Index of

Last updated : Thu Mar 23 01:58:55 JST 2017
Total : 65 (42) in this page
024526018.b3lyp_6-31g(d).inp

024526018.b3lyp_6-31g(d).qchem.inp (generated)

024526018.b3lyp_6-31g(d).gjf (generated)

024526018.b3lyp_6-31g(d).firefly.inp (generated)

024526018.b3lyp_6-31g(d).smash.inp (generated)

024526018.b3lyp_6-31g(d).nwchem.inp (generated) 024526018.b3lyp_6-31g(d).log.xz 024526018.td-b3lyp_6-31g+(d).inp 024526018.td-b3lyp_6-31g+(d).log.xz

024526018.td-b3lyp_6-31+g(d).qchem.inp (generated)

024526018.td-b3lyp_6-31+g(d).gjf (generated)

024526018.td-b3lyp_6-31+g(d).firefly.inp (generated)

024526018.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024526018.mol 024526018.PUBCHEM 024526018.mol (via Jmol)
024526043.b3lyp_6-31g(d).inp

024526043.b3lyp_6-31g(d).qchem.inp (generated)

024526043.b3lyp_6-31g(d).gjf (generated)

024526043.b3lyp_6-31g(d).firefly.inp (generated)

024526043.b3lyp_6-31g(d).smash.inp (generated)

024526043.b3lyp_6-31g(d).nwchem.inp (generated) 024526043.b3lyp_6-31g(d).log.xz 024526043.mol 024526043.PUBCHEM 024526043.mol (via Jmol)
024527275.b3lyp_6-31g(d).inp

024527275.b3lyp_6-31g(d).qchem.inp (generated)

024527275.b3lyp_6-31g(d).gjf (generated)

024527275.b3lyp_6-31g(d).firefly.inp (generated)

024527275.b3lyp_6-31g(d).smash.inp (generated)

024527275.b3lyp_6-31g(d).nwchem.inp (generated) 024527275.b3lyp_6-31g(d).log.xz 024527275.mol 024527275.PUBCHEM 024527275.mol (via Jmol)
024527319.b3lyp_6-31g(d).inp

024527319.b3lyp_6-31g(d).qchem.inp (generated)

024527319.b3lyp_6-31g(d).gjf (generated)

024527319.b3lyp_6-31g(d).firefly.inp (generated)

024527319.b3lyp_6-31g(d).smash.inp (generated)

024527319.b3lyp_6-31g(d).nwchem.inp (generated) 024527319.b3lyp_6-31g(d).log.xz 024527319.td-b3lyp_6-31g+(d).inp 024527319.td-b3lyp_6-31g+(d).log.xz

024527319.td-b3lyp_6-31+g(d).qchem.inp (generated)

024527319.td-b3lyp_6-31+g(d).gjf (generated)

024527319.td-b3lyp_6-31+g(d).firefly.inp (generated)

024527319.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024527319.mol 024527319.PUBCHEM 024527319.mol (via Jmol)
024527499.b3lyp_6-31g(d).inp

024527499.b3lyp_6-31g(d).qchem.inp (generated)

024527499.b3lyp_6-31g(d).gjf (generated)

024527499.b3lyp_6-31g(d).firefly.inp (generated)

024527499.b3lyp_6-31g(d).smash.inp (generated)

024527499.b3lyp_6-31g(d).nwchem.inp (generated) 024527499.b3lyp_6-31g(d).log.xz 024527499.mol 024527499.PUBCHEM 024527499.mol (via Jmol)
024528637.b3lyp_6-31g(d).inp

024528637.b3lyp_6-31g(d).qchem.inp (generated)

024528637.b3lyp_6-31g(d).gjf (generated)

024528637.b3lyp_6-31g(d).firefly.inp (generated)

024528637.b3lyp_6-31g(d).smash.inp (generated)

024528637.b3lyp_6-31g(d).nwchem.inp (generated) 024528637.b3lyp_6-31g(d).log.xz 024528637.mol 024528637.PUBCHEM 024528637.mol (via Jmol)
024528638.b3lyp_6-31g(d).inp

024528638.b3lyp_6-31g(d).qchem.inp (generated)

024528638.b3lyp_6-31g(d).gjf (generated)

024528638.b3lyp_6-31g(d).firefly.inp (generated)

024528638.b3lyp_6-31g(d).smash.inp (generated)

024528638.b3lyp_6-31g(d).nwchem.inp (generated) 024528638.b3lyp_6-31g(d).log.xz 024528638.mol 024528638.PUBCHEM 024528638.mol (via Jmol)
024528640.b3lyp_6-31g(d).inp

024528640.b3lyp_6-31g(d).qchem.inp (generated)

024528640.b3lyp_6-31g(d).gjf (generated)

024528640.b3lyp_6-31g(d).firefly.inp (generated)

024528640.b3lyp_6-31g(d).smash.inp (generated)

024528640.b3lyp_6-31g(d).nwchem.inp (generated) 024528640.b3lyp_6-31g(d).log.xz 024528640.td-b3lyp_6-31g+(d).inp 024528640.td-b3lyp_6-31g+(d).log.xz

024528640.td-b3lyp_6-31+g(d).qchem.inp (generated)

024528640.td-b3lyp_6-31+g(d).gjf (generated)

024528640.td-b3lyp_6-31+g(d).firefly.inp (generated)

024528640.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024528640.mol 024528640.PUBCHEM 024528640.mol (via Jmol)
024528665.b3lyp_6-31g(d).inp

024528665.b3lyp_6-31g(d).qchem.inp (generated)

024528665.b3lyp_6-31g(d).gjf (generated)

024528665.b3lyp_6-31g(d).firefly.inp (generated)

024528665.b3lyp_6-31g(d).smash.inp (generated)

024528665.b3lyp_6-31g(d).nwchem.inp (generated) 024528665.b3lyp_6-31g(d).log.xz 024528665.mol 024528665.PUBCHEM 024528665.mol (via Jmol)
024528668.b3lyp_6-31g(d).inp

024528668.b3lyp_6-31g(d).qchem.inp (generated)

024528668.b3lyp_6-31g(d).gjf (generated)

024528668.b3lyp_6-31g(d).firefly.inp (generated)

024528668.b3lyp_6-31g(d).smash.inp (generated)

024528668.b3lyp_6-31g(d).nwchem.inp (generated) 024528668.b3lyp_6-31g(d).log.xz 024528668.mol 024528668.PUBCHEM 024528668.mol (via Jmol)
024528720.b3lyp_6-31g(d).inp

024528720.b3lyp_6-31g(d).qchem.inp (generated)

024528720.b3lyp_6-31g(d).gjf (generated)

024528720.b3lyp_6-31g(d).firefly.inp (generated)

024528720.b3lyp_6-31g(d).smash.inp (generated)

024528720.b3lyp_6-31g(d).nwchem.inp (generated) 024528720.b3lyp_6-31g(d).log.xz 024528720.mol 024528720.PUBCHEM 024528720.mol (via Jmol)
024528724.b3lyp_6-31g(d).inp

024528724.b3lyp_6-31g(d).qchem.inp (generated)

024528724.b3lyp_6-31g(d).gjf (generated)

024528724.b3lyp_6-31g(d).firefly.inp (generated)

024528724.b3lyp_6-31g(d).smash.inp (generated)

024528724.b3lyp_6-31g(d).nwchem.inp (generated) 024528724.b3lyp_6-31g(d).log.xz 024528724.td-b3lyp_6-31g+(d).inp 024528724.td-b3lyp_6-31g+(d).log.xz

024528724.td-b3lyp_6-31+g(d).qchem.inp (generated)

024528724.td-b3lyp_6-31+g(d).gjf (generated)

024528724.td-b3lyp_6-31+g(d).firefly.inp (generated)

024528724.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024528724.mol 024528724.PUBCHEM 024528724.mol (via Jmol)
024528725.b3lyp_6-31g(d).inp

024528725.b3lyp_6-31g(d).qchem.inp (generated)

024528725.b3lyp_6-31g(d).gjf (generated)

024528725.b3lyp_6-31g(d).firefly.inp (generated)

024528725.b3lyp_6-31g(d).smash.inp (generated)

024528725.b3lyp_6-31g(d).nwchem.inp (generated) 024528725.b3lyp_6-31g(d).log.xz 024528725.mol 024528725.PUBCHEM 024528725.mol (via Jmol)
024528775.b3lyp_6-31g(d).inp

024528775.b3lyp_6-31g(d).qchem.inp (generated)

024528775.b3lyp_6-31g(d).gjf (generated)

024528775.b3lyp_6-31g(d).firefly.inp (generated)

024528775.b3lyp_6-31g(d).smash.inp (generated)

024528775.b3lyp_6-31g(d).nwchem.inp (generated) 024528775.b3lyp_6-31g(d).log.xz 024528775.td-b3lyp_6-31g+(d).inp 024528775.td-b3lyp_6-31g+(d).log.xz

024528775.td-b3lyp_6-31+g(d).qchem.inp (generated)

024528775.td-b3lyp_6-31+g(d).gjf (generated)

024528775.td-b3lyp_6-31+g(d).firefly.inp (generated)

024528775.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024528775.mol 024528775.PUBCHEM 024528775.mol (via Jmol)
024528786.b3lyp_6-31g(d).inp

024528786.b3lyp_6-31g(d).qchem.inp (generated)

024528786.b3lyp_6-31g(d).gjf (generated)

024528786.b3lyp_6-31g(d).firefly.inp (generated)

024528786.b3lyp_6-31g(d).smash.inp (generated)

024528786.b3lyp_6-31g(d).nwchem.inp (generated) 024528786.b3lyp_6-31g(d).log.xz 024528786.td-b3lyp_6-31g+(d).inp 024528786.td-b3lyp_6-31g+(d).log.xz

024528786.td-b3lyp_6-31+g(d).qchem.inp (generated)

024528786.td-b3lyp_6-31+g(d).gjf (generated)

024528786.td-b3lyp_6-31+g(d).firefly.inp (generated)

024528786.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024528786.mol 024528786.PUBCHEM 024528786.mol (via Jmol)
024528791.b3lyp_6-31g(d).inp

024528791.b3lyp_6-31g(d).qchem.inp (generated)

024528791.b3lyp_6-31g(d).gjf (generated)

024528791.b3lyp_6-31g(d).firefly.inp (generated)

024528791.b3lyp_6-31g(d).smash.inp (generated)

024528791.b3lyp_6-31g(d).nwchem.inp (generated) 024528791.b3lyp_6-31g(d).log.xz 024528791.td-b3lyp_6-31g+(d).inp 024528791.td-b3lyp_6-31g+(d).log.xz

024528791.td-b3lyp_6-31+g(d).qchem.inp (generated)

024528791.td-b3lyp_6-31+g(d).gjf (generated)

024528791.td-b3lyp_6-31+g(d).firefly.inp (generated)

024528791.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024528791.mol 024528791.PUBCHEM 024528791.mol (via Jmol)
024528792.b3lyp_6-31g(d).inp

024528792.b3lyp_6-31g(d).qchem.inp (generated)

024528792.b3lyp_6-31g(d).gjf (generated)

024528792.b3lyp_6-31g(d).firefly.inp (generated)

024528792.b3lyp_6-31g(d).smash.inp (generated)

024528792.b3lyp_6-31g(d).nwchem.inp (generated) 024528792.b3lyp_6-31g(d).log.xz 024528792.td-b3lyp_6-31g+(d).inp 024528792.td-b3lyp_6-31g+(d).log.xz

024528792.td-b3lyp_6-31+g(d).qchem.inp (generated)

024528792.td-b3lyp_6-31+g(d).gjf (generated)

024528792.td-b3lyp_6-31+g(d).firefly.inp (generated)

024528792.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024528792.mol 024528792.PUBCHEM 024528792.mol (via Jmol)
024528793.b3lyp_6-31g(d).inp

024528793.b3lyp_6-31g(d).qchem.inp (generated)

024528793.b3lyp_6-31g(d).gjf (generated)

024528793.b3lyp_6-31g(d).firefly.inp (generated)

024528793.b3lyp_6-31g(d).smash.inp (generated)

024528793.b3lyp_6-31g(d).nwchem.inp (generated) 024528793.b3lyp_6-31g(d).log.xz 024528793.td-b3lyp_6-31g+(d).inp 024528793.td-b3lyp_6-31g+(d).log.xz

024528793.td-b3lyp_6-31+g(d).qchem.inp (generated)

024528793.td-b3lyp_6-31+g(d).gjf (generated)

024528793.td-b3lyp_6-31+g(d).firefly.inp (generated)

024528793.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024528793.mol 024528793.PUBCHEM 024528793.mol (via Jmol)
024528794.b3lyp_6-31g(d).inp

024528794.b3lyp_6-31g(d).qchem.inp (generated)

024528794.b3lyp_6-31g(d).gjf (generated)

024528794.b3lyp_6-31g(d).firefly.inp (generated)

024528794.b3lyp_6-31g(d).smash.inp (generated)

024528794.b3lyp_6-31g(d).nwchem.inp (generated) 024528794.b3lyp_6-31g(d).log.xz 024528794.td-b3lyp_6-31g+(d).inp 024528794.td-b3lyp_6-31g+(d).log.xz

024528794.td-b3lyp_6-31+g(d).qchem.inp (generated)

024528794.td-b3lyp_6-31+g(d).gjf (generated)

024528794.td-b3lyp_6-31+g(d).firefly.inp (generated)

024528794.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024528794.mol 024528794.PUBCHEM 024528794.mol (via Jmol)
024528798.b3lyp_6-31g(d).inp

024528798.b3lyp_6-31g(d).qchem.inp (generated)

024528798.b3lyp_6-31g(d).gjf (generated)

024528798.b3lyp_6-31g(d).firefly.inp (generated)

024528798.b3lyp_6-31g(d).smash.inp (generated)

024528798.b3lyp_6-31g(d).nwchem.inp (generated) 024528798.b3lyp_6-31g(d).log.xz 024528798.mol 024528798.PUBCHEM 024528798.mol (via Jmol)
024528799.b3lyp_6-31g(d).inp

024528799.b3lyp_6-31g(d).qchem.inp (generated)

024528799.b3lyp_6-31g(d).gjf (generated)

024528799.b3lyp_6-31g(d).firefly.inp (generated)

024528799.b3lyp_6-31g(d).smash.inp (generated)

024528799.b3lyp_6-31g(d).nwchem.inp (generated) 024528799.b3lyp_6-31g(d).log.xz 024528799.mol 024528799.PUBCHEM 024528799.mol (via Jmol)
024528800.b3lyp_6-31g(d).inp

024528800.b3lyp_6-31g(d).qchem.inp (generated)

024528800.b3lyp_6-31g(d).gjf (generated)

024528800.b3lyp_6-31g(d).firefly.inp (generated)

024528800.b3lyp_6-31g(d).smash.inp (generated)

024528800.b3lyp_6-31g(d).nwchem.inp (generated) 024528800.b3lyp_6-31g(d).log.xz 024528800.td-b3lyp_6-31g+(d).inp 024528800.td-b3lyp_6-31g+(d).log.xz

024528800.td-b3lyp_6-31+g(d).qchem.inp (generated)

024528800.td-b3lyp_6-31+g(d).gjf (generated)

024528800.td-b3lyp_6-31+g(d).firefly.inp (generated)

024528800.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024528800.mol 024528800.PUBCHEM 024528800.mol (via Jmol)
024528802.b3lyp_6-31g(d).inp

024528802.b3lyp_6-31g(d).qchem.inp (generated)

024528802.b3lyp_6-31g(d).gjf (generated)

024528802.b3lyp_6-31g(d).firefly.inp (generated)

024528802.b3lyp_6-31g(d).smash.inp (generated)

024528802.b3lyp_6-31g(d).nwchem.inp (generated) 024528802.b3lyp_6-31g(d).log.xz 024528802.mol 024528802.PUBCHEM 024528802.mol (via Jmol)
024528803.b3lyp_6-31g(d).inp

024528803.b3lyp_6-31g(d).qchem.inp (generated)

024528803.b3lyp_6-31g(d).gjf (generated)

024528803.b3lyp_6-31g(d).firefly.inp (generated)

024528803.b3lyp_6-31g(d).smash.inp (generated)

024528803.b3lyp_6-31g(d).nwchem.inp (generated) 024528803.b3lyp_6-31g(d).log.xz 024528803.td-b3lyp_6-31g+(d).inp 024528803.td-b3lyp_6-31g+(d).log.xz

024528803.td-b3lyp_6-31+g(d).qchem.inp (generated)

024528803.td-b3lyp_6-31+g(d).gjf (generated)

024528803.td-b3lyp_6-31+g(d).firefly.inp (generated)

024528803.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024528803.mol 024528803.PUBCHEM 024528803.mol (via Jmol)
024529437.b3lyp_6-31g(d).inp

024529437.b3lyp_6-31g(d).qchem.inp (generated)

024529437.b3lyp_6-31g(d).gjf (generated)

024529437.b3lyp_6-31g(d).firefly.inp (generated)

024529437.b3lyp_6-31g(d).smash.inp (generated)

024529437.b3lyp_6-31g(d).nwchem.inp (generated) 024529437.b3lyp_6-31g(d).log.xz 024529437.td-b3lyp_6-31g+(d).inp 024529437.td-b3lyp_6-31g+(d).log.xz

024529437.td-b3lyp_6-31+g(d).qchem.inp (generated)

024529437.td-b3lyp_6-31+g(d).gjf (generated)

024529437.td-b3lyp_6-31+g(d).firefly.inp (generated)

024529437.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024529437.mol 024529437.PUBCHEM 024529437.mol (via Jmol)
024529445.b3lyp_6-31g(d).inp

024529445.b3lyp_6-31g(d).qchem.inp (generated)

024529445.b3lyp_6-31g(d).gjf (generated)

024529445.b3lyp_6-31g(d).firefly.inp (generated)

024529445.b3lyp_6-31g(d).smash.inp (generated)

024529445.b3lyp_6-31g(d).nwchem.inp (generated) 024529445.b3lyp_6-31g(d).log.xz 024529445.td-b3lyp_6-31g+(d).inp 024529445.td-b3lyp_6-31g+(d).log.xz

024529445.td-b3lyp_6-31+g(d).qchem.inp (generated)

024529445.td-b3lyp_6-31+g(d).gjf (generated)

024529445.td-b3lyp_6-31+g(d).firefly.inp (generated)

024529445.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024529445.mol 024529445.PUBCHEM 024529445.mol (via Jmol)
024529452.b3lyp_6-31g(d).inp

024529452.b3lyp_6-31g(d).qchem.inp (generated)

024529452.b3lyp_6-31g(d).gjf (generated)

024529452.b3lyp_6-31g(d).firefly.inp (generated)

024529452.b3lyp_6-31g(d).smash.inp (generated)

024529452.b3lyp_6-31g(d).nwchem.inp (generated) 024529452.b3lyp_6-31g(d).log.xz 024529452.mol 024529452.PUBCHEM 024529452.mol (via Jmol)
024530324.b3lyp_6-31g(d).inp

024530324.b3lyp_6-31g(d).qchem.inp (generated)

024530324.b3lyp_6-31g(d).gjf (generated)

024530324.b3lyp_6-31g(d).firefly.inp (generated)

024530324.b3lyp_6-31g(d).smash.inp (generated)

024530324.b3lyp_6-31g(d).nwchem.inp (generated) 024530324.b3lyp_6-31g(d).log.xz 024530324.td-b3lyp_6-31g+(d).inp 024530324.td-b3lyp_6-31g+(d).log.xz

024530324.td-b3lyp_6-31+g(d).qchem.inp (generated)

024530324.td-b3lyp_6-31+g(d).gjf (generated)

024530324.td-b3lyp_6-31+g(d).firefly.inp (generated)

024530324.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024530324.mol 024530324.PUBCHEM 024530324.mol (via Jmol)
024531984.b3lyp_6-31g(d).inp

024531984.b3lyp_6-31g(d).qchem.inp (generated)

024531984.b3lyp_6-31g(d).gjf (generated)

024531984.b3lyp_6-31g(d).firefly.inp (generated)

024531984.b3lyp_6-31g(d).smash.inp (generated)

024531984.b3lyp_6-31g(d).nwchem.inp (generated) 024531984.b3lyp_6-31g(d).log.xz 024531984.td-b3lyp_6-31g+(d).inp 024531984.td-b3lyp_6-31g+(d).log.xz

024531984.td-b3lyp_6-31+g(d).qchem.inp (generated)

024531984.td-b3lyp_6-31+g(d).gjf (generated)

024531984.td-b3lyp_6-31+g(d).firefly.inp (generated)

024531984.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024531984.mol 024531984.PUBCHEM 024531984.mol (via Jmol)
024532059.b3lyp_6-31g(d).inp

024532059.b3lyp_6-31g(d).qchem.inp (generated)

024532059.b3lyp_6-31g(d).gjf (generated)

024532059.b3lyp_6-31g(d).firefly.inp (generated)

024532059.b3lyp_6-31g(d).smash.inp (generated)

024532059.b3lyp_6-31g(d).nwchem.inp (generated) 024532059.b3lyp_6-31g(d).log.xz 024532059.td-b3lyp_6-31g+(d).inp 024532059.td-b3lyp_6-31g+(d).log.xz

024532059.td-b3lyp_6-31+g(d).qchem.inp (generated)

024532059.td-b3lyp_6-31+g(d).gjf (generated)

024532059.td-b3lyp_6-31+g(d).firefly.inp (generated)

024532059.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024532059.mol 024532059.PUBCHEM 024532059.mol (via Jmol)
024532111.b3lyp_6-31g(d).inp

024532111.b3lyp_6-31g(d).qchem.inp (generated)

024532111.b3lyp_6-31g(d).gjf (generated)

024532111.b3lyp_6-31g(d).firefly.inp (generated)

024532111.b3lyp_6-31g(d).smash.inp (generated)

024532111.b3lyp_6-31g(d).nwchem.inp (generated) 024532111.b3lyp_6-31g(d).log.xz 024532111.mol 024532111.PUBCHEM 024532111.mol (via Jmol)
024534264.b3lyp_6-31g(d).inp

024534264.b3lyp_6-31g(d).qchem.inp (generated)

024534264.b3lyp_6-31g(d).gjf (generated)

024534264.b3lyp_6-31g(d).firefly.inp (generated)

024534264.b3lyp_6-31g(d).smash.inp (generated)

024534264.b3lyp_6-31g(d).nwchem.inp (generated) 024534264.b3lyp_6-31g(d).log.xz 024534264.td-b3lyp_6-31g+(d).inp 024534264.td-b3lyp_6-31g+(d).log.xz

024534264.td-b3lyp_6-31+g(d).qchem.inp (generated)

024534264.td-b3lyp_6-31+g(d).gjf (generated)

024534264.td-b3lyp_6-31+g(d).firefly.inp (generated)

024534264.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024534264.mol 024534264.PUBCHEM 024534264.mol (via Jmol)
024535892.b3lyp_6-31g(d).inp

024535892.b3lyp_6-31g(d).qchem.inp (generated)

024535892.b3lyp_6-31g(d).gjf (generated)

024535892.b3lyp_6-31g(d).firefly.inp (generated)

024535892.b3lyp_6-31g(d).smash.inp (generated)

024535892.b3lyp_6-31g(d).nwchem.inp (generated) 024535892.b3lyp_6-31g(d).log.xz 024535892.td-b3lyp_6-31g+(d).inp 024535892.td-b3lyp_6-31g+(d).log.xz

024535892.td-b3lyp_6-31+g(d).qchem.inp (generated)

024535892.td-b3lyp_6-31+g(d).gjf (generated)

024535892.td-b3lyp_6-31+g(d).firefly.inp (generated)

024535892.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024535892.mol 024535892.PUBCHEM 024535892.mol (via Jmol)
024535894.b3lyp_6-31g(d).inp

024535894.b3lyp_6-31g(d).qchem.inp (generated)

024535894.b3lyp_6-31g(d).gjf (generated)

024535894.b3lyp_6-31g(d).firefly.inp (generated)

024535894.b3lyp_6-31g(d).smash.inp (generated)

024535894.b3lyp_6-31g(d).nwchem.inp (generated) 024535894.b3lyp_6-31g(d).log.xz 024535894.mol 024535894.PUBCHEM 024535894.mol (via Jmol)
024535895.b3lyp_6-31g(d).inp

024535895.b3lyp_6-31g(d).qchem.inp (generated)

024535895.b3lyp_6-31g(d).gjf (generated)

024535895.b3lyp_6-31g(d).firefly.inp (generated)

024535895.b3lyp_6-31g(d).smash.inp (generated)

024535895.b3lyp_6-31g(d).nwchem.inp (generated) 024535895.b3lyp_6-31g(d).log.xz 024535895.td-b3lyp_6-31g+(d).inp 024535895.td-b3lyp_6-31g+(d).log.xz

024535895.td-b3lyp_6-31+g(d).qchem.inp (generated)

024535895.td-b3lyp_6-31+g(d).gjf (generated)

024535895.td-b3lyp_6-31+g(d).firefly.inp (generated)

024535895.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024535895.mol 024535895.PUBCHEM 024535895.mol (via Jmol)
024536446.b3lyp_6-31g(d).inp

024536446.b3lyp_6-31g(d).qchem.inp (generated)

024536446.b3lyp_6-31g(d).gjf (generated)

024536446.b3lyp_6-31g(d).firefly.inp (generated)

024536446.b3lyp_6-31g(d).smash.inp (generated)

024536446.b3lyp_6-31g(d).nwchem.inp (generated) 024536446.b3lyp_6-31g(d).log.xz 024536446.td-b3lyp_6-31g+(d).inp 024536446.td-b3lyp_6-31g+(d).log.xz

024536446.td-b3lyp_6-31+g(d).qchem.inp (generated)

024536446.td-b3lyp_6-31+g(d).gjf (generated)

024536446.td-b3lyp_6-31+g(d).firefly.inp (generated)

024536446.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024536446.mol 024536446.PUBCHEM 024536446.mol (via Jmol)
024537107.b3lyp_6-31g(d).inp

024537107.b3lyp_6-31g(d).qchem.inp (generated)

024537107.b3lyp_6-31g(d).gjf (generated)

024537107.b3lyp_6-31g(d).firefly.inp (generated)

024537107.b3lyp_6-31g(d).smash.inp (generated)

024537107.b3lyp_6-31g(d).nwchem.inp (generated) 024537107.b3lyp_6-31g(d).log.xz 024537107.td-b3lyp_6-31g+(d).inp 024537107.td-b3lyp_6-31g+(d).log.xz

024537107.td-b3lyp_6-31+g(d).qchem.inp (generated)

024537107.td-b3lyp_6-31+g(d).gjf (generated)

024537107.td-b3lyp_6-31+g(d).firefly.inp (generated)

024537107.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024537107.mol 024537107.PUBCHEM 024537107.mol (via Jmol)
024537405.b3lyp_6-31g(d).inp

024537405.b3lyp_6-31g(d).qchem.inp (generated)

024537405.b3lyp_6-31g(d).gjf (generated)

024537405.b3lyp_6-31g(d).firefly.inp (generated)

024537405.b3lyp_6-31g(d).smash.inp (generated)

024537405.b3lyp_6-31g(d).nwchem.inp (generated) 024537405.b3lyp_6-31g(d).log.xz 024537405.td-b3lyp_6-31g+(d).inp 024537405.td-b3lyp_6-31g+(d).log.xz

024537405.td-b3lyp_6-31+g(d).qchem.inp (generated)

024537405.td-b3lyp_6-31+g(d).gjf (generated)

024537405.td-b3lyp_6-31+g(d).firefly.inp (generated)

024537405.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024537405.mol 024537405.PUBCHEM 024537405.mol (via Jmol)
024537580.b3lyp_6-31g(d).inp

024537580.b3lyp_6-31g(d).qchem.inp (generated)

024537580.b3lyp_6-31g(d).gjf (generated)

024537580.b3lyp_6-31g(d).firefly.inp (generated)

024537580.b3lyp_6-31g(d).smash.inp (generated)

024537580.b3lyp_6-31g(d).nwchem.inp (generated) 024537580.b3lyp_6-31g(d).log.xz 024537580.td-b3lyp_6-31g+(d).inp 024537580.td-b3lyp_6-31g+(d).log.xz

024537580.td-b3lyp_6-31+g(d).qchem.inp (generated)

024537580.td-b3lyp_6-31+g(d).gjf (generated)

024537580.td-b3lyp_6-31+g(d).firefly.inp (generated)

024537580.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024537580.mol 024537580.PUBCHEM 024537580.mol (via Jmol)
024537737.b3lyp_6-31g(d).inp

024537737.b3lyp_6-31g(d).qchem.inp (generated)

024537737.b3lyp_6-31g(d).gjf (generated)

024537737.b3lyp_6-31g(d).firefly.inp (generated)

024537737.b3lyp_6-31g(d).smash.inp (generated)

024537737.b3lyp_6-31g(d).nwchem.inp (generated) 024537737.b3lyp_6-31g(d).log.xz 024537737.td-b3lyp_6-31g+(d).inp 024537737.td-b3lyp_6-31g+(d).log.xz

024537737.td-b3lyp_6-31+g(d).qchem.inp (generated)

024537737.td-b3lyp_6-31+g(d).gjf (generated)

024537737.td-b3lyp_6-31+g(d).firefly.inp (generated)

024537737.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024537737.mol 024537737.PUBCHEM 024537737.mol (via Jmol)
024537987.b3lyp_6-31g(d).inp

024537987.b3lyp_6-31g(d).qchem.inp (generated)

024537987.b3lyp_6-31g(d).gjf (generated)

024537987.b3lyp_6-31g(d).firefly.inp (generated)

024537987.b3lyp_6-31g(d).smash.inp (generated)

024537987.b3lyp_6-31g(d).nwchem.inp (generated) 024537987.b3lyp_6-31g(d).log.xz 024537987.td-b3lyp_6-31g+(d).inp 024537987.td-b3lyp_6-31g+(d).log.xz

024537987.td-b3lyp_6-31+g(d).qchem.inp (generated)

024537987.td-b3lyp_6-31+g(d).gjf (generated)

024537987.td-b3lyp_6-31+g(d).firefly.inp (generated)

024537987.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024537987.mol 024537987.PUBCHEM 024537987.mol (via Jmol)
024538163.b3lyp_6-31g(d).inp

024538163.b3lyp_6-31g(d).qchem.inp (generated)

024538163.b3lyp_6-31g(d).gjf (generated)

024538163.b3lyp_6-31g(d).firefly.inp (generated)

024538163.b3lyp_6-31g(d).smash.inp (generated)

024538163.b3lyp_6-31g(d).nwchem.inp (generated) 024538163.b3lyp_6-31g(d).log.xz 024538163.mol 024538163.PUBCHEM 024538163.mol (via Jmol)
024538625.b3lyp_6-31g(d).inp

024538625.b3lyp_6-31g(d).qchem.inp (generated)

024538625.b3lyp_6-31g(d).gjf (generated)

024538625.b3lyp_6-31g(d).firefly.inp (generated)

024538625.b3lyp_6-31g(d).smash.inp (generated)

024538625.b3lyp_6-31g(d).nwchem.inp (generated) 024538625.b3lyp_6-31g(d).log.xz 024538625.td-b3lyp_6-31g+(d).inp 024538625.td-b3lyp_6-31g+(d).log.xz

024538625.td-b3lyp_6-31+g(d).qchem.inp (generated)

024538625.td-b3lyp_6-31+g(d).gjf (generated)

024538625.td-b3lyp_6-31+g(d).firefly.inp (generated)

024538625.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024538625.mol 024538625.PUBCHEM 024538625.mol (via Jmol)
024539597.b3lyp_6-31g(d).inp

024539597.b3lyp_6-31g(d).qchem.inp (generated)

024539597.b3lyp_6-31g(d).gjf (generated)

024539597.b3lyp_6-31g(d).firefly.inp (generated)

024539597.b3lyp_6-31g(d).smash.inp (generated)

024539597.b3lyp_6-31g(d).nwchem.inp (generated) 024539597.b3lyp_6-31g(d).log.xz 024539597.td-b3lyp_6-31g+(d).inp 024539597.td-b3lyp_6-31g+(d).log.xz

024539597.td-b3lyp_6-31+g(d).qchem.inp (generated)

024539597.td-b3lyp_6-31+g(d).gjf (generated)

024539597.td-b3lyp_6-31+g(d).firefly.inp (generated)

024539597.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024539597.mol 024539597.PUBCHEM 024539597.mol (via Jmol)
024539818.b3lyp_6-31g(d).inp

024539818.b3lyp_6-31g(d).qchem.inp (generated)

024539818.b3lyp_6-31g(d).gjf (generated)

024539818.b3lyp_6-31g(d).firefly.inp (generated)

024539818.b3lyp_6-31g(d).smash.inp (generated)

024539818.b3lyp_6-31g(d).nwchem.inp (generated) 024539818.b3lyp_6-31g(d).log.xz 024539818.td-b3lyp_6-31g+(d).inp 024539818.td-b3lyp_6-31g+(d).log.xz

024539818.td-b3lyp_6-31+g(d).qchem.inp (generated)

024539818.td-b3lyp_6-31+g(d).gjf (generated)

024539818.td-b3lyp_6-31+g(d).firefly.inp (generated)

024539818.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024539818.mol 024539818.PUBCHEM 024539818.mol (via Jmol)
024540111.b3lyp_6-31g(d).inp

024540111.b3lyp_6-31g(d).qchem.inp (generated)

024540111.b3lyp_6-31g(d).gjf (generated)

024540111.b3lyp_6-31g(d).firefly.inp (generated)

024540111.b3lyp_6-31g(d).smash.inp (generated)

024540111.b3lyp_6-31g(d).nwchem.inp (generated) 024540111.b3lyp_6-31g(d).log.xz 024540111.td-b3lyp_6-31g+(d).inp 024540111.td-b3lyp_6-31g+(d).log.xz

024540111.td-b3lyp_6-31+g(d).qchem.inp (generated)

024540111.td-b3lyp_6-31+g(d).gjf (generated)

024540111.td-b3lyp_6-31+g(d).firefly.inp (generated)

024540111.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024540111.mol 024540111.PUBCHEM 024540111.mol (via Jmol)
024541368.b3lyp_6-31g(d).inp

024541368.b3lyp_6-31g(d).qchem.inp (generated)

024541368.b3lyp_6-31g(d).gjf (generated)

024541368.b3lyp_6-31g(d).firefly.inp (generated)

024541368.b3lyp_6-31g(d).smash.inp (generated)

024541368.b3lyp_6-31g(d).nwchem.inp (generated) 024541368.b3lyp_6-31g(d).log.xz 024541368.td-b3lyp_6-31g+(d).inp 024541368.td-b3lyp_6-31g+(d).log.xz

024541368.td-b3lyp_6-31+g(d).qchem.inp (generated)

024541368.td-b3lyp_6-31+g(d).gjf (generated)

024541368.td-b3lyp_6-31+g(d).firefly.inp (generated)

024541368.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024541368.mol 024541368.PUBCHEM 024541368.mol (via Jmol)
024542165.b3lyp_6-31g(d).inp

024542165.b3lyp_6-31g(d).qchem.inp (generated)

024542165.b3lyp_6-31g(d).gjf (generated)

024542165.b3lyp_6-31g(d).firefly.inp (generated)

024542165.b3lyp_6-31g(d).smash.inp (generated)

024542165.b3lyp_6-31g(d).nwchem.inp (generated) 024542165.b3lyp_6-31g(d).log.xz 024542165.td-b3lyp_6-31g+(d).inp 024542165.td-b3lyp_6-31g+(d).log.xz

024542165.td-b3lyp_6-31+g(d).qchem.inp (generated)

024542165.td-b3lyp_6-31+g(d).gjf (generated)

024542165.td-b3lyp_6-31+g(d).firefly.inp (generated)

024542165.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024542165.mol 024542165.PUBCHEM 024542165.mol (via Jmol)
024542168.b3lyp_6-31g(d).inp

024542168.b3lyp_6-31g(d).qchem.inp (generated)

024542168.b3lyp_6-31g(d).gjf (generated)

024542168.b3lyp_6-31g(d).firefly.inp (generated)

024542168.b3lyp_6-31g(d).smash.inp (generated)

024542168.b3lyp_6-31g(d).nwchem.inp (generated) 024542168.b3lyp_6-31g(d).log.xz 024542168.td-b3lyp_6-31g+(d).inp 024542168.td-b3lyp_6-31g+(d).log.xz

024542168.td-b3lyp_6-31+g(d).qchem.inp (generated)

024542168.td-b3lyp_6-31+g(d).gjf (generated)

024542168.td-b3lyp_6-31+g(d).firefly.inp (generated)

024542168.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024542168.mol 024542168.PUBCHEM 024542168.mol (via Jmol)
024542171.b3lyp_6-31g(d).inp

024542171.b3lyp_6-31g(d).qchem.inp (generated)

024542171.b3lyp_6-31g(d).gjf (generated)

024542171.b3lyp_6-31g(d).firefly.inp (generated)

024542171.b3lyp_6-31g(d).smash.inp (generated)

024542171.b3lyp_6-31g(d).nwchem.inp (generated) 024542171.b3lyp_6-31g(d).log.xz 024542171.mol 024542171.PUBCHEM 024542171.mol (via Jmol)
024542172.b3lyp_6-31g(d).inp

024542172.b3lyp_6-31g(d).qchem.inp (generated)

024542172.b3lyp_6-31g(d).gjf (generated)

024542172.b3lyp_6-31g(d).firefly.inp (generated)

024542172.b3lyp_6-31g(d).smash.inp (generated)

024542172.b3lyp_6-31g(d).nwchem.inp (generated) 024542172.b3lyp_6-31g(d).log.xz 024542172.mol 024542172.PUBCHEM 024542172.mol (via Jmol)
024542178.b3lyp_6-31g(d).inp

024542178.b3lyp_6-31g(d).qchem.inp (generated)

024542178.b3lyp_6-31g(d).gjf (generated)

024542178.b3lyp_6-31g(d).firefly.inp (generated)

024542178.b3lyp_6-31g(d).smash.inp (generated)

024542178.b3lyp_6-31g(d).nwchem.inp (generated) 024542178.b3lyp_6-31g(d).log.xz 024542178.mol 024542178.PUBCHEM 024542178.mol (via Jmol)
024542184.b3lyp_6-31g(d).inp

024542184.b3lyp_6-31g(d).qchem.inp (generated)

024542184.b3lyp_6-31g(d).gjf (generated)

024542184.b3lyp_6-31g(d).firefly.inp (generated)

024542184.b3lyp_6-31g(d).smash.inp (generated)

024542184.b3lyp_6-31g(d).nwchem.inp (generated) 024542184.b3lyp_6-31g(d).log.xz 024542184.td-b3lyp_6-31g+(d).inp 024542184.td-b3lyp_6-31g+(d).log.xz

024542184.td-b3lyp_6-31+g(d).qchem.inp (generated)

024542184.td-b3lyp_6-31+g(d).gjf (generated)

024542184.td-b3lyp_6-31+g(d).firefly.inp (generated)

024542184.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024542184.mol 024542184.PUBCHEM 024542184.mol (via Jmol)
024542187.b3lyp_6-31g(d).inp

024542187.b3lyp_6-31g(d).qchem.inp (generated)

024542187.b3lyp_6-31g(d).gjf (generated)

024542187.b3lyp_6-31g(d).firefly.inp (generated)

024542187.b3lyp_6-31g(d).smash.inp (generated)

024542187.b3lyp_6-31g(d).nwchem.inp (generated) 024542187.b3lyp_6-31g(d).log.xz 024542187.td-b3lyp_6-31g+(d).inp 024542187.td-b3lyp_6-31g+(d).log.xz

024542187.td-b3lyp_6-31+g(d).qchem.inp (generated)

024542187.td-b3lyp_6-31+g(d).gjf (generated)

024542187.td-b3lyp_6-31+g(d).firefly.inp (generated)

024542187.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024542187.mol 024542187.PUBCHEM 024542187.mol (via Jmol)
024542188.b3lyp_6-31g(d).inp

024542188.b3lyp_6-31g(d).qchem.inp (generated)

024542188.b3lyp_6-31g(d).gjf (generated)

024542188.b3lyp_6-31g(d).firefly.inp (generated)

024542188.b3lyp_6-31g(d).smash.inp (generated)

024542188.b3lyp_6-31g(d).nwchem.inp (generated) 024542188.b3lyp_6-31g(d).log.xz 024542188.mol 024542188.PUBCHEM 024542188.mol (via Jmol)
024542192.b3lyp_6-31g(d).inp

024542192.b3lyp_6-31g(d).qchem.inp (generated)

024542192.b3lyp_6-31g(d).gjf (generated)

024542192.b3lyp_6-31g(d).firefly.inp (generated)

024542192.b3lyp_6-31g(d).smash.inp (generated)

024542192.b3lyp_6-31g(d).nwchem.inp (generated) 024542192.b3lyp_6-31g(d).log.xz 024542192.td-b3lyp_6-31g+(d).inp 024542192.td-b3lyp_6-31g+(d).log.xz

024542192.td-b3lyp_6-31+g(d).qchem.inp (generated)

024542192.td-b3lyp_6-31+g(d).gjf (generated)

024542192.td-b3lyp_6-31+g(d).firefly.inp (generated)

024542192.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024542192.mol 024542192.PUBCHEM 024542192.mol (via Jmol)
024542198.b3lyp_6-31g(d).inp

024542198.b3lyp_6-31g(d).qchem.inp (generated)

024542198.b3lyp_6-31g(d).gjf (generated)

024542198.b3lyp_6-31g(d).firefly.inp (generated)

024542198.b3lyp_6-31g(d).smash.inp (generated)

024542198.b3lyp_6-31g(d).nwchem.inp (generated) 024542198.b3lyp_6-31g(d).log.xz 024542198.mol 024542198.PUBCHEM 024542198.mol (via Jmol)
024542203.b3lyp_6-31g(d).inp

024542203.b3lyp_6-31g(d).qchem.inp (generated)

024542203.b3lyp_6-31g(d).gjf (generated)

024542203.b3lyp_6-31g(d).firefly.inp (generated)

024542203.b3lyp_6-31g(d).smash.inp (generated)

024542203.b3lyp_6-31g(d).nwchem.inp (generated) 024542203.b3lyp_6-31g(d).log.xz 024542203.td-b3lyp_6-31g+(d).inp 024542203.td-b3lyp_6-31g+(d).log.xz

024542203.td-b3lyp_6-31+g(d).qchem.inp (generated)

024542203.td-b3lyp_6-31+g(d).gjf (generated)

024542203.td-b3lyp_6-31+g(d).firefly.inp (generated)

024542203.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024542203.mol 024542203.PUBCHEM 024542203.mol (via Jmol)
024542205.b3lyp_6-31g(d).inp

024542205.b3lyp_6-31g(d).qchem.inp (generated)

024542205.b3lyp_6-31g(d).gjf (generated)

024542205.b3lyp_6-31g(d).firefly.inp (generated)

024542205.b3lyp_6-31g(d).smash.inp (generated)

024542205.b3lyp_6-31g(d).nwchem.inp (generated) 024542205.b3lyp_6-31g(d).log.xz 024542205.td-b3lyp_6-31g+(d).inp 024542205.td-b3lyp_6-31g+(d).log.xz

024542205.td-b3lyp_6-31+g(d).qchem.inp (generated)

024542205.td-b3lyp_6-31+g(d).gjf (generated)

024542205.td-b3lyp_6-31+g(d).firefly.inp (generated)

024542205.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024542205.mol 024542205.PUBCHEM 024542205.mol (via Jmol)
024542206.b3lyp_6-31g(d).inp

024542206.b3lyp_6-31g(d).qchem.inp (generated)

024542206.b3lyp_6-31g(d).gjf (generated)

024542206.b3lyp_6-31g(d).firefly.inp (generated)

024542206.b3lyp_6-31g(d).smash.inp (generated)

024542206.b3lyp_6-31g(d).nwchem.inp (generated) 024542206.b3lyp_6-31g(d).log.xz 024542206.mol 024542206.PUBCHEM 024542206.mol (via Jmol)
024542214.b3lyp_6-31g(d).inp

024542214.b3lyp_6-31g(d).qchem.inp (generated)

024542214.b3lyp_6-31g(d).gjf (generated)

024542214.b3lyp_6-31g(d).firefly.inp (generated)

024542214.b3lyp_6-31g(d).smash.inp (generated)

024542214.b3lyp_6-31g(d).nwchem.inp (generated) 024542214.b3lyp_6-31g(d).log.xz 024542214.td-b3lyp_6-31g+(d).inp 024542214.td-b3lyp_6-31g+(d).log.xz

024542214.td-b3lyp_6-31+g(d).qchem.inp (generated)

024542214.td-b3lyp_6-31+g(d).gjf (generated)

024542214.td-b3lyp_6-31+g(d).firefly.inp (generated)

024542214.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024542214.mol 024542214.PUBCHEM 024542214.mol (via Jmol)
024542215.b3lyp_6-31g(d).inp

024542215.b3lyp_6-31g(d).qchem.inp (generated)

024542215.b3lyp_6-31g(d).gjf (generated)

024542215.b3lyp_6-31g(d).firefly.inp (generated)

024542215.b3lyp_6-31g(d).smash.inp (generated)

024542215.b3lyp_6-31g(d).nwchem.inp (generated) 024542215.b3lyp_6-31g(d).log.xz 024542215.td-b3lyp_6-31g+(d).inp 024542215.td-b3lyp_6-31g+(d).log.xz

024542215.td-b3lyp_6-31+g(d).qchem.inp (generated)

024542215.td-b3lyp_6-31+g(d).gjf (generated)

024542215.td-b3lyp_6-31+g(d).firefly.inp (generated)

024542215.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024542215.mol 024542215.PUBCHEM 024542215.mol (via Jmol)
024542354.b3lyp_6-31g(d).inp

024542354.b3lyp_6-31g(d).qchem.inp (generated)

024542354.b3lyp_6-31g(d).gjf (generated)

024542354.b3lyp_6-31g(d).firefly.inp (generated)

024542354.b3lyp_6-31g(d).smash.inp (generated)

024542354.b3lyp_6-31g(d).nwchem.inp (generated) 024542354.b3lyp_6-31g(d).log.xz 024542354.td-b3lyp_6-31g+(d).inp 024542354.td-b3lyp_6-31g+(d).log.xz

024542354.td-b3lyp_6-31+g(d).qchem.inp (generated)

024542354.td-b3lyp_6-31+g(d).gjf (generated)

024542354.td-b3lyp_6-31+g(d).firefly.inp (generated)

024542354.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024542354.mol 024542354.PUBCHEM 024542354.mol (via Jmol)
024542356.b3lyp_6-31g(d).inp

024542356.b3lyp_6-31g(d).qchem.inp (generated)

024542356.b3lyp_6-31g(d).gjf (generated)

024542356.b3lyp_6-31g(d).firefly.inp (generated)

024542356.b3lyp_6-31g(d).smash.inp (generated)

024542356.b3lyp_6-31g(d).nwchem.inp (generated) 024542356.b3lyp_6-31g(d).log.xz 024542356.td-b3lyp_6-31g+(d).inp 024542356.td-b3lyp_6-31g+(d).log.xz

024542356.td-b3lyp_6-31+g(d).qchem.inp (generated)

024542356.td-b3lyp_6-31+g(d).gjf (generated)

024542356.td-b3lyp_6-31+g(d).firefly.inp (generated)

024542356.td-b3lyp_6-31+g(d).nwchem.inp (generated) 024542356.mol 024542356.PUBCHEM 024542356.mol (via Jmol)
024547787.b3lyp_6-31g(d).inp

024547787.b3lyp_6-31g(d).qchem.inp (generated)

024547787.b3lyp_6-31g(d).gjf (generated)

024547787.b3lyp_6-31g(d).firefly.inp (generated)

024547787.b3lyp_6-31g(d).smash.inp (generated)

024547787.b3lyp_6-31g(d).nwchem.inp (generated) 024547787.b3lyp_6-31g(d).log.xz 024547787.mol 024547787.PUBCHEM 024547787.mol (via Jmol)


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