Index of

Last updated : Thu Apr 20 01:52:35 JST 2017
Total : 31 (24) in this page
016550599.b3lyp_6-31g(d).inp

016550599.b3lyp_6-31g(d).qchem.inp (generated)

016550599.b3lyp_6-31g(d).gjf (generated)

016550599.b3lyp_6-31g(d).firefly.inp (generated)

016550599.b3lyp_6-31g(d).smash.inp (generated)

016550599.b3lyp_6-31g(d).nwchem.inp (generated) 016550599.b3lyp_6-31g(d).log.xz 016550599.td-b3lyp_6-31g+(d).inp 016550599.td-b3lyp_6-31g+(d).log.xz

016550599.td-b3lyp_6-31+g(d).qchem.inp (generated)

016550599.td-b3lyp_6-31+g(d).gjf (generated)

016550599.td-b3lyp_6-31+g(d).firefly.inp (generated)

016550599.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016550599.mol 016550599.PUBCHEM 016550599.mol (via Jmol)
016551086.b3lyp_6-31g(d).inp

016551086.b3lyp_6-31g(d).qchem.inp (generated)

016551086.b3lyp_6-31g(d).gjf (generated)

016551086.b3lyp_6-31g(d).firefly.inp (generated)

016551086.b3lyp_6-31g(d).smash.inp (generated)

016551086.b3lyp_6-31g(d).nwchem.inp (generated) 016551086.b3lyp_6-31g(d).log.xz 016551086.mol 016551086.PUBCHEM 016551086.mol (via Jmol)
016553964.b3lyp_6-31g(d).inp

016553964.b3lyp_6-31g(d).qchem.inp (generated)

016553964.b3lyp_6-31g(d).gjf (generated)

016553964.b3lyp_6-31g(d).firefly.inp (generated)

016553964.b3lyp_6-31g(d).smash.inp (generated)

016553964.b3lyp_6-31g(d).nwchem.inp (generated) 016553964.b3lyp_6-31g(d).log.xz 016553964.mol 016553964.PUBCHEM 016553964.mol (via Jmol)
016553981.b3lyp_6-31g(d).inp

016553981.b3lyp_6-31g(d).qchem.inp (generated)

016553981.b3lyp_6-31g(d).gjf (generated)

016553981.b3lyp_6-31g(d).firefly.inp (generated)

016553981.b3lyp_6-31g(d).smash.inp (generated)

016553981.b3lyp_6-31g(d).nwchem.inp (generated) 016553981.b3lyp_6-31g(d).log.xz 016553981.td-b3lyp_6-31g+(d).inp 016553981.td-b3lyp_6-31g+(d).log.xz

016553981.td-b3lyp_6-31+g(d).qchem.inp (generated)

016553981.td-b3lyp_6-31+g(d).gjf (generated)

016553981.td-b3lyp_6-31+g(d).firefly.inp (generated)

016553981.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016553981.mol 016553981.PUBCHEM 016553981.mol (via Jmol)
016553984.b3lyp_6-31g(d).inp

016553984.b3lyp_6-31g(d).qchem.inp (generated)

016553984.b3lyp_6-31g(d).gjf (generated)

016553984.b3lyp_6-31g(d).firefly.inp (generated)

016553984.b3lyp_6-31g(d).smash.inp (generated)

016553984.b3lyp_6-31g(d).nwchem.inp (generated) 016553984.b3lyp_6-31g(d).log.xz 016553984.td-b3lyp_6-31g+(d).inp 016553984.td-b3lyp_6-31g+(d).log.xz

016553984.td-b3lyp_6-31+g(d).qchem.inp (generated)

016553984.td-b3lyp_6-31+g(d).gjf (generated)

016553984.td-b3lyp_6-31+g(d).firefly.inp (generated)

016553984.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016553984.mol 016553984.PUBCHEM 016553984.mol (via Jmol)
016554022.b3lyp_6-31g(d).inp

016554022.b3lyp_6-31g(d).qchem.inp (generated)

016554022.b3lyp_6-31g(d).gjf (generated)

016554022.b3lyp_6-31g(d).firefly.inp (generated)

016554022.b3lyp_6-31g(d).smash.inp (generated)

016554022.b3lyp_6-31g(d).nwchem.inp (generated) 016554022.b3lyp_6-31g(d).log.xz 016554022.td-b3lyp_6-31g+(d).inp 016554022.td-b3lyp_6-31g+(d).log.xz

016554022.td-b3lyp_6-31+g(d).qchem.inp (generated)

016554022.td-b3lyp_6-31+g(d).gjf (generated)

016554022.td-b3lyp_6-31+g(d).firefly.inp (generated)

016554022.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016554022.mol 016554022.PUBCHEM 016554022.mol (via Jmol)
016555780.b3lyp_6-31g(d).inp

016555780.b3lyp_6-31g(d).qchem.inp (generated)

016555780.b3lyp_6-31g(d).gjf (generated)

016555780.b3lyp_6-31g(d).firefly.inp (generated)

016555780.b3lyp_6-31g(d).smash.inp (generated)

016555780.b3lyp_6-31g(d).nwchem.inp (generated) 016555780.b3lyp_6-31g(d).log.xz 016555780.mol 016555780.PUBCHEM 016555780.mol (via Jmol)
016555781.b3lyp_6-31g(d).inp

016555781.b3lyp_6-31g(d).qchem.inp (generated)

016555781.b3lyp_6-31g(d).gjf (generated)

016555781.b3lyp_6-31g(d).firefly.inp (generated)

016555781.b3lyp_6-31g(d).smash.inp (generated)

016555781.b3lyp_6-31g(d).nwchem.inp (generated) 016555781.b3lyp_6-31g(d).log.xz 016555781.mol 016555781.PUBCHEM 016555781.mol (via Jmol)
016556065.b3lyp_6-31g(d).inp

016556065.b3lyp_6-31g(d).qchem.inp (generated)

016556065.b3lyp_6-31g(d).gjf (generated)

016556065.b3lyp_6-31g(d).firefly.inp (generated)

016556065.b3lyp_6-31g(d).smash.inp (generated)

016556065.b3lyp_6-31g(d).nwchem.inp (generated) 016556065.b3lyp_6-31g(d).log.xz 016556065.td-b3lyp_6-31g+(d).inp 016556065.td-b3lyp_6-31g+(d).log.xz

016556065.td-b3lyp_6-31+g(d).qchem.inp (generated)

016556065.td-b3lyp_6-31+g(d).gjf (generated)

016556065.td-b3lyp_6-31+g(d).firefly.inp (generated)

016556065.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016556065.mol 016556065.PUBCHEM 016556065.mol (via Jmol)
016556217.b3lyp_6-31g(d).inp

016556217.b3lyp_6-31g(d).qchem.inp (generated)

016556217.b3lyp_6-31g(d).gjf (generated)

016556217.b3lyp_6-31g(d).firefly.inp (generated)

016556217.b3lyp_6-31g(d).smash.inp (generated)

016556217.b3lyp_6-31g(d).nwchem.inp (generated) 016556217.b3lyp_6-31g(d).log.xz 016556217.td-b3lyp_6-31g+(d).inp 016556217.td-b3lyp_6-31g+(d).log.xz

016556217.td-b3lyp_6-31+g(d).qchem.inp (generated)

016556217.td-b3lyp_6-31+g(d).gjf (generated)

016556217.td-b3lyp_6-31+g(d).firefly.inp (generated)

016556217.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016556217.mol 016556217.PUBCHEM 016556217.mol (via Jmol)
016557845.b3lyp_6-31g(d).inp

016557845.b3lyp_6-31g(d).qchem.inp (generated)

016557845.b3lyp_6-31g(d).gjf (generated)

016557845.b3lyp_6-31g(d).firefly.inp (generated)

016557845.b3lyp_6-31g(d).smash.inp (generated)

016557845.b3lyp_6-31g(d).nwchem.inp (generated) 016557845.b3lyp_6-31g(d).log.xz 016557845.td-b3lyp_6-31g+(d).inp 016557845.td-b3lyp_6-31g+(d).log.xz

016557845.td-b3lyp_6-31+g(d).qchem.inp (generated)

016557845.td-b3lyp_6-31+g(d).gjf (generated)

016557845.td-b3lyp_6-31+g(d).firefly.inp (generated)

016557845.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016557845.mol 016557845.PUBCHEM 016557845.mol (via Jmol)
016559700.b3lyp_6-31g(d).inp

016559700.b3lyp_6-31g(d).qchem.inp (generated)

016559700.b3lyp_6-31g(d).gjf (generated)

016559700.b3lyp_6-31g(d).firefly.inp (generated)

016559700.b3lyp_6-31g(d).smash.inp (generated)

016559700.b3lyp_6-31g(d).nwchem.inp (generated) 016559700.b3lyp_6-31g(d).log.xz 016559700.td-b3lyp_6-31g+(d).inp 016559700.td-b3lyp_6-31g+(d).log.xz

016559700.td-b3lyp_6-31+g(d).qchem.inp (generated)

016559700.td-b3lyp_6-31+g(d).gjf (generated)

016559700.td-b3lyp_6-31+g(d).firefly.inp (generated)

016559700.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016559700.mol 016559700.PUBCHEM 016559700.mol (via Jmol)
016560914.b3lyp_6-31g(d).inp

016560914.b3lyp_6-31g(d).qchem.inp (generated)

016560914.b3lyp_6-31g(d).gjf (generated)

016560914.b3lyp_6-31g(d).firefly.inp (generated)

016560914.b3lyp_6-31g(d).smash.inp (generated)

016560914.b3lyp_6-31g(d).nwchem.inp (generated) 016560914.b3lyp_6-31g(d).log.xz 016560914.mol 016560914.PUBCHEM 016560914.mol (via Jmol)
016561608.b3lyp_6-31g(d).inp

016561608.b3lyp_6-31g(d).qchem.inp (generated)

016561608.b3lyp_6-31g(d).gjf (generated)

016561608.b3lyp_6-31g(d).firefly.inp (generated)

016561608.b3lyp_6-31g(d).smash.inp (generated)

016561608.b3lyp_6-31g(d).nwchem.inp (generated) 016561608.b3lyp_6-31g(d).log.xz 016561608.td-b3lyp_6-31g+(d).inp 016561608.td-b3lyp_6-31g+(d).log.xz

016561608.td-b3lyp_6-31+g(d).qchem.inp (generated)

016561608.td-b3lyp_6-31+g(d).gjf (generated)

016561608.td-b3lyp_6-31+g(d).firefly.inp (generated)

016561608.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016561608.mol 016561608.PUBCHEM 016561608.mol (via Jmol)
016561698.b3lyp_6-31g(d).inp

016561698.b3lyp_6-31g(d).qchem.inp (generated)

016561698.b3lyp_6-31g(d).gjf (generated)

016561698.b3lyp_6-31g(d).firefly.inp (generated)

016561698.b3lyp_6-31g(d).smash.inp (generated)

016561698.b3lyp_6-31g(d).nwchem.inp (generated) 016561698.b3lyp_6-31g(d).log.xz 016561698.td-b3lyp_6-31g+(d).inp 016561698.td-b3lyp_6-31g+(d).log.xz

016561698.td-b3lyp_6-31+g(d).qchem.inp (generated)

016561698.td-b3lyp_6-31+g(d).gjf (generated)

016561698.td-b3lyp_6-31+g(d).firefly.inp (generated)

016561698.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016561698.mol 016561698.PUBCHEM 016561698.mol (via Jmol)
016561699.b3lyp_6-31g(d).inp

016561699.b3lyp_6-31g(d).qchem.inp (generated)

016561699.b3lyp_6-31g(d).gjf (generated)

016561699.b3lyp_6-31g(d).firefly.inp (generated)

016561699.b3lyp_6-31g(d).smash.inp (generated)

016561699.b3lyp_6-31g(d).nwchem.inp (generated) 016561699.b3lyp_6-31g(d).log.xz 016561699.td-b3lyp_6-31g+(d).inp 016561699.td-b3lyp_6-31g+(d).log.xz

016561699.td-b3lyp_6-31+g(d).qchem.inp (generated)

016561699.td-b3lyp_6-31+g(d).gjf (generated)

016561699.td-b3lyp_6-31+g(d).firefly.inp (generated)

016561699.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016561699.mol 016561699.PUBCHEM 016561699.mol (via Jmol)
016561943.b3lyp_6-31g(d).inp

016561943.b3lyp_6-31g(d).qchem.inp (generated)

016561943.b3lyp_6-31g(d).gjf (generated)

016561943.b3lyp_6-31g(d).firefly.inp (generated)

016561943.b3lyp_6-31g(d).smash.inp (generated)

016561943.b3lyp_6-31g(d).nwchem.inp (generated) 016561943.b3lyp_6-31g(d).log.xz 016561943.mol 016561943.PUBCHEM 016561943.mol (via Jmol)
016566128.b3lyp_6-31g(d).inp

016566128.b3lyp_6-31g(d).qchem.inp (generated)

016566128.b3lyp_6-31g(d).gjf (generated)

016566128.b3lyp_6-31g(d).firefly.inp (generated)

016566128.b3lyp_6-31g(d).smash.inp (generated)

016566128.b3lyp_6-31g(d).nwchem.inp (generated) 016566128.b3lyp_6-31g(d).log.xz 016566128.td-b3lyp_6-31g+(d).inp 016566128.td-b3lyp_6-31g+(d).log.xz

016566128.td-b3lyp_6-31+g(d).qchem.inp (generated)

016566128.td-b3lyp_6-31+g(d).gjf (generated)

016566128.td-b3lyp_6-31+g(d).firefly.inp (generated)

016566128.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016566128.mol 016566128.PUBCHEM 016566128.mol (via Jmol)
016566861.b3lyp_6-31g(d).inp

016566861.b3lyp_6-31g(d).qchem.inp (generated)

016566861.b3lyp_6-31g(d).gjf (generated)

016566861.b3lyp_6-31g(d).firefly.inp (generated)

016566861.b3lyp_6-31g(d).smash.inp (generated)

016566861.b3lyp_6-31g(d).nwchem.inp (generated) 016566861.b3lyp_6-31g(d).log.xz 016566861.td-b3lyp_6-31g+(d).inp 016566861.td-b3lyp_6-31g+(d).log.xz

016566861.td-b3lyp_6-31+g(d).qchem.inp (generated)

016566861.td-b3lyp_6-31+g(d).gjf (generated)

016566861.td-b3lyp_6-31+g(d).firefly.inp (generated)

016566861.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016566861.mol 016566861.PUBCHEM 016566861.mol (via Jmol)
016566904.b3lyp_6-31g(d).inp

016566904.b3lyp_6-31g(d).qchem.inp (generated)

016566904.b3lyp_6-31g(d).gjf (generated)

016566904.b3lyp_6-31g(d).firefly.inp (generated)

016566904.b3lyp_6-31g(d).smash.inp (generated)

016566904.b3lyp_6-31g(d).nwchem.inp (generated) 016566904.b3lyp_6-31g(d).log.xz 016566904.mol 016566904.PUBCHEM 016566904.mol (via Jmol)
016566914.b3lyp_6-31g(d).inp

016566914.b3lyp_6-31g(d).qchem.inp (generated)

016566914.b3lyp_6-31g(d).gjf (generated)

016566914.b3lyp_6-31g(d).firefly.inp (generated)

016566914.b3lyp_6-31g(d).smash.inp (generated)

016566914.b3lyp_6-31g(d).nwchem.inp (generated) 016566914.b3lyp_6-31g(d).log.xz 016566914.td-b3lyp_6-31g+(d).inp 016566914.td-b3lyp_6-31g+(d).log.xz

016566914.td-b3lyp_6-31+g(d).qchem.inp (generated)

016566914.td-b3lyp_6-31+g(d).gjf (generated)

016566914.td-b3lyp_6-31+g(d).firefly.inp (generated)

016566914.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016566914.mol 016566914.PUBCHEM 016566914.mol (via Jmol)
016566915.b3lyp_6-31g(d).inp

016566915.b3lyp_6-31g(d).qchem.inp (generated)

016566915.b3lyp_6-31g(d).gjf (generated)

016566915.b3lyp_6-31g(d).firefly.inp (generated)

016566915.b3lyp_6-31g(d).smash.inp (generated)

016566915.b3lyp_6-31g(d).nwchem.inp (generated) 016566915.b3lyp_6-31g(d).log.xz 016566915.td-b3lyp_6-31g+(d).inp 016566915.td-b3lyp_6-31g+(d).log.xz

016566915.td-b3lyp_6-31+g(d).qchem.inp (generated)

016566915.td-b3lyp_6-31+g(d).gjf (generated)

016566915.td-b3lyp_6-31+g(d).firefly.inp (generated)

016566915.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016566915.mol 016566915.PUBCHEM 016566915.mol (via Jmol)
016567420.b3lyp_6-31g(d).inp

016567420.b3lyp_6-31g(d).qchem.inp (generated)

016567420.b3lyp_6-31g(d).gjf (generated)

016567420.b3lyp_6-31g(d).firefly.inp (generated)

016567420.b3lyp_6-31g(d).smash.inp (generated)

016567420.b3lyp_6-31g(d).nwchem.inp (generated) 016567420.b3lyp_6-31g(d).log.xz 016567420.td-b3lyp_6-31g+(d).inp 016567420.td-b3lyp_6-31g+(d).log.xz

016567420.td-b3lyp_6-31+g(d).qchem.inp (generated)

016567420.td-b3lyp_6-31+g(d).gjf (generated)

016567420.td-b3lyp_6-31+g(d).firefly.inp (generated)

016567420.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016567420.mol 016567420.PUBCHEM 016567420.mol (via Jmol)
016567641.b3lyp_6-31g(d).inp

016567641.b3lyp_6-31g(d).qchem.inp (generated)

016567641.b3lyp_6-31g(d).gjf (generated)

016567641.b3lyp_6-31g(d).firefly.inp (generated)

016567641.b3lyp_6-31g(d).smash.inp (generated)

016567641.b3lyp_6-31g(d).nwchem.inp (generated) 016567641.b3lyp_6-31g(d).log.xz 016567641.td-b3lyp_6-31g+(d).inp 016567641.td-b3lyp_6-31g+(d).log.xz

016567641.td-b3lyp_6-31+g(d).qchem.inp (generated)

016567641.td-b3lyp_6-31+g(d).gjf (generated)

016567641.td-b3lyp_6-31+g(d).firefly.inp (generated)

016567641.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016567641.mol 016567641.PUBCHEM 016567641.mol (via Jmol)
016568323.b3lyp_6-31g(d).inp

016568323.b3lyp_6-31g(d).qchem.inp (generated)

016568323.b3lyp_6-31g(d).gjf (generated)

016568323.b3lyp_6-31g(d).firefly.inp (generated)

016568323.b3lyp_6-31g(d).smash.inp (generated)

016568323.b3lyp_6-31g(d).nwchem.inp (generated) 016568323.b3lyp_6-31g(d).log.xz 016568323.td-b3lyp_6-31g+(d).inp 016568323.td-b3lyp_6-31g+(d).log.xz

016568323.td-b3lyp_6-31+g(d).qchem.inp (generated)

016568323.td-b3lyp_6-31+g(d).gjf (generated)

016568323.td-b3lyp_6-31+g(d).firefly.inp (generated)

016568323.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016568323.mol 016568323.PUBCHEM 016568323.mol (via Jmol)
016568644.b3lyp_6-31g(d).inp

016568644.b3lyp_6-31g(d).qchem.inp (generated)

016568644.b3lyp_6-31g(d).gjf (generated)

016568644.b3lyp_6-31g(d).firefly.inp (generated)

016568644.b3lyp_6-31g(d).smash.inp (generated)

016568644.b3lyp_6-31g(d).nwchem.inp (generated) 016568644.b3lyp_6-31g(d).log.xz 016568644.td-b3lyp_6-31g+(d).inp 016568644.td-b3lyp_6-31g+(d).log.xz

016568644.td-b3lyp_6-31+g(d).qchem.inp (generated)

016568644.td-b3lyp_6-31+g(d).gjf (generated)

016568644.td-b3lyp_6-31+g(d).firefly.inp (generated)

016568644.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016568644.mol 016568644.PUBCHEM 016568644.mol (via Jmol)
016569662.b3lyp_6-31g(d).inp

016569662.b3lyp_6-31g(d).qchem.inp (generated)

016569662.b3lyp_6-31g(d).gjf (generated)

016569662.b3lyp_6-31g(d).firefly.inp (generated)

016569662.b3lyp_6-31g(d).smash.inp (generated)

016569662.b3lyp_6-31g(d).nwchem.inp (generated) 016569662.b3lyp_6-31g(d).log.xz 016569662.td-b3lyp_6-31g+(d).inp 016569662.td-b3lyp_6-31g+(d).log.xz

016569662.td-b3lyp_6-31+g(d).qchem.inp (generated)

016569662.td-b3lyp_6-31+g(d).gjf (generated)

016569662.td-b3lyp_6-31+g(d).firefly.inp (generated)

016569662.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016569662.mol 016569662.PUBCHEM 016569662.mol (via Jmol)
016569690.b3lyp_6-31g(d).inp

016569690.b3lyp_6-31g(d).qchem.inp (generated)

016569690.b3lyp_6-31g(d).gjf (generated)

016569690.b3lyp_6-31g(d).firefly.inp (generated)

016569690.b3lyp_6-31g(d).smash.inp (generated)

016569690.b3lyp_6-31g(d).nwchem.inp (generated) 016569690.b3lyp_6-31g(d).log.xz 016569690.td-b3lyp_6-31g+(d).inp 016569690.td-b3lyp_6-31g+(d).log.xz

016569690.td-b3lyp_6-31+g(d).qchem.inp (generated)

016569690.td-b3lyp_6-31+g(d).gjf (generated)

016569690.td-b3lyp_6-31+g(d).firefly.inp (generated)

016569690.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016569690.mol 016569690.PUBCHEM 016569690.mol (via Jmol)
016570967.b3lyp_6-31g(d).inp

016570967.b3lyp_6-31g(d).qchem.inp (generated)

016570967.b3lyp_6-31g(d).gjf (generated)

016570967.b3lyp_6-31g(d).firefly.inp (generated)

016570967.b3lyp_6-31g(d).smash.inp (generated)

016570967.b3lyp_6-31g(d).nwchem.inp (generated) 016570967.b3lyp_6-31g(d).log.xz 016570967.td-b3lyp_6-31g+(d).inp 016570967.td-b3lyp_6-31g+(d).log.xz

016570967.td-b3lyp_6-31+g(d).qchem.inp (generated)

016570967.td-b3lyp_6-31+g(d).gjf (generated)

016570967.td-b3lyp_6-31+g(d).firefly.inp (generated)

016570967.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016570967.mol 016570967.PUBCHEM 016570967.mol (via Jmol)
016573535.b3lyp_6-31g(d).inp

016573535.b3lyp_6-31g(d).qchem.inp (generated)

016573535.b3lyp_6-31g(d).gjf (generated)

016573535.b3lyp_6-31g(d).firefly.inp (generated)

016573535.b3lyp_6-31g(d).smash.inp (generated)

016573535.b3lyp_6-31g(d).nwchem.inp (generated) 016573535.b3lyp_6-31g(d).log.xz 016573535.td-b3lyp_6-31g+(d).inp 016573535.td-b3lyp_6-31g+(d).log.xz

016573535.td-b3lyp_6-31+g(d).qchem.inp (generated)

016573535.td-b3lyp_6-31+g(d).gjf (generated)

016573535.td-b3lyp_6-31+g(d).firefly.inp (generated)

016573535.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016573535.mol 016573535.PUBCHEM 016573535.mol (via Jmol)
016573831.b3lyp_6-31g(d).inp

016573831.b3lyp_6-31g(d).qchem.inp (generated)

016573831.b3lyp_6-31g(d).gjf (generated)

016573831.b3lyp_6-31g(d).firefly.inp (generated)

016573831.b3lyp_6-31g(d).smash.inp (generated)

016573831.b3lyp_6-31g(d).nwchem.inp (generated) 016573831.b3lyp_6-31g(d).log.xz 016573831.td-b3lyp_6-31g+(d).inp 016573831.td-b3lyp_6-31g+(d).log.xz

016573831.td-b3lyp_6-31+g(d).qchem.inp (generated)

016573831.td-b3lyp_6-31+g(d).gjf (generated)

016573831.td-b3lyp_6-31+g(d).firefly.inp (generated)

016573831.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016573831.mol 016573831.PUBCHEM 016573831.mol (via Jmol)


maho@riken.jp/maho.nakata@gmail.com