp (generated)

000176615.b3lyp_6-31g(d).gjf (generated)

000176615.b3lyp_6-31g(d).firefly.inp (generated)

000176615.b3lyp_6-31g(d).smash.inp (generated)

000176615.b3lyp_6-31g(d).nwchem.inp (generated) 000176615.b3lyp_6-31g(d).log.xz 000176615.td-b3lyp_6-31g+(d).inp 000176615.td-b3lyp_6-31g+(d).log.xz

000176615.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176615.td-b3lyp_6-31+g(d).gjf (generated)

000176615.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176615.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176615.mol 000176615.PUBCHEM 000176615.mol (via Jmol)
000176616.b3lyp_6-31g(d).inp

000176616.b3lyp_6-31g(d).qchem.inp (generated)

000176616.b3lyp_6-31g(d).gjf (generated)

000176616.b3lyp_6-31g(d).firefly.inp (generated)

000176616.b3lyp_6-31g(d).smash.inp (generated)

000176616.b3lyp_6-31g(d).nwchem.inp (generated) 000176616.b3lyp_6-31g(d).log.xz 000176616.td-b3lyp_6-31g+(d).inp 000176616.td-b3lyp_6-31g+(d).log.xz

000176616.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176616.td-b3lyp_6-31+g(d).gjf (generated)

000176616.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176616.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176616.mol 000176616.PUBCHEM 000176616.mol (via Jmol)
000176617.b3lyp_6-31g(d).inp

000176617.b3lyp_6-31g(d).qchem.inp (generated)

000176617.b3lyp_6-31g(d).gjf (generated)

000176617.b3lyp_6-31g(d).firefly.inp (generated)

000176617.b3lyp_6-31g(d).smash.inp (generated)

000176617.b3lyp_6-31g(d).nwchem.inp (generated) 000176617.b3lyp_6-31g(d).log.xz 000176617.td-b3lyp_6-31g+(d).inp 000176617.td-b3lyp_6-31g+(d).log.xz

000176617.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176617.td-b3lyp_6-31+g(d).gjf (generated)

000176617.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176617.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176617.mol 000176617.PUBCHEM 000176617.mol (via Jmol)
000176622.b3lyp_6-31g(d).inp

000176622.b3lyp_6-31g(d).qchem.inp (generated)

000176622.b3lyp_6-31g(d).gjf (generated)

000176622.b3lyp_6-31g(d).firefly.inp (generated)

000176622.b3lyp_6-31g(d).smash.inp (generated)

000176622.b3lyp_6-31g(d).nwchem.inp (generated) 000176622.b3lyp_6-31g(d).log.xz 000176622.td-b3lyp_6-31g+(d).inp 000176622.td-b3lyp_6-31g+(d).log.xz

000176622.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176622.td-b3lyp_6-31+g(d).gjf (generated)

000176622.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176622.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176622.mol 000176622.PUBCHEM 000176622.mol (via Jmol)
000176630.b3lyp_6-31g(d).inp

000176630.b3lyp_6-31g(d).qchem.inp (generated)

000176630.b3lyp_6-31g(d).gjf (generated)

000176630.b3lyp_6-31g(d).firefly.inp (generated)

000176630.b3lyp_6-31g(d).smash.inp (generated)

000176630.b3lyp_6-31g(d).nwchem.inp (generated) 000176630.b3lyp_6-31g(d).log.xz 000176630.mol 000176630.PUBCHEM 000176630.mol (via Jmol)
000176634.b3lyp_6-31g(d).inp

000176634.b3lyp_6-31g(d).qchem.inp (generated)

000176634.b3lyp_6-31g(d).gjf (generated)

000176634.b3lyp_6-31g(d).firefly.inp (generated)

000176634.b3lyp_6-31g(d).smash.inp (generated)

000176634.b3lyp_6-31g(d).nwchem.inp (generated) 000176634.b3lyp_6-31g(d).log.xz 000176634.td-b3lyp_6-31g+(d).inp 000176634.td-b3lyp_6-31g+(d).log.xz

000176634.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176634.td-b3lyp_6-31+g(d).gjf (generated)

000176634.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176634.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176634.mol 000176634.PUBCHEM 000176634.mol (via Jmol)
000176639.b3lyp_6-31g(d).inp

000176639.b3lyp_6-31g(d).qchem.inp (generated)

000176639.b3lyp_6-31g(d).gjf (generated)

000176639.b3lyp_6-31g(d).firefly.inp (generated)

000176639.b3lyp_6-31g(d).smash.inp (generated)

000176639.b3lyp_6-31g(d).nwchem.inp (generated) 000176639.b3lyp_6-31g(d).log.xz 000176639.td-b3lyp_6-31g+(d).inp 000176639.td-b3lyp_6-31g+(d).log.xz

000176639.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176639.td-b3lyp_6-31+g(d).gjf (generated)

000176639.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176639.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176639.mol 000176639.PUBCHEM 000176639.mol (via Jmol)
000176640.b3lyp_6-31g(d).inp

000176640.b3lyp_6-31g(d).qchem.inp (generated)

000176640.b3lyp_6-31g(d).gjf (generated)

000176640.b3lyp_6-31g(d).firefly.inp (generated)

000176640.b3lyp_6-31g(d).smash.inp (generated)

000176640.b3lyp_6-31g(d).nwchem.inp (generated) 000176640.b3lyp_6-31g(d).log.xz 000176640.td-b3lyp_6-31g+(d).inp 000176640.td-b3lyp_6-31g+(d).log.xz

000176640.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176640.td-b3lyp_6-31+g(d).gjf (generated)

000176640.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176640.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176640.mol 000176640.PUBCHEM 000176640.mol (via Jmol)
000176641.b3lyp_6-31g(d).inp

000176641.b3lyp_6-31g(d).qchem.inp (generated)

000176641.b3lyp_6-31g(d).gjf (generated)

000176641.b3lyp_6-31g(d).firefly.inp (generated)

000176641.b3lyp_6-31g(d).smash.inp (generated)

000176641.b3lyp_6-31g(d).nwchem.inp (generated) 000176641.b3lyp_6-31g(d).log.xz 000176641.td-b3lyp_6-31g+(d).inp 000176641.td-b3lyp_6-31g+(d).log.xz

000176641.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176641.td-b3lyp_6-31+g(d).gjf (generated)

000176641.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176641.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176641.mol 000176641.PUBCHEM 000176641.mol (via Jmol)
000176645.b3lyp_6-31g(d).inp

000176645.b3lyp_6-31g(d).qchem.inp (generated)

000176645.b3lyp_6-31g(d).gjf (generated)

000176645.b3lyp_6-31g(d).firefly.inp (generated)

000176645.b3lyp_6-31g(d).smash.inp (generated)

000176645.b3lyp_6-31g(d).nwchem.inp (generated) 000176645.b3lyp_6-31g(d).log.xz 000176645.td-b3lyp_6-31g+(d).inp 000176645.td-b3lyp_6-31g+(d).log.xz

000176645.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176645.td-b3lyp_6-31+g(d).gjf (generated)

000176645.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176645.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176645.mol 000176645.PUBCHEM 000176645.mol (via Jmol)
000176687.b3lyp_6-31g(d).inp

000176687.b3lyp_6-31g(d).qchem.inp (generated)

000176687.b3lyp_6-31g(d).gjf (generated)

000176687.b3lyp_6-31g(d).firefly.inp (generated)

000176687.b3lyp_6-31g(d).smash.inp (generated)

000176687.b3lyp_6-31g(d).nwchem.inp (generated) 000176687.b3lyp_6-31g(d).log.xz 000176687.td-b3lyp_6-31g+(d).inp 000176687.td-b3lyp_6-31g+(d).log.xz

000176687.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176687.td-b3lyp_6-31+g(d).gjf (generated)

000176687.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176687.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176687.mol 000176687.PUBCHEM 000176687.mol (via Jmol)
000176691.b3lyp_6-31g(d).inp

000176691.b3lyp_6-31g(d).qchem.inp (generated)

000176691.b3lyp_6-31g(d).gjf (generated)

000176691.b3lyp_6-31g(d).firefly.inp (generated)

000176691.b3lyp_6-31g(d).smash.inp (generated)

000176691.b3lyp_6-31g(d).nwchem.inp (generated) 000176691.b3lyp_6-31g(d).log.xz 000176691.td-b3lyp_6-31g+(d).inp 000176691.td-b3lyp_6-31g+(d).log.xz

000176691.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176691.td-b3lyp_6-31+g(d).gjf (generated)

000176691.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176691.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176691.mol 000176691.PUBCHEM 000176691.mol (via Jmol)
000176692.b3lyp_6-31g(d).inp

000176692.b3lyp_6-31g(d).qchem.inp (generated)

000176692.b3lyp_6-31g(d).gjf (generated)

000176692.b3lyp_6-31g(d).firefly.inp (generated)

000176692.b3lyp_6-31g(d).smash.inp (generated)

000176692.b3lyp_6-31g(d).nwchem.inp (generated) 000176692.b3lyp_6-31g(d).log.xz 000176692.td-b3lyp_6-31g+(d).inp 000176692.td-b3lyp_6-31g+(d).log.xz

000176692.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176692.td-b3lyp_6-31+g(d).gjf (generated)

000176692.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176692.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176692.mol 000176692.PUBCHEM 000176692.mol (via Jmol)
000176704.b3lyp_6-31g(d).inp

000176704.b3lyp_6-31g(d).qchem.inp (generated)

000176704.b3lyp_6-31g(d).gjf (generated)

000176704.b3lyp_6-31g(d).firefly.inp (generated)

000176704.b3lyp_6-31g(d).smash.inp (generated)

000176704.b3lyp_6-31g(d).nwchem.inp (generated) 000176704.b3lyp_6-31g(d).log.xz 000176704.mol 000176704.PUBCHEM 000176704.mol (via Jmol)
000176705.b3lyp_6-31g(d).inp

000176705.b3lyp_6-31g(d).qchem.inp (generated)

000176705.b3lyp_6-31g(d).gjf (generated)

000176705.b3lyp_6-31g(d).firefly.inp (generated)

000176705.b3lyp_6-31g(d).smash.inp (generated)

000176705.b3lyp_6-31g(d).nwchem.inp (generated) 000176705.b3lyp_6-31g(d).log.xz 000176705.td-b3lyp_6-31g+(d).inp 000176705.td-b3lyp_6-31g+(d).log.xz

000176705.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176705.td-b3lyp_6-31+g(d).gjf (generated)

000176705.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176705.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176705.mol 000176705.PUBCHEM 000176705.mol (via Jmol)
000176706.b3lyp_6-31g(d).inp

000176706.b3lyp_6-31g(d).qchem.inp (generated)

000176706.b3lyp_6-31g(d).gjf (generated)

000176706.b3lyp_6-31g(d).firefly.inp (generated)

000176706.b3lyp_6-31g(d).smash.inp (generated)

000176706.b3lyp_6-31g(d).nwchem.inp (generated) 000176706.b3lyp_6-31g(d).log.xz 000176706.td-b3lyp_6-31g+(d).inp 000176706.td-b3lyp_6-31g+(d).log.xz

000176706.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176706.td-b3lyp_6-31+g(d).gjf (generated)

000176706.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176706.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176706.mol 000176706.PUBCHEM 000176706.mol (via Jmol)
000176707.b3lyp_6-31g(d).inp

000176707.b3lyp_6-31g(d).qchem.inp (generated)

000176707.b3lyp_6-31g(d).gjf (generated)

000176707.b3lyp_6-31g(d).firefly.inp (generated)

000176707.b3lyp_6-31g(d).smash.inp (generated)

000176707.b3lyp_6-31g(d).nwchem.inp (generated) 000176707.b3lyp_6-31g(d).log.xz 000176707.td-b3lyp_6-31g+(d).inp 000176707.td-b3lyp_6-31g+(d).log.xz

000176707.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176707.td-b3lyp_6-31+g(d).gjf (generated)

000176707.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176707.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176707.mol 000176707.PUBCHEM 000176707.mol (via Jmol)
000176708.b3lyp_6-31g(d).inp

000176708.b3lyp_6-31g(d).qchem.inp (generated)

000176708.b3lyp_6-31g(d).gjf (generated)

000176708.b3lyp_6-31g(d).firefly.inp (generated)

000176708.b3lyp_6-31g(d).smash.inp (generated)

000176708.b3lyp_6-31g(d).nwchem.inp (generated) 000176708.b3lyp_6-31g(d).log.xz 000176708.td-b3lyp_6-31g+(d).inp 000176708.td-b3lyp_6-31g+(d).log.xz

000176708.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176708.td-b3lyp_6-31+g(d).gjf (generated)

000176708.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176708.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176708.mol 000176708.PUBCHEM 000176708.mol (via Jmol)
000176716.b3lyp_6-31g(d).inp

000176716.b3lyp_6-31g(d).qchem.inp (generated)

000176716.b3lyp_6-31g(d).gjf (generated)

000176716.b3lyp_6-31g(d).firefly.inp (generated)

000176716.b3lyp_6-31g(d).smash.inp (generated)

000176716.b3lyp_6-31g(d).nwchem.inp (generated) 000176716.b3lyp_6-31g(d).log.xz 000176716.mol 000176716.PUBCHEM 000176716.mol (via Jmol)
000176722.b3lyp_6-31g(d).inp

000176722.b3lyp_6-31g(d).qchem.inp (generated)

000176722.b3lyp_6-31g(d).gjf (generated)

000176722.b3lyp_6-31g(d).firefly.inp (generated)

000176722.b3lyp_6-31g(d).smash.inp (generated)

000176722.b3lyp_6-31g(d).nwchem.inp (generated) 000176722.b3lyp_6-31g(d).log.xz 000176722.td-b3lyp_6-31g+(d).inp 000176722.td-b3lyp_6-31g+(d).log.xz

000176722.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176722.td-b3lyp_6-31+g(d).gjf (generated)

000176722.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176722.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176722.mol 000176722.PUBCHEM 000176722.mol (via Jmol)
000176730.b3lyp_6-31g(d).inp

000176730.b3lyp_6-31g(d).qchem.inp (generated)

000176730.b3lyp_6-31g(d).gjf (generated)

000176730.b3lyp_6-31g(d).firefly.inp (generated)

000176730.b3lyp_6-31g(d).smash.inp (generated)

000176730.b3lyp_6-31g(d).nwchem.inp (generated) 000176730.b3lyp_6-31g(d).log.xz 000176730.mol 000176730.PUBCHEM 000176730.mol (via Jmol)
000176733.b3lyp_6-31g(d).inp

000176733.b3lyp_6-31g(d).qchem.inp (generated)

000176733.b3lyp_6-31g(d).gjf (generated)

000176733.b3lyp_6-31g(d).firefly.inp (generated)

000176733.b3lyp_6-31g(d).smash.inp (generated)

000176733.b3lyp_6-31g(d).nwchem.inp (generated) 000176733.b3lyp_6-31g(d).log.xz 000176733.td-b3lyp_6-31g+(d).inp 000176733.td-b3lyp_6-31g+(d).log.xz

000176733.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176733.td-b3lyp_6-31+g(d).gjf (generated)

000176733.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176733.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176733.mol 000176733.PUBCHEM 000176733.mol (via Jmol)
000176776.b3lyp_6-31g(d).inp

000176776.b3lyp_6-31g(d).qchem.inp (generated)

000176776.b3lyp_6-31g(d).gjf (generated)

000176776.b3lyp_6-31g(d).firefly.inp (generated)

000176776.b3lyp_6-31g(d).smash.inp (generated)

000176776.b3lyp_6-31g(d).nwchem.inp (generated) 000176776.b3lyp_6-31g(d).log.xz 000176776.td-b3lyp_6-31g+(d).inp 000176776.td-b3lyp_6-31g+(d).log.xz

000176776.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176776.td-b3lyp_6-31+g(d).gjf (generated)

000176776.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176776.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176776.mol 000176776.PUBCHEM 000176776.mol (via Jmol)
000176777.b3lyp_6-31g(d).inp

000176777.b3lyp_6-31g(d).qchem.inp (generated)

000176777.b3lyp_6-31g(d).gjf (generated)

000176777.b3lyp_6-31g(d).firefly.inp (generated)

000176777.b3lyp_6-31g(d).smash.inp (generated)

000176777.b3lyp_6-31g(d).nwchem.inp (generated) 000176777.b3lyp_6-31g(d).log.xz 000176777.mol 000176777.PUBCHEM 000176777.mol (via Jmol)
000176799.b3lyp_6-31g(d).inp

000176799.b3lyp_6-31g(d).qchem.inp (generated)

000176799.b3lyp_6-31g(d).gjf (generated)

000176799.b3lyp_6-31g(d).firefly.inp (generated)

000176799.b3lyp_6-31g(d).smash.inp (generated)

000176799.b3lyp_6-31g(d).nwchem.inp (generated) 000176799.b3lyp_6-31g(d).log.xz 000176799.td-b3lyp_6-31g+(d).inp 000176799.td-b3lyp_6-31g+(d).log.xz

000176799.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176799.td-b3lyp_6-31+g(d).gjf (generated)

000176799.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176799.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176799.mol 000176799.PUBCHEM 000176799.mol (via Jmol)
000176801.b3lyp_6-31g(d).inp

000176801.b3lyp_6-31g(d).qchem.inp (generated)

000176801.b3lyp_6-31g(d).gjf (generated)

000176801.b3lyp_6-31g(d).firefly.inp (generated)

000176801.b3lyp_6-31g(d).smash.inp (generated)

000176801.b3lyp_6-31g(d).nwchem.inp (generated) 000176801.b3lyp_6-31g(d).log.xz 000176801.mol 000176801.PUBCHEM 000176801.mol (via Jmol)
000176802.b3lyp_6-31g(d).inp

000176802.b3lyp_6-31g(d).qchem.inp (generated)

000176802.b3lyp_6-31g(d).gjf (generated)

000176802.b3lyp_6-31g(d).firefly.inp (generated)

000176802.b3lyp_6-31g(d).smash.inp (generated)

000176802.b3lyp_6-31g(d).nwchem.inp (generated) 000176802.b3lyp_6-31g(d).log.xz 000176802.mol 000176802.PUBCHEM 000176802.mol (via Jmol)
000176804.b3lyp_6-31g(d).inp

000176804.b3lyp_6-31g(d).qchem.inp (generated)

000176804.b3lyp_6-31g(d).gjf (generated)

000176804.b3lyp_6-31g(d).firefly.inp (generated)

000176804.b3lyp_6-31g(d).smash.inp (generated)

000176804.b3lyp_6-31g(d).nwchem.inp (generated) 000176804.b3lyp_6-31g(d).log.xz 000176804.td-b3lyp_6-31g+(d).inp 000176804.td-b3lyp_6-31g+(d).log.xz

000176804.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176804.td-b3lyp_6-31+g(d).gjf (generated)

000176804.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176804.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176804.mol 000176804.PUBCHEM 000176804.mol (via Jmol)
000176806.b3lyp_6-31g(d).inp

000176806.b3lyp_6-31g(d).qchem.inp (generated)

000176806.b3lyp_6-31g(d).gjf (generated)

000176806.b3lyp_6-31g(d).firefly.inp (generated)

000176806.b3lyp_6-31g(d).smash.inp (generated)

000176806.b3lyp_6-31g(d).nwchem.inp (generated) 000176806.b3lyp_6-31g(d).log.xz 000176806.td-b3lyp_6-31g+(d).inp 000176806.td-b3lyp_6-31g+(d).log.xz

000176806.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176806.td-b3lyp_6-31+g(d).gjf (generated)

000176806.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176806.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176806.mol 000176806.PUBCHEM 000176806.mol (via Jmol)
000176807.b3lyp_6-31g(d).inp

000176807.b3lyp_6-31g(d).qchem.inp (generated)

000176807.b3lyp_6-31g(d).gjf (generated)

000176807.b3lyp_6-31g(d).firefly.inp (generated)

000176807.b3lyp_6-31g(d).smash.inp (generated)

000176807.b3lyp_6-31g(d).nwchem.inp (generated) 000176807.b3lyp_6-31g(d).log.xz 000176807.td-b3lyp_6-31g+(d).inp 000176807.td-b3lyp_6-31g+(d).log.xz

000176807.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176807.td-b3lyp_6-31+g(d).gjf (generated)

000176807.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176807.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176807.mol 000176807.PUBCHEM 000176807.mol (via Jmol)
000176808.b3lyp_6-31g(d).inp

000176808.b3lyp_6-31g(d).qchem.inp (generated)

000176808.b3lyp_6-31g(d).gjf (generated)

000176808.b3lyp_6-31g(d).firefly.inp (generated)

000176808.b3lyp_6-31g(d).smash.inp (generated)

000176808.b3lyp_6-31g(d).nwchem.inp (generated) 000176808.b3lyp_6-31g(d).log.xz 000176808.td-b3lyp_6-31g+(d).inp 000176808.td-b3lyp_6-31g+(d).log.xz

000176808.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176808.td-b3lyp_6-31+g(d).gjf (generated)

000176808.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176808.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176808.mol 000176808.PUBCHEM 000176808.mol (via Jmol)
000176809.b3lyp_6-31g(d).inp

000176809.b3lyp_6-31g(d).qchem.inp (generated)

000176809.b3lyp_6-31g(d).gjf (generated)

000176809.b3lyp_6-31g(d).firefly.inp (generated)

000176809.b3lyp_6-31g(d).smash.inp (generated)

000176809.b3lyp_6-31g(d).nwchem.inp (generated) 000176809.b3lyp_6-31g(d).log.xz 000176809.td-b3lyp_6-31g+(d).inp 000176809.td-b3lyp_6-31g+(d).log.xz

000176809.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176809.td-b3lyp_6-31+g(d).gjf (generated)

000176809.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176809.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176809.mol 000176809.PUBCHEM 000176809.mol (via Jmol)
000176810.b3lyp_6-31g(d).inp

000176810.b3lyp_6-31g(d).qchem.inp (generated)

000176810.b3lyp_6-31g(d).gjf (generated)

000176810.b3lyp_6-31g(d).firefly.inp (generated)

000176810.b3lyp_6-31g(d).smash.inp (generated)

000176810.b3lyp_6-31g(d).nwchem.inp (generated) 000176810.b3lyp_6-31g(d).log.xz 000176810.td-b3lyp_6-31g+(d).inp 000176810.td-b3lyp_6-31g+(d).log.xz

000176810.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176810.td-b3lyp_6-31+g(d).gjf (generated)

000176810.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176810.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176810.mol 000176810.PUBCHEM 000176810.mol (via Jmol)
000176821.b3lyp_6-31g(d).inp

000176821.b3lyp_6-31g(d).qchem.inp (generated)

000176821.b3lyp_6-31g(d).gjf (generated)

000176821.b3lyp_6-31g(d).firefly.inp (generated)

000176821.b3lyp_6-31g(d).smash.inp (generated)

000176821.b3lyp_6-31g(d).nwchem.inp (generated) 000176821.b3lyp_6-31g(d).log.xz 000176821.td-b3lyp_6-31g+(d).inp 000176821.td-b3lyp_6-31g+(d).log.xz

000176821.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176821.td-b3lyp_6-31+g(d).gjf (generated)

000176821.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176821.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176821.mol 000176821.PUBCHEM 000176821.mol (via Jmol)
000176865.b3lyp_6-31g(d).inp

000176865.b3lyp_6-31g(d).qchem.inp (generated)

000176865.b3lyp_6-31g(d).gjf (generated)

000176865.b3lyp_6-31g(d).firefly.inp (generated)

000176865.b3lyp_6-31g(d).smash.inp (generated)

000176865.b3lyp_6-31g(d).nwchem.inp (generated) 000176865.b3lyp_6-31g(d).log.xz 000176865.td-b3lyp_6-31g+(d).inp 000176865.td-b3lyp_6-31g+(d).log.xz

000176865.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176865.td-b3lyp_6-31+g(d).gjf (generated)

000176865.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176865.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176865.mol 000176865.PUBCHEM 000176865.mol (via Jmol)
000176887.b3lyp_6-31g(d).inp

000176887.b3lyp_6-31g(d).qchem.inp (generated)

000176887.b3lyp_6-31g(d).gjf (generated)

000176887.b3lyp_6-31g(d).firefly.inp (generated)

000176887.b3lyp_6-31g(d).smash.inp (generated)

000176887.b3lyp_6-31g(d).nwchem.inp (generated) 000176887.b3lyp_6-31g(d).log.xz 000176887.td-b3lyp_6-31g+(d).inp 000176887.td-b3lyp_6-31g+(d).log.xz

000176887.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176887.td-b3lyp_6-31+g(d).gjf (generated)

000176887.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176887.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176887.mol 000176887.PUBCHEM 000176887.mol (via Jmol)
000176889.b3lyp_6-31g(d).inp

000176889.b3lyp_6-31g(d).qchem.inp (generated)

000176889.b3lyp_6-31g(d).gjf (generated)

000176889.b3lyp_6-31g(d).firefly.inp (generated)

000176889.b3lyp_6-31g(d).smash.inp (generated)

000176889.b3lyp_6-31g(d).nwchem.inp (generated) 000176889.b3lyp_6-31g(d).log.xz 000176889.td-b3lyp_6-31g+(d).inp 000176889.td-b3lyp_6-31g+(d).log.xz

000176889.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176889.td-b3lyp_6-31+g(d).gjf (generated)

000176889.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176889.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176889.mol 000176889.PUBCHEM 000176889.mol (via Jmol)
000176891.b3lyp_6-31g(d).inp

000176891.b3lyp_6-31g(d).qchem.inp (generated)

000176891.b3lyp_6-31g(d).gjf (generated)

000176891.b3lyp_6-31g(d).firefly.inp (generated)

000176891.b3lyp_6-31g(d).smash.inp (generated)

000176891.b3lyp_6-31g(d).nwchem.inp (generated) 000176891.b3lyp_6-31g(d).log.xz 000176891.td-b3lyp_6-31g+(d).inp 000176891.td-b3lyp_6-31g+(d).log.xz

000176891.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176891.td-b3lyp_6-31+g(d).gjf (generated)

000176891.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176891.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176891.mol 000176891.PUBCHEM 000176891.mol (via Jmol)
000176892.b3lyp_6-31g(d).inp

000176892.b3lyp_6-31g(d).qchem.inp (generated)

000176892.b3lyp_6-31g(d).gjf (generated)

000176892.b3lyp_6-31g(d).firefly.inp (generated)

000176892.b3lyp_6-31g(d).smash.inp (generated)

000176892.b3lyp_6-31g(d).nwchem.inp (generated) 000176892.b3lyp_6-31g(d).log.xz 000176892.mol 000176892.PUBCHEM 000176892.mol (via Jmol)
000176894.b3lyp_6-31g(d).inp

000176894.b3lyp_6-31g(d).qchem.inp (generated)

000176894.b3lyp_6-31g(d).gjf (generated)

000176894.b3lyp_6-31g(d).firefly.inp (generated)

000176894.b3lyp_6-31g(d).smash.inp (generated)

000176894.b3lyp_6-31g(d).nwchem.inp (generated) 000176894.b3lyp_6-31g(d).log.xz 000176894.td-b3lyp_6-31g+(d).inp 000176894.td-b3lyp_6-31g+(d).log.xz

000176894.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176894.td-b3lyp_6-31+g(d).gjf (generated)

000176894.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176894.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176894.mol 000176894.PUBCHEM 000176894.mol (via Jmol)
000176896.b3lyp_6-31g(d).inp

000176896.b3lyp_6-31g(d).qchem.inp (generated)

000176896.b3lyp_6-31g(d).gjf (generated)

000176896.b3lyp_6-31g(d).firefly.inp (generated)

000176896.b3lyp_6-31g(d).smash.inp (generated)

000176896.b3lyp_6-31g(d).nwchem.inp (generated) 000176896.b3lyp_6-31g(d).log.xz 000176896.td-b3lyp_6-31g+(d).inp 000176896.td-b3lyp_6-31g+(d).log.xz

000176896.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176896.td-b3lyp_6-31+g(d).gjf (generated)

000176896.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176896.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176896.mol 000176896.PUBCHEM 000176896.mol (via Jmol)
000176897.b3lyp_6-31g(d).inp

000176897.b3lyp_6-31g(d).qchem.inp (generated)

000176897.b3lyp_6-31g(d).gjf (generated)

000176897.b3lyp_6-31g(d).firefly.inp (generated)

000176897.b3lyp_6-31g(d).smash.inp (generated)

000176897.b3lyp_6-31g(d).nwchem.inp (generated) 000176897.b3lyp_6-31g(d).log.xz 000176897.td-b3lyp_6-31g+(d).inp 000176897.td-b3lyp_6-31g+(d).log.xz

000176897.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176897.td-b3lyp_6-31+g(d).gjf (generated)

000176897.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176897.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176897.mol 000176897.PUBCHEM 000176897.mol (via Jmol)
000176900.b3lyp_6-31g(d).inp

000176900.b3lyp_6-31g(d).qchem.inp (generated)

000176900.b3lyp_6-31g(d).gjf (generated)

000176900.b3lyp_6-31g(d).firefly.inp (generated)

000176900.b3lyp_6-31g(d).smash.inp (generated)

000176900.b3lyp_6-31g(d).nwchem.inp (generated) 000176900.b3lyp_6-31g(d).log.xz 000176900.td-b3lyp_6-31g+(d).inp 000176900.td-b3lyp_6-31g+(d).log.xz

000176900.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176900.td-b3lyp_6-31+g(d).gjf (generated)

000176900.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176900.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176900.mol 000176900.PUBCHEM 000176900.mol (via Jmol)
000176913.b3lyp_6-31g(d).inp

000176913.b3lyp_6-31g(d).qchem.inp (generated)

000176913.b3lyp_6-31g(d).gjf (generated)

000176913.b3lyp_6-31g(d).firefly.inp (generated)

000176913.b3lyp_6-31g(d).smash.inp (generated)

000176913.b3lyp_6-31g(d).nwchem.inp (generated) 000176913.b3lyp_6-31g(d).log.xz 000176913.mol 000176913.PUBCHEM 000176913.mol (via Jmol)
000176915.b3lyp_6-31g(d).inp

000176915.b3lyp_6-31g(d).qchem.inp (generated)

000176915.b3lyp_6-31g(d).gjf (generated)

000176915.b3lyp_6-31g(d).firefly.inp (generated)

000176915.b3lyp_6-31g(d).smash.inp (generated)

000176915.b3lyp_6-31g(d).nwchem.inp (generated) 000176915.b3lyp_6-31g(d).log.xz 000176915.td-b3lyp_6-31g+(d).inp 000176915.td-b3lyp_6-31g+(d).log.xz

000176915.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176915.td-b3lyp_6-31+g(d).gjf (generated)

000176915.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176915.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176915.mol 000176915.PUBCHEM 000176915.mol (via Jmol)
000176921.b3lyp_6-31g(d).inp

000176921.b3lyp_6-31g(d).qchem.inp (generated)

000176921.b3lyp_6-31g(d).gjf (generated)

000176921.b3lyp_6-31g(d).firefly.inp (generated)

000176921.b3lyp_6-31g(d).smash.inp (generated)

000176921.b3lyp_6-31g(d).nwchem.inp (generated) 000176921.b3lyp_6-31g(d).log.xz 000176921.td-b3lyp_6-31g+(d).inp 000176921.td-b3lyp_6-31g+(d).log.xz

000176921.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176921.td-b3lyp_6-31+g(d).gjf (generated)

000176921.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176921.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176921.mol 000176921.PUBCHEM 000176921.mol (via Jmol)
000176923.b3lyp_6-31g(d).inp

000176923.b3lyp_6-31g(d).qchem.inp (generated)

000176923.b3lyp_6-31g(d).gjf (generated)

000176923.b3lyp_6-31g(d).firefly.inp (generated)

000176923.b3lyp_6-31g(d).smash.inp (generated)

000176923.b3lyp_6-31g(d).nwchem.inp (generated) 000176923.b3lyp_6-31g(d).log.xz 000176923.td-b3lyp_6-31g+(d).inp 000176923.td-b3lyp_6-31g+(d).log.xz

000176923.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176923.td-b3lyp_6-31+g(d).gjf (generated)

000176923.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176923.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176923.mol 000176923.PUBCHEM 000176923.mol (via Jmol)
000176925.b3lyp_6-31g(d).inp

000176925.b3lyp_6-31g(d).qchem.inp (generated)

000176925.b3lyp_6-31g(d).gjf (generated)

000176925.b3lyp_6-31g(d).firefly.inp (generated)

000176925.b3lyp_6-31g(d).smash.inp (generated)

000176925.b3lyp_6-31g(d).nwchem.inp (generated) 000176925.b3lyp_6-31g(d).log.xz 000176925.td-b3lyp_6-31g+(d).inp 000176925.td-b3lyp_6-31g+(d).log.xz

000176925.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176925.td-b3lyp_6-31+g(d).gjf (generated)

000176925.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176925.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176925.mol 000176925.PUBCHEM 000176925.mol (via Jmol)
000176928.b3lyp_6-31g(d).inp

000176928.b3lyp_6-31g(d).qchem.inp (generated)

000176928.b3lyp_6-31g(d).gjf (generated)

000176928.b3lyp_6-31g(d).firefly.inp (generated)

000176928.b3lyp_6-31g(d).smash.inp (generated)

000176928.b3lyp_6-31g(d).nwchem.inp (generated) 000176928.b3lyp_6-31g(d).log.xz 000176928.td-b3lyp_6-31g+(d).inp 000176928.td-b3lyp_6-31g+(d).log.xz

000176928.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176928.td-b3lyp_6-31+g(d).gjf (generated)

000176928.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176928.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176928.mol 000176928.PUBCHEM 000176928.mol (via Jmol)
000176930.b3lyp_6-31g(d).inp

000176930.b3lyp_6-31g(d).qchem.inp (generated)

000176930.b3lyp_6-31g(d).gjf (generated)

000176930.b3lyp_6-31g(d).firefly.inp (generated)

000176930.b3lyp_6-31g(d).smash.inp (generated)

000176930.b3lyp_6-31g(d).nwchem.inp (generated) 000176930.b3lyp_6-31g(d).log.xz 000176930.mol 000176930.PUBCHEM 000176930.mol (via Jmol)
000176933.b3lyp_6-31g(d).inp

000176933.b3lyp_6-31g(d).qchem.inp (generated)

000176933.b3lyp_6-31g(d).gjf (generated)

000176933.b3lyp_6-31g(d).firefly.inp (generated)

000176933.b3lyp_6-31g(d).smash.inp (generated)

000176933.b3lyp_6-31g(d).nwchem.inp (generated) 000176933.b3lyp_6-31g(d).log.xz 000176933.td-b3lyp_6-31g+(d).inp 000176933.td-b3lyp_6-31g+(d).log.xz

000176933.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176933.td-b3lyp_6-31+g(d).gjf (generated)

000176933.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176933.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176933.mol 000176933.PUBCHEM 000176933.mol (via Jmol)
000176937.b3lyp_6-31g(d).inp

000176937.b3lyp_6-31g(d).qchem.inp (generated)

000176937.b3lyp_6-31g(d).gjf (generated)

000176937.b3lyp_6-31g(d).firefly.inp (generated)

000176937.b3lyp_6-31g(d).smash.inp (generated)

000176937.b3lyp_6-31g(d).nwchem.inp (generated) 000176937.b3lyp_6-31g(d).log.xz 000176937.td-b3lyp_6-31g+(d).inp 000176937.td-b3lyp_6-31g+(d).log.xz

000176937.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176937.td-b3lyp_6-31+g(d).gjf (generated)

000176937.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176937.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176937.mol 000176937.PUBCHEM 000176937.mol (via Jmol)
000176941.b3lyp_6-31g(d).inp

000176941.b3lyp_6-31g(d).qchem.inp (generated)

000176941.b3lyp_6-31g(d).gjf (generated)

000176941.b3lyp_6-31g(d).firefly.inp (generated)

000176941.b3lyp_6-31g(d).smash.inp (generated)

000176941.b3lyp_6-31g(d).nwchem.inp (generated) 000176941.b3lyp_6-31g(d).log.xz 000176941.td-b3lyp_6-31g+(d).inp 000176941.td-b3lyp_6-31g+(d).log.xz

000176941.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176941.td-b3lyp_6-31+g(d).gjf (generated)

000176941.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176941.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176941.mol 000176941.PUBCHEM 000176941.mol (via Jmol)
000176942.b3lyp_6-31g(d).inp

000176942.b3lyp_6-31g(d).qchem.inp (generated)

000176942.b3lyp_6-31g(d).gjf (generated)

000176942.b3lyp_6-31g(d).firefly.inp (generated)

000176942.b3lyp_6-31g(d).smash.inp (generated)

000176942.b3lyp_6-31g(d).nwchem.inp (generated) 000176942.b3lyp_6-31g(d).log.xz 000176942.td-b3lyp_6-31g+(d).inp 000176942.td-b3lyp_6-31g+(d).log.xz

000176942.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176942.td-b3lyp_6-31+g(d).gjf (generated)

000176942.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176942.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176942.mol 000176942.PUBCHEM 000176942.mol (via Jmol)
000176943.b3lyp_6-31g(d).inp

000176943.b3lyp_6-31g(d).qchem.inp (generated)

000176943.b3lyp_6-31g(d).gjf (generated)

000176943.b3lyp_6-31g(d).firefly.inp (generated)

000176943.b3lyp_6-31g(d).smash.inp (generated)

000176943.b3lyp_6-31g(d).nwchem.inp (generated) 000176943.b3lyp_6-31g(d).log.xz 000176943.td-b3lyp_6-31g+(d).inp 000176943.td-b3lyp_6-31g+(d).log.xz

000176943.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176943.td-b3lyp_6-31+g(d).gjf (generated)

000176943.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176943.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176943.mol 000176943.PUBCHEM 000176943.mol (via Jmol)
000176951.b3lyp_6-31g(d).inp

000176951.b3lyp_6-31g(d).qchem.inp (generated)

000176951.b3lyp_6-31g(d).gjf (generated)

000176951.b3lyp_6-31g(d).firefly.inp (generated)

000176951.b3lyp_6-31g(d).smash.inp (generated)

000176951.b3lyp_6-31g(d).nwchem.inp (generated) 000176951.b3lyp_6-31g(d).log.xz 000176951.td-b3lyp_6-31g+(d).inp 000176951.td-b3lyp_6-31g+(d).log.xz

000176951.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176951.td-b3lyp_6-31+g(d).gjf (generated)

000176951.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176951.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176951.mol 000176951.PUBCHEM 000176951.mol (via Jmol)
000176953.b3lyp_6-31g(d).inp

000176953.b3lyp_6-31g(d).qchem.inp (generated)

000176953.b3lyp_6-31g(d).gjf (generated)

000176953.b3lyp_6-31g(d).firefly.inp (generated)

000176953.b3lyp_6-31g(d).smash.inp (generated)

000176953.b3lyp_6-31g(d).nwchem.inp (generated) 000176953.b3lyp_6-31g(d).log.xz 000176953.td-b3lyp_6-31g+(d).inp 000176953.td-b3lyp_6-31g+(d).log.xz

000176953.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176953.td-b3lyp_6-31+g(d).gjf (generated)

000176953.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176953.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176953.mol 000176953.PUBCHEM 000176953.mol (via Jmol)
000176954.b3lyp_6-31g(d).inp

000176954.b3lyp_6-31g(d).qchem.inp (generated)

000176954.b3lyp_6-31g(d).gjf (generated)

000176954.b3lyp_6-31g(d).firefly.inp (generated)

000176954.b3lyp_6-31g(d).smash.inp (generated)

000176954.b3lyp_6-31g(d).nwchem.inp (generated) 000176954.b3lyp_6-31g(d).log.xz 000176954.td-b3lyp_6-31g+(d).inp 000176954.td-b3lyp_6-31g+(d).log.xz

000176954.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176954.td-b3lyp_6-31+g(d).gjf (generated)

000176954.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176954.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176954.mol 000176954.PUBCHEM 000176954.mol (via Jmol)
000176956.b3lyp_6-31g(d).inp

000176956.b3lyp_6-31g(d).qchem.inp (generated)

000176956.b3lyp_6-31g(d).gjf (generated)

000176956.b3lyp_6-31g(d).firefly.inp (generated)

000176956.b3lyp_6-31g(d).smash.inp (generated)

000176956.b3lyp_6-31g(d).nwchem.inp (generated) 000176956.b3lyp_6-31g(d).log.xz 000176956.td-b3lyp_6-31g+(d).inp 000176956.td-b3lyp_6-31g+(d).log.xz

000176956.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176956.td-b3lyp_6-31+g(d).gjf (generated)

000176956.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176956.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176956.mol 000176956.PUBCHEM 000176956.mol (via Jmol)
000176958.b3lyp_6-31g(d).inp

000176958.b3lyp_6-31g(d).qchem.inp (generated)

000176958.b3lyp_6-31g(d).gjf (generated)

000176958.b3lyp_6-31g(d).firefly.inp (generated)

000176958.b3lyp_6-31g(d).smash.inp (generated)

000176958.b3lyp_6-31g(d).nwchem.inp (generated) 000176958.b3lyp_6-31g(d).log.xz 000176958.td-b3lyp_6-31g+(d).inp 000176958.td-b3lyp_6-31g+(d).log.xz

000176958.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176958.td-b3lyp_6-31+g(d).gjf (generated)

000176958.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176958.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176958.mol 000176958.PUBCHEM 000176958.mol (via Jmol)
000176960.b3lyp_6-31g(d).inp

000176960.b3lyp_6-31g(d).qchem.inp (generated)

000176960.b3lyp_6-31g(d).gjf (generated)

000176960.b3lyp_6-31g(d).firefly.inp (generated)

000176960.b3lyp_6-31g(d).smash.inp (generated)

000176960.b3lyp_6-31g(d).nwchem.inp (generated) 000176960.b3lyp_6-31g(d).log.xz 000176960.td-b3lyp_6-31g+(d).inp 000176960.td-b3lyp_6-31g+(d).log.xz

000176960.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176960.td-b3lyp_6-31+g(d).gjf (generated)

000176960.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176960.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176960.mol 000176960.PUBCHEM 000176960.mol (via Jmol)
000176962.b3lyp_6-31g(d).inp

000176962.b3lyp_6-31g(d).qchem.inp (generated)

000176962.b3lyp_6-31g(d).gjf (generated)

000176962.b3lyp_6-31g(d).firefly.inp (generated)

000176962.b3lyp_6-31g(d).smash.inp (generated)

000176962.b3lyp_6-31g(d).nwchem.inp (generated) 000176962.b3lyp_6-31g(d).log.xz 000176962.mol 000176962.PUBCHEM 000176962.mol (via Jmol)
000176975.b3lyp_6-31g(d).inp

000176975.b3lyp_6-31g(d).qchem.inp (generated)

000176975.b3lyp_6-31g(d).gjf (generated)

000176975.b3lyp_6-31g(d).firefly.inp (generated)

000176975.b3lyp_6-31g(d).smash.inp (generated)

000176975.b3lyp_6-31g(d).nwchem.inp (generated) 000176975.b3lyp_6-31g(d).log.xz 000176975.td-b3lyp_6-31g+(d).inp 000176975.td-b3lyp_6-31g+(d).log.xz

000176975.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176975.td-b3lyp_6-31+g(d).gjf (generated)

000176975.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176975.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176975.mol 000176975.PUBCHEM 000176975.mol (via Jmol)
000176977.b3lyp_6-31g(d).inp

000176977.b3lyp_6-31g(d).qchem.inp (generated)

000176977.b3lyp_6-31g(d).gjf (generated)

000176977.b3lyp_6-31g(d).firefly.inp (generated)

000176977.b3lyp_6-31g(d).smash.inp (generated)

000176977.b3lyp_6-31g(d).nwchem.inp (generated) 000176977.b3lyp_6-31g(d).log.xz 000176977.td-b3lyp_6-31g+(d).inp 000176977.td-b3lyp_6-31g+(d).log.xz

000176977.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176977.td-b3lyp_6-31+g(d).gjf (generated)

000176977.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176977.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176977.mol 000176977.PUBCHEM 000176977.mol (via Jmol)
000176978.b3lyp_6-31g(d).inp

000176978.b3lyp_6-31g(d).qchem.inp (generated)

000176978.b3lyp_6-31g(d).gjf (generated)

000176978.b3lyp_6-31g(d).firefly.inp (generated)

000176978.b3lyp_6-31g(d).smash.inp (generated)

000176978.b3lyp_6-31g(d).nwchem.inp (generated) 000176978.b3lyp_6-31g(d).log.xz 000176978.td-b3lyp_6-31g+(d).inp 000176978.td-b3lyp_6-31g+(d).log.xz

000176978.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176978.td-b3lyp_6-31+g(d).gjf (generated)

000176978.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176978.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176978.mol 000176978.PUBCHEM 000176978.mol (via Jmol)
000176980.b3lyp_6-31g(d).inp

000176980.b3lyp_6-31g(d).qchem.inp (generated)

000176980.b3lyp_6-31g(d).gjf (generated)

000176980.b3lyp_6-31g(d).firefly.inp (generated)

000176980.b3lyp_6-31g(d).smash.inp (generated)

000176980.b3lyp_6-31g(d).nwchem.inp (generated) 000176980.b3lyp_6-31g(d).log.xz 000176980.td-b3lyp_6-31g+(d).inp 000176980.td-b3lyp_6-31g+(d).log.xz

000176980.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176980.td-b3lyp_6-31+g(d).gjf (generated)

000176980.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176980.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176980.mol 000176980.PUBCHEM 000176980.mol (via Jmol)
000176983.b3lyp_6-31g(d).inp

000176983.b3lyp_6-31g(d).qchem.inp (generated)

000176983.b3lyp_6-31g(d).gjf (generated)

000176983.b3lyp_6-31g(d).firefly.inp (generated)

000176983.b3lyp_6-31g(d).smash.inp (generated)

000176983.b3lyp_6-31g(d).nwchem.inp (generated) 000176983.b3lyp_6-31g(d).log.xz 000176983.td-b3lyp_6-31g+(d).inp 000176983.td-b3lyp_6-31g+(d).log.xz

000176983.td-b3lyp_6-31+g(d).qchem.inp (generated)

000176983.td-b3lyp_6-31+g(d).gjf (generated)

000176983.td-b3lyp_6-31+g(d).firefly.inp (generated)

000176983.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000176983.mol 000176983.PUBCHEM 000176983.mol (via Jmol)
000177008.b3lyp_6-31g(d).inp

000177008.b3lyp_6-31g(d).qchem.inp (generated)

000177008.b3lyp_6-31g(d).gjf (generated)

000177008.b3lyp_6-31g(d).firefly.inp (generated)

000177008.b3lyp_6-31g(d).smash.inp (generated)

000177008.b3lyp_6-31g(d).nwchem.inp (generated) 000177008.b3lyp_6-31g(d).log.xz 000177008.td-b3lyp_6-31g+(d).inp 000177008.td-b3lyp_6-31g+(d).log.xz

000177008.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177008.td-b3lyp_6-31+g(d).gjf (generated)

000177008.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177008.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177008.mol 000177008.PUBCHEM 000177008.mol (via Jmol)
000177009.b3lyp_6-31g(d).inp

000177009.b3lyp_6-31g(d).qchem.inp (generated)

000177009.b3lyp_6-31g(d).gjf (generated)

000177009.b3lyp_6-31g(d).firefly.inp (generated)

000177009.b3lyp_6-31g(d).smash.inp (generated)

000177009.b3lyp_6-31g(d).nwchem.inp (generated) 000177009.b3lyp_6-31g(d).log.xz 000177009.td-b3lyp_6-31g+(d).inp 000177009.td-b3lyp_6-31g+(d).log.xz

000177009.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177009.td-b3lyp_6-31+g(d).gjf (generated)

000177009.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177009.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177009.mol 000177009.PUBCHEM 000177009.mol (via Jmol)
000177010.b3lyp_6-31g(d).inp

000177010.b3lyp_6-31g(d).qchem.inp (generated)

000177010.b3lyp_6-31g(d).gjf (generated)

000177010.b3lyp_6-31g(d).firefly.inp (generated)

000177010.b3lyp_6-31g(d).smash.inp (generated)

000177010.b3lyp_6-31g(d).nwchem.inp (generated) 000177010.b3lyp_6-31g(d).log.xz 000177010.td-b3lyp_6-31g+(d).inp 000177010.td-b3lyp_6-31g+(d).log.xz

000177010.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177010.td-b3lyp_6-31+g(d).gjf (generated)

000177010.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177010.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177010.mol 000177010.PUBCHEM 000177010.mol (via Jmol)
000177018.b3lyp_6-31g(d).inp

000177018.b3lyp_6-31g(d).qchem.inp (generated)

000177018.b3lyp_6-31g(d).gjf (generated)

000177018.b3lyp_6-31g(d).firefly.inp (generated)

000177018.b3lyp_6-31g(d).smash.inp (generated)

000177018.b3lyp_6-31g(d).nwchem.inp (generated) 000177018.b3lyp_6-31g(d).log.xz 000177018.td-b3lyp_6-31g+(d).inp 000177018.td-b3lyp_6-31g+(d).log.xz

000177018.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177018.td-b3lyp_6-31+g(d).gjf (generated)

000177018.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177018.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177018.mol 000177018.PUBCHEM 000177018.mol (via Jmol)
000177024.b3lyp_6-31g(d).inp

000177024.b3lyp_6-31g(d).qchem.inp (generated)

000177024.b3lyp_6-31g(d).gjf (generated)

000177024.b3lyp_6-31g(d).firefly.inp (generated)

000177024.b3lyp_6-31g(d).smash.inp (generated)

000177024.b3lyp_6-31g(d).nwchem.inp (generated) 000177024.b3lyp_6-31g(d).log.xz 000177024.td-b3lyp_6-31g+(d).inp 000177024.td-b3lyp_6-31g+(d).log.xz

000177024.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177024.td-b3lyp_6-31+g(d).gjf (generated)

000177024.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177024.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177024.mol 000177024.PUBCHEM 000177024.mol (via Jmol)
000177027.b3lyp_6-31g(d).inp

000177027.b3lyp_6-31g(d).qchem.inp (generated)

000177027.b3lyp_6-31g(d).gjf (generated)

000177027.b3lyp_6-31g(d).firefly.inp (generated)

000177027.b3lyp_6-31g(d).smash.inp (generated)

000177027.b3lyp_6-31g(d).nwchem.inp (generated) 000177027.b3lyp_6-31g(d).log.xz 000177027.mol 000177027.PUBCHEM 000177027.mol (via Jmol)
000177028.b3lyp_6-31g(d).inp

000177028.b3lyp_6-31g(d).qchem.inp (generated)

000177028.b3lyp_6-31g(d).gjf (generated)

000177028.b3lyp_6-31g(d).firefly.inp (generated)

000177028.b3lyp_6-31g(d).smash.inp (generated)

000177028.b3lyp_6-31g(d).nwchem.inp (generated) 000177028.b3lyp_6-31g(d).log.xz 000177028.td-b3lyp_6-31g+(d).inp 000177028.td-b3lyp_6-31g+(d).log.xz

000177028.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177028.td-b3lyp_6-31+g(d).gjf (generated)

000177028.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177028.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177028.mol 000177028.PUBCHEM 000177028.mol (via Jmol)
000177029.b3lyp_6-31g(d).inp

000177029.b3lyp_6-31g(d).qchem.inp (generated)

000177029.b3lyp_6-31g(d).gjf (generated)

000177029.b3lyp_6-31g(d).firefly.inp (generated)

000177029.b3lyp_6-31g(d).smash.inp (generated)

000177029.b3lyp_6-31g(d).nwchem.inp (generated) 000177029.b3lyp_6-31g(d).log.xz 000177029.td-b3lyp_6-31g+(d).inp 000177029.td-b3lyp_6-31g+(d).log.xz

000177029.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177029.td-b3lyp_6-31+g(d).gjf (generated)

000177029.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177029.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177029.mol 000177029.PUBCHEM 000177029.mol (via Jmol)
000177030.b3lyp_6-31g(d).inp

000177030.b3lyp_6-31g(d).qchem.inp (generated)

000177030.b3lyp_6-31g(d).gjf (generated)

000177030.b3lyp_6-31g(d).firefly.inp (generated)

000177030.b3lyp_6-31g(d).smash.inp (generated)

000177030.b3lyp_6-31g(d).nwchem.inp (generated) 000177030.b3lyp_6-31g(d).log.xz 000177030.td-b3lyp_6-31g+(d).inp 000177030.td-b3lyp_6-31g+(d).log.xz

000177030.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177030.td-b3lyp_6-31+g(d).gjf (generated)

000177030.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177030.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177030.mol 000177030.PUBCHEM 000177030.mol (via Jmol)
000177036.b3lyp_6-31g(d).inp

000177036.b3lyp_6-31g(d).qchem.inp (generated)

000177036.b3lyp_6-31g(d).gjf (generated)

000177036.b3lyp_6-31g(d).firefly.inp (generated)

000177036.b3lyp_6-31g(d).smash.inp (generated)

000177036.b3lyp_6-31g(d).nwchem.inp (generated) 000177036.b3lyp_6-31g(d).log.xz 000177036.td-b3lyp_6-31g+(d).inp 000177036.td-b3lyp_6-31g+(d).log.xz

000177036.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177036.td-b3lyp_6-31+g(d).gjf (generated)

000177036.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177036.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177036.mol 000177036.PUBCHEM 000177036.mol (via Jmol)
000177037.b3lyp_6-31g(d).inp

000177037.b3lyp_6-31g(d).qchem.inp (generated)

000177037.b3lyp_6-31g(d).gjf (generated)

000177037.b3lyp_6-31g(d).firefly.inp (generated)

000177037.b3lyp_6-31g(d).smash.inp (generated)

000177037.b3lyp_6-31g(d).nwchem.inp (generated) 000177037.b3lyp_6-31g(d).log.xz 000177037.td-b3lyp_6-31g+(d).inp 000177037.td-b3lyp_6-31g+(d).log.xz

000177037.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177037.td-b3lyp_6-31+g(d).gjf (generated)

000177037.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177037.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177037.mol 000177037.PUBCHEM 000177037.mol (via Jmol)
000177038.b3lyp_6-31g(d).inp

000177038.b3lyp_6-31g(d).qchem.inp (generated)

000177038.b3lyp_6-31g(d).gjf (generated)

000177038.b3lyp_6-31g(d).firefly.inp (generated)

000177038.b3lyp_6-31g(d).smash.inp (generated)

000177038.b3lyp_6-31g(d).nwchem.inp (generated) 000177038.b3lyp_6-31g(d).log.xz 000177038.td-b3lyp_6-31g+(d).inp 000177038.td-b3lyp_6-31g+(d).log.xz

000177038.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177038.td-b3lyp_6-31+g(d).gjf (generated)

000177038.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177038.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177038.mol 000177038.PUBCHEM 000177038.mol (via Jmol)
000177039.b3lyp_6-31g(d).inp

000177039.b3lyp_6-31g(d).qchem.inp (generated)

000177039.b3lyp_6-31g(d).gjf (generated)

000177039.b3lyp_6-31g(d).firefly.inp (generated)

000177039.b3lyp_6-31g(d).smash.inp (generated)

000177039.b3lyp_6-31g(d).nwchem.inp (generated) 000177039.b3lyp_6-31g(d).log.xz 000177039.td-b3lyp_6-31g+(d).inp 000177039.td-b3lyp_6-31g+(d).log.xz

000177039.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177039.td-b3lyp_6-31+g(d).gjf (generated)

000177039.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177039.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177039.mol 000177039.PUBCHEM 000177039.mol (via Jmol)
000177040.b3lyp_6-31g(d).inp

000177040.b3lyp_6-31g(d).qchem.inp (generated)

000177040.b3lyp_6-31g(d).gjf (generated)

000177040.b3lyp_6-31g(d).firefly.inp (generated)

000177040.b3lyp_6-31g(d).smash.inp (generated)

000177040.b3lyp_6-31g(d).nwchem.inp (generated) 000177040.b3lyp_6-31g(d).log.xz 000177040.td-b3lyp_6-31g+(d).inp 000177040.td-b3lyp_6-31g+(d).log.xz

000177040.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177040.td-b3lyp_6-31+g(d).gjf (generated)

000177040.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177040.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177040.mol 000177040.PUBCHEM 000177040.mol (via Jmol)
000177043.b3lyp_6-31g(d).inp

000177043.b3lyp_6-31g(d).qchem.inp (generated)

000177043.b3lyp_6-31g(d).gjf (generated)

000177043.b3lyp_6-31g(d).firefly.inp (generated)

000177043.b3lyp_6-31g(d).smash.inp (generated)

000177043.b3lyp_6-31g(d).nwchem.inp (generated) 000177043.b3lyp_6-31g(d).log.xz 000177043.td-b3lyp_6-31g+(d).inp 000177043.td-b3lyp_6-31g+(d).log.xz

000177043.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177043.td-b3lyp_6-31+g(d).gjf (generated)

000177043.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177043.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177043.mol 000177043.PUBCHEM 000177043.mol (via Jmol)
000177044.b3lyp_6-31g(d).inp

000177044.b3lyp_6-31g(d).qchem.inp (generated)

000177044.b3lyp_6-31g(d).gjf (generated)

000177044.b3lyp_6-31g(d).firefly.inp (generated)

000177044.b3lyp_6-31g(d).smash.inp (generated)

000177044.b3lyp_6-31g(d).nwchem.inp (generated) 000177044.b3lyp_6-31g(d).log.xz 000177044.td-b3lyp_6-31g+(d).inp 000177044.td-b3lyp_6-31g+(d).log.xz

000177044.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177044.td-b3lyp_6-31+g(d).gjf (generated)

000177044.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177044.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177044.mol 000177044.PUBCHEM 000177044.mol (via Jmol)
000177045.b3lyp_6-31g(d).inp

000177045.b3lyp_6-31g(d).qchem.inp (generated)

000177045.b3lyp_6-31g(d).gjf (generated)

000177045.b3lyp_6-31g(d).firefly.inp (generated)

000177045.b3lyp_6-31g(d).smash.inp (generated)

000177045.b3lyp_6-31g(d).nwchem.inp (generated) 000177045.b3lyp_6-31g(d).log.xz 000177045.td-b3lyp_6-31g+(d).inp 000177045.td-b3lyp_6-31g+(d).log.xz

000177045.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177045.td-b3lyp_6-31+g(d).gjf (generated)

000177045.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177045.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177045.mol 000177045.PUBCHEM 000177045.mol (via Jmol)
000177046.b3lyp_6-31g(d).inp

000177046.b3lyp_6-31g(d).qchem.inp (generated)

000177046.b3lyp_6-31g(d).gjf (generated)

000177046.b3lyp_6-31g(d).firefly.inp (generated)

000177046.b3lyp_6-31g(d).smash.inp (generated)

000177046.b3lyp_6-31g(d).nwchem.inp (generated) 000177046.b3lyp_6-31g(d).log.xz 000177046.td-b3lyp_6-31g+(d).inp 000177046.td-b3lyp_6-31g+(d).log.xz

000177046.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177046.td-b3lyp_6-31+g(d).gjf (generated)

000177046.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177046.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177046.mol 000177046.PUBCHEM 000177046.mol (via Jmol)
000177047.b3lyp_6-31g(d).inp

000177047.b3lyp_6-31g(d).qchem.inp (generated)

000177047.b3lyp_6-31g(d).gjf (generated)

000177047.b3lyp_6-31g(d).firefly.inp (generated)

000177047.b3lyp_6-31g(d).smash.inp (generated)

000177047.b3lyp_6-31g(d).nwchem.inp (generated) 000177047.b3lyp_6-31g(d).log.xz 000177047.td-b3lyp_6-31g+(d).inp 000177047.td-b3lyp_6-31g+(d).log.xz

000177047.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177047.td-b3lyp_6-31+g(d).gjf (generated)

000177047.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177047.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177047.mol 000177047.PUBCHEM 000177047.mol (via Jmol)
000177048.b3lyp_6-31g(d).inp

000177048.b3lyp_6-31g(d).qchem.inp (generated)

000177048.b3lyp_6-31g(d).gjf (generated)

000177048.b3lyp_6-31g(d).firefly.inp (generated)

000177048.b3lyp_6-31g(d).smash.inp (generated)

000177048.b3lyp_6-31g(d).nwchem.inp (generated) 000177048.b3lyp_6-31g(d).log.xz 000177048.td-b3lyp_6-31g+(d).inp 000177048.td-b3lyp_6-31g+(d).log.xz

000177048.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177048.td-b3lyp_6-31+g(d).gjf (generated)

000177048.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177048.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177048.mol 000177048.PUBCHEM 000177048.mol (via Jmol)
000177050.b3lyp_6-31g(d).inp

000177050.b3lyp_6-31g(d).qchem.inp (generated)

000177050.b3lyp_6-31g(d).gjf (generated)

000177050.b3lyp_6-31g(d).firefly.inp (generated)

000177050.b3lyp_6-31g(d).smash.inp (generated)

000177050.b3lyp_6-31g(d).nwchem.inp (generated) 000177050.b3lyp_6-31g(d).log.xz 000177050.td-b3lyp_6-31g+(d).inp 000177050.td-b3lyp_6-31g+(d).log.xz

000177050.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177050.td-b3lyp_6-31+g(d).gjf (generated)

000177050.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177050.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177050.mol 000177050.PUBCHEM 000177050.mol (via Jmol)
000177051.b3lyp_6-31g(d).inp

000177051.b3lyp_6-31g(d).qchem.inp (generated)

000177051.b3lyp_6-31g(d).gjf (generated)

000177051.b3lyp_6-31g(d).firefly.inp (generated)

000177051.b3lyp_6-31g(d).smash.inp (generated)

000177051.b3lyp_6-31g(d).nwchem.inp (generated) 000177051.b3lyp_6-31g(d).log.xz 000177051.mol 000177051.PUBCHEM 000177051.mol (via Jmol)
000177053.b3lyp_6-31g(d).inp

000177053.b3lyp_6-31g(d).qchem.inp (generated)

000177053.b3lyp_6-31g(d).gjf (generated)

000177053.b3lyp_6-31g(d).firefly.inp (generated)

000177053.b3lyp_6-31g(d).smash.inp (generated)

000177053.b3lyp_6-31g(d).nwchem.inp (generated) 000177053.b3lyp_6-31g(d).log.xz 000177053.td-b3lyp_6-31g+(d).inp 000177053.td-b3lyp_6-31g+(d).log.xz

000177053.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177053.td-b3lyp_6-31+g(d).gjf (generated)

000177053.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177053.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177053.mol 000177053.PUBCHEM 000177053.mol (via Jmol)
000177055.b3lyp_6-31g(d).inp

000177055.b3lyp_6-31g(d).qchem.inp (generated)

000177055.b3lyp_6-31g(d).gjf (generated)

000177055.b3lyp_6-31g(d).firefly.inp (generated)

000177055.b3lyp_6-31g(d).smash.inp (generated)

000177055.b3lyp_6-31g(d).nwchem.inp (generated) 000177055.b3lyp_6-31g(d).log.xz 000177055.td-b3lyp_6-31g+(d).inp 000177055.td-b3lyp_6-31g+(d).log.xz

000177055.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177055.td-b3lyp_6-31+g(d).gjf (generated)

000177055.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177055.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177055.mol 000177055.PUBCHEM 000177055.mol (via Jmol)
000177058.b3lyp_6-31g(d).inp

000177058.b3lyp_6-31g(d).qchem.inp (generated)

000177058.b3lyp_6-31g(d).gjf (generated)

000177058.b3lyp_6-31g(d).firefly.inp (generated)

000177058.b3lyp_6-31g(d).smash.inp (generated)

000177058.b3lyp_6-31g(d).nwchem.inp (generated) 000177058.b3lyp_6-31g(d).log.xz 000177058.mol 000177058.PUBCHEM 000177058.mol (via Jmol)
000177061.b3lyp_6-31g(d).inp

000177061.b3lyp_6-31g(d).qchem.inp (generated)

000177061.b3lyp_6-31g(d).gjf (generated)

000177061.b3lyp_6-31g(d).firefly.inp (generated)

000177061.b3lyp_6-31g(d).smash.inp (generated)

000177061.b3lyp_6-31g(d).nwchem.inp (generated) 000177061.b3lyp_6-31g(d).log.xz 000177061.mol 000177061.PUBCHEM 000177061.mol (via Jmol)
000177063.b3lyp_6-31g(d).inp

000177063.b3lyp_6-31g(d).qchem.inp (generated)

000177063.b3lyp_6-31g(d).gjf (generated)

000177063.b3lyp_6-31g(d).firefly.inp (generated)

000177063.b3lyp_6-31g(d).smash.inp (generated)

000177063.b3lyp_6-31g(d).nwchem.inp (generated) 000177063.b3lyp_6-31g(d).log.xz 000177063.td-b3lyp_6-31g+(d).inp 000177063.td-b3lyp_6-31g+(d).log.xz

000177063.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177063.td-b3lyp_6-31+g(d).gjf (generated)

000177063.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177063.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177063.mol 000177063.PUBCHEM 000177063.mol (via Jmol)
000177064.b3lyp_6-31g(d).inp

000177064.b3lyp_6-31g(d).qchem.inp (generated)

000177064.b3lyp_6-31g(d).gjf (generated)

000177064.b3lyp_6-31g(d).firefly.inp (generated)

000177064.b3lyp_6-31g(d).smash.inp (generated)

000177064.b3lyp_6-31g(d).nwchem.inp (generated) 000177064.b3lyp_6-31g(d).log.xz 000177064.td-b3lyp_6-31g+(d).inp 000177064.td-b3lyp_6-31g+(d).log.xz

000177064.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177064.td-b3lyp_6-31+g(d).gjf (generated)

000177064.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177064.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177064.mol 000177064.PUBCHEM 000177064.mol (via Jmol)
000177065.b3lyp_6-31g(d).inp

000177065.b3lyp_6-31g(d).qchem.inp (generated)

000177065.b3lyp_6-31g(d).gjf (generated)

000177065.b3lyp_6-31g(d).firefly.inp (generated)

000177065.b3lyp_6-31g(d).smash.inp (generated)

000177065.b3lyp_6-31g(d).nwchem.inp (generated) 000177065.b3lyp_6-31g(d).log.xz 000177065.td-b3lyp_6-31g+(d).inp 000177065.td-b3lyp_6-31g+(d).log.xz

000177065.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177065.td-b3lyp_6-31+g(d).gjf (generated)

000177065.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177065.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177065.mol 000177065.PUBCHEM 000177065.mol (via Jmol)
000177067.b3lyp_6-31g(d).inp

000177067.b3lyp_6-31g(d).qchem.inp (generated)

000177067.b3lyp_6-31g(d).gjf (generated)

000177067.b3lyp_6-31g(d).firefly.inp (generated)

000177067.b3lyp_6-31g(d).smash.inp (generated)

000177067.b3lyp_6-31g(d).nwchem.inp (generated) 000177067.b3lyp_6-31g(d).log.xz 000177067.td-b3lyp_6-31g+(d).inp 000177067.td-b3lyp_6-31g+(d).log.xz

000177067.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177067.td-b3lyp_6-31+g(d).gjf (generated)

000177067.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177067.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177067.mol 000177067.PUBCHEM 000177067.mol (via Jmol)
000177068.b3lyp_6-31g(d).inp

000177068.b3lyp_6-31g(d).qchem.inp (generated)

000177068.b3lyp_6-31g(d).gjf (generated)

000177068.b3lyp_6-31g(d).firefly.inp (generated)

000177068.b3lyp_6-31g(d).smash.inp (generated)

000177068.b3lyp_6-31g(d).nwchem.inp (generated) 000177068.b3lyp_6-31g(d).log.xz 000177068.td-b3lyp_6-31g+(d).inp 000177068.td-b3lyp_6-31g+(d).log.xz

000177068.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177068.td-b3lyp_6-31+g(d).gjf (generated)

000177068.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177068.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177068.mol 000177068.PUBCHEM 000177068.mol (via Jmol)
000177069.b3lyp_6-31g(d).inp

000177069.b3lyp_6-31g(d).qchem.inp (generated)

000177069.b3lyp_6-31g(d).gjf (generated)

000177069.b3lyp_6-31g(d).firefly.inp (generated)

000177069.b3lyp_6-31g(d).smash.inp (generated)

000177069.b3lyp_6-31g(d).nwchem.inp (generated) 000177069.b3lyp_6-31g(d).log.xz 000177069.td-b3lyp_6-31g+(d).inp 000177069.td-b3lyp_6-31g+(d).log.xz

000177069.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177069.td-b3lyp_6-31+g(d).gjf (generated)

000177069.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177069.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177069.mol 000177069.PUBCHEM 000177069.mol (via Jmol)
000177071.b3lyp_6-31g(d).inp

000177071.b3lyp_6-31g(d).qchem.inp (generated)

000177071.b3lyp_6-31g(d).gjf (generated)

000177071.b3lyp_6-31g(d).firefly.inp (generated)

000177071.b3lyp_6-31g(d).smash.inp (generated)

000177071.b3lyp_6-31g(d).nwchem.inp (generated) 000177071.b3lyp_6-31g(d).log.xz 000177071.td-b3lyp_6-31g+(d).inp 000177071.td-b3lyp_6-31g+(d).log.xz

000177071.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177071.td-b3lyp_6-31+g(d).gjf (generated)

000177071.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177071.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177071.mol 000177071.PUBCHEM 000177071.mol (via Jmol)
000177072.b3lyp_6-31g(d).inp

000177072.b3lyp_6-31g(d).qchem.inp (generated)

000177072.b3lyp_6-31g(d).gjf (generated)

000177072.b3lyp_6-31g(d).firefly.inp (generated)

000177072.b3lyp_6-31g(d).smash.inp (generated)

000177072.b3lyp_6-31g(d).nwchem.inp (generated) 000177072.b3lyp_6-31g(d).log.xz 000177072.mol 000177072.PUBCHEM 000177072.mol (via Jmol)
000177081.b3lyp_6-31g(d).inp

000177081.b3lyp_6-31g(d).qchem.inp (generated)

000177081.b3lyp_6-31g(d).gjf (generated)

000177081.b3lyp_6-31g(d).firefly.inp (generated)

000177081.b3lyp_6-31g(d).smash.inp (generated)

000177081.b3lyp_6-31g(d).nwchem.inp (generated) 000177081.b3lyp_6-31g(d).log.xz 000177081.td-b3lyp_6-31g+(d).inp 000177081.td-b3lyp_6-31g+(d).log.xz

000177081.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177081.td-b3lyp_6-31+g(d).gjf (generated)

000177081.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177081.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177081.mol 000177081.PUBCHEM 000177081.mol (via Jmol)
000177082.b3lyp_6-31g(d).inp

000177082.b3lyp_6-31g(d).qchem.inp (generated)

000177082.b3lyp_6-31g(d).gjf (generated)

000177082.b3lyp_6-31g(d).firefly.inp (generated)

000177082.b3lyp_6-31g(d).smash.inp (generated)

000177082.b3lyp_6-31g(d).nwchem.inp (generated) 000177082.b3lyp_6-31g(d).log.xz 000177082.td-b3lyp_6-31g+(d).inp 000177082.td-b3lyp_6-31g+(d).log.xz

000177082.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177082.td-b3lyp_6-31+g(d).gjf (generated)

000177082.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177082.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177082.mol 000177082.PUBCHEM 000177082.mol (via Jmol)
000177084.b3lyp_6-31g(d).inp

000177084.b3lyp_6-31g(d).qchem.inp (generated)

000177084.b3lyp_6-31g(d).gjf (generated)

000177084.b3lyp_6-31g(d).firefly.inp (generated)

000177084.b3lyp_6-31g(d).smash.inp (generated)

000177084.b3lyp_6-31g(d).nwchem.inp (generated) 000177084.b3lyp_6-31g(d).log.xz 000177084.td-b3lyp_6-31g+(d).inp 000177084.td-b3lyp_6-31g+(d).log.xz

000177084.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177084.td-b3lyp_6-31+g(d).gjf (generated)

000177084.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177084.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177084.mol 000177084.PUBCHEM 000177084.mol (via Jmol)
000177085.b3lyp_6-31g(d).inp

000177085.b3lyp_6-31g(d).qchem.inp (generated)

000177085.b3lyp_6-31g(d).gjf (generated)

000177085.b3lyp_6-31g(d).firefly.inp (generated)

000177085.b3lyp_6-31g(d).smash.inp (generated)

000177085.b3lyp_6-31g(d).nwchem.inp (generated) 000177085.b3lyp_6-31g(d).log.xz 000177085.td-b3lyp_6-31g+(d).inp 000177085.td-b3lyp_6-31g+(d).log.xz

000177085.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177085.td-b3lyp_6-31+g(d).gjf (generated)

000177085.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177085.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177085.mol 000177085.PUBCHEM 000177085.mol (via Jmol)
000177089.b3lyp_6-31g(d).inp

000177089.b3lyp_6-31g(d).qchem.inp (generated)

000177089.b3lyp_6-31g(d).gjf (generated)

000177089.b3lyp_6-31g(d).firefly.inp (generated)

000177089.b3lyp_6-31g(d).smash.inp (generated)

000177089.b3lyp_6-31g(d).nwchem.inp (generated) 000177089.b3lyp_6-31g(d).log.xz 000177089.td-b3lyp_6-31g+(d).inp 000177089.td-b3lyp_6-31g+(d).log.xz

000177089.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177089.td-b3lyp_6-31+g(d).gjf (generated)

000177089.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177089.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177089.mol 000177089.PUBCHEM 000177089.mol (via Jmol)
000177095.b3lyp_6-31g(d).inp

000177095.b3lyp_6-31g(d).qchem.inp (generated)

000177095.b3lyp_6-31g(d).gjf (generated)

000177095.b3lyp_6-31g(d).firefly.inp (generated)

000177095.b3lyp_6-31g(d).smash.inp (generated)

000177095.b3lyp_6-31g(d).nwchem.inp (generated) 000177095.b3lyp_6-31g(d).log.xz 000177095.td-b3lyp_6-31g+(d).inp 000177095.td-b3lyp_6-31g+(d).log.xz

000177095.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177095.td-b3lyp_6-31+g(d).gjf (generated)

000177095.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177095.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177095.mol 000177095.PUBCHEM 000177095.mol (via Jmol)
000177096.b3lyp_6-31g(d).inp

000177096.b3lyp_6-31g(d).qchem.inp (generated)

000177096.b3lyp_6-31g(d).gjf (generated)

000177096.b3lyp_6-31g(d).firefly.inp (generated)

000177096.b3lyp_6-31g(d).smash.inp (generated)

000177096.b3lyp_6-31g(d).nwchem.inp (generated) 000177096.b3lyp_6-31g(d).log.xz 000177096.mol 000177096.PUBCHEM 000177096.mol (via Jmol)
000177098.b3lyp_6-31g(d).inp

000177098.b3lyp_6-31g(d).qchem.inp (generated)

000177098.b3lyp_6-31g(d).gjf (generated)

000177098.b3lyp_6-31g(d).firefly.inp (generated)

000177098.b3lyp_6-31g(d).smash.inp (generated)

000177098.b3lyp_6-31g(d).nwchem.inp (generated) 000177098.b3lyp_6-31g(d).log.xz 000177098.td-b3lyp_6-31g+(d).inp 000177098.td-b3lyp_6-31g+(d).log.xz

000177098.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177098.td-b3lyp_6-31+g(d).gjf (generated)

000177098.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177098.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177098.mol 000177098.PUBCHEM 000177098.mol (via Jmol)
000177099.b3lyp_6-31g(d).inp

000177099.b3lyp_6-31g(d).qchem.inp (generated)

000177099.b3lyp_6-31g(d).gjf (generated)

000177099.b3lyp_6-31g(d).firefly.inp (generated)

000177099.b3lyp_6-31g(d).smash.inp (generated)

000177099.b3lyp_6-31g(d).nwchem.inp (generated) 000177099.b3lyp_6-31g(d).log.xz 000177099.td-b3lyp_6-31g+(d).inp 000177099.td-b3lyp_6-31g+(d).log.xz

000177099.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177099.td-b3lyp_6-31+g(d).gjf (generated)

000177099.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177099.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177099.mol 000177099.PUBCHEM 000177099.mol (via Jmol)
000177102.b3lyp_6-31g(d).inp

000177102.b3lyp_6-31g(d).qchem.inp (generated)

000177102.b3lyp_6-31g(d).gjf (generated)

000177102.b3lyp_6-31g(d).firefly.inp (generated)

000177102.b3lyp_6-31g(d).smash.inp (generated)

000177102.b3lyp_6-31g(d).nwchem.inp (generated) 000177102.b3lyp_6-31g(d).log.xz 000177102.td-b3lyp_6-31g+(d).inp 000177102.td-b3lyp_6-31g+(d).log.xz

000177102.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177102.td-b3lyp_6-31+g(d).gjf (generated)

000177102.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177102.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177102.mol 000177102.PUBCHEM 000177102.mol (via Jmol)
000177104.b3lyp_6-31g(d).inp

000177104.b3lyp_6-31g(d).qchem.inp (generated)

000177104.b3lyp_6-31g(d).gjf (generated)

000177104.b3lyp_6-31g(d).firefly.inp (generated)

000177104.b3lyp_6-31g(d).smash.inp (generated)

000177104.b3lyp_6-31g(d).nwchem.inp (generated) 000177104.b3lyp_6-31g(d).log.xz 000177104.td-b3lyp_6-31g+(d).inp 000177104.td-b3lyp_6-31g+(d).log.xz

000177104.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177104.td-b3lyp_6-31+g(d).gjf (generated)

000177104.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177104.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177104.mol 000177104.PUBCHEM 000177104.mol (via Jmol)
000177110.b3lyp_6-31g(d).inp

000177110.b3lyp_6-31g(d).qchem.inp (generated)

000177110.b3lyp_6-31g(d).gjf (generated)

000177110.b3lyp_6-31g(d).firefly.inp (generated)

000177110.b3lyp_6-31g(d).smash.inp (generated)

000177110.b3lyp_6-31g(d).nwchem.inp (generated) 000177110.b3lyp_6-31g(d).log.xz 000177110.td-b3lyp_6-31g+(d).inp 000177110.td-b3lyp_6-31g+(d).log.xz

000177110.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177110.td-b3lyp_6-31+g(d).gjf (generated)

000177110.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177110.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177110.mol 000177110.PUBCHEM 000177110.mol (via Jmol)
000177112.b3lyp_6-31g(d).inp

000177112.b3lyp_6-31g(d).qchem.inp (generated)

000177112.b3lyp_6-31g(d).gjf (generated)

000177112.b3lyp_6-31g(d).firefly.inp (generated)

000177112.b3lyp_6-31g(d).smash.inp (generated)

000177112.b3lyp_6-31g(d).nwchem.inp (generated) 000177112.b3lyp_6-31g(d).log.xz 000177112.td-b3lyp_6-31g+(d).inp 000177112.td-b3lyp_6-31g+(d).log.xz

000177112.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177112.td-b3lyp_6-31+g(d).gjf (generated)

000177112.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177112.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177112.mol 000177112.PUBCHEM 000177112.mol (via Jmol)
000177114.b3lyp_6-31g(d).inp

000177114.b3lyp_6-31g(d).qchem.inp (generated)

000177114.b3lyp_6-31g(d).gjf (generated)

000177114.b3lyp_6-31g(d).firefly.inp (generated)

000177114.b3lyp_6-31g(d).smash.inp (generated)

000177114.b3lyp_6-31g(d).nwchem.inp (generated) 000177114.b3lyp_6-31g(d).log.xz 000177114.td-b3lyp_6-31g+(d).inp 000177114.td-b3lyp_6-31g+(d).log.xz

000177114.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177114.td-b3lyp_6-31+g(d).gjf (generated)

000177114.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177114.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177114.mol 000177114.PUBCHEM 000177114.mol (via Jmol)
000177120.b3lyp_6-31g(d).inp

000177120.b3lyp_6-31g(d).qchem.inp (generated)

000177120.b3lyp_6-31g(d).gjf (generated)

000177120.b3lyp_6-31g(d).firefly.inp (generated)

000177120.b3lyp_6-31g(d).smash.inp (generated)

000177120.b3lyp_6-31g(d).nwchem.inp (generated) 000177120.b3lyp_6-31g(d).log.xz 000177120.td-b3lyp_6-31g+(d).inp 000177120.td-b3lyp_6-31g+(d).log.xz

000177120.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177120.td-b3lyp_6-31+g(d).gjf (generated)

000177120.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177120.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177120.mol 000177120.PUBCHEM 000177120.mol (via Jmol)
000177122.b3lyp_6-31g(d).inp

000177122.b3lyp_6-31g(d).qchem.inp (generated)

000177122.b3lyp_6-31g(d).gjf (generated)

000177122.b3lyp_6-31g(d).firefly.inp (generated)

000177122.b3lyp_6-31g(d).smash.inp (generated)

000177122.b3lyp_6-31g(d).nwchem.inp (generated) 000177122.b3lyp_6-31g(d).log.xz 000177122.td-b3lyp_6-31g+(d).inp 000177122.td-b3lyp_6-31g+(d).log.xz

000177122.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177122.td-b3lyp_6-31+g(d).gjf (generated)

000177122.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177122.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177122.mol 000177122.PUBCHEM 000177122.mol (via Jmol)
000177123.b3lyp_6-31g(d).inp

000177123.b3lyp_6-31g(d).qchem.inp (generated)

000177123.b3lyp_6-31g(d).gjf (generated)

000177123.b3lyp_6-31g(d).firefly.inp (generated)

000177123.b3lyp_6-31g(d).smash.inp (generated)

000177123.b3lyp_6-31g(d).nwchem.inp (generated) 000177123.b3lyp_6-31g(d).log.xz 000177123.td-b3lyp_6-31g+(d).inp 000177123.td-b3lyp_6-31g+(d).log.xz

000177123.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177123.td-b3lyp_6-31+g(d).gjf (generated)

000177123.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177123.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177123.mol 000177123.PUBCHEM 000177123.mol (via Jmol)
000177127.b3lyp_6-31g(d).inp

000177127.b3lyp_6-31g(d).qchem.inp (generated)

000177127.b3lyp_6-31g(d).gjf (generated)

000177127.b3lyp_6-31g(d).firefly.inp (generated)

000177127.b3lyp_6-31g(d).smash.inp (generated)

000177127.b3lyp_6-31g(d).nwchem.inp (generated) 000177127.b3lyp_6-31g(d).log.xz 000177127.td-b3lyp_6-31g+(d).inp 000177127.td-b3lyp_6-31g+(d).log.xz

000177127.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177127.td-b3lyp_6-31+g(d).gjf (generated)

000177127.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177127.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177127.mol 000177127.PUBCHEM 000177127.mol (via Jmol)
000177128.b3lyp_6-31g(d).inp

000177128.b3lyp_6-31g(d).qchem.inp (generated)

000177128.b3lyp_6-31g(d).gjf (generated)

000177128.b3lyp_6-31g(d).firefly.inp (generated)

000177128.b3lyp_6-31g(d).smash.inp (generated)

000177128.b3lyp_6-31g(d).nwchem.inp (generated) 000177128.b3lyp_6-31g(d).log.xz 000177128.td-b3lyp_6-31g+(d).inp 000177128.td-b3lyp_6-31g+(d).log.xz

000177128.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177128.td-b3lyp_6-31+g(d).gjf (generated)

000177128.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177128.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177128.mol 000177128.PUBCHEM 000177128.mol (via Jmol)
000177129.b3lyp_6-31g(d).inp

000177129.b3lyp_6-31g(d).qchem.inp (generated)

000177129.b3lyp_6-31g(d).gjf (generated)

000177129.b3lyp_6-31g(d).firefly.inp (generated)

000177129.b3lyp_6-31g(d).smash.inp (generated)

000177129.b3lyp_6-31g(d).nwchem.inp (generated) 000177129.b3lyp_6-31g(d).log.xz 000177129.td-b3lyp_6-31g+(d).inp 000177129.td-b3lyp_6-31g+(d).log.xz

000177129.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177129.td-b3lyp_6-31+g(d).gjf (generated)

000177129.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177129.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177129.mol 000177129.PUBCHEM 000177129.mol (via Jmol)
000177136.b3lyp_6-31g(d).inp

000177136.b3lyp_6-31g(d).qchem.inp (generated)

000177136.b3lyp_6-31g(d).gjf (generated)

000177136.b3lyp_6-31g(d).firefly.inp (generated)

000177136.b3lyp_6-31g(d).smash.inp (generated)

000177136.b3lyp_6-31g(d).nwchem.inp (generated) 000177136.b3lyp_6-31g(d).log.xz 000177136.td-b3lyp_6-31g+(d).inp 000177136.td-b3lyp_6-31g+(d).log.xz

000177136.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177136.td-b3lyp_6-31+g(d).gjf (generated)

000177136.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177136.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177136.mol 000177136.PUBCHEM 000177136.mol (via Jmol)
000177137.b3lyp_6-31g(d).inp

000177137.b3lyp_6-31g(d).qchem.inp (generated)

000177137.b3lyp_6-31g(d).gjf (generated)

000177137.b3lyp_6-31g(d).firefly.inp (generated)

000177137.b3lyp_6-31g(d).smash.inp (generated)

000177137.b3lyp_6-31g(d).nwchem.inp (generated) 000177137.b3lyp_6-31g(d).log.xz 000177137.td-b3lyp_6-31g+(d).inp 000177137.td-b3lyp_6-31g+(d).log.xz

000177137.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177137.td-b3lyp_6-31+g(d).gjf (generated)

000177137.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177137.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177137.mol 000177137.PUBCHEM 000177137.mol (via Jmol)
000177150.b3lyp_6-31g(d).inp

000177150.b3lyp_6-31g(d).qchem.inp (generated)

000177150.b3lyp_6-31g(d).gjf (generated)

000177150.b3lyp_6-31g(d).firefly.inp (generated)

000177150.b3lyp_6-31g(d).smash.inp (generated)

000177150.b3lyp_6-31g(d).nwchem.inp (generated) 000177150.b3lyp_6-31g(d).log.xz 000177150.td-b3lyp_6-31g+(d).inp 000177150.td-b3lyp_6-31g+(d).log.xz

000177150.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177150.td-b3lyp_6-31+g(d).gjf (generated)

000177150.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177150.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177150.mol 000177150.PUBCHEM 000177150.mol (via Jmol)
000177153.b3lyp_6-31g(d).inp

000177153.b3lyp_6-31g(d).qchem.inp (generated)

000177153.b3lyp_6-31g(d).gjf (generated)

000177153.b3lyp_6-31g(d).firefly.inp (generated)

000177153.b3lyp_6-31g(d).smash.inp (generated)

000177153.b3lyp_6-31g(d).nwchem.inp (generated) 000177153.b3lyp_6-31g(d).log.xz 000177153.mol 000177153.PUBCHEM 000177153.mol (via Jmol)
000177161.b3lyp_6-31g(d).inp

000177161.b3lyp_6-31g(d).qchem.inp (generated)

000177161.b3lyp_6-31g(d).gjf (generated)

000177161.b3lyp_6-31g(d).firefly.inp (generated)

000177161.b3lyp_6-31g(d).smash.inp (generated)

000177161.b3lyp_6-31g(d).nwchem.inp (generated) 000177161.b3lyp_6-31g(d).log.xz 000177161.td-b3lyp_6-31g+(d).inp 000177161.td-b3lyp_6-31g+(d).log.xz

000177161.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177161.td-b3lyp_6-31+g(d).gjf (generated)

000177161.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177161.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177161.mol 000177161.PUBCHEM 000177161.mol (via Jmol)
000177164.b3lyp_6-31g(d).inp

000177164.b3lyp_6-31g(d).qchem.inp (generated)

000177164.b3lyp_6-31g(d).gjf (generated)

000177164.b3lyp_6-31g(d).firefly.inp (generated)

000177164.b3lyp_6-31g(d).smash.inp (generated)

000177164.b3lyp_6-31g(d).nwchem.inp (generated) 000177164.b3lyp_6-31g(d).log.xz 000177164.td-b3lyp_6-31g+(d).inp 000177164.td-b3lyp_6-31g+(d).log.xz

000177164.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177164.td-b3lyp_6-31+g(d).gjf (generated)

000177164.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177164.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177164.mol 000177164.PUBCHEM 000177164.mol (via Jmol)
000177167.b3lyp_6-31g(d).inp

000177167.b3lyp_6-31g(d).qchem.inp (generated)

000177167.b3lyp_6-31g(d).gjf (generated)

000177167.b3lyp_6-31g(d).firefly.inp (generated)

000177167.b3lyp_6-31g(d).smash.inp (generated)

000177167.b3lyp_6-31g(d).nwchem.inp (generated) 000177167.b3lyp_6-31g(d).log.xz 000177167.td-b3lyp_6-31g+(d).inp 000177167.td-b3lyp_6-31g+(d).log.xz

000177167.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177167.td-b3lyp_6-31+g(d).gjf (generated)

000177167.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177167.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177167.mol 000177167.PUBCHEM 000177167.mol (via Jmol)
000177168.b3lyp_6-31g(d).inp

000177168.b3lyp_6-31g(d).qchem.inp (generated)

000177168.b3lyp_6-31g(d).gjf (generated)

000177168.b3lyp_6-31g(d).firefly.inp (generated)

000177168.b3lyp_6-31g(d).smash.inp (generated)

000177168.b3lyp_6-31g(d).nwchem.inp (generated) 000177168.b3lyp_6-31g(d).log.xz 000177168.td-b3lyp_6-31g+(d).inp 000177168.td-b3lyp_6-31g+(d).log.xz

000177168.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177168.td-b3lyp_6-31+g(d).gjf (generated)

000177168.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177168.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177168.mol 000177168.PUBCHEM 000177168.mol (via Jmol)
000177170.b3lyp_6-31g(d).inp

000177170.b3lyp_6-31g(d).qchem.inp (generated)

000177170.b3lyp_6-31g(d).gjf (generated)

000177170.b3lyp_6-31g(d).firefly.inp (generated)

000177170.b3lyp_6-31g(d).smash.inp (generated)

000177170.b3lyp_6-31g(d).nwchem.inp (generated) 000177170.b3lyp_6-31g(d).log.xz 000177170.td-b3lyp_6-31g+(d).inp 000177170.td-b3lyp_6-31g+(d).log.xz

000177170.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177170.td-b3lyp_6-31+g(d).gjf (generated)

000177170.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177170.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177170.mol 000177170.PUBCHEM 000177170.mol (via Jmol)
000177171.b3lyp_6-31g(d).inp

000177171.b3lyp_6-31g(d).qchem.inp (generated)

000177171.b3lyp_6-31g(d).gjf (generated)

000177171.b3lyp_6-31g(d).firefly.inp (generated)

000177171.b3lyp_6-31g(d).smash.inp (generated)

000177171.b3lyp_6-31g(d).nwchem.inp (generated) 000177171.b3lyp_6-31g(d).log.xz 000177171.td-b3lyp_6-31g+(d).inp 000177171.td-b3lyp_6-31g+(d).log.xz

000177171.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177171.td-b3lyp_6-31+g(d).gjf (generated)

000177171.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177171.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177171.mol 000177171.PUBCHEM 000177171.mol (via Jmol)
000177177.b3lyp_6-31g(d).inp

000177177.b3lyp_6-31g(d).qchem.inp (generated)

000177177.b3lyp_6-31g(d).gjf (generated)

000177177.b3lyp_6-31g(d).firefly.inp (generated)

000177177.b3lyp_6-31g(d).smash.inp (generated)

000177177.b3lyp_6-31g(d).nwchem.inp (generated) 000177177.b3lyp_6-31g(d).log.xz 000177177.td-b3lyp_6-31g+(d).inp 000177177.td-b3lyp_6-31g+(d).log.xz

000177177.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177177.td-b3lyp_6-31+g(d).gjf (generated)

000177177.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177177.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177177.mol 000177177.PUBCHEM 000177177.mol (via Jmol)
000177179.b3lyp_6-31g(d).inp

000177179.b3lyp_6-31g(d).qchem.inp (generated)

000177179.b3lyp_6-31g(d).gjf (generated)

000177179.b3lyp_6-31g(d).firefly.inp (generated)

000177179.b3lyp_6-31g(d).smash.inp (generated)

000177179.b3lyp_6-31g(d).nwchem.inp (generated) 000177179.b3lyp_6-31g(d).log.xz 000177179.td-b3lyp_6-31g+(d).inp 000177179.td-b3lyp_6-31g+(d).log.xz

000177179.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177179.td-b3lyp_6-31+g(d).gjf (generated)

000177179.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177179.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177179.mol 000177179.PUBCHEM 000177179.mol (via Jmol)
000177187.b3lyp_6-31g(d).inp

000177187.b3lyp_6-31g(d).qchem.inp (generated)

000177187.b3lyp_6-31g(d).gjf (generated)

000177187.b3lyp_6-31g(d).firefly.inp (generated)

000177187.b3lyp_6-31g(d).smash.inp (generated)

000177187.b3lyp_6-31g(d).nwchem.inp (generated) 000177187.b3lyp_6-31g(d).log.xz 000177187.mol 000177187.PUBCHEM 000177187.mol (via Jmol)
000177189.b3lyp_6-31g(d).inp

000177189.b3lyp_6-31g(d).qchem.inp (generated)

000177189.b3lyp_6-31g(d).gjf (generated)

000177189.b3lyp_6-31g(d).firefly.inp (generated)

000177189.b3lyp_6-31g(d).smash.inp (generated)

000177189.b3lyp_6-31g(d).nwchem.inp (generated) 000177189.b3lyp_6-31g(d).log.xz 000177189.td-b3lyp_6-31g+(d).inp 000177189.td-b3lyp_6-31g+(d).log.xz

000177189.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177189.td-b3lyp_6-31+g(d).gjf (generated)

000177189.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177189.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177189.mol 000177189.PUBCHEM 000177189.mol (via Jmol)
000177210.b3lyp_6-31g(d).inp

000177210.b3lyp_6-31g(d).qchem.inp (generated)

000177210.b3lyp_6-31g(d).gjf (generated)

000177210.b3lyp_6-31g(d).firefly.inp (generated)

000177210.b3lyp_6-31g(d).smash.inp (generated)

000177210.b3lyp_6-31g(d).nwchem.inp (generated) 000177210.b3lyp_6-31g(d).log.xz 000177210.td-b3lyp_6-31g+(d).inp 000177210.td-b3lyp_6-31g+(d).log.xz

000177210.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177210.td-b3lyp_6-31+g(d).gjf (generated)

000177210.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177210.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177210.mol 000177210.PUBCHEM 000177210.mol (via Jmol)
000177222.b3lyp_6-31g(d).inp

000177222.b3lyp_6-31g(d).qchem.inp (generated)

000177222.b3lyp_6-31g(d).gjf (generated)

000177222.b3lyp_6-31g(d).firefly.inp (generated)

000177222.b3lyp_6-31g(d).smash.inp (generated)

000177222.b3lyp_6-31g(d).nwchem.inp (generated) 000177222.b3lyp_6-31g(d).log.xz 000177222.td-b3lyp_6-31g+(d).inp 000177222.td-b3lyp_6-31g+(d).log.xz

000177222.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177222.td-b3lyp_6-31+g(d).gjf (generated)

000177222.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177222.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177222.mol 000177222.PUBCHEM 000177222.mol (via Jmol)
000177228.b3lyp_6-31g(d).inp

000177228.b3lyp_6-31g(d).qchem.inp (generated)

000177228.b3lyp_6-31g(d).gjf (generated)

000177228.b3lyp_6-31g(d).firefly.inp (generated)

000177228.b3lyp_6-31g(d).smash.inp (generated)

000177228.b3lyp_6-31g(d).nwchem.inp (generated) 000177228.b3lyp_6-31g(d).log.xz 000177228.td-b3lyp_6-31g+(d).inp 000177228.td-b3lyp_6-31g+(d).log.xz

000177228.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177228.td-b3lyp_6-31+g(d).gjf (generated)

000177228.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177228.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177228.mol 000177228.PUBCHEM 000177228.mol (via Jmol)
000177233.b3lyp_6-31g(d).inp

000177233.b3lyp_6-31g(d).qchem.inp (generated)

000177233.b3lyp_6-31g(d).gjf (generated)

000177233.b3lyp_6-31g(d).firefly.inp (generated)

000177233.b3lyp_6-31g(d).smash.inp (generated)

000177233.b3lyp_6-31g(d).nwchem.inp (generated) 000177233.b3lyp_6-31g(d).log.xz 000177233.td-b3lyp_6-31g+(d).inp 000177233.td-b3lyp_6-31g+(d).log.xz

000177233.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177233.td-b3lyp_6-31+g(d).gjf (generated)

000177233.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177233.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177233.mol 000177233.PUBCHEM 000177233.mol (via Jmol)
000177237.b3lyp_6-31g(d).inp

000177237.b3lyp_6-31g(d).qchem.inp (generated)

000177237.b3lyp_6-31g(d).gjf (generated)

000177237.b3lyp_6-31g(d).firefly.inp (generated)

000177237.b3lyp_6-31g(d).smash.inp (generated)

000177237.b3lyp_6-31g(d).nwchem.inp (generated) 000177237.b3lyp_6-31g(d).log.xz 000177237.td-b3lyp_6-31g+(d).inp 000177237.td-b3lyp_6-31g+(d).log.xz

000177237.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177237.td-b3lyp_6-31+g(d).gjf (generated)

000177237.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177237.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177237.mol 000177237.PUBCHEM 000177237.mol (via Jmol)
000177268.b3lyp_6-31g(d).inp

000177268.b3lyp_6-31g(d).qchem.inp (generated)

000177268.b3lyp_6-31g(d).gjf (generated)

000177268.b3lyp_6-31g(d).firefly.inp (generated)

000177268.b3lyp_6-31g(d).smash.inp (generated)

000177268.b3lyp_6-31g(d).nwchem.inp (generated) 000177268.b3lyp_6-31g(d).log.xz 000177268.td-b3lyp_6-31g+(d).inp 000177268.td-b3lyp_6-31g+(d).log.xz

000177268.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177268.td-b3lyp_6-31+g(d).gjf (generated)

000177268.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177268.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177268.mol 000177268.PUBCHEM 000177268.mol (via Jmol)
000177272.b3lyp_6-31g(d).inp

000177272.b3lyp_6-31g(d).qchem.inp (generated)

000177272.b3lyp_6-31g(d).gjf (generated)

000177272.b3lyp_6-31g(d).firefly.inp (generated)

000177272.b3lyp_6-31g(d).smash.inp (generated)

000177272.b3lyp_6-31g(d).nwchem.inp (generated) 000177272.b3lyp_6-31g(d).log.xz 000177272.td-b3lyp_6-31g+(d).inp 000177272.td-b3lyp_6-31g+(d).log.xz

000177272.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177272.td-b3lyp_6-31+g(d).gjf (generated)

000177272.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177272.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177272.mol 000177272.PUBCHEM 000177272.mol (via Jmol)
000177281.b3lyp_6-31g(d).inp

000177281.b3lyp_6-31g(d).qchem.inp (generated)

000177281.b3lyp_6-31g(d).gjf (generated)

000177281.b3lyp_6-31g(d).firefly.inp (generated)

000177281.b3lyp_6-31g(d).smash.inp (generated)

000177281.b3lyp_6-31g(d).nwchem.inp (generated) 000177281.b3lyp_6-31g(d).log.xz 000177281.td-b3lyp_6-31g+(d).inp 000177281.td-b3lyp_6-31g+(d).log.xz

000177281.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177281.td-b3lyp_6-31+g(d).gjf (generated)

000177281.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177281.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177281.mol 000177281.PUBCHEM 000177281.mol (via Jmol)
000177292.b3lyp_6-31g(d).inp

000177292.b3lyp_6-31g(d).qchem.inp (generated)

000177292.b3lyp_6-31g(d).gjf (generated)

000177292.b3lyp_6-31g(d).firefly.inp (generated)

000177292.b3lyp_6-31g(d).smash.inp (generated)

000177292.b3lyp_6-31g(d).nwchem.inp (generated) 000177292.b3lyp_6-31g(d).log.xz 000177292.td-b3lyp_6-31g+(d).inp 000177292.td-b3lyp_6-31g+(d).log.xz

000177292.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177292.td-b3lyp_6-31+g(d).gjf (generated)

000177292.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177292.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177292.mol 000177292.PUBCHEM 000177292.mol (via Jmol)
000177302.b3lyp_6-31g(d).inp

000177302.b3lyp_6-31g(d).qchem.inp (generated)

000177302.b3lyp_6-31g(d).gjf (generated)

000177302.b3lyp_6-31g(d).firefly.inp (generated)

000177302.b3lyp_6-31g(d).smash.inp (generated)

000177302.b3lyp_6-31g(d).nwchem.inp (generated) 000177302.b3lyp_6-31g(d).log.xz 000177302.td-b3lyp_6-31g+(d).inp 000177302.td-b3lyp_6-31g+(d).log.xz

000177302.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177302.td-b3lyp_6-31+g(d).gjf (generated)

000177302.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177302.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177302.mol 000177302.PUBCHEM 000177302.mol (via Jmol)
000177303.b3lyp_6-31g(d).inp

000177303.b3lyp_6-31g(d).qchem.inp (generated)

000177303.b3lyp_6-31g(d).gjf (generated)

000177303.b3lyp_6-31g(d).firefly.inp (generated)

000177303.b3lyp_6-31g(d).smash.inp (generated)

000177303.b3lyp_6-31g(d).nwchem.inp (generated) 000177303.b3lyp_6-31g(d).log.xz 000177303.td-b3lyp_6-31g+(d).inp 000177303.td-b3lyp_6-31g+(d).log.xz

000177303.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177303.td-b3lyp_6-31+g(d).gjf (generated)

000177303.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177303.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177303.mol 000177303.PUBCHEM 000177303.mol (via Jmol)
000177310.b3lyp_6-31g(d).inp

000177310.b3lyp_6-31g(d).qchem.inp (generated)

000177310.b3lyp_6-31g(d).gjf (generated)

000177310.b3lyp_6-31g(d).firefly.inp (generated)

000177310.b3lyp_6-31g(d).smash.inp (generated)

000177310.b3lyp_6-31g(d).nwchem.inp (generated) 000177310.b3lyp_6-31g(d).log.xz 000177310.td-b3lyp_6-31g+(d).inp 000177310.td-b3lyp_6-31g+(d).log.xz

000177310.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177310.td-b3lyp_6-31+g(d).gjf (generated)

000177310.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177310.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177310.mol 000177310.PUBCHEM 000177310.mol (via Jmol)
000177338.b3lyp_6-31g(d).inp

000177338.b3lyp_6-31g(d).qchem.inp (generated)

000177338.b3lyp_6-31g(d).gjf (generated)

000177338.b3lyp_6-31g(d).firefly.inp (generated)

000177338.b3lyp_6-31g(d).smash.inp (generated)

000177338.b3lyp_6-31g(d).nwchem.inp (generated) 000177338.b3lyp_6-31g(d).log.xz 000177338.td-b3lyp_6-31g+(d).inp 000177338.td-b3lyp_6-31g+(d).log.xz

000177338.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177338.td-b3lyp_6-31+g(d).gjf (generated)

000177338.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177338.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177338.mol 000177338.PUBCHEM 000177338.mol (via Jmol)
000177348.b3lyp_6-31g(d).inp

000177348.b3lyp_6-31g(d).qchem.inp (generated)

000177348.b3lyp_6-31g(d).gjf (generated)

000177348.b3lyp_6-31g(d).firefly.inp (generated)

000177348.b3lyp_6-31g(d).smash.inp (generated)

000177348.b3lyp_6-31g(d).nwchem.inp (generated) 000177348.b3lyp_6-31g(d).log.xz 000177348.td-b3lyp_6-31g+(d).inp 000177348.td-b3lyp_6-31g+(d).log.xz

000177348.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177348.td-b3lyp_6-31+g(d).gjf (generated)

000177348.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177348.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177348.mol 000177348.PUBCHEM 000177348.mol (via Jmol)
000177363.b3lyp_6-31g(d).inp

000177363.b3lyp_6-31g(d).qchem.inp (generated)

000177363.b3lyp_6-31g(d).gjf (generated)

000177363.b3lyp_6-31g(d).firefly.inp (generated)

000177363.b3lyp_6-31g(d).smash.inp (generated)

000177363.b3lyp_6-31g(d).nwchem.inp (generated) 000177363.b3lyp_6-31g(d).log.xz 000177363.td-b3lyp_6-31g+(d).inp 000177363.td-b3lyp_6-31g+(d).log.xz

000177363.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177363.td-b3lyp_6-31+g(d).gjf (generated)

000177363.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177363.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177363.mol 000177363.PUBCHEM 000177363.mol (via Jmol)
000177381.b3lyp_6-31g(d).inp

000177381.b3lyp_6-31g(d).qchem.inp (generated)

000177381.b3lyp_6-31g(d).gjf (generated)

000177381.b3lyp_6-31g(d).firefly.inp (generated)

000177381.b3lyp_6-31g(d).smash.inp (generated)

000177381.b3lyp_6-31g(d).nwchem.inp (generated) 000177381.b3lyp_6-31g(d).log.xz 000177381.td-b3lyp_6-31g+(d).inp 000177381.td-b3lyp_6-31g+(d).log.xz

000177381.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177381.td-b3lyp_6-31+g(d).gjf (generated)

000177381.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177381.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177381.mol 000177381.PUBCHEM 000177381.mol (via Jmol)
000177382.b3lyp_6-31g(d).inp

000177382.b3lyp_6-31g(d).qchem.inp (generated)

000177382.b3lyp_6-31g(d).gjf (generated)

000177382.b3lyp_6-31g(d).firefly.inp (generated)

000177382.b3lyp_6-31g(d).smash.inp (generated)

000177382.b3lyp_6-31g(d).nwchem.inp (generated) 000177382.b3lyp_6-31g(d).log.xz 000177382.td-b3lyp_6-31g+(d).inp 000177382.td-b3lyp_6-31g+(d).log.xz

000177382.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177382.td-b3lyp_6-31+g(d).gjf (generated)

000177382.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177382.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177382.mol 000177382.PUBCHEM 000177382.mol (via Jmol)
000177447.b3lyp_6-31g(d).inp

000177447.b3lyp_6-31g(d).qchem.inp (generated)

000177447.b3lyp_6-31g(d).gjf (generated)

000177447.b3lyp_6-31g(d).firefly.inp (generated)

000177447.b3lyp_6-31g(d).smash.inp (generated)

000177447.b3lyp_6-31g(d).nwchem.inp (generated) 000177447.b3lyp_6-31g(d).log.xz 000177447.td-b3lyp_6-31g+(d).inp 000177447.td-b3lyp_6-31g+(d).log.xz

000177447.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177447.td-b3lyp_6-31+g(d).gjf (generated)

000177447.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177447.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177447.mol 000177447.PUBCHEM 000177447.mol (via Jmol)
000177454.b3lyp_6-31g(d).inp

000177454.b3lyp_6-31g(d).qchem.inp (generated)

000177454.b3lyp_6-31g(d).gjf (generated)

000177454.b3lyp_6-31g(d).firefly.inp (generated)

000177454.b3lyp_6-31g(d).smash.inp (generated)

000177454.b3lyp_6-31g(d).nwchem.inp (generated) 000177454.b3lyp_6-31g(d).log.xz 000177454.td-b3lyp_6-31g+(d).inp 000177454.td-b3lyp_6-31g+(d).log.xz

000177454.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177454.td-b3lyp_6-31+g(d).gjf (generated)

000177454.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177454.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177454.mol 000177454.PUBCHEM 000177454.mol (via Jmol)
000177459.b3lyp_6-31g(d).inp

000177459.b3lyp_6-31g(d).qchem.inp (generated)

000177459.b3lyp_6-31g(d).gjf (generated)

000177459.b3lyp_6-31g(d).firefly.inp (generated)

000177459.b3lyp_6-31g(d).smash.inp (generated)

000177459.b3lyp_6-31g(d).nwchem.inp (generated) 000177459.b3lyp_6-31g(d).log.xz 000177459.td-b3lyp_6-31g+(d).inp 000177459.td-b3lyp_6-31g+(d).log.xz

000177459.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177459.td-b3lyp_6-31+g(d).gjf (generated)

000177459.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177459.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177459.mol 000177459.PUBCHEM 000177459.mol (via Jmol)
000177461.b3lyp_6-31g(d).inp

000177461.b3lyp_6-31g(d).qchem.inp (generated)

000177461.b3lyp_6-31g(d).gjf (generated)

000177461.b3lyp_6-31g(d).firefly.inp (generated)

000177461.b3lyp_6-31g(d).smash.inp (generated)

000177461.b3lyp_6-31g(d).nwchem.inp (generated) 000177461.b3lyp_6-31g(d).log.xz 000177461.td-b3lyp_6-31g+(d).inp 000177461.td-b3lyp_6-31g+(d).log.xz

000177461.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177461.td-b3lyp_6-31+g(d).gjf (generated)

000177461.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177461.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177461.mol 000177461.PUBCHEM 000177461.mol (via Jmol)
000177463.b3lyp_6-31g(d).inp

000177463.b3lyp_6-31g(d).qchem.inp (generated)

000177463.b3lyp_6-31g(d).gjf (generated)

000177463.b3lyp_6-31g(d).firefly.inp (generated)

000177463.b3lyp_6-31g(d).smash.inp (generated)

000177463.b3lyp_6-31g(d).nwchem.inp (generated) 000177463.b3lyp_6-31g(d).log.xz 000177463.td-b3lyp_6-31g+(d).inp 000177463.td-b3lyp_6-31g+(d).log.xz

000177463.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177463.td-b3lyp_6-31+g(d).gjf (generated)

000177463.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177463.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177463.mol 000177463.PUBCHEM 000177463.mol (via Jmol)
000177468.b3lyp_6-31g(d).inp

000177468.b3lyp_6-31g(d).qchem.inp (generated)

000177468.b3lyp_6-31g(d).gjf (generated)

000177468.b3lyp_6-31g(d).firefly.inp (generated)

000177468.b3lyp_6-31g(d).smash.inp (generated)

000177468.b3lyp_6-31g(d).nwchem.inp (generated) 000177468.b3lyp_6-31g(d).log.xz 000177468.td-b3lyp_6-31g+(d).inp 000177468.td-b3lyp_6-31g+(d).log.xz

000177468.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177468.td-b3lyp_6-31+g(d).gjf (generated)

000177468.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177468.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177468.mol 000177468.PUBCHEM 000177468.mol (via Jmol)
000177476.b3lyp_6-31g(d).inp

000177476.b3lyp_6-31g(d).qchem.inp (generated)

000177476.b3lyp_6-31g(d).gjf (generated)

000177476.b3lyp_6-31g(d).firefly.inp (generated)

000177476.b3lyp_6-31g(d).smash.inp (generated)

000177476.b3lyp_6-31g(d).nwchem.inp (generated) 000177476.b3lyp_6-31g(d).log.xz 000177476.mol 000177476.PUBCHEM 000177476.mol (via Jmol)
000177477.b3lyp_6-31g(d).inp

000177477.b3lyp_6-31g(d).qchem.inp (generated)

000177477.b3lyp_6-31g(d).gjf (generated)

000177477.b3lyp_6-31g(d).firefly.inp (generated)

000177477.b3lyp_6-31g(d).smash.inp (generated)

000177477.b3lyp_6-31g(d).nwchem.inp (generated) 000177477.b3lyp_6-31g(d).log.xz 000177477.mol 000177477.PUBCHEM 000177477.mol (via Jmol)
000177496.b3lyp_6-31g(d).inp

000177496.b3lyp_6-31g(d).qchem.inp (generated)

000177496.b3lyp_6-31g(d).gjf (generated)

000177496.b3lyp_6-31g(d).firefly.inp (generated)

000177496.b3lyp_6-31g(d).smash.inp (generated)

000177496.b3lyp_6-31g(d).nwchem.inp (generated) 000177496.b3lyp_6-31g(d).log.xz 000177496.td-b3lyp_6-31g+(d).inp 000177496.td-b3lyp_6-31g+(d).log.xz

000177496.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177496.td-b3lyp_6-31+g(d).gjf (generated)

000177496.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177496.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177496.mol 000177496.PUBCHEM 000177496.mol (via Jmol)
000177503.b3lyp_6-31g(d).inp

000177503.b3lyp_6-31g(d).qchem.inp (generated)

000177503.b3lyp_6-31g(d).gjf (generated)

000177503.b3lyp_6-31g(d).firefly.inp (generated)

000177503.b3lyp_6-31g(d).smash.inp (generated)

000177503.b3lyp_6-31g(d).nwchem.inp (generated) 000177503.b3lyp_6-31g(d).log.xz 000177503.td-b3lyp_6-31g+(d).inp 000177503.td-b3lyp_6-31g+(d).log.xz

000177503.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177503.td-b3lyp_6-31+g(d).gjf (generated)

000177503.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177503.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177503.mol 000177503.PUBCHEM 000177503.mol (via Jmol)
000177518.b3lyp_6-31g(d).inp

000177518.b3lyp_6-31g(d).qchem.inp (generated)

000177518.b3lyp_6-31g(d).gjf (generated)

000177518.b3lyp_6-31g(d).firefly.inp (generated)

000177518.b3lyp_6-31g(d).smash.inp (generated)

000177518.b3lyp_6-31g(d).nwchem.inp (generated) 000177518.b3lyp_6-31g(d).log.xz 000177518.td-b3lyp_6-31g+(d).inp 000177518.td-b3lyp_6-31g+(d).log.xz

000177518.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177518.td-b3lyp_6-31+g(d).gjf (generated)

000177518.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177518.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177518.mol 000177518.PUBCHEM 000177518.mol (via Jmol)
000177559.b3lyp_6-31g(d).inp

000177559.b3lyp_6-31g(d).qchem.inp (generated)

000177559.b3lyp_6-31g(d).gjf (generated)

000177559.b3lyp_6-31g(d).firefly.inp (generated)

000177559.b3lyp_6-31g(d).smash.inp (generated)

000177559.b3lyp_6-31g(d).nwchem.inp (generated) 000177559.b3lyp_6-31g(d).log.xz 000177559.td-b3lyp_6-31g+(d).inp 000177559.td-b3lyp_6-31g+(d).log.xz

000177559.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177559.td-b3lyp_6-31+g(d).gjf (generated)

000177559.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177559.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177559.mol 000177559.PUBCHEM 000177559.mol (via Jmol)
000177578.b3lyp_6-31g(d).inp

000177578.b3lyp_6-31g(d).qchem.inp (generated)

000177578.b3lyp_6-31g(d).gjf (generated)

000177578.b3lyp_6-31g(d).firefly.inp (generated)

000177578.b3lyp_6-31g(d).smash.inp (generated)

000177578.b3lyp_6-31g(d).nwchem.inp (generated) 000177578.b3lyp_6-31g(d).log.xz 000177578.td-b3lyp_6-31g+(d).inp 000177578.td-b3lyp_6-31g+(d).log.xz

000177578.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177578.td-b3lyp_6-31+g(d).gjf (generated)

000177578.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177578.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177578.mol 000177578.PUBCHEM 000177578.mol (via Jmol)
000177585.b3lyp_6-31g(d).inp

000177585.b3lyp_6-31g(d).qchem.inp (generated)

000177585.b3lyp_6-31g(d).gjf (generated)

000177585.b3lyp_6-31g(d).firefly.inp (generated)

000177585.b3lyp_6-31g(d).smash.inp (generated)

000177585.b3lyp_6-31g(d).nwchem.inp (generated) 000177585.b3lyp_6-31g(d).log.xz 000177585.td-b3lyp_6-31g+(d).inp 000177585.td-b3lyp_6-31g+(d).log.xz

000177585.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177585.td-b3lyp_6-31+g(d).gjf (generated)

000177585.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177585.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177585.mol 000177585.PUBCHEM 000177585.mol (via Jmol)
000177591.b3lyp_6-31g(d).inp

000177591.b3lyp_6-31g(d).qchem.inp (generated)

000177591.b3lyp_6-31g(d).gjf (generated)

000177591.b3lyp_6-31g(d).firefly.inp (generated)

000177591.b3lyp_6-31g(d).smash.inp (generated)

000177591.b3lyp_6-31g(d).nwchem.inp (generated) 000177591.b3lyp_6-31g(d).log.xz 000177591.td-b3lyp_6-31g+(d).inp 000177591.td-b3lyp_6-31g+(d).log.xz

000177591.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177591.td-b3lyp_6-31+g(d).gjf (generated)

000177591.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177591.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177591.mol 000177591.PUBCHEM 000177591.mol (via Jmol)
000177593.b3lyp_6-31g(d).inp

000177593.b3lyp_6-31g(d).qchem.inp (generated)

000177593.b3lyp_6-31g(d).gjf (generated)

000177593.b3lyp_6-31g(d).firefly.inp (generated)

000177593.b3lyp_6-31g(d).smash.inp (generated)

000177593.b3lyp_6-31g(d).nwchem.inp (generated) 000177593.b3lyp_6-31g(d).log.xz 000177593.td-b3lyp_6-31g+(d).inp 000177593.td-b3lyp_6-31g+(d).log.xz

000177593.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177593.td-b3lyp_6-31+g(d).gjf (generated)

000177593.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177593.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177593.mol 000177593.PUBCHEM 000177593.mol (via Jmol)
000177595.b3lyp_6-31g(d).inp

000177595.b3lyp_6-31g(d).qchem.inp (generated)

000177595.b3lyp_6-31g(d).gjf (generated)

000177595.b3lyp_6-31g(d).firefly.inp (generated)

000177595.b3lyp_6-31g(d).smash.inp (generated)

000177595.b3lyp_6-31g(d).nwchem.inp (generated) 000177595.b3lyp_6-31g(d).log.xz 000177595.td-b3lyp_6-31g+(d).inp 000177595.td-b3lyp_6-31g+(d).log.xz

000177595.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177595.td-b3lyp_6-31+g(d).gjf (generated)

000177595.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177595.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177595.mol 000177595.PUBCHEM 000177595.mol (via Jmol)
000177602.b3lyp_6-31g(d).inp

000177602.b3lyp_6-31g(d).qchem.inp (generated)

000177602.b3lyp_6-31g(d).gjf (generated)

000177602.b3lyp_6-31g(d).firefly.inp (generated)

000177602.b3lyp_6-31g(d).smash.inp (generated)

000177602.b3lyp_6-31g(d).nwchem.inp (generated) 000177602.b3lyp_6-31g(d).log.xz 000177602.td-b3lyp_6-31g+(d).inp 000177602.td-b3lyp_6-31g+(d).log.xz

000177602.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177602.td-b3lyp_6-31+g(d).gjf (generated)

000177602.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177602.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177602.mol 000177602.PUBCHEM 000177602.mol (via Jmol)
000177605.b3lyp_6-31g(d).inp

000177605.b3lyp_6-31g(d).qchem.inp (generated)

000177605.b3lyp_6-31g(d).gjf (generated)

000177605.b3lyp_6-31g(d).firefly.inp (generated)

000177605.b3lyp_6-31g(d).smash.inp (generated)

000177605.b3lyp_6-31g(d).nwchem.inp (generated) 000177605.b3lyp_6-31g(d).log.xz 000177605.td-b3lyp_6-31g+(d).inp 000177605.td-b3lyp_6-31g+(d).log.xz

000177605.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177605.td-b3lyp_6-31+g(d).gjf (generated)

000177605.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177605.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177605.mol 000177605.PUBCHEM 000177605.mol (via Jmol)
000177606.b3lyp_6-31g(d).inp

000177606.b3lyp_6-31g(d).qchem.inp (generated)

000177606.b3lyp_6-31g(d).gjf (generated)

000177606.b3lyp_6-31g(d).firefly.inp (generated)

000177606.b3lyp_6-31g(d).smash.inp (generated)

000177606.b3lyp_6-31g(d).nwchem.inp (generated) 000177606.b3lyp_6-31g(d).log.xz 000177606.mol 000177606.PUBCHEM 000177606.mol (via Jmol)
000177609.b3lyp_6-31g(d).inp

000177609.b3lyp_6-31g(d).qchem.inp (generated)

000177609.b3lyp_6-31g(d).gjf (generated)

000177609.b3lyp_6-31g(d).firefly.inp (generated)

000177609.b3lyp_6-31g(d).smash.inp (generated)

000177609.b3lyp_6-31g(d).nwchem.inp (generated) 000177609.b3lyp_6-31g(d).log.xz 000177609.td-b3lyp_6-31g+(d).inp 000177609.td-b3lyp_6-31g+(d).log.xz

000177609.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177609.td-b3lyp_6-31+g(d).gjf (generated)

000177609.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177609.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177609.mol 000177609.PUBCHEM 000177609.mol (via Jmol)
000177610.b3lyp_6-31g(d).inp

000177610.b3lyp_6-31g(d).qchem.inp (generated)

000177610.b3lyp_6-31g(d).gjf (generated)

000177610.b3lyp_6-31g(d).firefly.inp (generated)

000177610.b3lyp_6-31g(d).smash.inp (generated)

000177610.b3lyp_6-31g(d).nwchem.inp (generated) 000177610.b3lyp_6-31g(d).log.xz 000177610.td-b3lyp_6-31g+(d).inp 000177610.td-b3lyp_6-31g+(d).log.xz

000177610.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177610.td-b3lyp_6-31+g(d).gjf (generated)

000177610.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177610.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177610.mol 000177610.PUBCHEM 000177610.mol (via Jmol)
000177611.b3lyp_6-31g(d).inp

000177611.b3lyp_6-31g(d).qchem.inp (generated)

000177611.b3lyp_6-31g(d).gjf (generated)

000177611.b3lyp_6-31g(d).firefly.inp (generated)

000177611.b3lyp_6-31g(d).smash.inp (generated)

000177611.b3lyp_6-31g(d).nwchem.inp (generated) 000177611.b3lyp_6-31g(d).log.xz 000177611.td-b3lyp_6-31g+(d).inp 000177611.td-b3lyp_6-31g+(d).log.xz

000177611.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177611.td-b3lyp_6-31+g(d).gjf (generated)

000177611.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177611.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177611.mol 000177611.PUBCHEM 000177611.mol (via Jmol)
000177613.b3lyp_6-31g(d).inp

000177613.b3lyp_6-31g(d).qchem.inp (generated)

000177613.b3lyp_6-31g(d).gjf (generated)

000177613.b3lyp_6-31g(d).firefly.inp (generated)

000177613.b3lyp_6-31g(d).smash.inp (generated)

000177613.b3lyp_6-31g(d).nwchem.inp (generated) 000177613.b3lyp_6-31g(d).log.xz 000177613.td-b3lyp_6-31g+(d).inp 000177613.td-b3lyp_6-31g+(d).log.xz

000177613.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177613.td-b3lyp_6-31+g(d).gjf (generated)

000177613.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177613.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177613.mol 000177613.PUBCHEM 000177613.mol (via Jmol)
000177643.b3lyp_6-31g(d).inp

000177643.b3lyp_6-31g(d).qchem.inp (generated)

000177643.b3lyp_6-31g(d).gjf (generated)

000177643.b3lyp_6-31g(d).firefly.inp (generated)

000177643.b3lyp_6-31g(d).smash.inp (generated)

000177643.b3lyp_6-31g(d).nwchem.inp (generated) 000177643.b3lyp_6-31g(d).log.xz 000177643.td-b3lyp_6-31g+(d).inp 000177643.td-b3lyp_6-31g+(d).log.xz

000177643.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177643.td-b3lyp_6-31+g(d).gjf (generated)

000177643.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177643.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177643.mol 000177643.PUBCHEM 000177643.mol (via Jmol)
000177650.b3lyp_6-31g(d).inp

000177650.b3lyp_6-31g(d).qchem.inp (generated)

000177650.b3lyp_6-31g(d).gjf (generated)

000177650.b3lyp_6-31g(d).firefly.inp (generated)

000177650.b3lyp_6-31g(d).smash.inp (generated)

000177650.b3lyp_6-31g(d).nwchem.inp (generated) 000177650.b3lyp_6-31g(d).log.xz 000177650.mol 000177650.PUBCHEM 000177650.mol (via Jmol)
000177674.b3lyp_6-31g(d).inp

000177674.b3lyp_6-31g(d).qchem.inp (generated)

000177674.b3lyp_6-31g(d).gjf (generated)

000177674.b3lyp_6-31g(d).firefly.inp (generated)

000177674.b3lyp_6-31g(d).smash.inp (generated)

000177674.b3lyp_6-31g(d).nwchem.inp (generated) 000177674.b3lyp_6-31g(d).log.xz 000177674.td-b3lyp_6-31g+(d).inp 000177674.td-b3lyp_6-31g+(d).log.xz

000177674.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177674.td-b3lyp_6-31+g(d).gjf (generated)

000177674.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177674.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177674.mol 000177674.PUBCHEM 000177674.mol (via Jmol)
000177684.b3lyp_6-31g(d).inp

000177684.b3lyp_6-31g(d).qchem.inp (generated)

000177684.b3lyp_6-31g(d).gjf (generated)

000177684.b3lyp_6-31g(d).firefly.inp (generated)

000177684.b3lyp_6-31g(d).smash.inp (generated)

000177684.b3lyp_6-31g(d).nwchem.inp (generated) 000177684.b3lyp_6-31g(d).log.xz 000177684.td-b3lyp_6-31g+(d).inp 000177684.td-b3lyp_6-31g+(d).log.xz

000177684.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177684.td-b3lyp_6-31+g(d).gjf (generated)

000177684.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177684.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177684.mol 000177684.PUBCHEM 000177684.mol (via Jmol)
000177691.b3lyp_6-31g(d).inp

000177691.b3lyp_6-31g(d).qchem.inp (generated)

000177691.b3lyp_6-31g(d).gjf (generated)

000177691.b3lyp_6-31g(d).firefly.inp (generated)

000177691.b3lyp_6-31g(d).smash.inp (generated)

000177691.b3lyp_6-31g(d).nwchem.inp (generated) 000177691.b3lyp_6-31g(d).log.xz 000177691.td-b3lyp_6-31g+(d).inp 000177691.td-b3lyp_6-31g+(d).log.xz

000177691.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177691.td-b3lyp_6-31+g(d).gjf (generated)

000177691.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177691.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177691.mol 000177691.PUBCHEM 000177691.mol (via Jmol)
000177700.b3lyp_6-31g(d).inp

000177700.b3lyp_6-31g(d).qchem.inp (generated)

000177700.b3lyp_6-31g(d).gjf (generated)

000177700.b3lyp_6-31g(d).firefly.inp (generated)

000177700.b3lyp_6-31g(d).smash.inp (generated)

000177700.b3lyp_6-31g(d).nwchem.inp (generated) 000177700.b3lyp_6-31g(d).log.xz 000177700.td-b3lyp_6-31g+(d).inp 000177700.td-b3lyp_6-31g+(d).log.xz

000177700.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177700.td-b3lyp_6-31+g(d).gjf (generated)

000177700.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177700.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177700.mol 000177700.PUBCHEM 000177700.mol (via Jmol)
000177708.b3lyp_6-31g(d).inp

000177708.b3lyp_6-31g(d).qchem.inp (generated)

000177708.b3lyp_6-31g(d).gjf (generated)

000177708.b3lyp_6-31g(d).firefly.inp (generated)

000177708.b3lyp_6-31g(d).smash.inp (generated)

000177708.b3lyp_6-31g(d).nwchem.inp (generated) 000177708.b3lyp_6-31g(d).log.xz 000177708.td-b3lyp_6-31g+(d).inp 000177708.td-b3lyp_6-31g+(d).log.xz

000177708.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177708.td-b3lyp_6-31+g(d).gjf (generated)

000177708.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177708.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177708.mol 000177708.PUBCHEM 000177708.mol (via Jmol)
000177709.b3lyp_6-31g(d).inp

000177709.b3lyp_6-31g(d).qchem.inp (generated)

000177709.b3lyp_6-31g(d).gjf (generated)

000177709.b3lyp_6-31g(d).firefly.inp (generated)

000177709.b3lyp_6-31g(d).smash.inp (generated)

000177709.b3lyp_6-31g(d).nwchem.inp (generated) 000177709.b3lyp_6-31g(d).log.xz 000177709.td-b3lyp_6-31g+(d).inp 000177709.td-b3lyp_6-31g+(d).log.xz

000177709.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177709.td-b3lyp_6-31+g(d).gjf (generated)

000177709.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177709.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177709.mol 000177709.PUBCHEM 000177709.mol (via Jmol)
000177711.b3lyp_6-31g(d).inp

000177711.b3lyp_6-31g(d).qchem.inp (generated)

000177711.b3lyp_6-31g(d).gjf (generated)

000177711.b3lyp_6-31g(d).firefly.inp (generated)

000177711.b3lyp_6-31g(d).smash.inp (generated)

000177711.b3lyp_6-31g(d).nwchem.inp (generated) 000177711.b3lyp_6-31g(d).log.xz 000177711.mol 000177711.PUBCHEM 000177711.mol (via Jmol)
000177717.b3lyp_6-31g(d).inp

000177717.b3lyp_6-31g(d).qchem.inp (generated)

000177717.b3lyp_6-31g(d).gjf (generated)

000177717.b3lyp_6-31g(d).firefly.inp (generated)

000177717.b3lyp_6-31g(d).smash.inp (generated)

000177717.b3lyp_6-31g(d).nwchem.inp (generated) 000177717.b3lyp_6-31g(d).log.xz 000177717.td-b3lyp_6-31g+(d).inp 000177717.td-b3lyp_6-31g+(d).log.xz

000177717.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177717.td-b3lyp_6-31+g(d).gjf (generated)

000177717.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177717.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177717.mol 000177717.PUBCHEM 000177717.mol (via Jmol)
000177720.b3lyp_6-31g(d).inp

000177720.b3lyp_6-31g(d).qchem.inp (generated)

000177720.b3lyp_6-31g(d).gjf (generated)

000177720.b3lyp_6-31g(d).firefly.inp (generated)

000177720.b3lyp_6-31g(d).smash.inp (generated)

000177720.b3lyp_6-31g(d).nwchem.inp (generated) 000177720.b3lyp_6-31g(d).log.xz 000177720.td-b3lyp_6-31g+(d).inp 000177720.td-b3lyp_6-31g+(d).log.xz

000177720.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177720.td-b3lyp_6-31+g(d).gjf (generated)

000177720.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177720.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177720.mol 000177720.PUBCHEM 000177720.mol (via Jmol)
000177726.b3lyp_6-31g(d).inp

000177726.b3lyp_6-31g(d).qchem.inp (generated)

000177726.b3lyp_6-31g(d).gjf (generated)

000177726.b3lyp_6-31g(d).firefly.inp (generated)

000177726.b3lyp_6-31g(d).smash.inp (generated)

000177726.b3lyp_6-31g(d).nwchem.inp (generated) 000177726.b3lyp_6-31g(d).log.xz 000177726.mol 000177726.PUBCHEM 000177726.mol (via Jmol)
000177727.b3lyp_6-31g(d).inp

000177727.b3lyp_6-31g(d).qchem.inp (generated)

000177727.b3lyp_6-31g(d).gjf (generated)

000177727.b3lyp_6-31g(d).firefly.inp (generated)

000177727.b3lyp_6-31g(d).smash.inp (generated)

000177727.b3lyp_6-31g(d).nwchem.inp (generated) 000177727.b3lyp_6-31g(d).log.xz 000177727.td-b3lyp_6-31g+(d).inp 000177727.td-b3lyp_6-31g+(d).log.xz

000177727.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177727.td-b3lyp_6-31+g(d).gjf (generated)

000177727.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177727.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177727.mol 000177727.PUBCHEM 000177727.mol (via Jmol)
000177732.b3lyp_6-31g(d).inp

000177732.b3lyp_6-31g(d).qchem.inp (generated)

000177732.b3lyp_6-31g(d).gjf (generated)

000177732.b3lyp_6-31g(d).firefly.inp (generated)

000177732.b3lyp_6-31g(d).smash.inp (generated)

000177732.b3lyp_6-31g(d).nwchem.inp (generated) 000177732.b3lyp_6-31g(d).log.xz 000177732.td-b3lyp_6-31g+(d).inp 000177732.td-b3lyp_6-31g+(d).log.xz

000177732.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177732.td-b3lyp_6-31+g(d).gjf (generated)

000177732.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177732.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177732.mol 000177732.PUBCHEM 000177732.mol (via Jmol)
000177735.b3lyp_6-31g(d).inp

000177735.b3lyp_6-31g(d).qchem.inp (generated)

000177735.b3lyp_6-31g(d).gjf (generated)

000177735.b3lyp_6-31g(d).firefly.inp (generated)

000177735.b3lyp_6-31g(d).smash.inp (generated)

000177735.b3lyp_6-31g(d).nwchem.inp (generated) 000177735.b3lyp_6-31g(d).log.xz 000177735.td-b3lyp_6-31g+(d).inp 000177735.td-b3lyp_6-31g+(d).log.xz

000177735.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177735.td-b3lyp_6-31+g(d).gjf (generated)

000177735.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177735.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177735.mol 000177735.PUBCHEM 000177735.mol (via Jmol)
000177736.b3lyp_6-31g(d).inp

000177736.b3lyp_6-31g(d).qchem.inp (generated)

000177736.b3lyp_6-31g(d).gjf (generated)

000177736.b3lyp_6-31g(d).firefly.inp (generated)

000177736.b3lyp_6-31g(d).smash.inp (generated)

000177736.b3lyp_6-31g(d).nwchem.inp (generated) 000177736.b3lyp_6-31g(d).log.xz 000177736.mol 000177736.PUBCHEM 000177736.mol (via Jmol)
000177738.b3lyp_6-31g(d).inp

000177738.b3lyp_6-31g(d).qchem.inp (generated)

000177738.b3lyp_6-31g(d).gjf (generated)

000177738.b3lyp_6-31g(d).firefly.inp (generated)

000177738.b3lyp_6-31g(d).smash.inp (generated)

000177738.b3lyp_6-31g(d).nwchem.inp (generated) 000177738.b3lyp_6-31g(d).log.xz 000177738.td-b3lyp_6-31g+(d).inp 000177738.td-b3lyp_6-31g+(d).log.xz

000177738.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177738.td-b3lyp_6-31+g(d).gjf (generated)

000177738.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177738.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177738.mol 000177738.PUBCHEM 000177738.mol (via Jmol)
000177739.b3lyp_6-31g(d).inp

000177739.b3lyp_6-31g(d).qchem.inp (generated)

000177739.b3lyp_6-31g(d).gjf (generated)

000177739.b3lyp_6-31g(d).firefly.inp (generated)

000177739.b3lyp_6-31g(d).smash.inp (generated)

000177739.b3lyp_6-31g(d).nwchem.inp (generated) 000177739.b3lyp_6-31g(d).log.xz 000177739.td-b3lyp_6-31g+(d).inp 000177739.td-b3lyp_6-31g+(d).log.xz

000177739.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177739.td-b3lyp_6-31+g(d).gjf (generated)

000177739.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177739.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177739.mol 000177739.PUBCHEM 000177739.mol (via Jmol)
000177742.b3lyp_6-31g(d).inp

000177742.b3lyp_6-31g(d).qchem.inp (generated)

000177742.b3lyp_6-31g(d).gjf (generated)

000177742.b3lyp_6-31g(d).firefly.inp (generated)

000177742.b3lyp_6-31g(d).smash.inp (generated)

000177742.b3lyp_6-31g(d).nwchem.inp (generated) 000177742.b3lyp_6-31g(d).log.xz 000177742.td-b3lyp_6-31g+(d).inp 000177742.td-b3lyp_6-31g+(d).log.xz

000177742.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177742.td-b3lyp_6-31+g(d).gjf (generated)

000177742.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177742.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177742.mol 000177742.PUBCHEM 000177742.mol (via Jmol)
000177745.b3lyp_6-31g(d).inp

000177745.b3lyp_6-31g(d).qchem.inp (generated)

000177745.b3lyp_6-31g(d).gjf (generated)

000177745.b3lyp_6-31g(d).firefly.inp (generated)

000177745.b3lyp_6-31g(d).smash.inp (generated)

000177745.b3lyp_6-31g(d).nwchem.inp (generated) 000177745.b3lyp_6-31g(d).log.xz 000177745.td-b3lyp_6-31g+(d).inp 000177745.td-b3lyp_6-31g+(d).log.xz

000177745.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177745.td-b3lyp_6-31+g(d).gjf (generated)

000177745.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177745.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177745.mol 000177745.PUBCHEM 000177745.mol (via Jmol)
000177746.b3lyp_6-31g(d).inp

000177746.b3lyp_6-31g(d).qchem.inp (generated)

000177746.b3lyp_6-31g(d).gjf (generated)

000177746.b3lyp_6-31g(d).firefly.inp (generated)

000177746.b3lyp_6-31g(d).smash.inp (generated)

000177746.b3lyp_6-31g(d).nwchem.inp (generated) 000177746.b3lyp_6-31g(d).log.xz 000177746.td-b3lyp_6-31g+(d).inp 000177746.td-b3lyp_6-31g+(d).log.xz

000177746.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177746.td-b3lyp_6-31+g(d).gjf (generated)

000177746.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177746.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177746.mol 000177746.PUBCHEM 000177746.mol (via Jmol)
000177747.b3lyp_6-31g(d).inp

000177747.b3lyp_6-31g(d).qchem.inp (generated)

000177747.b3lyp_6-31g(d).gjf (generated)

000177747.b3lyp_6-31g(d).firefly.inp (generated)

000177747.b3lyp_6-31g(d).smash.inp (generated)

000177747.b3lyp_6-31g(d).nwchem.inp (generated) 000177747.b3lyp_6-31g(d).log.xz 000177747.td-b3lyp_6-31g+(d).inp 000177747.td-b3lyp_6-31g+(d).log.xz

000177747.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177747.td-b3lyp_6-31+g(d).gjf (generated)

000177747.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177747.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177747.mol 000177747.PUBCHEM 000177747.mol (via Jmol)
000177748.b3lyp_6-31g(d).inp

000177748.b3lyp_6-31g(d).qchem.inp (generated)

000177748.b3lyp_6-31g(d).gjf (generated)

000177748.b3lyp_6-31g(d).firefly.inp (generated)

000177748.b3lyp_6-31g(d).smash.inp (generated)

000177748.b3lyp_6-31g(d).nwchem.inp (generated) 000177748.b3lyp_6-31g(d).log.xz 000177748.td-b3lyp_6-31g+(d).inp 000177748.td-b3lyp_6-31g+(d).log.xz

000177748.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177748.td-b3lyp_6-31+g(d).gjf (generated)

000177748.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177748.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177748.mol 000177748.PUBCHEM 000177748.mol (via Jmol)
000177753.b3lyp_6-31g(d).inp

000177753.b3lyp_6-31g(d).qchem.inp (generated)

000177753.b3lyp_6-31g(d).gjf (generated)

000177753.b3lyp_6-31g(d).firefly.inp (generated)

000177753.b3lyp_6-31g(d).smash.inp (generated)

000177753.b3lyp_6-31g(d).nwchem.inp (generated) 000177753.b3lyp_6-31g(d).log.xz 000177753.td-b3lyp_6-31g+(d).inp 000177753.td-b3lyp_6-31g+(d).log.xz

000177753.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177753.td-b3lyp_6-31+g(d).gjf (generated)

000177753.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177753.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177753.mol 000177753.PUBCHEM 000177753.mol (via Jmol)
000177755.b3lyp_6-31g(d).inp

000177755.b3lyp_6-31g(d).qchem.inp (generated)

000177755.b3lyp_6-31g(d).gjf (generated)

000177755.b3lyp_6-31g(d).firefly.inp (generated)

000177755.b3lyp_6-31g(d).smash.inp (generated)

000177755.b3lyp_6-31g(d).nwchem.inp (generated) 000177755.b3lyp_6-31g(d).log.xz 000177755.td-b3lyp_6-31g+(d).inp 000177755.td-b3lyp_6-31g+(d).log.xz

000177755.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177755.td-b3lyp_6-31+g(d).gjf (generated)

000177755.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177755.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177755.mol 000177755.PUBCHEM 000177755.mol (via Jmol)
000177756.b3lyp_6-31g(d).inp

000177756.b3lyp_6-31g(d).qchem.inp (generated)

000177756.b3lyp_6-31g(d).gjf (generated)

000177756.b3lyp_6-31g(d).firefly.inp (generated)

000177756.b3lyp_6-31g(d).smash.inp (generated)

000177756.b3lyp_6-31g(d).nwchem.inp (generated) 000177756.b3lyp_6-31g(d).log.xz 000177756.td-b3lyp_6-31g+(d).inp 000177756.td-b3lyp_6-31g+(d).log.xz

000177756.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177756.td-b3lyp_6-31+g(d).gjf (generated)

000177756.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177756.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177756.mol 000177756.PUBCHEM 000177756.mol (via Jmol)
000177757.b3lyp_6-31g(d).inp

000177757.b3lyp_6-31g(d).qchem.inp (generated)

000177757.b3lyp_6-31g(d).gjf (generated)

000177757.b3lyp_6-31g(d).firefly.inp (generated)

000177757.b3lyp_6-31g(d).smash.inp (generated)

000177757.b3lyp_6-31g(d).nwchem.inp (generated) 000177757.b3lyp_6-31g(d).log.xz 000177757.td-b3lyp_6-31g+(d).inp 000177757.td-b3lyp_6-31g+(d).log.xz

000177757.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177757.td-b3lyp_6-31+g(d).gjf (generated)

000177757.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177757.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177757.mol 000177757.PUBCHEM 000177757.mol (via Jmol)
000177759.b3lyp_6-31g(d).inp

000177759.b3lyp_6-31g(d).qchem.inp (generated)

000177759.b3lyp_6-31g(d).gjf (generated)

000177759.b3lyp_6-31g(d).firefly.inp (generated)

000177759.b3lyp_6-31g(d).smash.inp (generated)

000177759.b3lyp_6-31g(d).nwchem.inp (generated) 000177759.b3lyp_6-31g(d).log.xz 000177759.mol 000177759.PUBCHEM 000177759.mol (via Jmol)
000177760.b3lyp_6-31g(d).inp

000177760.b3lyp_6-31g(d).qchem.inp (generated)

000177760.b3lyp_6-31g(d).gjf (generated)

000177760.b3lyp_6-31g(d).firefly.inp (generated)

000177760.b3lyp_6-31g(d).smash.inp (generated)

000177760.b3lyp_6-31g(d).nwchem.inp (generated) 000177760.b3lyp_6-31g(d).log.xz 000177760.td-b3lyp_6-31g+(d).inp 000177760.td-b3lyp_6-31g+(d).log.xz

000177760.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177760.td-b3lyp_6-31+g(d).gjf (generated)

000177760.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177760.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177760.mol 000177760.PUBCHEM 000177760.mol (via Jmol)
000177763.b3lyp_6-31g(d).inp

000177763.b3lyp_6-31g(d).qchem.inp (generated)

000177763.b3lyp_6-31g(d).gjf (generated)

000177763.b3lyp_6-31g(d).firefly.inp (generated)

000177763.b3lyp_6-31g(d).smash.inp (generated)

000177763.b3lyp_6-31g(d).nwchem.inp (generated) 000177763.b3lyp_6-31g(d).log.xz 000177763.td-b3lyp_6-31g+(d).inp 000177763.td-b3lyp_6-31g+(d).log.xz

000177763.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177763.td-b3lyp_6-31+g(d).gjf (generated)

000177763.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177763.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177763.mol 000177763.PUBCHEM 000177763.mol (via Jmol)
000177767.b3lyp_6-31g(d).inp

000177767.b3lyp_6-31g(d).qchem.inp (generated)

000177767.b3lyp_6-31g(d).gjf (generated)

000177767.b3lyp_6-31g(d).firefly.inp (generated)

000177767.b3lyp_6-31g(d).smash.inp (generated)

000177767.b3lyp_6-31g(d).nwchem.inp (generated) 000177767.b3lyp_6-31g(d).log.xz 000177767.td-b3lyp_6-31g+(d).inp 000177767.td-b3lyp_6-31g+(d).log.xz

000177767.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177767.td-b3lyp_6-31+g(d).gjf (generated)

000177767.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177767.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177767.mol 000177767.PUBCHEM 000177767.mol (via Jmol)
000177768.b3lyp_6-31g(d).inp

000177768.b3lyp_6-31g(d).qchem.inp (generated)

000177768.b3lyp_6-31g(d).gjf (generated)

000177768.b3lyp_6-31g(d).firefly.inp (generated)

000177768.b3lyp_6-31g(d).smash.inp (generated)

000177768.b3lyp_6-31g(d).nwchem.inp (generated) 000177768.b3lyp_6-31g(d).log.xz 000177768.td-b3lyp_6-31g+(d).inp 000177768.td-b3lyp_6-31g+(d).log.xz

000177768.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177768.td-b3lyp_6-31+g(d).gjf (generated)

000177768.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177768.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177768.mol 000177768.PUBCHEM 000177768.mol (via Jmol)
000177771.b3lyp_6-31g(d).inp

000177771.b3lyp_6-31g(d).qchem.inp (generated)

000177771.b3lyp_6-31g(d).gjf (generated)

000177771.b3lyp_6-31g(d).firefly.inp (generated)

000177771.b3lyp_6-31g(d).smash.inp (generated)

000177771.b3lyp_6-31g(d).nwchem.inp (generated) 000177771.b3lyp_6-31g(d).log.xz 000177771.td-b3lyp_6-31g+(d).inp 000177771.td-b3lyp_6-31g+(d).log.xz

000177771.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177771.td-b3lyp_6-31+g(d).gjf (generated)

000177771.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177771.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177771.mol 000177771.PUBCHEM 000177771.mol (via Jmol)
000177773.b3lyp_6-31g(d).inp

000177773.b3lyp_6-31g(d).qchem.inp (generated)

000177773.b3lyp_6-31g(d).gjf (generated)

000177773.b3lyp_6-31g(d).firefly.inp (generated)

000177773.b3lyp_6-31g(d).smash.inp (generated)

000177773.b3lyp_6-31g(d).nwchem.inp (generated) 000177773.b3lyp_6-31g(d).log.xz 000177773.td-b3lyp_6-31g+(d).inp 000177773.td-b3lyp_6-31g+(d).log.xz

000177773.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177773.td-b3lyp_6-31+g(d).gjf (generated)

000177773.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177773.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177773.mol 000177773.PUBCHEM 000177773.mol (via Jmol)
000177776.b3lyp_6-31g(d).inp

000177776.b3lyp_6-31g(d).qchem.inp (generated)

000177776.b3lyp_6-31g(d).gjf (generated)

000177776.b3lyp_6-31g(d).firefly.inp (generated)

000177776.b3lyp_6-31g(d).smash.inp (generated)

000177776.b3lyp_6-31g(d).nwchem.inp (generated) 000177776.b3lyp_6-31g(d).log.xz 000177776.td-b3lyp_6-31g+(d).inp 000177776.td-b3lyp_6-31g+(d).log.xz

000177776.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177776.td-b3lyp_6-31+g(d).gjf (generated)

000177776.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177776.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177776.mol 000177776.PUBCHEM 000177776.mol (via Jmol)
000177783.b3lyp_6-31g(d).inp

000177783.b3lyp_6-31g(d).qchem.inp (generated)

000177783.b3lyp_6-31g(d).gjf (generated)

000177783.b3lyp_6-31g(d).firefly.inp (generated)

000177783.b3lyp_6-31g(d).smash.inp (generated)

000177783.b3lyp_6-31g(d).nwchem.inp (generated) 000177783.b3lyp_6-31g(d).log.xz 000177783.td-b3lyp_6-31g+(d).inp 000177783.td-b3lyp_6-31g+(d).log.xz

000177783.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177783.td-b3lyp_6-31+g(d).gjf (generated)

000177783.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177783.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177783.mol 000177783.PUBCHEM 000177783.mol (via Jmol)
000177785.b3lyp_6-31g(d).inp

000177785.b3lyp_6-31g(d).qchem.inp (generated)

000177785.b3lyp_6-31g(d).gjf (generated)

000177785.b3lyp_6-31g(d).firefly.inp (generated)

000177785.b3lyp_6-31g(d).smash.inp (generated)

000177785.b3lyp_6-31g(d).nwchem.inp (generated) 000177785.b3lyp_6-31g(d).log.xz 000177785.td-b3lyp_6-31g+(d).inp 000177785.td-b3lyp_6-31g+(d).log.xz

000177785.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177785.td-b3lyp_6-31+g(d).gjf (generated)

000177785.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177785.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177785.mol 000177785.PUBCHEM 000177785.mol (via Jmol)
000177787.b3lyp_6-31g(d).inp

000177787.b3lyp_6-31g(d).qchem.inp (generated)

000177787.b3lyp_6-31g(d).gjf (generated)

000177787.b3lyp_6-31g(d).firefly.inp (generated)

000177787.b3lyp_6-31g(d).smash.inp (generated)

000177787.b3lyp_6-31g(d).nwchem.inp (generated) 000177787.b3lyp_6-31g(d).log.xz 000177787.td-b3lyp_6-31g+(d).inp 000177787.td-b3lyp_6-31g+(d).log.xz

000177787.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177787.td-b3lyp_6-31+g(d).gjf (generated)

000177787.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177787.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177787.mol 000177787.PUBCHEM 000177787.mol (via Jmol)
000177788.b3lyp_6-31g(d).inp

000177788.b3lyp_6-31g(d).qchem.inp (generated)

000177788.b3lyp_6-31g(d).gjf (generated)

000177788.b3lyp_6-31g(d).firefly.inp (generated)

000177788.b3lyp_6-31g(d).smash.inp (generated)

000177788.b3lyp_6-31g(d).nwchem.inp (generated) 000177788.b3lyp_6-31g(d).log.xz 000177788.td-b3lyp_6-31g+(d).inp 000177788.td-b3lyp_6-31g+(d).log.xz

000177788.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177788.td-b3lyp_6-31+g(d).gjf (generated)

000177788.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177788.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177788.mol 000177788.PUBCHEM 000177788.mol (via Jmol)
000177789.b3lyp_6-31g(d).inp

000177789.b3lyp_6-31g(d).qchem.inp (generated)

000177789.b3lyp_6-31g(d).gjf (generated)

000177789.b3lyp_6-31g(d).firefly.inp (generated)

000177789.b3lyp_6-31g(d).smash.inp (generated)

000177789.b3lyp_6-31g(d).nwchem.inp (generated) 000177789.b3lyp_6-31g(d).log.xz 000177789.td-b3lyp_6-31g+(d).inp 000177789.td-b3lyp_6-31g+(d).log.xz

000177789.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177789.td-b3lyp_6-31+g(d).gjf (generated)

000177789.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177789.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177789.mol 000177789.PUBCHEM 000177789.mol (via Jmol)
000177790.b3lyp_6-31g(d).inp

000177790.b3lyp_6-31g(d).qchem.inp (generated)

000177790.b3lyp_6-31g(d).gjf (generated)

000177790.b3lyp_6-31g(d).firefly.inp (generated)

000177790.b3lyp_6-31g(d).smash.inp (generated)

000177790.b3lyp_6-31g(d).nwchem.inp (generated) 000177790.b3lyp_6-31g(d).log.xz 000177790.td-b3lyp_6-31g+(d).inp 000177790.td-b3lyp_6-31g+(d).log.xz

000177790.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177790.td-b3lyp_6-31+g(d).gjf (generated)

000177790.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177790.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177790.mol 000177790.PUBCHEM 000177790.mol (via Jmol)
000177791.b3lyp_6-31g(d).inp

000177791.b3lyp_6-31g(d).qchem.inp (generated)

000177791.b3lyp_6-31g(d).gjf (generated)

000177791.b3lyp_6-31g(d).firefly.inp (generated)

000177791.b3lyp_6-31g(d).smash.inp (generated)

000177791.b3lyp_6-31g(d).nwchem.inp (generated) 000177791.b3lyp_6-31g(d).log.xz 000177791.td-b3lyp_6-31g+(d).inp 000177791.td-b3lyp_6-31g+(d).log.xz

000177791.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177791.td-b3lyp_6-31+g(d).gjf (generated)

000177791.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177791.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177791.mol 000177791.PUBCHEM 000177791.mol (via Jmol)
000177792.b3lyp_6-31g(d).inp

000177792.b3lyp_6-31g(d).qchem.inp (generated)

000177792.b3lyp_6-31g(d).gjf (generated)

000177792.b3lyp_6-31g(d).firefly.inp (generated)

000177792.b3lyp_6-31g(d).smash.inp (generated)

000177792.b3lyp_6-31g(d).nwchem.inp (generated) 000177792.b3lyp_6-31g(d).log.xz 000177792.td-b3lyp_6-31g+(d).inp 000177792.td-b3lyp_6-31g+(d).log.xz

000177792.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177792.td-b3lyp_6-31+g(d).gjf (generated)

000177792.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177792.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177792.mol 000177792.PUBCHEM 000177792.mol (via Jmol)
000177794.b3lyp_6-31g(d).inp

000177794.b3lyp_6-31g(d).qchem.inp (generated)

000177794.b3lyp_6-31g(d).gjf (generated)

000177794.b3lyp_6-31g(d).firefly.inp (generated)

000177794.b3lyp_6-31g(d).smash.inp (generated)

000177794.b3lyp_6-31g(d).nwchem.inp (generated) 000177794.b3lyp_6-31g(d).log.xz 000177794.td-b3lyp_6-31g+(d).inp 000177794.td-b3lyp_6-31g+(d).log.xz

000177794.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177794.td-b3lyp_6-31+g(d).gjf (generated)

000177794.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177794.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177794.mol 000177794.PUBCHEM 000177794.mol (via Jmol)
000177802.b3lyp_6-31g(d).inp

000177802.b3lyp_6-31g(d).qchem.inp (generated)

000177802.b3lyp_6-31g(d).gjf (generated)

000177802.b3lyp_6-31g(d).firefly.inp (generated)

000177802.b3lyp_6-31g(d).smash.inp (generated)

000177802.b3lyp_6-31g(d).nwchem.inp (generated) 000177802.b3lyp_6-31g(d).log.xz 000177802.mol 000177802.PUBCHEM 000177802.mol (via Jmol)
000177803.b3lyp_6-31g(d).inp

000177803.b3lyp_6-31g(d).qchem.inp (generated)

000177803.b3lyp_6-31g(d).gjf (generated)

000177803.b3lyp_6-31g(d).firefly.inp (generated)

000177803.b3lyp_6-31g(d).smash.inp (generated)

000177803.b3lyp_6-31g(d).nwchem.inp (generated) 000177803.b3lyp_6-31g(d).log.xz 000177803.td-b3lyp_6-31g+(d).inp 000177803.td-b3lyp_6-31g+(d).log.xz

000177803.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177803.td-b3lyp_6-31+g(d).gjf (generated)

000177803.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177803.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177803.mol 000177803.PUBCHEM 000177803.mol (via Jmol)
000177804.b3lyp_6-31g(d).inp

000177804.b3lyp_6-31g(d).qchem.inp (generated)

000177804.b3lyp_6-31g(d).gjf (generated)

000177804.b3lyp_6-31g(d).firefly.inp (generated)

000177804.b3lyp_6-31g(d).smash.inp (generated)

000177804.b3lyp_6-31g(d).nwchem.inp (generated) 000177804.b3lyp_6-31g(d).log.xz 000177804.td-b3lyp_6-31g+(d).inp 000177804.td-b3lyp_6-31g+(d).log.xz

000177804.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177804.td-b3lyp_6-31+g(d).gjf (generated)

000177804.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177804.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177804.mol 000177804.PUBCHEM 000177804.mol (via Jmol)
000177805.b3lyp_6-31g(d).inp

000177805.b3lyp_6-31g(d).qchem.inp (generated)

000177805.b3lyp_6-31g(d).gjf (generated)

000177805.b3lyp_6-31g(d).firefly.inp (generated)

000177805.b3lyp_6-31g(d).smash.inp (generated)

000177805.b3lyp_6-31g(d).nwchem.inp (generated) 000177805.b3lyp_6-31g(d).log.xz 000177805.td-b3lyp_6-31g+(d).inp 000177805.td-b3lyp_6-31g+(d).log.xz

000177805.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177805.td-b3lyp_6-31+g(d).gjf (generated)

000177805.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177805.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177805.mol 000177805.PUBCHEM 000177805.mol (via Jmol)
000177806.b3lyp_6-31g(d).inp

000177806.b3lyp_6-31g(d).qchem.inp (generated)

000177806.b3lyp_6-31g(d).gjf (generated)

000177806.b3lyp_6-31g(d).firefly.inp (generated)

000177806.b3lyp_6-31g(d).smash.inp (generated)

000177806.b3lyp_6-31g(d).nwchem.inp (generated) 000177806.b3lyp_6-31g(d).log.xz 000177806.td-b3lyp_6-31g+(d).inp 000177806.td-b3lyp_6-31g+(d).log.xz

000177806.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177806.td-b3lyp_6-31+g(d).gjf (generated)

000177806.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177806.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177806.mol 000177806.PUBCHEM 000177806.mol (via Jmol)
000177812.b3lyp_6-31g(d).inp

000177812.b3lyp_6-31g(d).qchem.inp (generated)

000177812.b3lyp_6-31g(d).gjf (generated)

000177812.b3lyp_6-31g(d).firefly.inp (generated)

000177812.b3lyp_6-31g(d).smash.inp (generated)

000177812.b3lyp_6-31g(d).nwchem.inp (generated) 000177812.b3lyp_6-31g(d).log.xz 000177812.td-b3lyp_6-31g+(d).inp 000177812.td-b3lyp_6-31g+(d).log.xz

000177812.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177812.td-b3lyp_6-31+g(d).gjf (generated)

000177812.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177812.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177812.mol 000177812.PUBCHEM 000177812.mol (via Jmol)
000177814.b3lyp_6-31g(d).inp

000177814.b3lyp_6-31g(d).qchem.inp (generated)

000177814.b3lyp_6-31g(d).gjf (generated)

000177814.b3lyp_6-31g(d).firefly.inp (generated)

000177814.b3lyp_6-31g(d).smash.inp (generated)

000177814.b3lyp_6-31g(d).nwchem.inp (generated) 000177814.b3lyp_6-31g(d).log.xz 000177814.td-b3lyp_6-31g+(d).inp 000177814.td-b3lyp_6-31g+(d).log.xz

000177814.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177814.td-b3lyp_6-31+g(d).gjf (generated)

000177814.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177814.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177814.mol 000177814.PUBCHEM 000177814.mol (via Jmol)
000177815.b3lyp_6-31g(d).inp

000177815.b3lyp_6-31g(d).qchem.inp (generated)

000177815.b3lyp_6-31g(d).gjf (generated)

000177815.b3lyp_6-31g(d).firefly.inp (generated)

000177815.b3lyp_6-31g(d).smash.inp (generated)

000177815.b3lyp_6-31g(d).nwchem.inp (generated) 000177815.b3lyp_6-31g(d).log.xz 000177815.td-b3lyp_6-31g+(d).inp 000177815.td-b3lyp_6-31g+(d).log.xz

000177815.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177815.td-b3lyp_6-31+g(d).gjf (generated)

000177815.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177815.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177815.mol 000177815.PUBCHEM 000177815.mol (via Jmol)
000177816.b3lyp_6-31g(d).inp

000177816.b3lyp_6-31g(d).qchem.inp (generated)

000177816.b3lyp_6-31g(d).gjf (generated)

000177816.b3lyp_6-31g(d).firefly.inp (generated)

000177816.b3lyp_6-31g(d).smash.inp (generated)

000177816.b3lyp_6-31g(d).nwchem.inp (generated) 000177816.b3lyp_6-31g(d).log.xz 000177816.td-b3lyp_6-31g+(d).inp 000177816.td-b3lyp_6-31g+(d).log.xz

000177816.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177816.td-b3lyp_6-31+g(d).gjf (generated)

000177816.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177816.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177816.mol 000177816.PUBCHEM 000177816.mol (via Jmol)
000177817.b3lyp_6-31g(d).inp

000177817.b3lyp_6-31g(d).qchem.inp (generated)

000177817.b3lyp_6-31g(d).gjf (generated)

000177817.b3lyp_6-31g(d).firefly.inp (generated)

000177817.b3lyp_6-31g(d).smash.inp (generated)

000177817.b3lyp_6-31g(d).nwchem.inp (generated) 000177817.b3lyp_6-31g(d).log.xz 000177817.td-b3lyp_6-31g+(d).inp 000177817.td-b3lyp_6-31g+(d).log.xz

000177817.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177817.td-b3lyp_6-31+g(d).gjf (generated)

000177817.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177817.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177817.mol 000177817.PUBCHEM 000177817.mol (via Jmol)
000177840.b3lyp_6-31g(d).inp

000177840.b3lyp_6-31g(d).qchem.inp (generated)

000177840.b3lyp_6-31g(d).gjf (generated)

000177840.b3lyp_6-31g(d).firefly.inp (generated)

000177840.b3lyp_6-31g(d).smash.inp (generated)

000177840.b3lyp_6-31g(d).nwchem.inp (generated) 000177840.b3lyp_6-31g(d).log.xz 000177840.td-b3lyp_6-31g+(d).inp 000177840.td-b3lyp_6-31g+(d).log.xz

000177840.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177840.td-b3lyp_6-31+g(d).gjf (generated)

000177840.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177840.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177840.mol 000177840.PUBCHEM 000177840.mol (via Jmol)
000177847.b3lyp_6-31g(d).inp

000177847.b3lyp_6-31g(d).qchem.inp (generated)

000177847.b3lyp_6-31g(d).gjf (generated)

000177847.b3lyp_6-31g(d).firefly.inp (generated)

000177847.b3lyp_6-31g(d).smash.inp (generated)

000177847.b3lyp_6-31g(d).nwchem.inp (generated) 000177847.b3lyp_6-31g(d).log.xz 000177847.td-b3lyp_6-31g+(d).inp 000177847.td-b3lyp_6-31g+(d).log.xz

000177847.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177847.td-b3lyp_6-31+g(d).gjf (generated)

000177847.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177847.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177847.mol 000177847.PUBCHEM 000177847.mol (via Jmol)
000177848.b3lyp_6-31g(d).inp

000177848.b3lyp_6-31g(d).qchem.inp (generated)

000177848.b3lyp_6-31g(d).gjf (generated)

000177848.b3lyp_6-31g(d).firefly.inp (generated)

000177848.b3lyp_6-31g(d).smash.inp (generated)

000177848.b3lyp_6-31g(d).nwchem.inp (generated) 000177848.b3lyp_6-31g(d).log.xz 000177848.td-b3lyp_6-31g+(d).inp 000177848.td-b3lyp_6-31g+(d).log.xz

000177848.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177848.td-b3lyp_6-31+g(d).gjf (generated)

000177848.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177848.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177848.mol 000177848.PUBCHEM 000177848.mol (via Jmol)
000177853.b3lyp_6-31g(d).inp

000177853.b3lyp_6-31g(d).qchem.inp (generated)

000177853.b3lyp_6-31g(d).gjf (generated)

000177853.b3lyp_6-31g(d).firefly.inp (generated)

000177853.b3lyp_6-31g(d).smash.inp (generated)

000177853.b3lyp_6-31g(d).nwchem.inp (generated) 000177853.b3lyp_6-31g(d).log.xz 000177853.td-b3lyp_6-31g+(d).inp 000177853.td-b3lyp_6-31g+(d).log.xz

000177853.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177853.td-b3lyp_6-31+g(d).gjf (generated)

000177853.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177853.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177853.mol 000177853.PUBCHEM 000177853.mol (via Jmol)
000177875.b3lyp_6-31g(d).inp

000177875.b3lyp_6-31g(d).qchem.inp (generated)

000177875.b3lyp_6-31g(d).gjf (generated)

000177875.b3lyp_6-31g(d).firefly.inp (generated)

000177875.b3lyp_6-31g(d).smash.inp (generated)

000177875.b3lyp_6-31g(d).nwchem.inp (generated) 000177875.b3lyp_6-31g(d).log.xz 000177875.td-b3lyp_6-31g+(d).inp 000177875.td-b3lyp_6-31g+(d).log.xz

000177875.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177875.td-b3lyp_6-31+g(d).gjf (generated)

000177875.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177875.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177875.mol 000177875.PUBCHEM 000177875.mol (via Jmol)
000177876.b3lyp_6-31g(d).inp

000177876.b3lyp_6-31g(d).qchem.inp (generated)

000177876.b3lyp_6-31g(d).gjf (generated)

000177876.b3lyp_6-31g(d).firefly.inp (generated)

000177876.b3lyp_6-31g(d).smash.inp (generated)

000177876.b3lyp_6-31g(d).nwchem.inp (generated) 000177876.b3lyp_6-31g(d).log.xz 000177876.mol 000177876.PUBCHEM 000177876.mol (via Jmol)
000177895.b3lyp_6-31g(d).inp

000177895.b3lyp_6-31g(d).qchem.inp (generated)

000177895.b3lyp_6-31g(d).gjf (generated)

000177895.b3lyp_6-31g(d).firefly.inp (generated)

000177895.b3lyp_6-31g(d).smash.inp (generated)

000177895.b3lyp_6-31g(d).nwchem.inp (generated) 000177895.b3lyp_6-31g(d).log.xz 000177895.td-b3lyp_6-31g+(d).inp 000177895.td-b3lyp_6-31g+(d).log.xz

000177895.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177895.td-b3lyp_6-31+g(d).gjf (generated)

000177895.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177895.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177895.mol 000177895.PUBCHEM 000177895.mol (via Jmol)
000177909.b3lyp_6-31g(d).inp

000177909.b3lyp_6-31g(d).qchem.inp (generated)

000177909.b3lyp_6-31g(d).gjf (generated)

000177909.b3lyp_6-31g(d).firefly.inp (generated)

000177909.b3lyp_6-31g(d).smash.inp (generated)

000177909.b3lyp_6-31g(d).nwchem.inp (generated) 000177909.b3lyp_6-31g(d).log.xz 000177909.td-b3lyp_6-31g+(d).inp 000177909.td-b3lyp_6-31g+(d).log.xz

000177909.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177909.td-b3lyp_6-31+g(d).gjf (generated)

000177909.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177909.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177909.mol 000177909.PUBCHEM 000177909.mol (via Jmol)
000177918.b3lyp_6-31g(d).inp

000177918.b3lyp_6-31g(d).qchem.inp (generated)

000177918.b3lyp_6-31g(d).gjf (generated)

000177918.b3lyp_6-31g(d).firefly.inp (generated)

000177918.b3lyp_6-31g(d).smash.inp (generated)

000177918.b3lyp_6-31g(d).nwchem.inp (generated) 000177918.b3lyp_6-31g(d).log.xz 000177918.td-b3lyp_6-31g+(d).inp 000177918.td-b3lyp_6-31g+(d).log.xz

000177918.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177918.td-b3lyp_6-31+g(d).gjf (generated)

000177918.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177918.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177918.mol 000177918.PUBCHEM 000177918.mol (via Jmol)
000177920.b3lyp_6-31g(d).inp

000177920.b3lyp_6-31g(d).qchem.inp (generated)

000177920.b3lyp_6-31g(d).gjf (generated)

000177920.b3lyp_6-31g(d).firefly.inp (generated)

000177920.b3lyp_6-31g(d).smash.inp (generated)

000177920.b3lyp_6-31g(d).nwchem.inp (generated) 000177920.b3lyp_6-31g(d).log.xz 000177920.td-b3lyp_6-31g+(d).inp 000177920.td-b3lyp_6-31g+(d).log.xz

000177920.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177920.td-b3lyp_6-31+g(d).gjf (generated)

000177920.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177920.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177920.mol 000177920.PUBCHEM 000177920.mol (via Jmol)
000177921.b3lyp_6-31g(d).inp

000177921.b3lyp_6-31g(d).qchem.inp (generated)

000177921.b3lyp_6-31g(d).gjf (generated)

000177921.b3lyp_6-31g(d).firefly.inp (generated)

000177921.b3lyp_6-31g(d).smash.inp (generated)

000177921.b3lyp_6-31g(d).nwchem.inp (generated) 000177921.b3lyp_6-31g(d).log.xz 000177921.td-b3lyp_6-31g+(d).inp 000177921.td-b3lyp_6-31g+(d).log.xz

000177921.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177921.td-b3lyp_6-31+g(d).gjf (generated)

000177921.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177921.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177921.mol 000177921.PUBCHEM 000177921.mol (via Jmol)
000177937.b3lyp_6-31g(d).inp

000177937.b3lyp_6-31g(d).qchem.inp (generated)

000177937.b3lyp_6-31g(d).gjf (generated)

000177937.b3lyp_6-31g(d).firefly.inp (generated)

000177937.b3lyp_6-31g(d).smash.inp (generated)

000177937.b3lyp_6-31g(d).nwchem.inp (generated) 000177937.b3lyp_6-31g(d).log.xz 000177937.td-b3lyp_6-31g+(d).inp 000177937.td-b3lyp_6-31g+(d).log.xz

000177937.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177937.td-b3lyp_6-31+g(d).gjf (generated)

000177937.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177937.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177937.mol 000177937.PUBCHEM 000177937.mol (via Jmol)
000177955.b3lyp_6-31g(d).inp

000177955.b3lyp_6-31g(d).qchem.inp (generated)

000177955.b3lyp_6-31g(d).gjf (generated)

000177955.b3lyp_6-31g(d).firefly.inp (generated)

000177955.b3lyp_6-31g(d).smash.inp (generated)

000177955.b3lyp_6-31g(d).nwchem.inp (generated) 000177955.b3lyp_6-31g(d).log.xz 000177955.td-b3lyp_6-31g+(d).inp 000177955.td-b3lyp_6-31g+(d).log.xz

000177955.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177955.td-b3lyp_6-31+g(d).gjf (generated)

000177955.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177955.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177955.mol 000177955.PUBCHEM 000177955.mol (via Jmol)
000177962.b3lyp_6-31g(d).inp

000177962.b3lyp_6-31g(d).qchem.inp (generated)

000177962.b3lyp_6-31g(d).gjf (generated)

000177962.b3lyp_6-31g(d).firefly.inp (generated)

000177962.b3lyp_6-31g(d).smash.inp (generated)

000177962.b3lyp_6-31g(d).nwchem.inp (generated) 000177962.b3lyp_6-31g(d).log.xz 000177962.td-b3lyp_6-31g+(d).inp 000177962.td-b3lyp_6-31g+(d).log.xz

000177962.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177962.td-b3lyp_6-31+g(d).gjf (generated)

000177962.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177962.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177962.mol 000177962.PUBCHEM 000177962.mol (via Jmol)
000177982.b3lyp_6-31g(d).inp

000177982.b3lyp_6-31g(d).qchem.inp (generated)

000177982.b3lyp_6-31g(d).gjf (generated)

000177982.b3lyp_6-31g(d).firefly.inp (generated)

000177982.b3lyp_6-31g(d).smash.inp (generated)

000177982.b3lyp_6-31g(d).nwchem.inp (generated) 000177982.b3lyp_6-31g(d).log.xz 000177982.td-b3lyp_6-31g+(d).inp 000177982.td-b3lyp_6-31g+(d).log.xz

000177982.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177982.td-b3lyp_6-31+g(d).gjf (generated)

000177982.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177982.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177982.mol 000177982.PUBCHEM 000177982.mol (via Jmol)
000177987.b3lyp_6-31g(d).inp

000177987.b3lyp_6-31g(d).qchem.inp (generated)

000177987.b3lyp_6-31g(d).gjf (generated)

000177987.b3lyp_6-31g(d).firefly.inp (generated)

000177987.b3lyp_6-31g(d).smash.inp (generated)

000177987.b3lyp_6-31g(d).nwchem.inp (generated) 000177987.b3lyp_6-31g(d).log.xz 000177987.td-b3lyp_6-31g+(d).inp 000177987.td-b3lyp_6-31g+(d).log.xz

000177987.td-b3lyp_6-31+g(d).qchem.inp (generated)

000177987.td-b3lyp_6-31+g(d).gjf (generated)

000177987.td-b3lyp_6-31+g(d).firefly.inp (generated)

000177987.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000177987.mol 000177987.PUBCHEM 000177987.mol (via Jmol)
000178017.b3lyp_6-31g(d).inp

000178017.b3lyp_6-31g(d).qchem.inp (generated)

000178017.b3lyp_6-31g(d).gjf (generated)

000178017.b3lyp_6-31g(d).firefly.inp (generated)

000178017.b3lyp_6-31g(d).smash.inp (generated)

000178017.b3lyp_6-31g(d).nwchem.inp (generated) 000178017.b3lyp_6-31g(d).log.xz 000178017.td-b3lyp_6-31g+(d).inp 000178017.td-b3lyp_6-31g+(d).log.xz

000178017.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178017.td-b3lyp_6-31+g(d).gjf (generated)

000178017.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178017.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178017.mol 000178017.PUBCHEM 000178017.mol (via Jmol)
000178018.b3lyp_6-31g(d).inp

000178018.b3lyp_6-31g(d).qchem.inp (generated)

000178018.b3lyp_6-31g(d).gjf (generated)

000178018.b3lyp_6-31g(d).firefly.inp (generated)

000178018.b3lyp_6-31g(d).smash.inp (generated)

000178018.b3lyp_6-31g(d).nwchem.inp (generated) 000178018.b3lyp_6-31g(d).log.xz 000178018.td-b3lyp_6-31g+(d).inp 000178018.td-b3lyp_6-31g+(d).log.xz

000178018.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178018.td-b3lyp_6-31+g(d).gjf (generated)

000178018.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178018.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178018.mol 000178018.PUBCHEM 000178018.mol (via Jmol)
000178030.b3lyp_6-31g(d).inp

000178030.b3lyp_6-31g(d).qchem.inp (generated)

000178030.b3lyp_6-31g(d).gjf (generated)

000178030.b3lyp_6-31g(d).firefly.inp (generated)

000178030.b3lyp_6-31g(d).smash.inp (generated)

000178030.b3lyp_6-31g(d).nwchem.inp (generated) 000178030.b3lyp_6-31g(d).log.xz 000178030.td-b3lyp_6-31g+(d).inp 000178030.td-b3lyp_6-31g+(d).log.xz

000178030.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178030.td-b3lyp_6-31+g(d).gjf (generated)

000178030.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178030.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178030.mol 000178030.PUBCHEM 000178030.mol (via Jmol)
000178052.b3lyp_6-31g(d).inp

000178052.b3lyp_6-31g(d).qchem.inp (generated)

000178052.b3lyp_6-31g(d).gjf (generated)

000178052.b3lyp_6-31g(d).firefly.inp (generated)

000178052.b3lyp_6-31g(d).smash.inp (generated)

000178052.b3lyp_6-31g(d).nwchem.inp (generated) 000178052.b3lyp_6-31g(d).log.xz 000178052.td-b3lyp_6-31g+(d).inp 000178052.td-b3lyp_6-31g+(d).log.xz

000178052.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178052.td-b3lyp_6-31+g(d).gjf (generated)

000178052.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178052.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178052.mol 000178052.PUBCHEM 000178052.mol (via Jmol)
000178096.b3lyp_6-31g(d).inp

000178096.b3lyp_6-31g(d).qchem.inp (generated)

000178096.b3lyp_6-31g(d).gjf (generated)

000178096.b3lyp_6-31g(d).firefly.inp (generated)

000178096.b3lyp_6-31g(d).smash.inp (generated)

000178096.b3lyp_6-31g(d).nwchem.inp (generated) 000178096.b3lyp_6-31g(d).log.xz 000178096.td-b3lyp_6-31g+(d).inp 000178096.td-b3lyp_6-31g+(d).log.xz

000178096.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178096.td-b3lyp_6-31+g(d).gjf (generated)

000178096.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178096.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178096.mol 000178096.PUBCHEM 000178096.mol (via Jmol)
000178119.b3lyp_6-31g(d).inp

000178119.b3lyp_6-31g(d).qchem.inp (generated)

000178119.b3lyp_6-31g(d).gjf (generated)

000178119.b3lyp_6-31g(d).firefly.inp (generated)

000178119.b3lyp_6-31g(d).smash.inp (generated)

000178119.b3lyp_6-31g(d).nwchem.inp (generated) 000178119.b3lyp_6-31g(d).log.xz 000178119.td-b3lyp_6-31g+(d).inp 000178119.td-b3lyp_6-31g+(d).log.xz

000178119.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178119.td-b3lyp_6-31+g(d).gjf (generated)

000178119.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178119.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178119.mol 000178119.PUBCHEM 000178119.mol (via Jmol)
000178128.b3lyp_6-31g(d).inp

000178128.b3lyp_6-31g(d).qchem.inp (generated)

000178128.b3lyp_6-31g(d).gjf (generated)

000178128.b3lyp_6-31g(d).firefly.inp (generated)

000178128.b3lyp_6-31g(d).smash.inp (generated)

000178128.b3lyp_6-31g(d).nwchem.inp (generated) 000178128.b3lyp_6-31g(d).log.xz 000178128.mol 000178128.PUBCHEM 000178128.mol (via Jmol)
000178133.b3lyp_6-31g(d).inp

000178133.b3lyp_6-31g(d).qchem.inp (generated)

000178133.b3lyp_6-31g(d).gjf (generated)

000178133.b3lyp_6-31g(d).firefly.inp (generated)

000178133.b3lyp_6-31g(d).smash.inp (generated)

000178133.b3lyp_6-31g(d).nwchem.inp (generated) 000178133.b3lyp_6-31g(d).log.xz 000178133.mol 000178133.PUBCHEM 000178133.mol (via Jmol)
000178134.b3lyp_6-31g(d).inp

000178134.b3lyp_6-31g(d).qchem.inp (generated)

000178134.b3lyp_6-31g(d).gjf (generated)

000178134.b3lyp_6-31g(d).firefly.inp (generated)

000178134.b3lyp_6-31g(d).smash.inp (generated)

000178134.b3lyp_6-31g(d).nwchem.inp (generated) 000178134.b3lyp_6-31g(d).log.xz 000178134.td-b3lyp_6-31g+(d).inp 000178134.td-b3lyp_6-31g+(d).log.xz

000178134.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178134.td-b3lyp_6-31+g(d).gjf (generated)

000178134.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178134.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178134.mol 000178134.PUBCHEM 000178134.mol (via Jmol)
000178152.b3lyp_6-31g(d).inp

000178152.b3lyp_6-31g(d).qchem.inp (generated)

000178152.b3lyp_6-31g(d).gjf (generated)

000178152.b3lyp_6-31g(d).firefly.inp (generated)

000178152.b3lyp_6-31g(d).smash.inp (generated)

000178152.b3lyp_6-31g(d).nwchem.inp (generated) 000178152.b3lyp_6-31g(d).log.xz 000178152.td-b3lyp_6-31g+(d).inp 000178152.td-b3lyp_6-31g+(d).log.xz

000178152.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178152.td-b3lyp_6-31+g(d).gjf (generated)

000178152.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178152.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178152.mol 000178152.PUBCHEM 000178152.mol (via Jmol)
000178187.b3lyp_6-31g(d).inp

000178187.b3lyp_6-31g(d).qchem.inp (generated)

000178187.b3lyp_6-31g(d).gjf (generated)

000178187.b3lyp_6-31g(d).firefly.inp (generated)

000178187.b3lyp_6-31g(d).smash.inp (generated)

000178187.b3lyp_6-31g(d).nwchem.inp (generated) 000178187.b3lyp_6-31g(d).log.xz 000178187.td-b3lyp_6-31g+(d).inp 000178187.td-b3lyp_6-31g+(d).log.xz

000178187.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178187.td-b3lyp_6-31+g(d).gjf (generated)

000178187.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178187.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178187.mol 000178187.PUBCHEM 000178187.mol (via Jmol)
000178194.b3lyp_6-31g(d).inp

000178194.b3lyp_6-31g(d).qchem.inp (generated)

000178194.b3lyp_6-31g(d).gjf (generated)

000178194.b3lyp_6-31g(d).firefly.inp (generated)

000178194.b3lyp_6-31g(d).smash.inp (generated)

000178194.b3lyp_6-31g(d).nwchem.inp (generated) 000178194.b3lyp_6-31g(d).log.xz 000178194.td-b3lyp_6-31g+(d).inp 000178194.td-b3lyp_6-31g+(d).log.xz

000178194.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178194.td-b3lyp_6-31+g(d).gjf (generated)

000178194.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178194.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178194.mol 000178194.PUBCHEM 000178194.mol (via Jmol)
000178195.b3lyp_6-31g(d).inp

000178195.b3lyp_6-31g(d).qchem.inp (generated)

000178195.b3lyp_6-31g(d).gjf (generated)

000178195.b3lyp_6-31g(d).firefly.inp (generated)

000178195.b3lyp_6-31g(d).smash.inp (generated)

000178195.b3lyp_6-31g(d).nwchem.inp (generated) 000178195.b3lyp_6-31g(d).log.xz 000178195.td-b3lyp_6-31g+(d).inp 000178195.td-b3lyp_6-31g+(d).log.xz

000178195.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178195.td-b3lyp_6-31+g(d).gjf (generated)

000178195.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178195.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178195.mol 000178195.PUBCHEM 000178195.mol (via Jmol)
000178202.b3lyp_6-31g(d).inp

000178202.b3lyp_6-31g(d).qchem.inp (generated)

000178202.b3lyp_6-31g(d).gjf (generated)

000178202.b3lyp_6-31g(d).firefly.inp (generated)

000178202.b3lyp_6-31g(d).smash.inp (generated)

000178202.b3lyp_6-31g(d).nwchem.inp (generated) 000178202.b3lyp_6-31g(d).log.xz 000178202.td-b3lyp_6-31g+(d).inp 000178202.td-b3lyp_6-31g+(d).log.xz

000178202.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178202.td-b3lyp_6-31+g(d).gjf (generated)

000178202.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178202.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178202.mol 000178202.PUBCHEM 000178202.mol (via Jmol)
000178203.b3lyp_6-31g(d).inp

000178203.b3lyp_6-31g(d).qchem.inp (generated)

000178203.b3lyp_6-31g(d).gjf (generated)

000178203.b3lyp_6-31g(d).firefly.inp (generated)

000178203.b3lyp_6-31g(d).smash.inp (generated)

000178203.b3lyp_6-31g(d).nwchem.inp (generated) 000178203.b3lyp_6-31g(d).log.xz 000178203.td-b3lyp_6-31g+(d).inp 000178203.td-b3lyp_6-31g+(d).log.xz

000178203.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178203.td-b3lyp_6-31+g(d).gjf (generated)

000178203.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178203.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178203.mol 000178203.PUBCHEM 000178203.mol (via Jmol)
000178204.b3lyp_6-31g(d).inp

000178204.b3lyp_6-31g(d).qchem.inp (generated)

000178204.b3lyp_6-31g(d).gjf (generated)

000178204.b3lyp_6-31g(d).firefly.inp (generated)

000178204.b3lyp_6-31g(d).smash.inp (generated)

000178204.b3lyp_6-31g(d).nwchem.inp (generated) 000178204.b3lyp_6-31g(d).log.xz 000178204.td-b3lyp_6-31g+(d).inp 000178204.td-b3lyp_6-31g+(d).log.xz

000178204.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178204.td-b3lyp_6-31+g(d).gjf (generated)

000178204.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178204.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178204.mol 000178204.PUBCHEM 000178204.mol (via Jmol)
000178205.b3lyp_6-31g(d).inp

000178205.b3lyp_6-31g(d).qchem.inp (generated)

000178205.b3lyp_6-31g(d).gjf (generated)

000178205.b3lyp_6-31g(d).firefly.inp (generated)

000178205.b3lyp_6-31g(d).smash.inp (generated)

000178205.b3lyp_6-31g(d).nwchem.inp (generated) 000178205.b3lyp_6-31g(d).log.xz 000178205.td-b3lyp_6-31g+(d).inp 000178205.td-b3lyp_6-31g+(d).log.xz

000178205.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178205.td-b3lyp_6-31+g(d).gjf (generated)

000178205.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178205.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178205.mol 000178205.PUBCHEM 000178205.mol (via Jmol)
000178206.b3lyp_6-31g(d).inp

000178206.b3lyp_6-31g(d).qchem.inp (generated)

000178206.b3lyp_6-31g(d).gjf (generated)

000178206.b3lyp_6-31g(d).firefly.inp (generated)

000178206.b3lyp_6-31g(d).smash.inp (generated)

000178206.b3lyp_6-31g(d).nwchem.inp (generated) 000178206.b3lyp_6-31g(d).log.xz 000178206.mol 000178206.PUBCHEM 000178206.mol (via Jmol)
000178211.b3lyp_6-31g(d).inp

000178211.b3lyp_6-31g(d).qchem.inp (generated)

000178211.b3lyp_6-31g(d).gjf (generated)

000178211.b3lyp_6-31g(d).firefly.inp (generated)

000178211.b3lyp_6-31g(d).smash.inp (generated)

000178211.b3lyp_6-31g(d).nwchem.inp (generated) 000178211.b3lyp_6-31g(d).log.xz 000178211.mol 000178211.PUBCHEM 000178211.mol (via Jmol)
000178234.b3lyp_6-31g(d).inp

000178234.b3lyp_6-31g(d).qchem.inp (generated)

000178234.b3lyp_6-31g(d).gjf (generated)

000178234.b3lyp_6-31g(d).firefly.inp (generated)

000178234.b3lyp_6-31g(d).smash.inp (generated)

000178234.b3lyp_6-31g(d).nwchem.inp (generated) 000178234.b3lyp_6-31g(d).log.xz 000178234.td-b3lyp_6-31g+(d).inp 000178234.td-b3lyp_6-31g+(d).log.xz

000178234.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178234.td-b3lyp_6-31+g(d).gjf (generated)

000178234.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178234.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178234.mol 000178234.PUBCHEM 000178234.mol (via Jmol)
000178235.b3lyp_6-31g(d).inp

000178235.b3lyp_6-31g(d).qchem.inp (generated)

000178235.b3lyp_6-31g(d).gjf (generated)

000178235.b3lyp_6-31g(d).firefly.inp (generated)

000178235.b3lyp_6-31g(d).smash.inp (generated)

000178235.b3lyp_6-31g(d).nwchem.inp (generated) 000178235.b3lyp_6-31g(d).log.xz 000178235.td-b3lyp_6-31g+(d).inp 000178235.td-b3lyp_6-31g+(d).log.xz

000178235.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178235.td-b3lyp_6-31+g(d).gjf (generated)

000178235.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178235.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178235.mol 000178235.PUBCHEM 000178235.mol (via Jmol)
000178239.b3lyp_6-31g(d).inp

000178239.b3lyp_6-31g(d).qchem.inp (generated)

000178239.b3lyp_6-31g(d).gjf (generated)

000178239.b3lyp_6-31g(d).firefly.inp (generated)

000178239.b3lyp_6-31g(d).smash.inp (generated)

000178239.b3lyp_6-31g(d).nwchem.inp (generated) 000178239.b3lyp_6-31g(d).log.xz 000178239.td-b3lyp_6-31g+(d).inp 000178239.td-b3lyp_6-31g+(d).log.xz

000178239.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178239.td-b3lyp_6-31+g(d).gjf (generated)

000178239.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178239.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178239.mol 000178239.PUBCHEM 000178239.mol (via Jmol)
000178241.b3lyp_6-31g(d).inp

000178241.b3lyp_6-31g(d).qchem.inp (generated)

000178241.b3lyp_6-31g(d).gjf (generated)

000178241.b3lyp_6-31g(d).firefly.inp (generated)

000178241.b3lyp_6-31g(d).smash.inp (generated)

000178241.b3lyp_6-31g(d).nwchem.inp (generated) 000178241.b3lyp_6-31g(d).log.xz 000178241.td-b3lyp_6-31g+(d).inp 000178241.td-b3lyp_6-31g+(d).log.xz

000178241.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178241.td-b3lyp_6-31+g(d).gjf (generated)

000178241.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178241.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178241.mol 000178241.PUBCHEM 000178241.mol (via Jmol)
000178242.b3lyp_6-31g(d).inp

000178242.b3lyp_6-31g(d).qchem.inp (generated)

000178242.b3lyp_6-31g(d).gjf (generated)

000178242.b3lyp_6-31g(d).firefly.inp (generated)

000178242.b3lyp_6-31g(d).smash.inp (generated)

000178242.b3lyp_6-31g(d).nwchem.inp (generated) 000178242.b3lyp_6-31g(d).log.xz 000178242.td-b3lyp_6-31g+(d).inp 000178242.td-b3lyp_6-31g+(d).log.xz

000178242.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178242.td-b3lyp_6-31+g(d).gjf (generated)

000178242.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178242.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178242.mol 000178242.PUBCHEM 000178242.mol (via Jmol)
000178244.b3lyp_6-31g(d).inp

000178244.b3lyp_6-31g(d).qchem.inp (generated)

000178244.b3lyp_6-31g(d).gjf (generated)

000178244.b3lyp_6-31g(d).firefly.inp (generated)

000178244.b3lyp_6-31g(d).smash.inp (generated)

000178244.b3lyp_6-31g(d).nwchem.inp (generated) 000178244.b3lyp_6-31g(d).log.xz 000178244.td-b3lyp_6-31g+(d).inp 000178244.td-b3lyp_6-31g+(d).log.xz

000178244.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178244.td-b3lyp_6-31+g(d).gjf (generated)

000178244.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178244.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178244.mol 000178244.PUBCHEM 000178244.mol (via Jmol)
000178245.b3lyp_6-31g(d).inp

000178245.b3lyp_6-31g(d).qchem.inp (generated)

000178245.b3lyp_6-31g(d).gjf (generated)

000178245.b3lyp_6-31g(d).firefly.inp (generated)

000178245.b3lyp_6-31g(d).smash.inp (generated)

000178245.b3lyp_6-31g(d).nwchem.inp (generated) 000178245.b3lyp_6-31g(d).log.xz 000178245.td-b3lyp_6-31g+(d).inp 000178245.td-b3lyp_6-31g+(d).log.xz

000178245.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178245.td-b3lyp_6-31+g(d).gjf (generated)

000178245.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178245.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178245.mol 000178245.PUBCHEM 000178245.mol (via Jmol)
000178246.b3lyp_6-31g(d).inp

000178246.b3lyp_6-31g(d).qchem.inp (generated)

000178246.b3lyp_6-31g(d).gjf (generated)

000178246.b3lyp_6-31g(d).firefly.inp (generated)

000178246.b3lyp_6-31g(d).smash.inp (generated)

000178246.b3lyp_6-31g(d).nwchem.inp (generated) 000178246.b3lyp_6-31g(d).log.xz 000178246.td-b3lyp_6-31g+(d).inp 000178246.td-b3lyp_6-31g+(d).log.xz

000178246.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178246.td-b3lyp_6-31+g(d).gjf (generated)

000178246.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178246.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178246.mol 000178246.PUBCHEM 000178246.mol (via Jmol)
000178248.b3lyp_6-31g(d).inp

000178248.b3lyp_6-31g(d).qchem.inp (generated)

000178248.b3lyp_6-31g(d).gjf (generated)

000178248.b3lyp_6-31g(d).firefly.inp (generated)

000178248.b3lyp_6-31g(d).smash.inp (generated)

000178248.b3lyp_6-31g(d).nwchem.inp (generated) 000178248.b3lyp_6-31g(d).log.xz 000178248.td-b3lyp_6-31g+(d).inp 000178248.td-b3lyp_6-31g+(d).log.xz

000178248.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178248.td-b3lyp_6-31+g(d).gjf (generated)

000178248.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178248.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178248.mol 000178248.PUBCHEM 000178248.mol (via Jmol)
000178249.b3lyp_6-31g(d).inp

000178249.b3lyp_6-31g(d).qchem.inp (generated)

000178249.b3lyp_6-31g(d).gjf (generated)

000178249.b3lyp_6-31g(d).firefly.inp (generated)

000178249.b3lyp_6-31g(d).smash.inp (generated)

000178249.b3lyp_6-31g(d).nwchem.inp (generated) 000178249.b3lyp_6-31g(d).log.xz 000178249.td-b3lyp_6-31g+(d).inp 000178249.td-b3lyp_6-31g+(d).log.xz

000178249.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178249.td-b3lyp_6-31+g(d).gjf (generated)

000178249.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178249.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178249.mol 000178249.PUBCHEM 000178249.mol (via Jmol)
000178250.b3lyp_6-31g(d).inp

000178250.b3lyp_6-31g(d).qchem.inp (generated)

000178250.b3lyp_6-31g(d).gjf (generated)

000178250.b3lyp_6-31g(d).firefly.inp (generated)

000178250.b3lyp_6-31g(d).smash.inp (generated)

000178250.b3lyp_6-31g(d).nwchem.inp (generated) 000178250.b3lyp_6-31g(d).log.xz 000178250.td-b3lyp_6-31g+(d).inp 000178250.td-b3lyp_6-31g+(d).log.xz

000178250.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178250.td-b3lyp_6-31+g(d).gjf (generated)

000178250.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178250.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178250.mol 000178250.PUBCHEM 000178250.mol (via Jmol)
000178272.b3lyp_6-31g(d).inp

000178272.b3lyp_6-31g(d).qchem.inp (generated)

000178272.b3lyp_6-31g(d).gjf (generated)

000178272.b3lyp_6-31g(d).firefly.inp (generated)

000178272.b3lyp_6-31g(d).smash.inp (generated)

000178272.b3lyp_6-31g(d).nwchem.inp (generated) 000178272.b3lyp_6-31g(d).log.xz 000178272.td-b3lyp_6-31g+(d).inp 000178272.td-b3lyp_6-31g+(d).log.xz

000178272.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178272.td-b3lyp_6-31+g(d).gjf (generated)

000178272.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178272.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178272.mol 000178272.PUBCHEM 000178272.mol (via Jmol)
000178273.b3lyp_6-31g(d).inp

000178273.b3lyp_6-31g(d).qchem.inp (generated)

000178273.b3lyp_6-31g(d).gjf (generated)

000178273.b3lyp_6-31g(d).firefly.inp (generated)

000178273.b3lyp_6-31g(d).smash.inp (generated)

000178273.b3lyp_6-31g(d).nwchem.inp (generated) 000178273.b3lyp_6-31g(d).log.xz 000178273.mol 000178273.PUBCHEM 000178273.mol (via Jmol)
000178305.b3lyp_6-31g(d).inp

000178305.b3lyp_6-31g(d).qchem.inp (generated)

000178305.b3lyp_6-31g(d).gjf (generated)

000178305.b3lyp_6-31g(d).firefly.inp (generated)

000178305.b3lyp_6-31g(d).smash.inp (generated)

000178305.b3lyp_6-31g(d).nwchem.inp (generated) 000178305.b3lyp_6-31g(d).log.xz 000178305.td-b3lyp_6-31g+(d).inp 000178305.td-b3lyp_6-31g+(d).log.xz

000178305.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178305.td-b3lyp_6-31+g(d).gjf (generated)

000178305.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178305.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178305.mol 000178305.PUBCHEM 000178305.mol (via Jmol)
000178323.b3lyp_6-31g(d).inp

000178323.b3lyp_6-31g(d).qchem.inp (generated)

000178323.b3lyp_6-31g(d).gjf (generated)

000178323.b3lyp_6-31g(d).firefly.inp (generated)

000178323.b3lyp_6-31g(d).smash.inp (generated)

000178323.b3lyp_6-31g(d).nwchem.inp (generated) 000178323.b3lyp_6-31g(d).log.xz 000178323.mol 000178323.PUBCHEM 000178323.mol (via Jmol)
000178324.b3lyp_6-31g(d).inp

000178324.b3lyp_6-31g(d).qchem.inp (generated)

000178324.b3lyp_6-31g(d).gjf (generated)

000178324.b3lyp_6-31g(d).firefly.inp (generated)

000178324.b3lyp_6-31g(d).smash.inp (generated)

000178324.b3lyp_6-31g(d).nwchem.inp (generated) 000178324.b3lyp_6-31g(d).log.xz 000178324.td-b3lyp_6-31g+(d).inp 000178324.td-b3lyp_6-31g+(d).log.xz

000178324.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178324.td-b3lyp_6-31+g(d).gjf (generated)

000178324.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178324.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178324.mol 000178324.PUBCHEM 000178324.mol (via Jmol)
000178361.b3lyp_6-31g(d).inp

000178361.b3lyp_6-31g(d).qchem.inp (generated)

000178361.b3lyp_6-31g(d).gjf (generated)

000178361.b3lyp_6-31g(d).firefly.inp (generated)

000178361.b3lyp_6-31g(d).smash.inp (generated)

000178361.b3lyp_6-31g(d).nwchem.inp (generated) 000178361.b3lyp_6-31g(d).log.xz 000178361.td-b3lyp_6-31g+(d).inp 000178361.td-b3lyp_6-31g+(d).log.xz

000178361.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178361.td-b3lyp_6-31+g(d).gjf (generated)

000178361.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178361.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178361.mol 000178361.PUBCHEM 000178361.mol (via Jmol)
000178362.b3lyp_6-31g(d).inp

000178362.b3lyp_6-31g(d).qchem.inp (generated)

000178362.b3lyp_6-31g(d).gjf (generated)

000178362.b3lyp_6-31g(d).firefly.inp (generated)

000178362.b3lyp_6-31g(d).smash.inp (generated)

000178362.b3lyp_6-31g(d).nwchem.inp (generated) 000178362.b3lyp_6-31g(d).log.xz 000178362.td-b3lyp_6-31g+(d).inp 000178362.td-b3lyp_6-31g+(d).log.xz

000178362.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178362.td-b3lyp_6-31+g(d).gjf (generated)

000178362.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178362.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178362.mol 000178362.PUBCHEM 000178362.mol (via Jmol)
000178363.b3lyp_6-31g(d).inp

000178363.b3lyp_6-31g(d).qchem.inp (generated)

000178363.b3lyp_6-31g(d).gjf (generated)

000178363.b3lyp_6-31g(d).firefly.inp (generated)

000178363.b3lyp_6-31g(d).smash.inp (generated)

000178363.b3lyp_6-31g(d).nwchem.inp (generated) 000178363.b3lyp_6-31g(d).log.xz 000178363.td-b3lyp_6-31g+(d).inp 000178363.td-b3lyp_6-31g+(d).log.xz

000178363.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178363.td-b3lyp_6-31+g(d).gjf (generated)

000178363.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178363.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178363.mol 000178363.PUBCHEM 000178363.mol (via Jmol)
000178364.b3lyp_6-31g(d).inp

000178364.b3lyp_6-31g(d).qchem.inp (generated)

000178364.b3lyp_6-31g(d).gjf (generated)

000178364.b3lyp_6-31g(d).firefly.inp (generated)

000178364.b3lyp_6-31g(d).smash.inp (generated)

000178364.b3lyp_6-31g(d).nwchem.inp (generated) 000178364.b3lyp_6-31g(d).log.xz 000178364.td-b3lyp_6-31g+(d).inp 000178364.td-b3lyp_6-31g+(d).log.xz

000178364.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178364.td-b3lyp_6-31+g(d).gjf (generated)

000178364.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178364.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178364.mol 000178364.PUBCHEM 000178364.mol (via Jmol)
000178366.b3lyp_6-31g(d).inp

000178366.b3lyp_6-31g(d).qchem.inp (generated)

000178366.b3lyp_6-31g(d).gjf (generated)

000178366.b3lyp_6-31g(d).firefly.inp (generated)

000178366.b3lyp_6-31g(d).smash.inp (generated)

000178366.b3lyp_6-31g(d).nwchem.inp (generated) 000178366.b3lyp_6-31g(d).log.xz 000178366.td-b3lyp_6-31g+(d).inp 000178366.td-b3lyp_6-31g+(d).log.xz

000178366.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178366.td-b3lyp_6-31+g(d).gjf (generated)

000178366.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178366.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178366.mol 000178366.PUBCHEM 000178366.mol (via Jmol)
000178367.b3lyp_6-31g(d).inp

000178367.b3lyp_6-31g(d).qchem.inp (generated)

000178367.b3lyp_6-31g(d).gjf (generated)

000178367.b3lyp_6-31g(d).firefly.inp (generated)

000178367.b3lyp_6-31g(d).smash.inp (generated)

000178367.b3lyp_6-31g(d).nwchem.inp (generated) 000178367.b3lyp_6-31g(d).log.xz 000178367.td-b3lyp_6-31g+(d).inp 000178367.td-b3lyp_6-31g+(d).log.xz

000178367.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178367.td-b3lyp_6-31+g(d).gjf (generated)

000178367.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178367.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178367.mol 000178367.PUBCHEM 000178367.mol (via Jmol)
000178368.b3lyp_6-31g(d).inp

000178368.b3lyp_6-31g(d).qchem.inp (generated)

000178368.b3lyp_6-31g(d).gjf (generated)

000178368.b3lyp_6-31g(d).firefly.inp (generated)

000178368.b3lyp_6-31g(d).smash.inp (generated)

000178368.b3lyp_6-31g(d).nwchem.inp (generated) 000178368.b3lyp_6-31g(d).log.xz 000178368.td-b3lyp_6-31g+(d).inp 000178368.td-b3lyp_6-31g+(d).log.xz

000178368.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178368.td-b3lyp_6-31+g(d).gjf (generated)

000178368.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178368.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178368.mol 000178368.PUBCHEM 000178368.mol (via Jmol)
000178371.b3lyp_6-31g(d).inp

000178371.b3lyp_6-31g(d).qchem.inp (generated)

000178371.b3lyp_6-31g(d).gjf (generated)

000178371.b3lyp_6-31g(d).firefly.inp (generated)

000178371.b3lyp_6-31g(d).smash.inp (generated)

000178371.b3lyp_6-31g(d).nwchem.inp (generated) 000178371.b3lyp_6-31g(d).log.xz 000178371.td-b3lyp_6-31g+(d).inp 000178371.td-b3lyp_6-31g+(d).log.xz

000178371.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178371.td-b3lyp_6-31+g(d).gjf (generated)

000178371.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178371.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178371.mol 000178371.PUBCHEM 000178371.mol (via Jmol)
000178378.b3lyp_6-31g(d).inp

000178378.b3lyp_6-31g(d).qchem.inp (generated)

000178378.b3lyp_6-31g(d).gjf (generated)

000178378.b3lyp_6-31g(d).firefly.inp (generated)

000178378.b3lyp_6-31g(d).smash.inp (generated)

000178378.b3lyp_6-31g(d).nwchem.inp (generated) 000178378.b3lyp_6-31g(d).log.xz 000178378.td-b3lyp_6-31g+(d).inp 000178378.td-b3lyp_6-31g+(d).log.xz

000178378.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178378.td-b3lyp_6-31+g(d).gjf (generated)

000178378.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178378.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178378.mol 000178378.PUBCHEM 000178378.mol (via Jmol)
000178379.b3lyp_6-31g(d).inp

000178379.b3lyp_6-31g(d).qchem.inp (generated)

000178379.b3lyp_6-31g(d).gjf (generated)

000178379.b3lyp_6-31g(d).firefly.inp (generated)

000178379.b3lyp_6-31g(d).smash.inp (generated)

000178379.b3lyp_6-31g(d).nwchem.inp (generated) 000178379.b3lyp_6-31g(d).log.xz 000178379.td-b3lyp_6-31g+(d).inp 000178379.td-b3lyp_6-31g+(d).log.xz

000178379.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178379.td-b3lyp_6-31+g(d).gjf (generated)

000178379.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178379.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178379.mol 000178379.PUBCHEM 000178379.mol (via Jmol)
000178390.b3lyp_6-31g(d).inp

000178390.b3lyp_6-31g(d).qchem.inp (generated)

000178390.b3lyp_6-31g(d).gjf (generated)

000178390.b3lyp_6-31g(d).firefly.inp (generated)

000178390.b3lyp_6-31g(d).smash.inp (generated)

000178390.b3lyp_6-31g(d).nwchem.inp (generated) 000178390.b3lyp_6-31g(d).log.xz 000178390.td-b3lyp_6-31g+(d).inp 000178390.td-b3lyp_6-31g+(d).log.xz

000178390.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178390.td-b3lyp_6-31+g(d).gjf (generated)

000178390.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178390.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178390.mol 000178390.PUBCHEM 000178390.mol (via Jmol)
000178402.b3lyp_6-31g(d).inp

000178402.b3lyp_6-31g(d).qchem.inp (generated)

000178402.b3lyp_6-31g(d).gjf (generated)

000178402.b3lyp_6-31g(d).firefly.inp (generated)

000178402.b3lyp_6-31g(d).smash.inp (generated)

000178402.b3lyp_6-31g(d).nwchem.inp (generated) 000178402.b3lyp_6-31g(d).log.xz 000178402.td-b3lyp_6-31g+(d).inp 000178402.td-b3lyp_6-31g+(d).log.xz

000178402.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178402.td-b3lyp_6-31+g(d).gjf (generated)

000178402.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178402.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178402.mol 000178402.PUBCHEM 000178402.mol (via Jmol)
000178404.b3lyp_6-31g(d).inp

000178404.b3lyp_6-31g(d).qchem.inp (generated)

000178404.b3lyp_6-31g(d).gjf (generated)

000178404.b3lyp_6-31g(d).firefly.inp (generated)

000178404.b3lyp_6-31g(d).smash.inp (generated)

000178404.b3lyp_6-31g(d).nwchem.inp (generated) 000178404.b3lyp_6-31g(d).log.xz 000178404.td-b3lyp_6-31g+(d).inp 000178404.td-b3lyp_6-31g+(d).log.xz

000178404.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178404.td-b3lyp_6-31+g(d).gjf (generated)

000178404.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178404.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178404.mol 000178404.PUBCHEM 000178404.mol (via Jmol)
000178405.b3lyp_6-31g(d).inp

000178405.b3lyp_6-31g(d).qchem.inp (generated)

000178405.b3lyp_6-31g(d).gjf (generated)

000178405.b3lyp_6-31g(d).firefly.inp (generated)

000178405.b3lyp_6-31g(d).smash.inp (generated)

000178405.b3lyp_6-31g(d).nwchem.inp (generated) 000178405.b3lyp_6-31g(d).log.xz 000178405.td-b3lyp_6-31g+(d).inp 000178405.td-b3lyp_6-31g+(d).log.xz

000178405.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178405.td-b3lyp_6-31+g(d).gjf (generated)

000178405.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178405.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178405.mol 000178405.PUBCHEM 000178405.mol (via Jmol)
000178406.b3lyp_6-31g(d).inp

000178406.b3lyp_6-31g(d).qchem.inp (generated)

000178406.b3lyp_6-31g(d).gjf (generated)

000178406.b3lyp_6-31g(d).firefly.inp (generated)

000178406.b3lyp_6-31g(d).smash.inp (generated)

000178406.b3lyp_6-31g(d).nwchem.inp (generated) 000178406.b3lyp_6-31g(d).log.xz 000178406.td-b3lyp_6-31g+(d).inp 000178406.td-b3lyp_6-31g+(d).log.xz

000178406.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178406.td-b3lyp_6-31+g(d).gjf (generated)

000178406.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178406.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178406.mol 000178406.PUBCHEM 000178406.mol (via Jmol)
000178407.b3lyp_6-31g(d).inp

000178407.b3lyp_6-31g(d).qchem.inp (generated)

000178407.b3lyp_6-31g(d).gjf (generated)

000178407.b3lyp_6-31g(d).firefly.inp (generated)

000178407.b3lyp_6-31g(d).smash.inp (generated)

000178407.b3lyp_6-31g(d).nwchem.inp (generated) 000178407.b3lyp_6-31g(d).log.xz 000178407.td-b3lyp_6-31g+(d).inp 000178407.td-b3lyp_6-31g+(d).log.xz

000178407.td-b3lyp_6-31+g(d).qchem.inp (generated)

000178407.td-b3lyp_6-31+g(d).gjf (generated)

000178407.td-b3lyp_6-31+g(d).firefly.inp (generated)

000178407.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000178407.mol 000178407.PUBCHEM 000178407.mol (via Jmol)
000178409.b3lyp_6-31g(d).inp

000178409.b3lyp_6-31g(d).qchem.inp (generated)

000178409.b3lyp_6-31g(d).gjf (generated)

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