Index of

Last updated : Thu Aug 17 01:52:36 JST 2017
Total : 87 (63) in this page
053181228.b3lyp_6-31g(d).inp

053181228.b3lyp_6-31g(d).qchem.inp (generated)

053181228.b3lyp_6-31g(d).gjf (generated)

053181228.b3lyp_6-31g(d).firefly.inp (generated)

053181228.b3lyp_6-31g(d).smash.inp (generated)

053181228.b3lyp_6-31g(d).nwchem.inp (generated) 053181228.b3lyp_6-31g(d).log.xz 053181228.td-b3lyp_6-31g+(d).inp 053181228.td-b3lyp_6-31g+(d).log.xz

053181228.td-b3lyp_6-31+g(d).qchem.inp (generated)

053181228.td-b3lyp_6-31+g(d).gjf (generated)

053181228.td-b3lyp_6-31+g(d).firefly.inp (generated)

053181228.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053181228.mol 053181228.PUBCHEM 053181228.mol (via Jmol)
053184851.b3lyp_6-31g(d).inp

053184851.b3lyp_6-31g(d).qchem.inp (generated)

053184851.b3lyp_6-31g(d).gjf (generated)

053184851.b3lyp_6-31g(d).firefly.inp (generated)

053184851.b3lyp_6-31g(d).smash.inp (generated)

053184851.b3lyp_6-31g(d).nwchem.inp (generated) 053184851.b3lyp_6-31g(d).log.xz 053184851.mol 053184851.PUBCHEM 053184851.mol (via Jmol)
053184896.b3lyp_6-31g(d).inp

053184896.b3lyp_6-31g(d).qchem.inp (generated)

053184896.b3lyp_6-31g(d).gjf (generated)

053184896.b3lyp_6-31g(d).firefly.inp (generated)

053184896.b3lyp_6-31g(d).smash.inp (generated)

053184896.b3lyp_6-31g(d).nwchem.inp (generated) 053184896.b3lyp_6-31g(d).log.xz 053184896.td-b3lyp_6-31g+(d).inp 053184896.td-b3lyp_6-31g+(d).log.xz

053184896.td-b3lyp_6-31+g(d).qchem.inp (generated)

053184896.td-b3lyp_6-31+g(d).gjf (generated)

053184896.td-b3lyp_6-31+g(d).firefly.inp (generated)

053184896.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053184896.mol 053184896.PUBCHEM 053184896.mol (via Jmol)
053184898.b3lyp_6-31g(d).inp

053184898.b3lyp_6-31g(d).qchem.inp (generated)

053184898.b3lyp_6-31g(d).gjf (generated)

053184898.b3lyp_6-31g(d).firefly.inp (generated)

053184898.b3lyp_6-31g(d).smash.inp (generated)

053184898.b3lyp_6-31g(d).nwchem.inp (generated) 053184898.b3lyp_6-31g(d).log.xz 053184898.td-b3lyp_6-31g+(d).inp 053184898.td-b3lyp_6-31g+(d).log.xz

053184898.td-b3lyp_6-31+g(d).qchem.inp (generated)

053184898.td-b3lyp_6-31+g(d).gjf (generated)

053184898.td-b3lyp_6-31+g(d).firefly.inp (generated)

053184898.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053184898.mol 053184898.PUBCHEM 053184898.mol (via Jmol)
053185088.b3lyp_6-31g(d).inp

053185088.b3lyp_6-31g(d).qchem.inp (generated)

053185088.b3lyp_6-31g(d).gjf (generated)

053185088.b3lyp_6-31g(d).firefly.inp (generated)

053185088.b3lyp_6-31g(d).smash.inp (generated)

053185088.b3lyp_6-31g(d).nwchem.inp (generated) 053185088.b3lyp_6-31g(d).log.xz 053185088.td-b3lyp_6-31g+(d).inp 053185088.td-b3lyp_6-31g+(d).log.xz

053185088.td-b3lyp_6-31+g(d).qchem.inp (generated)

053185088.td-b3lyp_6-31+g(d).gjf (generated)

053185088.td-b3lyp_6-31+g(d).firefly.inp (generated)

053185088.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053185088.mol 053185088.PUBCHEM 053185088.mol (via Jmol)
053185280.b3lyp_6-31g(d).inp

053185280.b3lyp_6-31g(d).qchem.inp (generated)

053185280.b3lyp_6-31g(d).gjf (generated)

053185280.b3lyp_6-31g(d).firefly.inp (generated)

053185280.b3lyp_6-31g(d).smash.inp (generated)

053185280.b3lyp_6-31g(d).nwchem.inp (generated) 053185280.b3lyp_6-31g(d).log.xz 053185280.td-b3lyp_6-31g+(d).inp 053185280.td-b3lyp_6-31g+(d).log.xz

053185280.td-b3lyp_6-31+g(d).qchem.inp (generated)

053185280.td-b3lyp_6-31+g(d).gjf (generated)

053185280.td-b3lyp_6-31+g(d).firefly.inp (generated)

053185280.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053185280.mol 053185280.PUBCHEM 053185280.mol (via Jmol)
053185387.b3lyp_6-31g(d).inp

053185387.b3lyp_6-31g(d).qchem.inp (generated)

053185387.b3lyp_6-31g(d).gjf (generated)

053185387.b3lyp_6-31g(d).firefly.inp (generated)

053185387.b3lyp_6-31g(d).smash.inp (generated)

053185387.b3lyp_6-31g(d).nwchem.inp (generated) 053185387.b3lyp_6-31g(d).log.xz 053185387.td-b3lyp_6-31g+(d).inp 053185387.td-b3lyp_6-31g+(d).log.xz

053185387.td-b3lyp_6-31+g(d).qchem.inp (generated)

053185387.td-b3lyp_6-31+g(d).gjf (generated)

053185387.td-b3lyp_6-31+g(d).firefly.inp (generated)

053185387.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053185387.mol 053185387.PUBCHEM 053185387.mol (via Jmol)
053185751.b3lyp_6-31g(d).inp

053185751.b3lyp_6-31g(d).qchem.inp (generated)

053185751.b3lyp_6-31g(d).gjf (generated)

053185751.b3lyp_6-31g(d).firefly.inp (generated)

053185751.b3lyp_6-31g(d).smash.inp (generated)

053185751.b3lyp_6-31g(d).nwchem.inp (generated) 053185751.b3lyp_6-31g(d).log.xz 053185751.td-b3lyp_6-31g+(d).inp 053185751.td-b3lyp_6-31g+(d).log.xz

053185751.td-b3lyp_6-31+g(d).qchem.inp (generated)

053185751.td-b3lyp_6-31+g(d).gjf (generated)

053185751.td-b3lyp_6-31+g(d).firefly.inp (generated)

053185751.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053185751.mol 053185751.PUBCHEM 053185751.mol (via Jmol)
053185813.b3lyp_6-31g(d).inp

053185813.b3lyp_6-31g(d).qchem.inp (generated)

053185813.b3lyp_6-31g(d).gjf (generated)

053185813.b3lyp_6-31g(d).firefly.inp (generated)

053185813.b3lyp_6-31g(d).smash.inp (generated)

053185813.b3lyp_6-31g(d).nwchem.inp (generated) 053185813.b3lyp_6-31g(d).log.xz 053185813.mol 053185813.PUBCHEM 053185813.mol (via Jmol)
053185916.b3lyp_6-31g(d).inp

053185916.b3lyp_6-31g(d).qchem.inp (generated)

053185916.b3lyp_6-31g(d).gjf (generated)

053185916.b3lyp_6-31g(d).firefly.inp (generated)

053185916.b3lyp_6-31g(d).smash.inp (generated)

053185916.b3lyp_6-31g(d).nwchem.inp (generated) 053185916.b3lyp_6-31g(d).log.xz 053185916.td-b3lyp_6-31g+(d).inp 053185916.td-b3lyp_6-31g+(d).log.xz

053185916.td-b3lyp_6-31+g(d).qchem.inp (generated)

053185916.td-b3lyp_6-31+g(d).gjf (generated)

053185916.td-b3lyp_6-31+g(d).firefly.inp (generated)

053185916.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053185916.mol 053185916.PUBCHEM 053185916.mol (via Jmol)
053186098.b3lyp_6-31g(d).inp

053186098.b3lyp_6-31g(d).qchem.inp (generated)

053186098.b3lyp_6-31g(d).gjf (generated)

053186098.b3lyp_6-31g(d).firefly.inp (generated)

053186098.b3lyp_6-31g(d).smash.inp (generated)

053186098.b3lyp_6-31g(d).nwchem.inp (generated) 053186098.b3lyp_6-31g(d).log.xz 053186098.td-b3lyp_6-31g+(d).inp 053186098.td-b3lyp_6-31g+(d).log.xz

053186098.td-b3lyp_6-31+g(d).qchem.inp (generated)

053186098.td-b3lyp_6-31+g(d).gjf (generated)

053186098.td-b3lyp_6-31+g(d).firefly.inp (generated)

053186098.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053186098.mol 053186098.PUBCHEM 053186098.mol (via Jmol)
053191675.b3lyp_6-31g(d).inp

053191675.b3lyp_6-31g(d).qchem.inp (generated)

053191675.b3lyp_6-31g(d).gjf (generated)

053191675.b3lyp_6-31g(d).firefly.inp (generated)

053191675.b3lyp_6-31g(d).smash.inp (generated)

053191675.b3lyp_6-31g(d).nwchem.inp (generated) 053191675.b3lyp_6-31g(d).log.xz 053191675.td-b3lyp_6-31g+(d).inp 053191675.td-b3lyp_6-31g+(d).log.xz

053191675.td-b3lyp_6-31+g(d).qchem.inp (generated)

053191675.td-b3lyp_6-31+g(d).gjf (generated)

053191675.td-b3lyp_6-31+g(d).firefly.inp (generated)

053191675.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053191675.mol 053191675.PUBCHEM 053191675.mol (via Jmol)
053191769.b3lyp_6-31g(d).inp

053191769.b3lyp_6-31g(d).qchem.inp (generated)

053191769.b3lyp_6-31g(d).gjf (generated)

053191769.b3lyp_6-31g(d).firefly.inp (generated)

053191769.b3lyp_6-31g(d).smash.inp (generated)

053191769.b3lyp_6-31g(d).nwchem.inp (generated) 053191769.b3lyp_6-31g(d).log.xz 053191769.td-b3lyp_6-31g+(d).inp 053191769.td-b3lyp_6-31g+(d).log.xz

053191769.td-b3lyp_6-31+g(d).qchem.inp (generated)

053191769.td-b3lyp_6-31+g(d).gjf (generated)

053191769.td-b3lyp_6-31+g(d).firefly.inp (generated)

053191769.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053191769.mol 053191769.PUBCHEM 053191769.mol (via Jmol)
053191771.b3lyp_6-31g(d).inp

053191771.b3lyp_6-31g(d).qchem.inp (generated)

053191771.b3lyp_6-31g(d).gjf (generated)

053191771.b3lyp_6-31g(d).firefly.inp (generated)

053191771.b3lyp_6-31g(d).smash.inp (generated)

053191771.b3lyp_6-31g(d).nwchem.inp (generated) 053191771.b3lyp_6-31g(d).log.xz 053191771.mol 053191771.PUBCHEM 053191771.mol (via Jmol)
053191772.b3lyp_6-31g(d).inp

053191772.b3lyp_6-31g(d).qchem.inp (generated)

053191772.b3lyp_6-31g(d).gjf (generated)

053191772.b3lyp_6-31g(d).firefly.inp (generated)

053191772.b3lyp_6-31g(d).smash.inp (generated)

053191772.b3lyp_6-31g(d).nwchem.inp (generated) 053191772.b3lyp_6-31g(d).log.xz 053191772.mol 053191772.PUBCHEM 053191772.mol (via Jmol)
053191773.b3lyp_6-31g(d).inp

053191773.b3lyp_6-31g(d).qchem.inp (generated)

053191773.b3lyp_6-31g(d).gjf (generated)

053191773.b3lyp_6-31g(d).firefly.inp (generated)

053191773.b3lyp_6-31g(d).smash.inp (generated)

053191773.b3lyp_6-31g(d).nwchem.inp (generated) 053191773.b3lyp_6-31g(d).log.xz 053191773.td-b3lyp_6-31g+(d).inp 053191773.td-b3lyp_6-31g+(d).log.xz

053191773.td-b3lyp_6-31+g(d).qchem.inp (generated)

053191773.td-b3lyp_6-31+g(d).gjf (generated)

053191773.td-b3lyp_6-31+g(d).firefly.inp (generated)

053191773.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053191773.mol 053191773.PUBCHEM 053191773.mol (via Jmol)
053191775.b3lyp_6-31g(d).inp

053191775.b3lyp_6-31g(d).qchem.inp (generated)

053191775.b3lyp_6-31g(d).gjf (generated)

053191775.b3lyp_6-31g(d).firefly.inp (generated)

053191775.b3lyp_6-31g(d).smash.inp (generated)

053191775.b3lyp_6-31g(d).nwchem.inp (generated) 053191775.b3lyp_6-31g(d).log.xz 053191775.td-b3lyp_6-31g+(d).inp 053191775.td-b3lyp_6-31g+(d).log.xz

053191775.td-b3lyp_6-31+g(d).qchem.inp (generated)

053191775.td-b3lyp_6-31+g(d).gjf (generated)

053191775.td-b3lyp_6-31+g(d).firefly.inp (generated)

053191775.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053191775.mol 053191775.PUBCHEM 053191775.mol (via Jmol)
053191791.b3lyp_6-31g(d).inp

053191791.b3lyp_6-31g(d).qchem.inp (generated)

053191791.b3lyp_6-31g(d).gjf (generated)

053191791.b3lyp_6-31g(d).firefly.inp (generated)

053191791.b3lyp_6-31g(d).smash.inp (generated)

053191791.b3lyp_6-31g(d).nwchem.inp (generated) 053191791.b3lyp_6-31g(d).log.xz 053191791.td-b3lyp_6-31g+(d).inp 053191791.td-b3lyp_6-31g+(d).log.xz

053191791.td-b3lyp_6-31+g(d).qchem.inp (generated)

053191791.td-b3lyp_6-31+g(d).gjf (generated)

053191791.td-b3lyp_6-31+g(d).firefly.inp (generated)

053191791.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053191791.mol 053191791.PUBCHEM 053191791.mol (via Jmol)
053191792.b3lyp_6-31g(d).inp

053191792.b3lyp_6-31g(d).qchem.inp (generated)

053191792.b3lyp_6-31g(d).gjf (generated)

053191792.b3lyp_6-31g(d).firefly.inp (generated)

053191792.b3lyp_6-31g(d).smash.inp (generated)

053191792.b3lyp_6-31g(d).nwchem.inp (generated) 053191792.b3lyp_6-31g(d).log.xz 053191792.td-b3lyp_6-31g+(d).inp 053191792.td-b3lyp_6-31g+(d).log.xz

053191792.td-b3lyp_6-31+g(d).qchem.inp (generated)

053191792.td-b3lyp_6-31+g(d).gjf (generated)

053191792.td-b3lyp_6-31+g(d).firefly.inp (generated)

053191792.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053191792.mol 053191792.PUBCHEM 053191792.mol (via Jmol)
053191794.b3lyp_6-31g(d).inp

053191794.b3lyp_6-31g(d).qchem.inp (generated)

053191794.b3lyp_6-31g(d).gjf (generated)

053191794.b3lyp_6-31g(d).firefly.inp (generated)

053191794.b3lyp_6-31g(d).smash.inp (generated)

053191794.b3lyp_6-31g(d).nwchem.inp (generated) 053191794.b3lyp_6-31g(d).log.xz 053191794.td-b3lyp_6-31g+(d).inp 053191794.td-b3lyp_6-31g+(d).log.xz

053191794.td-b3lyp_6-31+g(d).qchem.inp (generated)

053191794.td-b3lyp_6-31+g(d).gjf (generated)

053191794.td-b3lyp_6-31+g(d).firefly.inp (generated)

053191794.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053191794.mol 053191794.PUBCHEM 053191794.mol (via Jmol)
053191795.b3lyp_6-31g(d).inp

053191795.b3lyp_6-31g(d).qchem.inp (generated)

053191795.b3lyp_6-31g(d).gjf (generated)

053191795.b3lyp_6-31g(d).firefly.inp (generated)

053191795.b3lyp_6-31g(d).smash.inp (generated)

053191795.b3lyp_6-31g(d).nwchem.inp (generated) 053191795.b3lyp_6-31g(d).log.xz 053191795.mol 053191795.PUBCHEM 053191795.mol (via Jmol)
053191799.b3lyp_6-31g(d).inp

053191799.b3lyp_6-31g(d).qchem.inp (generated)

053191799.b3lyp_6-31g(d).gjf (generated)

053191799.b3lyp_6-31g(d).firefly.inp (generated)

053191799.b3lyp_6-31g(d).smash.inp (generated)

053191799.b3lyp_6-31g(d).nwchem.inp (generated) 053191799.b3lyp_6-31g(d).log.xz 053191799.td-b3lyp_6-31g+(d).inp 053191799.td-b3lyp_6-31g+(d).log.xz

053191799.td-b3lyp_6-31+g(d).qchem.inp (generated)

053191799.td-b3lyp_6-31+g(d).gjf (generated)

053191799.td-b3lyp_6-31+g(d).firefly.inp (generated)

053191799.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053191799.mol 053191799.PUBCHEM 053191799.mol (via Jmol)
053191800.b3lyp_6-31g(d).inp

053191800.b3lyp_6-31g(d).qchem.inp (generated)

053191800.b3lyp_6-31g(d).gjf (generated)

053191800.b3lyp_6-31g(d).firefly.inp (generated)

053191800.b3lyp_6-31g(d).smash.inp (generated)

053191800.b3lyp_6-31g(d).nwchem.inp (generated) 053191800.b3lyp_6-31g(d).log.xz 053191800.td-b3lyp_6-31g+(d).inp 053191800.td-b3lyp_6-31g+(d).log.xz

053191800.td-b3lyp_6-31+g(d).qchem.inp (generated)

053191800.td-b3lyp_6-31+g(d).gjf (generated)

053191800.td-b3lyp_6-31+g(d).firefly.inp (generated)

053191800.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053191800.mol 053191800.PUBCHEM 053191800.mol (via Jmol)
053191809.b3lyp_6-31g(d).inp

053191809.b3lyp_6-31g(d).qchem.inp (generated)

053191809.b3lyp_6-31g(d).gjf (generated)

053191809.b3lyp_6-31g(d).firefly.inp (generated)

053191809.b3lyp_6-31g(d).smash.inp (generated)

053191809.b3lyp_6-31g(d).nwchem.inp (generated) 053191809.b3lyp_6-31g(d).log.xz 053191809.td-b3lyp_6-31g+(d).inp 053191809.td-b3lyp_6-31g+(d).log.xz

053191809.td-b3lyp_6-31+g(d).qchem.inp (generated)

053191809.td-b3lyp_6-31+g(d).gjf (generated)

053191809.td-b3lyp_6-31+g(d).firefly.inp (generated)

053191809.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053191809.mol 053191809.PUBCHEM 053191809.mol (via Jmol)
053191810.b3lyp_6-31g(d).inp

053191810.b3lyp_6-31g(d).qchem.inp (generated)

053191810.b3lyp_6-31g(d).gjf (generated)

053191810.b3lyp_6-31g(d).firefly.inp (generated)

053191810.b3lyp_6-31g(d).smash.inp (generated)

053191810.b3lyp_6-31g(d).nwchem.inp (generated) 053191810.b3lyp_6-31g(d).log.xz 053191810.td-b3lyp_6-31g+(d).inp 053191810.td-b3lyp_6-31g+(d).log.xz

053191810.td-b3lyp_6-31+g(d).qchem.inp (generated)

053191810.td-b3lyp_6-31+g(d).gjf (generated)

053191810.td-b3lyp_6-31+g(d).firefly.inp (generated)

053191810.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053191810.mol 053191810.PUBCHEM 053191810.mol (via Jmol)
053191818.b3lyp_6-31g(d).inp

053191818.b3lyp_6-31g(d).qchem.inp (generated)

053191818.b3lyp_6-31g(d).gjf (generated)

053191818.b3lyp_6-31g(d).firefly.inp (generated)

053191818.b3lyp_6-31g(d).smash.inp (generated)

053191818.b3lyp_6-31g(d).nwchem.inp (generated) 053191818.b3lyp_6-31g(d).log.xz 053191818.td-b3lyp_6-31g+(d).inp 053191818.td-b3lyp_6-31g+(d).log.xz

053191818.td-b3lyp_6-31+g(d).qchem.inp (generated)

053191818.td-b3lyp_6-31+g(d).gjf (generated)

053191818.td-b3lyp_6-31+g(d).firefly.inp (generated)

053191818.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053191818.mol 053191818.PUBCHEM 053191818.mol (via Jmol)
053192255.b3lyp_6-31g(d).inp

053192255.b3lyp_6-31g(d).qchem.inp (generated)

053192255.b3lyp_6-31g(d).gjf (generated)

053192255.b3lyp_6-31g(d).firefly.inp (generated)

053192255.b3lyp_6-31g(d).smash.inp (generated)

053192255.b3lyp_6-31g(d).nwchem.inp (generated) 053192255.b3lyp_6-31g(d).log.xz 053192255.td-b3lyp_6-31g+(d).inp 053192255.td-b3lyp_6-31g+(d).log.xz

053192255.td-b3lyp_6-31+g(d).qchem.inp (generated)

053192255.td-b3lyp_6-31+g(d).gjf (generated)

053192255.td-b3lyp_6-31+g(d).firefly.inp (generated)

053192255.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053192255.mol 053192255.PUBCHEM 053192255.mol (via Jmol)
053192256.b3lyp_6-31g(d).inp

053192256.b3lyp_6-31g(d).qchem.inp (generated)

053192256.b3lyp_6-31g(d).gjf (generated)

053192256.b3lyp_6-31g(d).firefly.inp (generated)

053192256.b3lyp_6-31g(d).smash.inp (generated)

053192256.b3lyp_6-31g(d).nwchem.inp (generated) 053192256.b3lyp_6-31g(d).log.xz 053192256.td-b3lyp_6-31g+(d).inp 053192256.td-b3lyp_6-31g+(d).log.xz

053192256.td-b3lyp_6-31+g(d).qchem.inp (generated)

053192256.td-b3lyp_6-31+g(d).gjf (generated)

053192256.td-b3lyp_6-31+g(d).firefly.inp (generated)

053192256.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053192256.mol 053192256.PUBCHEM 053192256.mol (via Jmol)
053192491.b3lyp_6-31g(d).inp

053192491.b3lyp_6-31g(d).qchem.inp (generated)

053192491.b3lyp_6-31g(d).gjf (generated)

053192491.b3lyp_6-31g(d).firefly.inp (generated)

053192491.b3lyp_6-31g(d).smash.inp (generated)

053192491.b3lyp_6-31g(d).nwchem.inp (generated) 053192491.b3lyp_6-31g(d).log.xz 053192491.td-b3lyp_6-31g+(d).inp 053192491.td-b3lyp_6-31g+(d).log.xz

053192491.td-b3lyp_6-31+g(d).qchem.inp (generated)

053192491.td-b3lyp_6-31+g(d).gjf (generated)

053192491.td-b3lyp_6-31+g(d).firefly.inp (generated)

053192491.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053192491.mol 053192491.PUBCHEM 053192491.mol (via Jmol)
053192546.b3lyp_6-31g(d).inp

053192546.b3lyp_6-31g(d).qchem.inp (generated)

053192546.b3lyp_6-31g(d).gjf (generated)

053192546.b3lyp_6-31g(d).firefly.inp (generated)

053192546.b3lyp_6-31g(d).smash.inp (generated)

053192546.b3lyp_6-31g(d).nwchem.inp (generated) 053192546.b3lyp_6-31g(d).log.xz 053192546.td-b3lyp_6-31g+(d).inp 053192546.td-b3lyp_6-31g+(d).log.xz

053192546.td-b3lyp_6-31+g(d).qchem.inp (generated)

053192546.td-b3lyp_6-31+g(d).gjf (generated)

053192546.td-b3lyp_6-31+g(d).firefly.inp (generated)

053192546.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053192546.mol 053192546.PUBCHEM 053192546.mol (via Jmol)
053192751.b3lyp_6-31g(d).inp

053192751.b3lyp_6-31g(d).qchem.inp (generated)

053192751.b3lyp_6-31g(d).gjf (generated)

053192751.b3lyp_6-31g(d).firefly.inp (generated)

053192751.b3lyp_6-31g(d).smash.inp (generated)

053192751.b3lyp_6-31g(d).nwchem.inp (generated) 053192751.b3lyp_6-31g(d).log.xz 053192751.td-b3lyp_6-31g+(d).inp 053192751.td-b3lyp_6-31g+(d).log.xz

053192751.td-b3lyp_6-31+g(d).qchem.inp (generated)

053192751.td-b3lyp_6-31+g(d).gjf (generated)

053192751.td-b3lyp_6-31+g(d).firefly.inp (generated)

053192751.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053192751.mol 053192751.PUBCHEM 053192751.mol (via Jmol)
053192839.b3lyp_6-31g(d).inp

053192839.b3lyp_6-31g(d).qchem.inp (generated)

053192839.b3lyp_6-31g(d).gjf (generated)

053192839.b3lyp_6-31g(d).firefly.inp (generated)

053192839.b3lyp_6-31g(d).smash.inp (generated)

053192839.b3lyp_6-31g(d).nwchem.inp (generated) 053192839.b3lyp_6-31g(d).log.xz 053192839.mol 053192839.PUBCHEM 053192839.mol (via Jmol)
053192843.b3lyp_6-31g(d).inp

053192843.b3lyp_6-31g(d).qchem.inp (generated)

053192843.b3lyp_6-31g(d).gjf (generated)

053192843.b3lyp_6-31g(d).firefly.inp (generated)

053192843.b3lyp_6-31g(d).smash.inp (generated)

053192843.b3lyp_6-31g(d).nwchem.inp (generated) 053192843.b3lyp_6-31g(d).log.xz 053192843.td-b3lyp_6-31g+(d).inp 053192843.td-b3lyp_6-31g+(d).log.xz

053192843.td-b3lyp_6-31+g(d).qchem.inp (generated)

053192843.td-b3lyp_6-31+g(d).gjf (generated)

053192843.td-b3lyp_6-31+g(d).firefly.inp (generated)

053192843.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053192843.mol 053192843.PUBCHEM 053192843.mol (via Jmol)
053192844.b3lyp_6-31g(d).inp

053192844.b3lyp_6-31g(d).qchem.inp (generated)

053192844.b3lyp_6-31g(d).gjf (generated)

053192844.b3lyp_6-31g(d).firefly.inp (generated)

053192844.b3lyp_6-31g(d).smash.inp (generated)

053192844.b3lyp_6-31g(d).nwchem.inp (generated) 053192844.b3lyp_6-31g(d).log.xz 053192844.mol 053192844.PUBCHEM 053192844.mol (via Jmol)
053192845.b3lyp_6-31g(d).inp

053192845.b3lyp_6-31g(d).qchem.inp (generated)

053192845.b3lyp_6-31g(d).gjf (generated)

053192845.b3lyp_6-31g(d).firefly.inp (generated)

053192845.b3lyp_6-31g(d).smash.inp (generated)

053192845.b3lyp_6-31g(d).nwchem.inp (generated) 053192845.b3lyp_6-31g(d).log.xz 053192845.mol 053192845.PUBCHEM 053192845.mol (via Jmol)
053192846.b3lyp_6-31g(d).inp

053192846.b3lyp_6-31g(d).qchem.inp (generated)

053192846.b3lyp_6-31g(d).gjf (generated)

053192846.b3lyp_6-31g(d).firefly.inp (generated)

053192846.b3lyp_6-31g(d).smash.inp (generated)

053192846.b3lyp_6-31g(d).nwchem.inp (generated) 053192846.b3lyp_6-31g(d).log.xz 053192846.mol 053192846.PUBCHEM 053192846.mol (via Jmol)
053192848.b3lyp_6-31g(d).inp

053192848.b3lyp_6-31g(d).qchem.inp (generated)

053192848.b3lyp_6-31g(d).gjf (generated)

053192848.b3lyp_6-31g(d).firefly.inp (generated)

053192848.b3lyp_6-31g(d).smash.inp (generated)

053192848.b3lyp_6-31g(d).nwchem.inp (generated) 053192848.b3lyp_6-31g(d).log.xz 053192848.td-b3lyp_6-31g+(d).inp 053192848.td-b3lyp_6-31g+(d).log.xz

053192848.td-b3lyp_6-31+g(d).qchem.inp (generated)

053192848.td-b3lyp_6-31+g(d).gjf (generated)

053192848.td-b3lyp_6-31+g(d).firefly.inp (generated)

053192848.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053192848.mol 053192848.PUBCHEM 053192848.mol (via Jmol)
053192850.b3lyp_6-31g(d).inp

053192850.b3lyp_6-31g(d).qchem.inp (generated)

053192850.b3lyp_6-31g(d).gjf (generated)

053192850.b3lyp_6-31g(d).firefly.inp (generated)

053192850.b3lyp_6-31g(d).smash.inp (generated)

053192850.b3lyp_6-31g(d).nwchem.inp (generated) 053192850.b3lyp_6-31g(d).log.xz 053192850.td-b3lyp_6-31g+(d).inp 053192850.td-b3lyp_6-31g+(d).log.xz

053192850.td-b3lyp_6-31+g(d).qchem.inp (generated)

053192850.td-b3lyp_6-31+g(d).gjf (generated)

053192850.td-b3lyp_6-31+g(d).firefly.inp (generated)

053192850.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053192850.mol 053192850.PUBCHEM 053192850.mol (via Jmol)
053192857.b3lyp_6-31g(d).inp

053192857.b3lyp_6-31g(d).qchem.inp (generated)

053192857.b3lyp_6-31g(d).gjf (generated)

053192857.b3lyp_6-31g(d).firefly.inp (generated)

053192857.b3lyp_6-31g(d).smash.inp (generated)

053192857.b3lyp_6-31g(d).nwchem.inp (generated) 053192857.b3lyp_6-31g(d).log.xz 053192857.td-b3lyp_6-31g+(d).inp 053192857.td-b3lyp_6-31g+(d).log.xz

053192857.td-b3lyp_6-31+g(d).qchem.inp (generated)

053192857.td-b3lyp_6-31+g(d).gjf (generated)

053192857.td-b3lyp_6-31+g(d).firefly.inp (generated)

053192857.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053192857.mol 053192857.PUBCHEM 053192857.mol (via Jmol)
053192861.b3lyp_6-31g(d).inp

053192861.b3lyp_6-31g(d).qchem.inp (generated)

053192861.b3lyp_6-31g(d).gjf (generated)

053192861.b3lyp_6-31g(d).firefly.inp (generated)

053192861.b3lyp_6-31g(d).smash.inp (generated)

053192861.b3lyp_6-31g(d).nwchem.inp (generated) 053192861.b3lyp_6-31g(d).log.xz 053192861.mol 053192861.PUBCHEM 053192861.mol (via Jmol)
053192863.b3lyp_6-31g(d).inp

053192863.b3lyp_6-31g(d).qchem.inp (generated)

053192863.b3lyp_6-31g(d).gjf (generated)

053192863.b3lyp_6-31g(d).firefly.inp (generated)

053192863.b3lyp_6-31g(d).smash.inp (generated)

053192863.b3lyp_6-31g(d).nwchem.inp (generated) 053192863.b3lyp_6-31g(d).log.xz 053192863.td-b3lyp_6-31g+(d).inp 053192863.td-b3lyp_6-31g+(d).log.xz

053192863.td-b3lyp_6-31+g(d).qchem.inp (generated)

053192863.td-b3lyp_6-31+g(d).gjf (generated)

053192863.td-b3lyp_6-31+g(d).firefly.inp (generated)

053192863.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053192863.mol 053192863.PUBCHEM 053192863.mol (via Jmol)
053192871.b3lyp_6-31g(d).inp

053192871.b3lyp_6-31g(d).qchem.inp (generated)

053192871.b3lyp_6-31g(d).gjf (generated)

053192871.b3lyp_6-31g(d).firefly.inp (generated)

053192871.b3lyp_6-31g(d).smash.inp (generated)

053192871.b3lyp_6-31g(d).nwchem.inp (generated) 053192871.b3lyp_6-31g(d).log.xz 053192871.mol 053192871.PUBCHEM 053192871.mol (via Jmol)
053192872.b3lyp_6-31g(d).inp

053192872.b3lyp_6-31g(d).qchem.inp (generated)

053192872.b3lyp_6-31g(d).gjf (generated)

053192872.b3lyp_6-31g(d).firefly.inp (generated)

053192872.b3lyp_6-31g(d).smash.inp (generated)

053192872.b3lyp_6-31g(d).nwchem.inp (generated) 053192872.b3lyp_6-31g(d).log.xz 053192872.td-b3lyp_6-31g+(d).inp 053192872.td-b3lyp_6-31g+(d).log.xz

053192872.td-b3lyp_6-31+g(d).qchem.inp (generated)

053192872.td-b3lyp_6-31+g(d).gjf (generated)

053192872.td-b3lyp_6-31+g(d).firefly.inp (generated)

053192872.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053192872.mol 053192872.PUBCHEM 053192872.mol (via Jmol)
053192873.b3lyp_6-31g(d).inp

053192873.b3lyp_6-31g(d).qchem.inp (generated)

053192873.b3lyp_6-31g(d).gjf (generated)

053192873.b3lyp_6-31g(d).firefly.inp (generated)

053192873.b3lyp_6-31g(d).smash.inp (generated)

053192873.b3lyp_6-31g(d).nwchem.inp (generated) 053192873.b3lyp_6-31g(d).log.xz 053192873.td-b3lyp_6-31g+(d).inp 053192873.td-b3lyp_6-31g+(d).log.xz

053192873.td-b3lyp_6-31+g(d).qchem.inp (generated)

053192873.td-b3lyp_6-31+g(d).gjf (generated)

053192873.td-b3lyp_6-31+g(d).firefly.inp (generated)

053192873.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053192873.mol 053192873.PUBCHEM 053192873.mol (via Jmol)
053192877.b3lyp_6-31g(d).inp

053192877.b3lyp_6-31g(d).qchem.inp (generated)

053192877.b3lyp_6-31g(d).gjf (generated)

053192877.b3lyp_6-31g(d).firefly.inp (generated)

053192877.b3lyp_6-31g(d).smash.inp (generated)

053192877.b3lyp_6-31g(d).nwchem.inp (generated) 053192877.b3lyp_6-31g(d).log.xz 053192877.td-b3lyp_6-31g+(d).inp 053192877.td-b3lyp_6-31g+(d).log.xz

053192877.td-b3lyp_6-31+g(d).qchem.inp (generated)

053192877.td-b3lyp_6-31+g(d).gjf (generated)

053192877.td-b3lyp_6-31+g(d).firefly.inp (generated)

053192877.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053192877.mol 053192877.PUBCHEM 053192877.mol (via Jmol)
053192878.b3lyp_6-31g(d).inp

053192878.b3lyp_6-31g(d).qchem.inp (generated)

053192878.b3lyp_6-31g(d).gjf (generated)

053192878.b3lyp_6-31g(d).firefly.inp (generated)

053192878.b3lyp_6-31g(d).smash.inp (generated)

053192878.b3lyp_6-31g(d).nwchem.inp (generated) 053192878.b3lyp_6-31g(d).log.xz 053192878.td-b3lyp_6-31g+(d).inp 053192878.td-b3lyp_6-31g+(d).log.xz

053192878.td-b3lyp_6-31+g(d).qchem.inp (generated)

053192878.td-b3lyp_6-31+g(d).gjf (generated)

053192878.td-b3lyp_6-31+g(d).firefly.inp (generated)

053192878.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053192878.mol 053192878.PUBCHEM 053192878.mol (via Jmol)
053192882.b3lyp_6-31g(d).inp

053192882.b3lyp_6-31g(d).qchem.inp (generated)

053192882.b3lyp_6-31g(d).gjf (generated)

053192882.b3lyp_6-31g(d).firefly.inp (generated)

053192882.b3lyp_6-31g(d).smash.inp (generated)

053192882.b3lyp_6-31g(d).nwchem.inp (generated) 053192882.b3lyp_6-31g(d).log.xz 053192882.td-b3lyp_6-31g+(d).inp 053192882.td-b3lyp_6-31g+(d).log.xz

053192882.td-b3lyp_6-31+g(d).qchem.inp (generated)

053192882.td-b3lyp_6-31+g(d).gjf (generated)

053192882.td-b3lyp_6-31+g(d).firefly.inp (generated)

053192882.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053192882.mol 053192882.PUBCHEM 053192882.mol (via Jmol)
053192883.b3lyp_6-31g(d).inp

053192883.b3lyp_6-31g(d).qchem.inp (generated)

053192883.b3lyp_6-31g(d).gjf (generated)

053192883.b3lyp_6-31g(d).firefly.inp (generated)

053192883.b3lyp_6-31g(d).smash.inp (generated)

053192883.b3lyp_6-31g(d).nwchem.inp (generated) 053192883.b3lyp_6-31g(d).log.xz 053192883.td-b3lyp_6-31g+(d).inp 053192883.td-b3lyp_6-31g+(d).log.xz

053192883.td-b3lyp_6-31+g(d).qchem.inp (generated)

053192883.td-b3lyp_6-31+g(d).gjf (generated)

053192883.td-b3lyp_6-31+g(d).firefly.inp (generated)

053192883.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053192883.mol 053192883.PUBCHEM 053192883.mol (via Jmol)
053192885.b3lyp_6-31g(d).inp

053192885.b3lyp_6-31g(d).qchem.inp (generated)

053192885.b3lyp_6-31g(d).gjf (generated)

053192885.b3lyp_6-31g(d).firefly.inp (generated)

053192885.b3lyp_6-31g(d).smash.inp (generated)

053192885.b3lyp_6-31g(d).nwchem.inp (generated) 053192885.b3lyp_6-31g(d).log.xz 053192885.td-b3lyp_6-31g+(d).inp 053192885.td-b3lyp_6-31g+(d).log.xz

053192885.td-b3lyp_6-31+g(d).qchem.inp (generated)

053192885.td-b3lyp_6-31+g(d).gjf (generated)

053192885.td-b3lyp_6-31+g(d).firefly.inp (generated)

053192885.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053192885.mol 053192885.PUBCHEM 053192885.mol (via Jmol)
053192894.b3lyp_6-31g(d).inp

053192894.b3lyp_6-31g(d).qchem.inp (generated)

053192894.b3lyp_6-31g(d).gjf (generated)

053192894.b3lyp_6-31g(d).firefly.inp (generated)

053192894.b3lyp_6-31g(d).smash.inp (generated)

053192894.b3lyp_6-31g(d).nwchem.inp (generated) 053192894.b3lyp_6-31g(d).log.xz 053192894.td-b3lyp_6-31g+(d).inp 053192894.td-b3lyp_6-31g+(d).log.xz

053192894.td-b3lyp_6-31+g(d).qchem.inp (generated)

053192894.td-b3lyp_6-31+g(d).gjf (generated)

053192894.td-b3lyp_6-31+g(d).firefly.inp (generated)

053192894.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053192894.mol 053192894.PUBCHEM 053192894.mol (via Jmol)
053193029.b3lyp_6-31g(d).inp

053193029.b3lyp_6-31g(d).qchem.inp (generated)

053193029.b3lyp_6-31g(d).gjf (generated)

053193029.b3lyp_6-31g(d).firefly.inp (generated)

053193029.b3lyp_6-31g(d).smash.inp (generated)

053193029.b3lyp_6-31g(d).nwchem.inp (generated) 053193029.b3lyp_6-31g(d).log.xz 053193029.td-b3lyp_6-31g+(d).inp 053193029.td-b3lyp_6-31g+(d).log.xz

053193029.td-b3lyp_6-31+g(d).qchem.inp (generated)

053193029.td-b3lyp_6-31+g(d).gjf (generated)

053193029.td-b3lyp_6-31+g(d).firefly.inp (generated)

053193029.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053193029.mol 053193029.PUBCHEM 053193029.mol (via Jmol)
053193095.b3lyp_6-31g(d).inp

053193095.b3lyp_6-31g(d).qchem.inp (generated)

053193095.b3lyp_6-31g(d).gjf (generated)

053193095.b3lyp_6-31g(d).firefly.inp (generated)

053193095.b3lyp_6-31g(d).smash.inp (generated)

053193095.b3lyp_6-31g(d).nwchem.inp (generated) 053193095.b3lyp_6-31g(d).log.xz 053193095.mol 053193095.PUBCHEM 053193095.mol (via Jmol)
053193096.b3lyp_6-31g(d).inp

053193096.b3lyp_6-31g(d).qchem.inp (generated)

053193096.b3lyp_6-31g(d).gjf (generated)

053193096.b3lyp_6-31g(d).firefly.inp (generated)

053193096.b3lyp_6-31g(d).smash.inp (generated)

053193096.b3lyp_6-31g(d).nwchem.inp (generated) 053193096.b3lyp_6-31g(d).log.xz 053193096.td-b3lyp_6-31g+(d).inp 053193096.td-b3lyp_6-31g+(d).log.xz

053193096.td-b3lyp_6-31+g(d).qchem.inp (generated)

053193096.td-b3lyp_6-31+g(d).gjf (generated)

053193096.td-b3lyp_6-31+g(d).firefly.inp (generated)

053193096.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053193096.mol 053193096.PUBCHEM 053193096.mol (via Jmol)
053193099.b3lyp_6-31g(d).inp

053193099.b3lyp_6-31g(d).qchem.inp (generated)

053193099.b3lyp_6-31g(d).gjf (generated)

053193099.b3lyp_6-31g(d).firefly.inp (generated)

053193099.b3lyp_6-31g(d).smash.inp (generated)

053193099.b3lyp_6-31g(d).nwchem.inp (generated) 053193099.b3lyp_6-31g(d).log.xz 053193099.td-b3lyp_6-31g+(d).inp 053193099.td-b3lyp_6-31g+(d).log.xz

053193099.td-b3lyp_6-31+g(d).qchem.inp (generated)

053193099.td-b3lyp_6-31+g(d).gjf (generated)

053193099.td-b3lyp_6-31+g(d).firefly.inp (generated)

053193099.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053193099.mol 053193099.PUBCHEM 053193099.mol (via Jmol)
053193103.b3lyp_6-31g(d).inp

053193103.b3lyp_6-31g(d).qchem.inp (generated)

053193103.b3lyp_6-31g(d).gjf (generated)

053193103.b3lyp_6-31g(d).firefly.inp (generated)

053193103.b3lyp_6-31g(d).smash.inp (generated)

053193103.b3lyp_6-31g(d).nwchem.inp (generated) 053193103.b3lyp_6-31g(d).log.xz 053193103.mol 053193103.PUBCHEM 053193103.mol (via Jmol)
053193107.b3lyp_6-31g(d).inp

053193107.b3lyp_6-31g(d).qchem.inp (generated)

053193107.b3lyp_6-31g(d).gjf (generated)

053193107.b3lyp_6-31g(d).firefly.inp (generated)

053193107.b3lyp_6-31g(d).smash.inp (generated)

053193107.b3lyp_6-31g(d).nwchem.inp (generated) 053193107.b3lyp_6-31g(d).log.xz 053193107.td-b3lyp_6-31g+(d).inp 053193107.td-b3lyp_6-31g+(d).log.xz

053193107.td-b3lyp_6-31+g(d).qchem.inp (generated)

053193107.td-b3lyp_6-31+g(d).gjf (generated)

053193107.td-b3lyp_6-31+g(d).firefly.inp (generated)

053193107.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053193107.mol 053193107.PUBCHEM 053193107.mol (via Jmol)
053193110.b3lyp_6-31g(d).inp

053193110.b3lyp_6-31g(d).qchem.inp (generated)

053193110.b3lyp_6-31g(d).gjf (generated)

053193110.b3lyp_6-31g(d).firefly.inp (generated)

053193110.b3lyp_6-31g(d).smash.inp (generated)

053193110.b3lyp_6-31g(d).nwchem.inp (generated) 053193110.b3lyp_6-31g(d).log.xz 053193110.td-b3lyp_6-31g+(d).inp 053193110.td-b3lyp_6-31g+(d).log.xz

053193110.td-b3lyp_6-31+g(d).qchem.inp (generated)

053193110.td-b3lyp_6-31+g(d).gjf (generated)

053193110.td-b3lyp_6-31+g(d).firefly.inp (generated)

053193110.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053193110.mol 053193110.PUBCHEM 053193110.mol (via Jmol)
053193117.b3lyp_6-31g(d).inp

053193117.b3lyp_6-31g(d).qchem.inp (generated)

053193117.b3lyp_6-31g(d).gjf (generated)

053193117.b3lyp_6-31g(d).firefly.inp (generated)

053193117.b3lyp_6-31g(d).smash.inp (generated)

053193117.b3lyp_6-31g(d).nwchem.inp (generated) 053193117.b3lyp_6-31g(d).log.xz 053193117.td-b3lyp_6-31g+(d).inp 053193117.td-b3lyp_6-31g+(d).log.xz

053193117.td-b3lyp_6-31+g(d).qchem.inp (generated)

053193117.td-b3lyp_6-31+g(d).gjf (generated)

053193117.td-b3lyp_6-31+g(d).firefly.inp (generated)

053193117.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053193117.mol 053193117.PUBCHEM 053193117.mol (via Jmol)
053193120.b3lyp_6-31g(d).inp

053193120.b3lyp_6-31g(d).qchem.inp (generated)

053193120.b3lyp_6-31g(d).gjf (generated)

053193120.b3lyp_6-31g(d).firefly.inp (generated)

053193120.b3lyp_6-31g(d).smash.inp (generated)

053193120.b3lyp_6-31g(d).nwchem.inp (generated) 053193120.b3lyp_6-31g(d).log.xz 053193120.td-b3lyp_6-31g+(d).inp 053193120.td-b3lyp_6-31g+(d).log.xz

053193120.td-b3lyp_6-31+g(d).qchem.inp (generated)

053193120.td-b3lyp_6-31+g(d).gjf (generated)

053193120.td-b3lyp_6-31+g(d).firefly.inp (generated)

053193120.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053193120.mol 053193120.PUBCHEM 053193120.mol (via Jmol)
053193127.b3lyp_6-31g(d).inp

053193127.b3lyp_6-31g(d).qchem.inp (generated)

053193127.b3lyp_6-31g(d).gjf (generated)

053193127.b3lyp_6-31g(d).firefly.inp (generated)

053193127.b3lyp_6-31g(d).smash.inp (generated)

053193127.b3lyp_6-31g(d).nwchem.inp (generated) 053193127.b3lyp_6-31g(d).log.xz 053193127.mol 053193127.PUBCHEM 053193127.mol (via Jmol)
053193141.b3lyp_6-31g(d).inp

053193141.b3lyp_6-31g(d).qchem.inp (generated)

053193141.b3lyp_6-31g(d).gjf (generated)

053193141.b3lyp_6-31g(d).firefly.inp (generated)

053193141.b3lyp_6-31g(d).smash.inp (generated)

053193141.b3lyp_6-31g(d).nwchem.inp (generated) 053193141.b3lyp_6-31g(d).log.xz 053193141.td-b3lyp_6-31g+(d).inp 053193141.td-b3lyp_6-31g+(d).log.xz

053193141.td-b3lyp_6-31+g(d).qchem.inp (generated)

053193141.td-b3lyp_6-31+g(d).gjf (generated)

053193141.td-b3lyp_6-31+g(d).firefly.inp (generated)

053193141.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053193141.mol 053193141.PUBCHEM 053193141.mol (via Jmol)
053193144.b3lyp_6-31g(d).inp

053193144.b3lyp_6-31g(d).qchem.inp (generated)

053193144.b3lyp_6-31g(d).gjf (generated)

053193144.b3lyp_6-31g(d).firefly.inp (generated)

053193144.b3lyp_6-31g(d).smash.inp (generated)

053193144.b3lyp_6-31g(d).nwchem.inp (generated) 053193144.b3lyp_6-31g(d).log.xz 053193144.mol 053193144.PUBCHEM 053193144.mol (via Jmol)
053193146.b3lyp_6-31g(d).inp

053193146.b3lyp_6-31g(d).qchem.inp (generated)

053193146.b3lyp_6-31g(d).gjf (generated)

053193146.b3lyp_6-31g(d).firefly.inp (generated)

053193146.b3lyp_6-31g(d).smash.inp (generated)

053193146.b3lyp_6-31g(d).nwchem.inp (generated) 053193146.b3lyp_6-31g(d).log.xz 053193146.mol 053193146.PUBCHEM 053193146.mol (via Jmol)
053193164.b3lyp_6-31g(d).inp

053193164.b3lyp_6-31g(d).qchem.inp (generated)

053193164.b3lyp_6-31g(d).gjf (generated)

053193164.b3lyp_6-31g(d).firefly.inp (generated)

053193164.b3lyp_6-31g(d).smash.inp (generated)

053193164.b3lyp_6-31g(d).nwchem.inp (generated) 053193164.b3lyp_6-31g(d).log.xz 053193164.td-b3lyp_6-31g+(d).inp 053193164.td-b3lyp_6-31g+(d).log.xz

053193164.td-b3lyp_6-31+g(d).qchem.inp (generated)

053193164.td-b3lyp_6-31+g(d).gjf (generated)

053193164.td-b3lyp_6-31+g(d).firefly.inp (generated)

053193164.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053193164.mol 053193164.PUBCHEM 053193164.mol (via Jmol)
053193193.b3lyp_6-31g(d).inp

053193193.b3lyp_6-31g(d).qchem.inp (generated)

053193193.b3lyp_6-31g(d).gjf (generated)

053193193.b3lyp_6-31g(d).firefly.inp (generated)

053193193.b3lyp_6-31g(d).smash.inp (generated)

053193193.b3lyp_6-31g(d).nwchem.inp (generated) 053193193.b3lyp_6-31g(d).log.xz 053193193.td-b3lyp_6-31g+(d).inp 053193193.td-b3lyp_6-31g+(d).log.xz

053193193.td-b3lyp_6-31+g(d).qchem.inp (generated)

053193193.td-b3lyp_6-31+g(d).gjf (generated)

053193193.td-b3lyp_6-31+g(d).firefly.inp (generated)

053193193.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053193193.mol 053193193.PUBCHEM 053193193.mol (via Jmol)
053193197.b3lyp_6-31g(d).inp

053193197.b3lyp_6-31g(d).qchem.inp (generated)

053193197.b3lyp_6-31g(d).gjf (generated)

053193197.b3lyp_6-31g(d).firefly.inp (generated)

053193197.b3lyp_6-31g(d).smash.inp (generated)

053193197.b3lyp_6-31g(d).nwchem.inp (generated) 053193197.b3lyp_6-31g(d).log.xz 053193197.mol 053193197.PUBCHEM 053193197.mol (via Jmol)
053193198.b3lyp_6-31g(d).inp

053193198.b3lyp_6-31g(d).qchem.inp (generated)

053193198.b3lyp_6-31g(d).gjf (generated)

053193198.b3lyp_6-31g(d).firefly.inp (generated)

053193198.b3lyp_6-31g(d).smash.inp (generated)

053193198.b3lyp_6-31g(d).nwchem.inp (generated) 053193198.b3lyp_6-31g(d).log.xz 053193198.mol 053193198.PUBCHEM 053193198.mol (via Jmol)
053193212.b3lyp_6-31g(d).inp

053193212.b3lyp_6-31g(d).qchem.inp (generated)

053193212.b3lyp_6-31g(d).gjf (generated)

053193212.b3lyp_6-31g(d).firefly.inp (generated)

053193212.b3lyp_6-31g(d).smash.inp (generated)

053193212.b3lyp_6-31g(d).nwchem.inp (generated) 053193212.b3lyp_6-31g(d).log.xz 053193212.mol 053193212.PUBCHEM 053193212.mol (via Jmol)
053193213.b3lyp_6-31g(d).inp

053193213.b3lyp_6-31g(d).qchem.inp (generated)

053193213.b3lyp_6-31g(d).gjf (generated)

053193213.b3lyp_6-31g(d).firefly.inp (generated)

053193213.b3lyp_6-31g(d).smash.inp (generated)

053193213.b3lyp_6-31g(d).nwchem.inp (generated) 053193213.b3lyp_6-31g(d).log.xz 053193213.mol 053193213.PUBCHEM 053193213.mol (via Jmol)
053193222.b3lyp_6-31g(d).inp

053193222.b3lyp_6-31g(d).qchem.inp (generated)

053193222.b3lyp_6-31g(d).gjf (generated)

053193222.b3lyp_6-31g(d).firefly.inp (generated)

053193222.b3lyp_6-31g(d).smash.inp (generated)

053193222.b3lyp_6-31g(d).nwchem.inp (generated) 053193222.b3lyp_6-31g(d).log.xz 053193222.td-b3lyp_6-31g+(d).inp 053193222.td-b3lyp_6-31g+(d).log.xz

053193222.td-b3lyp_6-31+g(d).qchem.inp (generated)

053193222.td-b3lyp_6-31+g(d).gjf (generated)

053193222.td-b3lyp_6-31+g(d).firefly.inp (generated)

053193222.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053193222.mol 053193222.PUBCHEM 053193222.mol (via Jmol)
053193229.b3lyp_6-31g(d).inp

053193229.b3lyp_6-31g(d).qchem.inp (generated)

053193229.b3lyp_6-31g(d).gjf (generated)

053193229.b3lyp_6-31g(d).firefly.inp (generated)

053193229.b3lyp_6-31g(d).smash.inp (generated)

053193229.b3lyp_6-31g(d).nwchem.inp (generated) 053193229.b3lyp_6-31g(d).log.xz 053193229.td-b3lyp_6-31g+(d).inp 053193229.td-b3lyp_6-31g+(d).log.xz

053193229.td-b3lyp_6-31+g(d).qchem.inp (generated)

053193229.td-b3lyp_6-31+g(d).gjf (generated)

053193229.td-b3lyp_6-31+g(d).firefly.inp (generated)

053193229.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053193229.mol 053193229.PUBCHEM 053193229.mol (via Jmol)
053193264.b3lyp_6-31g(d).inp

053193264.b3lyp_6-31g(d).qchem.inp (generated)

053193264.b3lyp_6-31g(d).gjf (generated)

053193264.b3lyp_6-31g(d).firefly.inp (generated)

053193264.b3lyp_6-31g(d).smash.inp (generated)

053193264.b3lyp_6-31g(d).nwchem.inp (generated) 053193264.b3lyp_6-31g(d).log.xz 053193264.td-b3lyp_6-31g+(d).inp 053193264.td-b3lyp_6-31g+(d).log.xz

053193264.td-b3lyp_6-31+g(d).qchem.inp (generated)

053193264.td-b3lyp_6-31+g(d).gjf (generated)

053193264.td-b3lyp_6-31+g(d).firefly.inp (generated)

053193264.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053193264.mol 053193264.PUBCHEM 053193264.mol (via Jmol)
053193285.b3lyp_6-31g(d).inp

053193285.b3lyp_6-31g(d).qchem.inp (generated)

053193285.b3lyp_6-31g(d).gjf (generated)

053193285.b3lyp_6-31g(d).firefly.inp (generated)

053193285.b3lyp_6-31g(d).smash.inp (generated)

053193285.b3lyp_6-31g(d).nwchem.inp (generated) 053193285.b3lyp_6-31g(d).log.xz 053193285.td-b3lyp_6-31g+(d).inp 053193285.td-b3lyp_6-31g+(d).log.xz

053193285.td-b3lyp_6-31+g(d).qchem.inp (generated)

053193285.td-b3lyp_6-31+g(d).gjf (generated)

053193285.td-b3lyp_6-31+g(d).firefly.inp (generated)

053193285.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053193285.mol 053193285.PUBCHEM 053193285.mol (via Jmol)
053193288.b3lyp_6-31g(d).inp

053193288.b3lyp_6-31g(d).qchem.inp (generated)

053193288.b3lyp_6-31g(d).gjf (generated)

053193288.b3lyp_6-31g(d).firefly.inp (generated)

053193288.b3lyp_6-31g(d).smash.inp (generated)

053193288.b3lyp_6-31g(d).nwchem.inp (generated) 053193288.b3lyp_6-31g(d).log.xz 053193288.mol 053193288.PUBCHEM 053193288.mol (via Jmol)
053193291.b3lyp_6-31g(d).inp

053193291.b3lyp_6-31g(d).qchem.inp (generated)

053193291.b3lyp_6-31g(d).gjf (generated)

053193291.b3lyp_6-31g(d).firefly.inp (generated)

053193291.b3lyp_6-31g(d).smash.inp (generated)

053193291.b3lyp_6-31g(d).nwchem.inp (generated) 053193291.b3lyp_6-31g(d).log.xz 053193291.td-b3lyp_6-31g+(d).inp 053193291.td-b3lyp_6-31g+(d).log.xz

053193291.td-b3lyp_6-31+g(d).qchem.inp (generated)

053193291.td-b3lyp_6-31+g(d).gjf (generated)

053193291.td-b3lyp_6-31+g(d).firefly.inp (generated)

053193291.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053193291.mol 053193291.PUBCHEM 053193291.mol (via Jmol)
053193292.b3lyp_6-31g(d).inp

053193292.b3lyp_6-31g(d).qchem.inp (generated)

053193292.b3lyp_6-31g(d).gjf (generated)

053193292.b3lyp_6-31g(d).firefly.inp (generated)

053193292.b3lyp_6-31g(d).smash.inp (generated)

053193292.b3lyp_6-31g(d).nwchem.inp (generated) 053193292.b3lyp_6-31g(d).log.xz 053193292.td-b3lyp_6-31g+(d).inp 053193292.td-b3lyp_6-31g+(d).log.xz

053193292.td-b3lyp_6-31+g(d).qchem.inp (generated)

053193292.td-b3lyp_6-31+g(d).gjf (generated)

053193292.td-b3lyp_6-31+g(d).firefly.inp (generated)

053193292.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053193292.mol 053193292.PUBCHEM 053193292.mol (via Jmol)
053193308.b3lyp_6-31g(d).inp

053193308.b3lyp_6-31g(d).qchem.inp (generated)

053193308.b3lyp_6-31g(d).gjf (generated)

053193308.b3lyp_6-31g(d).firefly.inp (generated)

053193308.b3lyp_6-31g(d).smash.inp (generated)

053193308.b3lyp_6-31g(d).nwchem.inp (generated) 053193308.b3lyp_6-31g(d).log.xz 053193308.td-b3lyp_6-31g+(d).inp 053193308.td-b3lyp_6-31g+(d).log.xz

053193308.td-b3lyp_6-31+g(d).qchem.inp (generated)

053193308.td-b3lyp_6-31+g(d).gjf (generated)

053193308.td-b3lyp_6-31+g(d).firefly.inp (generated)

053193308.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053193308.mol 053193308.PUBCHEM 053193308.mol (via Jmol)
053193365.b3lyp_6-31g(d).inp

053193365.b3lyp_6-31g(d).qchem.inp (generated)

053193365.b3lyp_6-31g(d).gjf (generated)

053193365.b3lyp_6-31g(d).firefly.inp (generated)

053193365.b3lyp_6-31g(d).smash.inp (generated)

053193365.b3lyp_6-31g(d).nwchem.inp (generated) 053193365.b3lyp_6-31g(d).log.xz 053193365.td-b3lyp_6-31g+(d).inp 053193365.td-b3lyp_6-31g+(d).log.xz

053193365.td-b3lyp_6-31+g(d).qchem.inp (generated)

053193365.td-b3lyp_6-31+g(d).gjf (generated)

053193365.td-b3lyp_6-31+g(d).firefly.inp (generated)

053193365.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053193365.mol 053193365.PUBCHEM 053193365.mol (via Jmol)
053193460.b3lyp_6-31g(d).inp

053193460.b3lyp_6-31g(d).qchem.inp (generated)

053193460.b3lyp_6-31g(d).gjf (generated)

053193460.b3lyp_6-31g(d).firefly.inp (generated)

053193460.b3lyp_6-31g(d).smash.inp (generated)

053193460.b3lyp_6-31g(d).nwchem.inp (generated) 053193460.b3lyp_6-31g(d).log.xz 053193460.td-b3lyp_6-31g+(d).inp 053193460.td-b3lyp_6-31g+(d).log.xz

053193460.td-b3lyp_6-31+g(d).qchem.inp (generated)

053193460.td-b3lyp_6-31+g(d).gjf (generated)

053193460.td-b3lyp_6-31+g(d).firefly.inp (generated)

053193460.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053193460.mol 053193460.PUBCHEM 053193460.mol (via Jmol)
053193671.b3lyp_6-31g(d).inp

053193671.b3lyp_6-31g(d).qchem.inp (generated)

053193671.b3lyp_6-31g(d).gjf (generated)

053193671.b3lyp_6-31g(d).firefly.inp (generated)

053193671.b3lyp_6-31g(d).smash.inp (generated)

053193671.b3lyp_6-31g(d).nwchem.inp (generated) 053193671.b3lyp_6-31g(d).log.xz 053193671.td-b3lyp_6-31g+(d).inp 053193671.td-b3lyp_6-31g+(d).log.xz

053193671.td-b3lyp_6-31+g(d).qchem.inp (generated)

053193671.td-b3lyp_6-31+g(d).gjf (generated)

053193671.td-b3lyp_6-31+g(d).firefly.inp (generated)

053193671.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053193671.mol 053193671.PUBCHEM 053193671.mol (via Jmol)
053193695.b3lyp_6-31g(d).inp

053193695.b3lyp_6-31g(d).qchem.inp (generated)

053193695.b3lyp_6-31g(d).gjf (generated)

053193695.b3lyp_6-31g(d).firefly.inp (generated)

053193695.b3lyp_6-31g(d).smash.inp (generated)

053193695.b3lyp_6-31g(d).nwchem.inp (generated) 053193695.b3lyp_6-31g(d).log.xz 053193695.td-b3lyp_6-31g+(d).inp 053193695.td-b3lyp_6-31g+(d).log.xz

053193695.td-b3lyp_6-31+g(d).qchem.inp (generated)

053193695.td-b3lyp_6-31+g(d).gjf (generated)

053193695.td-b3lyp_6-31+g(d).firefly.inp (generated)

053193695.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053193695.mol 053193695.PUBCHEM 053193695.mol (via Jmol)
053194914.b3lyp_6-31g(d).inp

053194914.b3lyp_6-31g(d).qchem.inp (generated)

053194914.b3lyp_6-31g(d).gjf (generated)

053194914.b3lyp_6-31g(d).firefly.inp (generated)

053194914.b3lyp_6-31g(d).smash.inp (generated)

053194914.b3lyp_6-31g(d).nwchem.inp (generated) 053194914.b3lyp_6-31g(d).log.xz 053194914.td-b3lyp_6-31g+(d).inp 053194914.td-b3lyp_6-31g+(d).log.xz

053194914.td-b3lyp_6-31+g(d).qchem.inp (generated)

053194914.td-b3lyp_6-31+g(d).gjf (generated)

053194914.td-b3lyp_6-31+g(d).firefly.inp (generated)

053194914.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053194914.mol 053194914.PUBCHEM 053194914.mol (via Jmol)
053194918.b3lyp_6-31g(d).inp

053194918.b3lyp_6-31g(d).qchem.inp (generated)

053194918.b3lyp_6-31g(d).gjf (generated)

053194918.b3lyp_6-31g(d).firefly.inp (generated)

053194918.b3lyp_6-31g(d).smash.inp (generated)

053194918.b3lyp_6-31g(d).nwchem.inp (generated) 053194918.b3lyp_6-31g(d).log.xz 053194918.mol 053194918.PUBCHEM 053194918.mol (via Jmol)
053195125.b3lyp_6-31g(d).inp

053195125.b3lyp_6-31g(d).qchem.inp (generated)

053195125.b3lyp_6-31g(d).gjf (generated)

053195125.b3lyp_6-31g(d).firefly.inp (generated)

053195125.b3lyp_6-31g(d).smash.inp (generated)

053195125.b3lyp_6-31g(d).nwchem.inp (generated) 053195125.b3lyp_6-31g(d).log.xz 053195125.mol 053195125.PUBCHEM 053195125.mol (via Jmol)
053195165.b3lyp_6-31g(d).inp

053195165.b3lyp_6-31g(d).qchem.inp (generated)

053195165.b3lyp_6-31g(d).gjf (generated)

053195165.b3lyp_6-31g(d).firefly.inp (generated)

053195165.b3lyp_6-31g(d).smash.inp (generated)

053195165.b3lyp_6-31g(d).nwchem.inp (generated) 053195165.b3lyp_6-31g(d).log.xz 053195165.td-b3lyp_6-31g+(d).inp 053195165.td-b3lyp_6-31g+(d).log.xz

053195165.td-b3lyp_6-31+g(d).qchem.inp (generated)

053195165.td-b3lyp_6-31+g(d).gjf (generated)

053195165.td-b3lyp_6-31+g(d).firefly.inp (generated)

053195165.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053195165.mol 053195165.PUBCHEM 053195165.mol (via Jmol)
053195178.b3lyp_6-31g(d).inp

053195178.b3lyp_6-31g(d).qchem.inp (generated)

053195178.b3lyp_6-31g(d).gjf (generated)

053195178.b3lyp_6-31g(d).firefly.inp (generated)

053195178.b3lyp_6-31g(d).smash.inp (generated)

053195178.b3lyp_6-31g(d).nwchem.inp (generated) 053195178.b3lyp_6-31g(d).log.xz 053195178.td-b3lyp_6-31g+(d).inp 053195178.td-b3lyp_6-31g+(d).log.xz

053195178.td-b3lyp_6-31+g(d).qchem.inp (generated)

053195178.td-b3lyp_6-31+g(d).gjf (generated)

053195178.td-b3lyp_6-31+g(d).firefly.inp (generated)

053195178.td-b3lyp_6-31+g(d).nwchem.inp (generated) 053195178.mol 053195178.PUBCHEM 053195178.mol (via Jmol)
053198848.b3lyp_6-31g(d).inp

053198848.b3lyp_6-31g(d).qchem.inp (generated)

053198848.b3lyp_6-31g(d).gjf (generated)

053198848.b3lyp_6-31g(d).firefly.inp (generated)

053198848.b3lyp_6-31g(d).smash.inp (generated)

053198848.b3lyp_6-31g(d).nwchem.inp (generated) 053198848.b3lyp_6-31g(d).log.xz 053198848.mol 053198848.PUBCHEM 053198848.mol (via Jmol)


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