Index of

Last updated : Thu Jun 22 02:29:55 JST 2017
Total : 121 (93) in this page
060450062.b3lyp_6-31g(d).inp

060450062.b3lyp_6-31g(d).qchem.inp (generated)

060450062.b3lyp_6-31g(d).gjf (generated)

060450062.b3lyp_6-31g(d).firefly.inp (generated)

060450062.b3lyp_6-31g(d).smash.inp (generated)

060450062.b3lyp_6-31g(d).nwchem.inp (generated) 060450062.b3lyp_6-31g(d).log.xz 060450062.td-b3lyp_6-31g+(d).inp 060450062.td-b3lyp_6-31g+(d).log.xz

060450062.td-b3lyp_6-31+g(d).qchem.inp (generated)

060450062.td-b3lyp_6-31+g(d).gjf (generated)

060450062.td-b3lyp_6-31+g(d).firefly.inp (generated)

060450062.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060450062.mol 060450062.PUBCHEM 060450062.mol (via Jmol)
060450159.b3lyp_6-31g(d).inp

060450159.b3lyp_6-31g(d).qchem.inp (generated)

060450159.b3lyp_6-31g(d).gjf (generated)

060450159.b3lyp_6-31g(d).firefly.inp (generated)

060450159.b3lyp_6-31g(d).smash.inp (generated)

060450159.b3lyp_6-31g(d).nwchem.inp (generated) 060450159.b3lyp_6-31g(d).log.xz 060450159.td-b3lyp_6-31g+(d).inp 060450159.td-b3lyp_6-31g+(d).log.xz

060450159.td-b3lyp_6-31+g(d).qchem.inp (generated)

060450159.td-b3lyp_6-31+g(d).gjf (generated)

060450159.td-b3lyp_6-31+g(d).firefly.inp (generated)

060450159.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060450159.mol 060450159.PUBCHEM 060450159.mol (via Jmol)
060450310.b3lyp_6-31g(d).inp

060450310.b3lyp_6-31g(d).qchem.inp (generated)

060450310.b3lyp_6-31g(d).gjf (generated)

060450310.b3lyp_6-31g(d).firefly.inp (generated)

060450310.b3lyp_6-31g(d).smash.inp (generated)

060450310.b3lyp_6-31g(d).nwchem.inp (generated) 060450310.b3lyp_6-31g(d).log.xz 060450310.td-b3lyp_6-31g+(d).inp 060450310.td-b3lyp_6-31g+(d).log.xz

060450310.td-b3lyp_6-31+g(d).qchem.inp (generated)

060450310.td-b3lyp_6-31+g(d).gjf (generated)

060450310.td-b3lyp_6-31+g(d).firefly.inp (generated)

060450310.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060450310.mol 060450310.PUBCHEM 060450310.mol (via Jmol)
060450339.b3lyp_6-31g(d).inp

060450339.b3lyp_6-31g(d).qchem.inp (generated)

060450339.b3lyp_6-31g(d).gjf (generated)

060450339.b3lyp_6-31g(d).firefly.inp (generated)

060450339.b3lyp_6-31g(d).smash.inp (generated)

060450339.b3lyp_6-31g(d).nwchem.inp (generated) 060450339.b3lyp_6-31g(d).log.xz 060450339.td-b3lyp_6-31g+(d).inp 060450339.td-b3lyp_6-31g+(d).log.xz

060450339.td-b3lyp_6-31+g(d).qchem.inp (generated)

060450339.td-b3lyp_6-31+g(d).gjf (generated)

060450339.td-b3lyp_6-31+g(d).firefly.inp (generated)

060450339.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060450339.mol 060450339.PUBCHEM 060450339.mol (via Jmol)
060450403.b3lyp_6-31g(d).inp

060450403.b3lyp_6-31g(d).qchem.inp (generated)

060450403.b3lyp_6-31g(d).gjf (generated)

060450403.b3lyp_6-31g(d).firefly.inp (generated)

060450403.b3lyp_6-31g(d).smash.inp (generated)

060450403.b3lyp_6-31g(d).nwchem.inp (generated) 060450403.b3lyp_6-31g(d).log.xz 060450403.td-b3lyp_6-31g+(d).inp 060450403.td-b3lyp_6-31g+(d).log.xz

060450403.td-b3lyp_6-31+g(d).qchem.inp (generated)

060450403.td-b3lyp_6-31+g(d).gjf (generated)

060450403.td-b3lyp_6-31+g(d).firefly.inp (generated)

060450403.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060450403.mol 060450403.PUBCHEM 060450403.mol (via Jmol)
060450757.b3lyp_6-31g(d).inp

060450757.b3lyp_6-31g(d).qchem.inp (generated)

060450757.b3lyp_6-31g(d).gjf (generated)

060450757.b3lyp_6-31g(d).firefly.inp (generated)

060450757.b3lyp_6-31g(d).smash.inp (generated)

060450757.b3lyp_6-31g(d).nwchem.inp (generated) 060450757.b3lyp_6-31g(d).log.xz 060450757.mol 060450757.PUBCHEM 060450757.mol (via Jmol)
060451627.b3lyp_6-31g(d).inp

060451627.b3lyp_6-31g(d).qchem.inp (generated)

060451627.b3lyp_6-31g(d).gjf (generated)

060451627.b3lyp_6-31g(d).firefly.inp (generated)

060451627.b3lyp_6-31g(d).smash.inp (generated)

060451627.b3lyp_6-31g(d).nwchem.inp (generated) 060451627.b3lyp_6-31g(d).log.xz 060451627.mol 060451627.PUBCHEM 060451627.mol (via Jmol)
060451860.b3lyp_6-31g(d).inp

060451860.b3lyp_6-31g(d).qchem.inp (generated)

060451860.b3lyp_6-31g(d).gjf (generated)

060451860.b3lyp_6-31g(d).firefly.inp (generated)

060451860.b3lyp_6-31g(d).smash.inp (generated)

060451860.b3lyp_6-31g(d).nwchem.inp (generated) 060451860.b3lyp_6-31g(d).log.xz 060451860.td-b3lyp_6-31g+(d).inp 060451860.td-b3lyp_6-31g+(d).log.xz

060451860.td-b3lyp_6-31+g(d).qchem.inp (generated)

060451860.td-b3lyp_6-31+g(d).gjf (generated)

060451860.td-b3lyp_6-31+g(d).firefly.inp (generated)

060451860.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060451860.mol 060451860.PUBCHEM 060451860.mol (via Jmol)
060451967.b3lyp_6-31g(d).inp

060451967.b3lyp_6-31g(d).qchem.inp (generated)

060451967.b3lyp_6-31g(d).gjf (generated)

060451967.b3lyp_6-31g(d).firefly.inp (generated)

060451967.b3lyp_6-31g(d).smash.inp (generated)

060451967.b3lyp_6-31g(d).nwchem.inp (generated) 060451967.b3lyp_6-31g(d).log.xz 060451967.mol 060451967.PUBCHEM 060451967.mol (via Jmol)
060452215.b3lyp_6-31g(d).inp

060452215.b3lyp_6-31g(d).qchem.inp (generated)

060452215.b3lyp_6-31g(d).gjf (generated)

060452215.b3lyp_6-31g(d).firefly.inp (generated)

060452215.b3lyp_6-31g(d).smash.inp (generated)

060452215.b3lyp_6-31g(d).nwchem.inp (generated) 060452215.b3lyp_6-31g(d).log.xz 060452215.td-b3lyp_6-31g+(d).inp 060452215.td-b3lyp_6-31g+(d).log.xz

060452215.td-b3lyp_6-31+g(d).qchem.inp (generated)

060452215.td-b3lyp_6-31+g(d).gjf (generated)

060452215.td-b3lyp_6-31+g(d).firefly.inp (generated)

060452215.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060452215.mol 060452215.PUBCHEM 060452215.mol (via Jmol)
060452475.b3lyp_6-31g(d).inp

060452475.b3lyp_6-31g(d).qchem.inp (generated)

060452475.b3lyp_6-31g(d).gjf (generated)

060452475.b3lyp_6-31g(d).firefly.inp (generated)

060452475.b3lyp_6-31g(d).smash.inp (generated)

060452475.b3lyp_6-31g(d).nwchem.inp (generated) 060452475.b3lyp_6-31g(d).log.xz 060452475.mol 060452475.PUBCHEM 060452475.mol (via Jmol)
060452842.b3lyp_6-31g(d).inp

060452842.b3lyp_6-31g(d).qchem.inp (generated)

060452842.b3lyp_6-31g(d).gjf (generated)

060452842.b3lyp_6-31g(d).firefly.inp (generated)

060452842.b3lyp_6-31g(d).smash.inp (generated)

060452842.b3lyp_6-31g(d).nwchem.inp (generated) 060452842.b3lyp_6-31g(d).log.xz 060452842.mol 060452842.PUBCHEM 060452842.mol (via Jmol)
060452909.b3lyp_6-31g(d).inp

060452909.b3lyp_6-31g(d).qchem.inp (generated)

060452909.b3lyp_6-31g(d).gjf (generated)

060452909.b3lyp_6-31g(d).firefly.inp (generated)

060452909.b3lyp_6-31g(d).smash.inp (generated)

060452909.b3lyp_6-31g(d).nwchem.inp (generated) 060452909.b3lyp_6-31g(d).log.xz 060452909.td-b3lyp_6-31g+(d).inp 060452909.td-b3lyp_6-31g+(d).log.xz

060452909.td-b3lyp_6-31+g(d).qchem.inp (generated)

060452909.td-b3lyp_6-31+g(d).gjf (generated)

060452909.td-b3lyp_6-31+g(d).firefly.inp (generated)

060452909.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060452909.mol 060452909.PUBCHEM 060452909.mol (via Jmol)
060453095.b3lyp_6-31g(d).inp

060453095.b3lyp_6-31g(d).qchem.inp (generated)

060453095.b3lyp_6-31g(d).gjf (generated)

060453095.b3lyp_6-31g(d).firefly.inp (generated)

060453095.b3lyp_6-31g(d).smash.inp (generated)

060453095.b3lyp_6-31g(d).nwchem.inp (generated) 060453095.b3lyp_6-31g(d).log.xz 060453095.td-b3lyp_6-31g+(d).inp 060453095.td-b3lyp_6-31g+(d).log.xz

060453095.td-b3lyp_6-31+g(d).qchem.inp (generated)

060453095.td-b3lyp_6-31+g(d).gjf (generated)

060453095.td-b3lyp_6-31+g(d).firefly.inp (generated)

060453095.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060453095.mol 060453095.PUBCHEM 060453095.mol (via Jmol)
060453097.b3lyp_6-31g(d).inp

060453097.b3lyp_6-31g(d).qchem.inp (generated)

060453097.b3lyp_6-31g(d).gjf (generated)

060453097.b3lyp_6-31g(d).firefly.inp (generated)

060453097.b3lyp_6-31g(d).smash.inp (generated)

060453097.b3lyp_6-31g(d).nwchem.inp (generated) 060453097.b3lyp_6-31g(d).log.xz 060453097.td-b3lyp_6-31g+(d).inp 060453097.td-b3lyp_6-31g+(d).log.xz

060453097.td-b3lyp_6-31+g(d).qchem.inp (generated)

060453097.td-b3lyp_6-31+g(d).gjf (generated)

060453097.td-b3lyp_6-31+g(d).firefly.inp (generated)

060453097.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060453097.mol 060453097.PUBCHEM 060453097.mol (via Jmol)
060453119.b3lyp_6-31g(d).inp

060453119.b3lyp_6-31g(d).qchem.inp (generated)

060453119.b3lyp_6-31g(d).gjf (generated)

060453119.b3lyp_6-31g(d).firefly.inp (generated)

060453119.b3lyp_6-31g(d).smash.inp (generated)

060453119.b3lyp_6-31g(d).nwchem.inp (generated) 060453119.b3lyp_6-31g(d).log.xz 060453119.td-b3lyp_6-31g+(d).inp 060453119.td-b3lyp_6-31g+(d).log.xz

060453119.td-b3lyp_6-31+g(d).qchem.inp (generated)

060453119.td-b3lyp_6-31+g(d).gjf (generated)

060453119.td-b3lyp_6-31+g(d).firefly.inp (generated)

060453119.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060453119.mol 060453119.PUBCHEM 060453119.mol (via Jmol)
060453120.b3lyp_6-31g(d).inp

060453120.b3lyp_6-31g(d).qchem.inp (generated)

060453120.b3lyp_6-31g(d).gjf (generated)

060453120.b3lyp_6-31g(d).firefly.inp (generated)

060453120.b3lyp_6-31g(d).smash.inp (generated)

060453120.b3lyp_6-31g(d).nwchem.inp (generated) 060453120.b3lyp_6-31g(d).log.xz 060453120.td-b3lyp_6-31g+(d).inp 060453120.td-b3lyp_6-31g+(d).log.xz

060453120.td-b3lyp_6-31+g(d).qchem.inp (generated)

060453120.td-b3lyp_6-31+g(d).gjf (generated)

060453120.td-b3lyp_6-31+g(d).firefly.inp (generated)

060453120.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060453120.mol 060453120.PUBCHEM 060453120.mol (via Jmol)
060453271.b3lyp_6-31g(d).inp

060453271.b3lyp_6-31g(d).qchem.inp (generated)

060453271.b3lyp_6-31g(d).gjf (generated)

060453271.b3lyp_6-31g(d).firefly.inp (generated)

060453271.b3lyp_6-31g(d).smash.inp (generated)

060453271.b3lyp_6-31g(d).nwchem.inp (generated) 060453271.b3lyp_6-31g(d).log.xz 060453271.td-b3lyp_6-31g+(d).inp 060453271.td-b3lyp_6-31g+(d).log.xz

060453271.td-b3lyp_6-31+g(d).qchem.inp (generated)

060453271.td-b3lyp_6-31+g(d).gjf (generated)

060453271.td-b3lyp_6-31+g(d).firefly.inp (generated)

060453271.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060453271.mol 060453271.PUBCHEM 060453271.mol (via Jmol)
060453274.b3lyp_6-31g(d).inp

060453274.b3lyp_6-31g(d).qchem.inp (generated)

060453274.b3lyp_6-31g(d).gjf (generated)

060453274.b3lyp_6-31g(d).firefly.inp (generated)

060453274.b3lyp_6-31g(d).smash.inp (generated)

060453274.b3lyp_6-31g(d).nwchem.inp (generated) 060453274.b3lyp_6-31g(d).log.xz 060453274.td-b3lyp_6-31g+(d).inp 060453274.td-b3lyp_6-31g+(d).log.xz

060453274.td-b3lyp_6-31+g(d).qchem.inp (generated)

060453274.td-b3lyp_6-31+g(d).gjf (generated)

060453274.td-b3lyp_6-31+g(d).firefly.inp (generated)

060453274.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060453274.mol 060453274.PUBCHEM 060453274.mol (via Jmol)
060453338.b3lyp_6-31g(d).inp

060453338.b3lyp_6-31g(d).qchem.inp (generated)

060453338.b3lyp_6-31g(d).gjf (generated)

060453338.b3lyp_6-31g(d).firefly.inp (generated)

060453338.b3lyp_6-31g(d).smash.inp (generated)

060453338.b3lyp_6-31g(d).nwchem.inp (generated) 060453338.b3lyp_6-31g(d).log.xz 060453338.td-b3lyp_6-31g+(d).inp 060453338.td-b3lyp_6-31g+(d).log.xz

060453338.td-b3lyp_6-31+g(d).qchem.inp (generated)

060453338.td-b3lyp_6-31+g(d).gjf (generated)

060453338.td-b3lyp_6-31+g(d).firefly.inp (generated)

060453338.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060453338.mol 060453338.PUBCHEM 060453338.mol (via Jmol)
060453353.b3lyp_6-31g(d).inp

060453353.b3lyp_6-31g(d).qchem.inp (generated)

060453353.b3lyp_6-31g(d).gjf (generated)

060453353.b3lyp_6-31g(d).firefly.inp (generated)

060453353.b3lyp_6-31g(d).smash.inp (generated)

060453353.b3lyp_6-31g(d).nwchem.inp (generated) 060453353.b3lyp_6-31g(d).log.xz 060453353.td-b3lyp_6-31g+(d).inp 060453353.td-b3lyp_6-31g+(d).log.xz

060453353.td-b3lyp_6-31+g(d).qchem.inp (generated)

060453353.td-b3lyp_6-31+g(d).gjf (generated)

060453353.td-b3lyp_6-31+g(d).firefly.inp (generated)

060453353.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060453353.mol 060453353.PUBCHEM 060453353.mol (via Jmol)
060453511.b3lyp_6-31g(d).inp

060453511.b3lyp_6-31g(d).qchem.inp (generated)

060453511.b3lyp_6-31g(d).gjf (generated)

060453511.b3lyp_6-31g(d).firefly.inp (generated)

060453511.b3lyp_6-31g(d).smash.inp (generated)

060453511.b3lyp_6-31g(d).nwchem.inp (generated) 060453511.b3lyp_6-31g(d).log.xz 060453511.mol 060453511.PUBCHEM 060453511.mol (via Jmol)
060453895.b3lyp_6-31g(d).inp

060453895.b3lyp_6-31g(d).qchem.inp (generated)

060453895.b3lyp_6-31g(d).gjf (generated)

060453895.b3lyp_6-31g(d).firefly.inp (generated)

060453895.b3lyp_6-31g(d).smash.inp (generated)

060453895.b3lyp_6-31g(d).nwchem.inp (generated) 060453895.b3lyp_6-31g(d).log.xz 060453895.td-b3lyp_6-31g+(d).inp 060453895.td-b3lyp_6-31g+(d).log.xz

060453895.td-b3lyp_6-31+g(d).qchem.inp (generated)

060453895.td-b3lyp_6-31+g(d).gjf (generated)

060453895.td-b3lyp_6-31+g(d).firefly.inp (generated)

060453895.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060453895.mol 060453895.PUBCHEM 060453895.mol (via Jmol)
060453932.b3lyp_6-31g(d).inp

060453932.b3lyp_6-31g(d).qchem.inp (generated)

060453932.b3lyp_6-31g(d).gjf (generated)

060453932.b3lyp_6-31g(d).firefly.inp (generated)

060453932.b3lyp_6-31g(d).smash.inp (generated)

060453932.b3lyp_6-31g(d).nwchem.inp (generated) 060453932.b3lyp_6-31g(d).log.xz 060453932.mol 060453932.PUBCHEM 060453932.mol (via Jmol)
060453963.b3lyp_6-31g(d).inp

060453963.b3lyp_6-31g(d).qchem.inp (generated)

060453963.b3lyp_6-31g(d).gjf (generated)

060453963.b3lyp_6-31g(d).firefly.inp (generated)

060453963.b3lyp_6-31g(d).smash.inp (generated)

060453963.b3lyp_6-31g(d).nwchem.inp (generated) 060453963.b3lyp_6-31g(d).log.xz 060453963.td-b3lyp_6-31g+(d).inp 060453963.td-b3lyp_6-31g+(d).log.xz

060453963.td-b3lyp_6-31+g(d).qchem.inp (generated)

060453963.td-b3lyp_6-31+g(d).gjf (generated)

060453963.td-b3lyp_6-31+g(d).firefly.inp (generated)

060453963.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060453963.mol 060453963.PUBCHEM 060453963.mol (via Jmol)
060453966.b3lyp_6-31g(d).inp

060453966.b3lyp_6-31g(d).qchem.inp (generated)

060453966.b3lyp_6-31g(d).gjf (generated)

060453966.b3lyp_6-31g(d).firefly.inp (generated)

060453966.b3lyp_6-31g(d).smash.inp (generated)

060453966.b3lyp_6-31g(d).nwchem.inp (generated) 060453966.b3lyp_6-31g(d).log.xz 060453966.td-b3lyp_6-31g+(d).inp 060453966.td-b3lyp_6-31g+(d).log.xz

060453966.td-b3lyp_6-31+g(d).qchem.inp (generated)

060453966.td-b3lyp_6-31+g(d).gjf (generated)

060453966.td-b3lyp_6-31+g(d).firefly.inp (generated)

060453966.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060453966.mol 060453966.PUBCHEM 060453966.mol (via Jmol)
060453986.b3lyp_6-31g(d).inp

060453986.b3lyp_6-31g(d).qchem.inp (generated)

060453986.b3lyp_6-31g(d).gjf (generated)

060453986.b3lyp_6-31g(d).firefly.inp (generated)

060453986.b3lyp_6-31g(d).smash.inp (generated)

060453986.b3lyp_6-31g(d).nwchem.inp (generated) 060453986.b3lyp_6-31g(d).log.xz 060453986.td-b3lyp_6-31g+(d).inp 060453986.td-b3lyp_6-31g+(d).log.xz

060453986.td-b3lyp_6-31+g(d).qchem.inp (generated)

060453986.td-b3lyp_6-31+g(d).gjf (generated)

060453986.td-b3lyp_6-31+g(d).firefly.inp (generated)

060453986.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060453986.mol 060453986.PUBCHEM 060453986.mol (via Jmol)
060454003.b3lyp_6-31g(d).inp

060454003.b3lyp_6-31g(d).qchem.inp (generated)

060454003.b3lyp_6-31g(d).gjf (generated)

060454003.b3lyp_6-31g(d).firefly.inp (generated)

060454003.b3lyp_6-31g(d).smash.inp (generated)

060454003.b3lyp_6-31g(d).nwchem.inp (generated) 060454003.b3lyp_6-31g(d).log.xz 060454003.td-b3lyp_6-31g+(d).inp 060454003.td-b3lyp_6-31g+(d).log.xz

060454003.td-b3lyp_6-31+g(d).qchem.inp (generated)

060454003.td-b3lyp_6-31+g(d).gjf (generated)

060454003.td-b3lyp_6-31+g(d).firefly.inp (generated)

060454003.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060454003.mol 060454003.PUBCHEM 060454003.mol (via Jmol)
060454091.b3lyp_6-31g(d).inp

060454091.b3lyp_6-31g(d).qchem.inp (generated)

060454091.b3lyp_6-31g(d).gjf (generated)

060454091.b3lyp_6-31g(d).firefly.inp (generated)

060454091.b3lyp_6-31g(d).smash.inp (generated)

060454091.b3lyp_6-31g(d).nwchem.inp (generated) 060454091.b3lyp_6-31g(d).log.xz 060454091.td-b3lyp_6-31g+(d).inp 060454091.td-b3lyp_6-31g+(d).log.xz

060454091.td-b3lyp_6-31+g(d).qchem.inp (generated)

060454091.td-b3lyp_6-31+g(d).gjf (generated)

060454091.td-b3lyp_6-31+g(d).firefly.inp (generated)

060454091.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060454091.mol 060454091.PUBCHEM 060454091.mol (via Jmol)
060454215.b3lyp_6-31g(d).inp

060454215.b3lyp_6-31g(d).qchem.inp (generated)

060454215.b3lyp_6-31g(d).gjf (generated)

060454215.b3lyp_6-31g(d).firefly.inp (generated)

060454215.b3lyp_6-31g(d).smash.inp (generated)

060454215.b3lyp_6-31g(d).nwchem.inp (generated) 060454215.b3lyp_6-31g(d).log.xz 060454215.td-b3lyp_6-31g+(d).inp 060454215.td-b3lyp_6-31g+(d).log.xz

060454215.td-b3lyp_6-31+g(d).qchem.inp (generated)

060454215.td-b3lyp_6-31+g(d).gjf (generated)

060454215.td-b3lyp_6-31+g(d).firefly.inp (generated)

060454215.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060454215.mol 060454215.PUBCHEM 060454215.mol (via Jmol)
060454227.b3lyp_6-31g(d).inp

060454227.b3lyp_6-31g(d).qchem.inp (generated)

060454227.b3lyp_6-31g(d).gjf (generated)

060454227.b3lyp_6-31g(d).firefly.inp (generated)

060454227.b3lyp_6-31g(d).smash.inp (generated)

060454227.b3lyp_6-31g(d).nwchem.inp (generated) 060454227.b3lyp_6-31g(d).log.xz 060454227.td-b3lyp_6-31g+(d).inp 060454227.td-b3lyp_6-31g+(d).log.xz

060454227.td-b3lyp_6-31+g(d).qchem.inp (generated)

060454227.td-b3lyp_6-31+g(d).gjf (generated)

060454227.td-b3lyp_6-31+g(d).firefly.inp (generated)

060454227.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060454227.mol 060454227.PUBCHEM 060454227.mol (via Jmol)
060454259.b3lyp_6-31g(d).inp

060454259.b3lyp_6-31g(d).qchem.inp (generated)

060454259.b3lyp_6-31g(d).gjf (generated)

060454259.b3lyp_6-31g(d).firefly.inp (generated)

060454259.b3lyp_6-31g(d).smash.inp (generated)

060454259.b3lyp_6-31g(d).nwchem.inp (generated) 060454259.b3lyp_6-31g(d).log.xz 060454259.td-b3lyp_6-31g+(d).inp 060454259.td-b3lyp_6-31g+(d).log.xz

060454259.td-b3lyp_6-31+g(d).qchem.inp (generated)

060454259.td-b3lyp_6-31+g(d).gjf (generated)

060454259.td-b3lyp_6-31+g(d).firefly.inp (generated)

060454259.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060454259.mol 060454259.PUBCHEM 060454259.mol (via Jmol)
060454359.b3lyp_6-31g(d).inp

060454359.b3lyp_6-31g(d).qchem.inp (generated)

060454359.b3lyp_6-31g(d).gjf (generated)

060454359.b3lyp_6-31g(d).firefly.inp (generated)

060454359.b3lyp_6-31g(d).smash.inp (generated)

060454359.b3lyp_6-31g(d).nwchem.inp (generated) 060454359.b3lyp_6-31g(d).log.xz 060454359.mol 060454359.PUBCHEM 060454359.mol (via Jmol)
060454405.b3lyp_6-31g(d).inp

060454405.b3lyp_6-31g(d).qchem.inp (generated)

060454405.b3lyp_6-31g(d).gjf (generated)

060454405.b3lyp_6-31g(d).firefly.inp (generated)

060454405.b3lyp_6-31g(d).smash.inp (generated)

060454405.b3lyp_6-31g(d).nwchem.inp (generated) 060454405.b3lyp_6-31g(d).log.xz 060454405.td-b3lyp_6-31g+(d).inp 060454405.td-b3lyp_6-31g+(d).log.xz

060454405.td-b3lyp_6-31+g(d).qchem.inp (generated)

060454405.td-b3lyp_6-31+g(d).gjf (generated)

060454405.td-b3lyp_6-31+g(d).firefly.inp (generated)

060454405.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060454405.mol 060454405.PUBCHEM 060454405.mol (via Jmol)
060454447.b3lyp_6-31g(d).inp

060454447.b3lyp_6-31g(d).qchem.inp (generated)

060454447.b3lyp_6-31g(d).gjf (generated)

060454447.b3lyp_6-31g(d).firefly.inp (generated)

060454447.b3lyp_6-31g(d).smash.inp (generated)

060454447.b3lyp_6-31g(d).nwchem.inp (generated) 060454447.b3lyp_6-31g(d).log.xz 060454447.mol 060454447.PUBCHEM 060454447.mol (via Jmol)
060454474.b3lyp_6-31g(d).inp

060454474.b3lyp_6-31g(d).qchem.inp (generated)

060454474.b3lyp_6-31g(d).gjf (generated)

060454474.b3lyp_6-31g(d).firefly.inp (generated)

060454474.b3lyp_6-31g(d).smash.inp (generated)

060454474.b3lyp_6-31g(d).nwchem.inp (generated) 060454474.b3lyp_6-31g(d).log.xz 060454474.mol 060454474.PUBCHEM 060454474.mol (via Jmol)
060454476.b3lyp_6-31g(d).inp

060454476.b3lyp_6-31g(d).qchem.inp (generated)

060454476.b3lyp_6-31g(d).gjf (generated)

060454476.b3lyp_6-31g(d).firefly.inp (generated)

060454476.b3lyp_6-31g(d).smash.inp (generated)

060454476.b3lyp_6-31g(d).nwchem.inp (generated) 060454476.b3lyp_6-31g(d).log.xz 060454476.td-b3lyp_6-31g+(d).inp 060454476.td-b3lyp_6-31g+(d).log.xz

060454476.td-b3lyp_6-31+g(d).qchem.inp (generated)

060454476.td-b3lyp_6-31+g(d).gjf (generated)

060454476.td-b3lyp_6-31+g(d).firefly.inp (generated)

060454476.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060454476.mol 060454476.PUBCHEM 060454476.mol (via Jmol)
060454483.b3lyp_6-31g(d).inp

060454483.b3lyp_6-31g(d).qchem.inp (generated)

060454483.b3lyp_6-31g(d).gjf (generated)

060454483.b3lyp_6-31g(d).firefly.inp (generated)

060454483.b3lyp_6-31g(d).smash.inp (generated)

060454483.b3lyp_6-31g(d).nwchem.inp (generated) 060454483.b3lyp_6-31g(d).log.xz 060454483.td-b3lyp_6-31g+(d).inp 060454483.td-b3lyp_6-31g+(d).log.xz

060454483.td-b3lyp_6-31+g(d).qchem.inp (generated)

060454483.td-b3lyp_6-31+g(d).gjf (generated)

060454483.td-b3lyp_6-31+g(d).firefly.inp (generated)

060454483.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060454483.mol 060454483.PUBCHEM 060454483.mol (via Jmol)
060454500.b3lyp_6-31g(d).inp

060454500.b3lyp_6-31g(d).qchem.inp (generated)

060454500.b3lyp_6-31g(d).gjf (generated)

060454500.b3lyp_6-31g(d).firefly.inp (generated)

060454500.b3lyp_6-31g(d).smash.inp (generated)

060454500.b3lyp_6-31g(d).nwchem.inp (generated) 060454500.b3lyp_6-31g(d).log.xz 060454500.td-b3lyp_6-31g+(d).inp 060454500.td-b3lyp_6-31g+(d).log.xz

060454500.td-b3lyp_6-31+g(d).qchem.inp (generated)

060454500.td-b3lyp_6-31+g(d).gjf (generated)

060454500.td-b3lyp_6-31+g(d).firefly.inp (generated)

060454500.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060454500.mol 060454500.PUBCHEM 060454500.mol (via Jmol)
060454554.b3lyp_6-31g(d).inp

060454554.b3lyp_6-31g(d).qchem.inp (generated)

060454554.b3lyp_6-31g(d).gjf (generated)

060454554.b3lyp_6-31g(d).firefly.inp (generated)

060454554.b3lyp_6-31g(d).smash.inp (generated)

060454554.b3lyp_6-31g(d).nwchem.inp (generated) 060454554.b3lyp_6-31g(d).log.xz 060454554.td-b3lyp_6-31g+(d).inp 060454554.td-b3lyp_6-31g+(d).log.xz

060454554.td-b3lyp_6-31+g(d).qchem.inp (generated)

060454554.td-b3lyp_6-31+g(d).gjf (generated)

060454554.td-b3lyp_6-31+g(d).firefly.inp (generated)

060454554.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060454554.mol 060454554.PUBCHEM 060454554.mol (via Jmol)
060454588.b3lyp_6-31g(d).inp

060454588.b3lyp_6-31g(d).qchem.inp (generated)

060454588.b3lyp_6-31g(d).gjf (generated)

060454588.b3lyp_6-31g(d).firefly.inp (generated)

060454588.b3lyp_6-31g(d).smash.inp (generated)

060454588.b3lyp_6-31g(d).nwchem.inp (generated) 060454588.b3lyp_6-31g(d).log.xz 060454588.td-b3lyp_6-31g+(d).inp 060454588.td-b3lyp_6-31g+(d).log.xz

060454588.td-b3lyp_6-31+g(d).qchem.inp (generated)

060454588.td-b3lyp_6-31+g(d).gjf (generated)

060454588.td-b3lyp_6-31+g(d).firefly.inp (generated)

060454588.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060454588.mol 060454588.PUBCHEM 060454588.mol (via Jmol)
060454693.b3lyp_6-31g(d).inp

060454693.b3lyp_6-31g(d).qchem.inp (generated)

060454693.b3lyp_6-31g(d).gjf (generated)

060454693.b3lyp_6-31g(d).firefly.inp (generated)

060454693.b3lyp_6-31g(d).smash.inp (generated)

060454693.b3lyp_6-31g(d).nwchem.inp (generated) 060454693.b3lyp_6-31g(d).log.xz 060454693.td-b3lyp_6-31g+(d).inp 060454693.td-b3lyp_6-31g+(d).log.xz

060454693.td-b3lyp_6-31+g(d).qchem.inp (generated)

060454693.td-b3lyp_6-31+g(d).gjf (generated)

060454693.td-b3lyp_6-31+g(d).firefly.inp (generated)

060454693.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060454693.mol 060454693.PUBCHEM 060454693.mol (via Jmol)
060454698.b3lyp_6-31g(d).inp

060454698.b3lyp_6-31g(d).qchem.inp (generated)

060454698.b3lyp_6-31g(d).gjf (generated)

060454698.b3lyp_6-31g(d).firefly.inp (generated)

060454698.b3lyp_6-31g(d).smash.inp (generated)

060454698.b3lyp_6-31g(d).nwchem.inp (generated) 060454698.b3lyp_6-31g(d).log.xz 060454698.td-b3lyp_6-31g+(d).inp 060454698.td-b3lyp_6-31g+(d).log.xz

060454698.td-b3lyp_6-31+g(d).qchem.inp (generated)

060454698.td-b3lyp_6-31+g(d).gjf (generated)

060454698.td-b3lyp_6-31+g(d).firefly.inp (generated)

060454698.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060454698.mol 060454698.PUBCHEM 060454698.mol (via Jmol)
060454775.b3lyp_6-31g(d).inp

060454775.b3lyp_6-31g(d).qchem.inp (generated)

060454775.b3lyp_6-31g(d).gjf (generated)

060454775.b3lyp_6-31g(d).firefly.inp (generated)

060454775.b3lyp_6-31g(d).smash.inp (generated)

060454775.b3lyp_6-31g(d).nwchem.inp (generated) 060454775.b3lyp_6-31g(d).log.xz 060454775.td-b3lyp_6-31g+(d).inp 060454775.td-b3lyp_6-31g+(d).log.xz

060454775.td-b3lyp_6-31+g(d).qchem.inp (generated)

060454775.td-b3lyp_6-31+g(d).gjf (generated)

060454775.td-b3lyp_6-31+g(d).firefly.inp (generated)

060454775.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060454775.mol 060454775.PUBCHEM 060454775.mol (via Jmol)
060454779.b3lyp_6-31g(d).inp

060454779.b3lyp_6-31g(d).qchem.inp (generated)

060454779.b3lyp_6-31g(d).gjf (generated)

060454779.b3lyp_6-31g(d).firefly.inp (generated)

060454779.b3lyp_6-31g(d).smash.inp (generated)

060454779.b3lyp_6-31g(d).nwchem.inp (generated) 060454779.b3lyp_6-31g(d).log.xz 060454779.td-b3lyp_6-31g+(d).inp 060454779.td-b3lyp_6-31g+(d).log.xz

060454779.td-b3lyp_6-31+g(d).qchem.inp (generated)

060454779.td-b3lyp_6-31+g(d).gjf (generated)

060454779.td-b3lyp_6-31+g(d).firefly.inp (generated)

060454779.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060454779.mol 060454779.PUBCHEM 060454779.mol (via Jmol)
060454815.b3lyp_6-31g(d).inp

060454815.b3lyp_6-31g(d).qchem.inp (generated)

060454815.b3lyp_6-31g(d).gjf (generated)

060454815.b3lyp_6-31g(d).firefly.inp (generated)

060454815.b3lyp_6-31g(d).smash.inp (generated)

060454815.b3lyp_6-31g(d).nwchem.inp (generated) 060454815.b3lyp_6-31g(d).log.xz 060454815.td-b3lyp_6-31g+(d).inp 060454815.td-b3lyp_6-31g+(d).log.xz

060454815.td-b3lyp_6-31+g(d).qchem.inp (generated)

060454815.td-b3lyp_6-31+g(d).gjf (generated)

060454815.td-b3lyp_6-31+g(d).firefly.inp (generated)

060454815.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060454815.mol 060454815.PUBCHEM 060454815.mol (via Jmol)
060454840.b3lyp_6-31g(d).inp

060454840.b3lyp_6-31g(d).qchem.inp (generated)

060454840.b3lyp_6-31g(d).gjf (generated)

060454840.b3lyp_6-31g(d).firefly.inp (generated)

060454840.b3lyp_6-31g(d).smash.inp (generated)

060454840.b3lyp_6-31g(d).nwchem.inp (generated) 060454840.b3lyp_6-31g(d).log.xz 060454840.td-b3lyp_6-31g+(d).inp 060454840.td-b3lyp_6-31g+(d).log.xz

060454840.td-b3lyp_6-31+g(d).qchem.inp (generated)

060454840.td-b3lyp_6-31+g(d).gjf (generated)

060454840.td-b3lyp_6-31+g(d).firefly.inp (generated)

060454840.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060454840.mol 060454840.PUBCHEM 060454840.mol (via Jmol)
060454848.b3lyp_6-31g(d).inp

060454848.b3lyp_6-31g(d).qchem.inp (generated)

060454848.b3lyp_6-31g(d).gjf (generated)

060454848.b3lyp_6-31g(d).firefly.inp (generated)

060454848.b3lyp_6-31g(d).smash.inp (generated)

060454848.b3lyp_6-31g(d).nwchem.inp (generated) 060454848.b3lyp_6-31g(d).log.xz 060454848.mol 060454848.PUBCHEM 060454848.mol (via Jmol)
060454957.b3lyp_6-31g(d).inp

060454957.b3lyp_6-31g(d).qchem.inp (generated)

060454957.b3lyp_6-31g(d).gjf (generated)

060454957.b3lyp_6-31g(d).firefly.inp (generated)

060454957.b3lyp_6-31g(d).smash.inp (generated)

060454957.b3lyp_6-31g(d).nwchem.inp (generated) 060454957.b3lyp_6-31g(d).log.xz 060454957.mol 060454957.PUBCHEM 060454957.mol (via Jmol)
060455239.b3lyp_6-31g(d).inp

060455239.b3lyp_6-31g(d).qchem.inp (generated)

060455239.b3lyp_6-31g(d).gjf (generated)

060455239.b3lyp_6-31g(d).firefly.inp (generated)

060455239.b3lyp_6-31g(d).smash.inp (generated)

060455239.b3lyp_6-31g(d).nwchem.inp (generated) 060455239.b3lyp_6-31g(d).log.xz 060455239.td-b3lyp_6-31g+(d).inp 060455239.td-b3lyp_6-31g+(d).log.xz

060455239.td-b3lyp_6-31+g(d).qchem.inp (generated)

060455239.td-b3lyp_6-31+g(d).gjf (generated)

060455239.td-b3lyp_6-31+g(d).firefly.inp (generated)

060455239.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060455239.mol 060455239.PUBCHEM 060455239.mol (via Jmol)
060455261.b3lyp_6-31g(d).inp

060455261.b3lyp_6-31g(d).qchem.inp (generated)

060455261.b3lyp_6-31g(d).gjf (generated)

060455261.b3lyp_6-31g(d).firefly.inp (generated)

060455261.b3lyp_6-31g(d).smash.inp (generated)

060455261.b3lyp_6-31g(d).nwchem.inp (generated) 060455261.b3lyp_6-31g(d).log.xz 060455261.td-b3lyp_6-31g+(d).inp 060455261.td-b3lyp_6-31g+(d).log.xz

060455261.td-b3lyp_6-31+g(d).qchem.inp (generated)

060455261.td-b3lyp_6-31+g(d).gjf (generated)

060455261.td-b3lyp_6-31+g(d).firefly.inp (generated)

060455261.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060455261.mol 060455261.PUBCHEM 060455261.mol (via Jmol)
060455690.b3lyp_6-31g(d).inp

060455690.b3lyp_6-31g(d).qchem.inp (generated)

060455690.b3lyp_6-31g(d).gjf (generated)

060455690.b3lyp_6-31g(d).firefly.inp (generated)

060455690.b3lyp_6-31g(d).smash.inp (generated)

060455690.b3lyp_6-31g(d).nwchem.inp (generated) 060455690.b3lyp_6-31g(d).log.xz 060455690.mol 060455690.PUBCHEM 060455690.mol (via Jmol)
060455881.b3lyp_6-31g(d).inp

060455881.b3lyp_6-31g(d).qchem.inp (generated)

060455881.b3lyp_6-31g(d).gjf (generated)

060455881.b3lyp_6-31g(d).firefly.inp (generated)

060455881.b3lyp_6-31g(d).smash.inp (generated)

060455881.b3lyp_6-31g(d).nwchem.inp (generated) 060455881.b3lyp_6-31g(d).log.xz 060455881.mol 060455881.PUBCHEM 060455881.mol (via Jmol)
060455996.b3lyp_6-31g(d).inp

060455996.b3lyp_6-31g(d).qchem.inp (generated)

060455996.b3lyp_6-31g(d).gjf (generated)

060455996.b3lyp_6-31g(d).firefly.inp (generated)

060455996.b3lyp_6-31g(d).smash.inp (generated)

060455996.b3lyp_6-31g(d).nwchem.inp (generated) 060455996.b3lyp_6-31g(d).log.xz 060455996.td-b3lyp_6-31g+(d).inp 060455996.td-b3lyp_6-31g+(d).log.xz

060455996.td-b3lyp_6-31+g(d).qchem.inp (generated)

060455996.td-b3lyp_6-31+g(d).gjf (generated)

060455996.td-b3lyp_6-31+g(d).firefly.inp (generated)

060455996.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060455996.mol 060455996.PUBCHEM 060455996.mol (via Jmol)
060456206.b3lyp_6-31g(d).inp

060456206.b3lyp_6-31g(d).qchem.inp (generated)

060456206.b3lyp_6-31g(d).gjf (generated)

060456206.b3lyp_6-31g(d).firefly.inp (generated)

060456206.b3lyp_6-31g(d).smash.inp (generated)

060456206.b3lyp_6-31g(d).nwchem.inp (generated) 060456206.b3lyp_6-31g(d).log.xz 060456206.td-b3lyp_6-31g+(d).inp 060456206.td-b3lyp_6-31g+(d).log.xz

060456206.td-b3lyp_6-31+g(d).qchem.inp (generated)

060456206.td-b3lyp_6-31+g(d).gjf (generated)

060456206.td-b3lyp_6-31+g(d).firefly.inp (generated)

060456206.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060456206.mol 060456206.PUBCHEM 060456206.mol (via Jmol)
060456300.b3lyp_6-31g(d).inp

060456300.b3lyp_6-31g(d).qchem.inp (generated)

060456300.b3lyp_6-31g(d).gjf (generated)

060456300.b3lyp_6-31g(d).firefly.inp (generated)

060456300.b3lyp_6-31g(d).smash.inp (generated)

060456300.b3lyp_6-31g(d).nwchem.inp (generated) 060456300.b3lyp_6-31g(d).log.xz 060456300.td-b3lyp_6-31g+(d).inp 060456300.td-b3lyp_6-31g+(d).log.xz

060456300.td-b3lyp_6-31+g(d).qchem.inp (generated)

060456300.td-b3lyp_6-31+g(d).gjf (generated)

060456300.td-b3lyp_6-31+g(d).firefly.inp (generated)

060456300.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060456300.mol 060456300.PUBCHEM 060456300.mol (via Jmol)
060456349.b3lyp_6-31g(d).inp

060456349.b3lyp_6-31g(d).qchem.inp (generated)

060456349.b3lyp_6-31g(d).gjf (generated)

060456349.b3lyp_6-31g(d).firefly.inp (generated)

060456349.b3lyp_6-31g(d).smash.inp (generated)

060456349.b3lyp_6-31g(d).nwchem.inp (generated) 060456349.b3lyp_6-31g(d).log.xz 060456349.td-b3lyp_6-31g+(d).inp 060456349.td-b3lyp_6-31g+(d).log.xz

060456349.td-b3lyp_6-31+g(d).qchem.inp (generated)

060456349.td-b3lyp_6-31+g(d).gjf (generated)

060456349.td-b3lyp_6-31+g(d).firefly.inp (generated)

060456349.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060456349.mol 060456349.PUBCHEM 060456349.mol (via Jmol)
060456508.b3lyp_6-31g(d).inp

060456508.b3lyp_6-31g(d).qchem.inp (generated)

060456508.b3lyp_6-31g(d).gjf (generated)

060456508.b3lyp_6-31g(d).firefly.inp (generated)

060456508.b3lyp_6-31g(d).smash.inp (generated)

060456508.b3lyp_6-31g(d).nwchem.inp (generated) 060456508.b3lyp_6-31g(d).log.xz 060456508.td-b3lyp_6-31g+(d).inp 060456508.td-b3lyp_6-31g+(d).log.xz

060456508.td-b3lyp_6-31+g(d).qchem.inp (generated)

060456508.td-b3lyp_6-31+g(d).gjf (generated)

060456508.td-b3lyp_6-31+g(d).firefly.inp (generated)

060456508.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060456508.mol 060456508.PUBCHEM 060456508.mol (via Jmol)
060456981.b3lyp_6-31g(d).inp

060456981.b3lyp_6-31g(d).qchem.inp (generated)

060456981.b3lyp_6-31g(d).gjf (generated)

060456981.b3lyp_6-31g(d).firefly.inp (generated)

060456981.b3lyp_6-31g(d).smash.inp (generated)

060456981.b3lyp_6-31g(d).nwchem.inp (generated) 060456981.b3lyp_6-31g(d).log.xz 060456981.td-b3lyp_6-31g+(d).inp 060456981.td-b3lyp_6-31g+(d).log.xz

060456981.td-b3lyp_6-31+g(d).qchem.inp (generated)

060456981.td-b3lyp_6-31+g(d).gjf (generated)

060456981.td-b3lyp_6-31+g(d).firefly.inp (generated)

060456981.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060456981.mol 060456981.PUBCHEM 060456981.mol (via Jmol)
060457003.b3lyp_6-31g(d).inp

060457003.b3lyp_6-31g(d).qchem.inp (generated)

060457003.b3lyp_6-31g(d).gjf (generated)

060457003.b3lyp_6-31g(d).firefly.inp (generated)

060457003.b3lyp_6-31g(d).smash.inp (generated)

060457003.b3lyp_6-31g(d).nwchem.inp (generated) 060457003.b3lyp_6-31g(d).log.xz 060457003.mol 060457003.PUBCHEM 060457003.mol (via Jmol)
060457016.b3lyp_6-31g(d).inp

060457016.b3lyp_6-31g(d).qchem.inp (generated)

060457016.b3lyp_6-31g(d).gjf (generated)

060457016.b3lyp_6-31g(d).firefly.inp (generated)

060457016.b3lyp_6-31g(d).smash.inp (generated)

060457016.b3lyp_6-31g(d).nwchem.inp (generated) 060457016.b3lyp_6-31g(d).log.xz 060457016.td-b3lyp_6-31g+(d).inp 060457016.td-b3lyp_6-31g+(d).log.xz

060457016.td-b3lyp_6-31+g(d).qchem.inp (generated)

060457016.td-b3lyp_6-31+g(d).gjf (generated)

060457016.td-b3lyp_6-31+g(d).firefly.inp (generated)

060457016.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060457016.mol 060457016.PUBCHEM 060457016.mol (via Jmol)
060457055.b3lyp_6-31g(d).inp

060457055.b3lyp_6-31g(d).qchem.inp (generated)

060457055.b3lyp_6-31g(d).gjf (generated)

060457055.b3lyp_6-31g(d).firefly.inp (generated)

060457055.b3lyp_6-31g(d).smash.inp (generated)

060457055.b3lyp_6-31g(d).nwchem.inp (generated) 060457055.b3lyp_6-31g(d).log.xz 060457055.td-b3lyp_6-31g+(d).inp 060457055.td-b3lyp_6-31g+(d).log.xz

060457055.td-b3lyp_6-31+g(d).qchem.inp (generated)

060457055.td-b3lyp_6-31+g(d).gjf (generated)

060457055.td-b3lyp_6-31+g(d).firefly.inp (generated)

060457055.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060457055.mol 060457055.PUBCHEM 060457055.mol (via Jmol)
060457067.b3lyp_6-31g(d).inp

060457067.b3lyp_6-31g(d).qchem.inp (generated)

060457067.b3lyp_6-31g(d).gjf (generated)

060457067.b3lyp_6-31g(d).firefly.inp (generated)

060457067.b3lyp_6-31g(d).smash.inp (generated)

060457067.b3lyp_6-31g(d).nwchem.inp (generated) 060457067.b3lyp_6-31g(d).log.xz 060457067.td-b3lyp_6-31g+(d).inp 060457067.td-b3lyp_6-31g+(d).log.xz

060457067.td-b3lyp_6-31+g(d).qchem.inp (generated)

060457067.td-b3lyp_6-31+g(d).gjf (generated)

060457067.td-b3lyp_6-31+g(d).firefly.inp (generated)

060457067.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060457067.mol 060457067.PUBCHEM 060457067.mol (via Jmol)
060457253.b3lyp_6-31g(d).inp

060457253.b3lyp_6-31g(d).qchem.inp (generated)

060457253.b3lyp_6-31g(d).gjf (generated)

060457253.b3lyp_6-31g(d).firefly.inp (generated)

060457253.b3lyp_6-31g(d).smash.inp (generated)

060457253.b3lyp_6-31g(d).nwchem.inp (generated) 060457253.b3lyp_6-31g(d).log.xz 060457253.td-b3lyp_6-31g+(d).inp 060457253.td-b3lyp_6-31g+(d).log.xz

060457253.td-b3lyp_6-31+g(d).qchem.inp (generated)

060457253.td-b3lyp_6-31+g(d).gjf (generated)

060457253.td-b3lyp_6-31+g(d).firefly.inp (generated)

060457253.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060457253.mol 060457253.PUBCHEM 060457253.mol (via Jmol)
060457260.b3lyp_6-31g(d).inp

060457260.b3lyp_6-31g(d).qchem.inp (generated)

060457260.b3lyp_6-31g(d).gjf (generated)

060457260.b3lyp_6-31g(d).firefly.inp (generated)

060457260.b3lyp_6-31g(d).smash.inp (generated)

060457260.b3lyp_6-31g(d).nwchem.inp (generated) 060457260.b3lyp_6-31g(d).log.xz 060457260.td-b3lyp_6-31g+(d).inp 060457260.td-b3lyp_6-31g+(d).log.xz

060457260.td-b3lyp_6-31+g(d).qchem.inp (generated)

060457260.td-b3lyp_6-31+g(d).gjf (generated)

060457260.td-b3lyp_6-31+g(d).firefly.inp (generated)

060457260.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060457260.mol 060457260.PUBCHEM 060457260.mol (via Jmol)
060458842.b3lyp_6-31g(d).inp

060458842.b3lyp_6-31g(d).qchem.inp (generated)

060458842.b3lyp_6-31g(d).gjf (generated)

060458842.b3lyp_6-31g(d).firefly.inp (generated)

060458842.b3lyp_6-31g(d).smash.inp (generated)

060458842.b3lyp_6-31g(d).nwchem.inp (generated) 060458842.b3lyp_6-31g(d).log.xz 060458842.mol 060458842.PUBCHEM 060458842.mol (via Jmol)
060458918.b3lyp_6-31g(d).inp

060458918.b3lyp_6-31g(d).qchem.inp (generated)

060458918.b3lyp_6-31g(d).gjf (generated)

060458918.b3lyp_6-31g(d).firefly.inp (generated)

060458918.b3lyp_6-31g(d).smash.inp (generated)

060458918.b3lyp_6-31g(d).nwchem.inp (generated) 060458918.b3lyp_6-31g(d).log.xz 060458918.mol 060458918.PUBCHEM 060458918.mol (via Jmol)
060458942.b3lyp_6-31g(d).inp

060458942.b3lyp_6-31g(d).qchem.inp (generated)

060458942.b3lyp_6-31g(d).gjf (generated)

060458942.b3lyp_6-31g(d).firefly.inp (generated)

060458942.b3lyp_6-31g(d).smash.inp (generated)

060458942.b3lyp_6-31g(d).nwchem.inp (generated) 060458942.b3lyp_6-31g(d).log.xz 060458942.td-b3lyp_6-31g+(d).inp 060458942.td-b3lyp_6-31g+(d).log.xz

060458942.td-b3lyp_6-31+g(d).qchem.inp (generated)

060458942.td-b3lyp_6-31+g(d).gjf (generated)

060458942.td-b3lyp_6-31+g(d).firefly.inp (generated)

060458942.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060458942.mol 060458942.PUBCHEM 060458942.mol (via Jmol)
060458992.b3lyp_6-31g(d).inp

060458992.b3lyp_6-31g(d).qchem.inp (generated)

060458992.b3lyp_6-31g(d).gjf (generated)

060458992.b3lyp_6-31g(d).firefly.inp (generated)

060458992.b3lyp_6-31g(d).smash.inp (generated)

060458992.b3lyp_6-31g(d).nwchem.inp (generated) 060458992.b3lyp_6-31g(d).log.xz 060458992.td-b3lyp_6-31g+(d).inp 060458992.td-b3lyp_6-31g+(d).log.xz

060458992.td-b3lyp_6-31+g(d).qchem.inp (generated)

060458992.td-b3lyp_6-31+g(d).gjf (generated)

060458992.td-b3lyp_6-31+g(d).firefly.inp (generated)

060458992.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060458992.mol 060458992.PUBCHEM 060458992.mol (via Jmol)
060459046.b3lyp_6-31g(d).inp

060459046.b3lyp_6-31g(d).qchem.inp (generated)

060459046.b3lyp_6-31g(d).gjf (generated)

060459046.b3lyp_6-31g(d).firefly.inp (generated)

060459046.b3lyp_6-31g(d).smash.inp (generated)

060459046.b3lyp_6-31g(d).nwchem.inp (generated) 060459046.b3lyp_6-31g(d).log.xz 060459046.td-b3lyp_6-31g+(d).inp 060459046.td-b3lyp_6-31g+(d).log.xz

060459046.td-b3lyp_6-31+g(d).qchem.inp (generated)

060459046.td-b3lyp_6-31+g(d).gjf (generated)

060459046.td-b3lyp_6-31+g(d).firefly.inp (generated)

060459046.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060459046.mol 060459046.PUBCHEM 060459046.mol (via Jmol)
060459109.b3lyp_6-31g(d).inp

060459109.b3lyp_6-31g(d).qchem.inp (generated)

060459109.b3lyp_6-31g(d).gjf (generated)

060459109.b3lyp_6-31g(d).firefly.inp (generated)

060459109.b3lyp_6-31g(d).smash.inp (generated)

060459109.b3lyp_6-31g(d).nwchem.inp (generated) 060459109.b3lyp_6-31g(d).log.xz 060459109.td-b3lyp_6-31g+(d).inp 060459109.td-b3lyp_6-31g+(d).log.xz

060459109.td-b3lyp_6-31+g(d).qchem.inp (generated)

060459109.td-b3lyp_6-31+g(d).gjf (generated)

060459109.td-b3lyp_6-31+g(d).firefly.inp (generated)

060459109.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060459109.mol 060459109.PUBCHEM 060459109.mol (via Jmol)
060459125.b3lyp_6-31g(d).inp

060459125.b3lyp_6-31g(d).qchem.inp (generated)

060459125.b3lyp_6-31g(d).gjf (generated)

060459125.b3lyp_6-31g(d).firefly.inp (generated)

060459125.b3lyp_6-31g(d).smash.inp (generated)

060459125.b3lyp_6-31g(d).nwchem.inp (generated) 060459125.b3lyp_6-31g(d).log.xz 060459125.td-b3lyp_6-31g+(d).inp 060459125.td-b3lyp_6-31g+(d).log.xz

060459125.td-b3lyp_6-31+g(d).qchem.inp (generated)

060459125.td-b3lyp_6-31+g(d).gjf (generated)

060459125.td-b3lyp_6-31+g(d).firefly.inp (generated)

060459125.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060459125.mol 060459125.PUBCHEM 060459125.mol (via Jmol)
060459202.b3lyp_6-31g(d).inp

060459202.b3lyp_6-31g(d).qchem.inp (generated)

060459202.b3lyp_6-31g(d).gjf (generated)

060459202.b3lyp_6-31g(d).firefly.inp (generated)

060459202.b3lyp_6-31g(d).smash.inp (generated)

060459202.b3lyp_6-31g(d).nwchem.inp (generated) 060459202.b3lyp_6-31g(d).log.xz 060459202.td-b3lyp_6-31g+(d).inp 060459202.td-b3lyp_6-31g+(d).log.xz

060459202.td-b3lyp_6-31+g(d).qchem.inp (generated)

060459202.td-b3lyp_6-31+g(d).gjf (generated)

060459202.td-b3lyp_6-31+g(d).firefly.inp (generated)

060459202.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060459202.mol 060459202.PUBCHEM 060459202.mol (via Jmol)
060459217.b3lyp_6-31g(d).inp

060459217.b3lyp_6-31g(d).qchem.inp (generated)

060459217.b3lyp_6-31g(d).gjf (generated)

060459217.b3lyp_6-31g(d).firefly.inp (generated)

060459217.b3lyp_6-31g(d).smash.inp (generated)

060459217.b3lyp_6-31g(d).nwchem.inp (generated) 060459217.b3lyp_6-31g(d).log.xz 060459217.td-b3lyp_6-31g+(d).inp 060459217.td-b3lyp_6-31g+(d).log.xz

060459217.td-b3lyp_6-31+g(d).qchem.inp (generated)

060459217.td-b3lyp_6-31+g(d).gjf (generated)

060459217.td-b3lyp_6-31+g(d).firefly.inp (generated)

060459217.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060459217.mol 060459217.PUBCHEM 060459217.mol (via Jmol)
060459236.b3lyp_6-31g(d).inp

060459236.b3lyp_6-31g(d).qchem.inp (generated)

060459236.b3lyp_6-31g(d).gjf (generated)

060459236.b3lyp_6-31g(d).firefly.inp (generated)

060459236.b3lyp_6-31g(d).smash.inp (generated)

060459236.b3lyp_6-31g(d).nwchem.inp (generated) 060459236.b3lyp_6-31g(d).log.xz 060459236.mol 060459236.PUBCHEM 060459236.mol (via Jmol)
060459270.b3lyp_6-31g(d).inp

060459270.b3lyp_6-31g(d).qchem.inp (generated)

060459270.b3lyp_6-31g(d).gjf (generated)

060459270.b3lyp_6-31g(d).firefly.inp (generated)

060459270.b3lyp_6-31g(d).smash.inp (generated)

060459270.b3lyp_6-31g(d).nwchem.inp (generated) 060459270.b3lyp_6-31g(d).log.xz 060459270.td-b3lyp_6-31g+(d).inp 060459270.td-b3lyp_6-31g+(d).log.xz

060459270.td-b3lyp_6-31+g(d).qchem.inp (generated)

060459270.td-b3lyp_6-31+g(d).gjf (generated)

060459270.td-b3lyp_6-31+g(d).firefly.inp (generated)

060459270.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060459270.mol 060459270.PUBCHEM 060459270.mol (via Jmol)
060459300.b3lyp_6-31g(d).inp

060459300.b3lyp_6-31g(d).qchem.inp (generated)

060459300.b3lyp_6-31g(d).gjf (generated)

060459300.b3lyp_6-31g(d).firefly.inp (generated)

060459300.b3lyp_6-31g(d).smash.inp (generated)

060459300.b3lyp_6-31g(d).nwchem.inp (generated) 060459300.b3lyp_6-31g(d).log.xz 060459300.mol 060459300.PUBCHEM 060459300.mol (via Jmol)
060459365.b3lyp_6-31g(d).inp

060459365.b3lyp_6-31g(d).qchem.inp (generated)

060459365.b3lyp_6-31g(d).gjf (generated)

060459365.b3lyp_6-31g(d).firefly.inp (generated)

060459365.b3lyp_6-31g(d).smash.inp (generated)

060459365.b3lyp_6-31g(d).nwchem.inp (generated) 060459365.b3lyp_6-31g(d).log.xz 060459365.td-b3lyp_6-31g+(d).inp 060459365.td-b3lyp_6-31g+(d).log.xz

060459365.td-b3lyp_6-31+g(d).qchem.inp (generated)

060459365.td-b3lyp_6-31+g(d).gjf (generated)

060459365.td-b3lyp_6-31+g(d).firefly.inp (generated)

060459365.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060459365.mol 060459365.PUBCHEM 060459365.mol (via Jmol)
060459379.b3lyp_6-31g(d).inp

060459379.b3lyp_6-31g(d).qchem.inp (generated)

060459379.b3lyp_6-31g(d).gjf (generated)

060459379.b3lyp_6-31g(d).firefly.inp (generated)

060459379.b3lyp_6-31g(d).smash.inp (generated)

060459379.b3lyp_6-31g(d).nwchem.inp (generated) 060459379.b3lyp_6-31g(d).log.xz 060459379.td-b3lyp_6-31g+(d).inp 060459379.td-b3lyp_6-31g+(d).log.xz

060459379.td-b3lyp_6-31+g(d).qchem.inp (generated)

060459379.td-b3lyp_6-31+g(d).gjf (generated)

060459379.td-b3lyp_6-31+g(d).firefly.inp (generated)

060459379.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060459379.mol 060459379.PUBCHEM 060459379.mol (via Jmol)
060459401.b3lyp_6-31g(d).inp

060459401.b3lyp_6-31g(d).qchem.inp (generated)

060459401.b3lyp_6-31g(d).gjf (generated)

060459401.b3lyp_6-31g(d).firefly.inp (generated)

060459401.b3lyp_6-31g(d).smash.inp (generated)

060459401.b3lyp_6-31g(d).nwchem.inp (generated) 060459401.b3lyp_6-31g(d).log.xz 060459401.td-b3lyp_6-31g+(d).inp 060459401.td-b3lyp_6-31g+(d).log.xz

060459401.td-b3lyp_6-31+g(d).qchem.inp (generated)

060459401.td-b3lyp_6-31+g(d).gjf (generated)

060459401.td-b3lyp_6-31+g(d).firefly.inp (generated)

060459401.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060459401.mol 060459401.PUBCHEM 060459401.mol (via Jmol)
060460053.b3lyp_6-31g(d).inp

060460053.b3lyp_6-31g(d).qchem.inp (generated)

060460053.b3lyp_6-31g(d).gjf (generated)

060460053.b3lyp_6-31g(d).firefly.inp (generated)

060460053.b3lyp_6-31g(d).smash.inp (generated)

060460053.b3lyp_6-31g(d).nwchem.inp (generated) 060460053.b3lyp_6-31g(d).log.xz 060460053.td-b3lyp_6-31g+(d).inp 060460053.td-b3lyp_6-31g+(d).log.xz

060460053.td-b3lyp_6-31+g(d).qchem.inp (generated)

060460053.td-b3lyp_6-31+g(d).gjf (generated)

060460053.td-b3lyp_6-31+g(d).firefly.inp (generated)

060460053.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060460053.mol 060460053.PUBCHEM 060460053.mol (via Jmol)
060460059.b3lyp_6-31g(d).inp

060460059.b3lyp_6-31g(d).qchem.inp (generated)

060460059.b3lyp_6-31g(d).gjf (generated)

060460059.b3lyp_6-31g(d).firefly.inp (generated)

060460059.b3lyp_6-31g(d).smash.inp (generated)

060460059.b3lyp_6-31g(d).nwchem.inp (generated) 060460059.b3lyp_6-31g(d).log.xz 060460059.td-b3lyp_6-31g+(d).inp 060460059.td-b3lyp_6-31g+(d).log.xz

060460059.td-b3lyp_6-31+g(d).qchem.inp (generated)

060460059.td-b3lyp_6-31+g(d).gjf (generated)

060460059.td-b3lyp_6-31+g(d).firefly.inp (generated)

060460059.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060460059.mol 060460059.PUBCHEM 060460059.mol (via Jmol)
060461155.b3lyp_6-31g(d).inp

060461155.b3lyp_6-31g(d).qchem.inp (generated)

060461155.b3lyp_6-31g(d).gjf (generated)

060461155.b3lyp_6-31g(d).firefly.inp (generated)

060461155.b3lyp_6-31g(d).smash.inp (generated)

060461155.b3lyp_6-31g(d).nwchem.inp (generated) 060461155.b3lyp_6-31g(d).log.xz 060461155.mol 060461155.PUBCHEM 060461155.mol (via Jmol)
060462327.b3lyp_6-31g(d).inp

060462327.b3lyp_6-31g(d).qchem.inp (generated)

060462327.b3lyp_6-31g(d).gjf (generated)

060462327.b3lyp_6-31g(d).firefly.inp (generated)

060462327.b3lyp_6-31g(d).smash.inp (generated)

060462327.b3lyp_6-31g(d).nwchem.inp (generated) 060462327.b3lyp_6-31g(d).log.xz 060462327.mol 060462327.PUBCHEM 060462327.mol (via Jmol)
060462404.b3lyp_6-31g(d).inp

060462404.b3lyp_6-31g(d).qchem.inp (generated)

060462404.b3lyp_6-31g(d).gjf (generated)

060462404.b3lyp_6-31g(d).firefly.inp (generated)

060462404.b3lyp_6-31g(d).smash.inp (generated)

060462404.b3lyp_6-31g(d).nwchem.inp (generated) 060462404.b3lyp_6-31g(d).log.xz 060462404.td-b3lyp_6-31g+(d).inp 060462404.td-b3lyp_6-31g+(d).log.xz

060462404.td-b3lyp_6-31+g(d).qchem.inp (generated)

060462404.td-b3lyp_6-31+g(d).gjf (generated)

060462404.td-b3lyp_6-31+g(d).firefly.inp (generated)

060462404.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060462404.mol 060462404.PUBCHEM 060462404.mol (via Jmol)
060462436.b3lyp_6-31g(d).inp

060462436.b3lyp_6-31g(d).qchem.inp (generated)

060462436.b3lyp_6-31g(d).gjf (generated)

060462436.b3lyp_6-31g(d).firefly.inp (generated)

060462436.b3lyp_6-31g(d).smash.inp (generated)

060462436.b3lyp_6-31g(d).nwchem.inp (generated) 060462436.b3lyp_6-31g(d).log.xz 060462436.mol 060462436.PUBCHEM 060462436.mol (via Jmol)
060462441.b3lyp_6-31g(d).inp

060462441.b3lyp_6-31g(d).qchem.inp (generated)

060462441.b3lyp_6-31g(d).gjf (generated)

060462441.b3lyp_6-31g(d).firefly.inp (generated)

060462441.b3lyp_6-31g(d).smash.inp (generated)

060462441.b3lyp_6-31g(d).nwchem.inp (generated) 060462441.b3lyp_6-31g(d).log.xz 060462441.td-b3lyp_6-31g+(d).inp 060462441.td-b3lyp_6-31g+(d).log.xz

060462441.td-b3lyp_6-31+g(d).qchem.inp (generated)

060462441.td-b3lyp_6-31+g(d).gjf (generated)

060462441.td-b3lyp_6-31+g(d).firefly.inp (generated)

060462441.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060462441.mol 060462441.PUBCHEM 060462441.mol (via Jmol)
060462558.b3lyp_6-31g(d).inp

060462558.b3lyp_6-31g(d).qchem.inp (generated)

060462558.b3lyp_6-31g(d).gjf (generated)

060462558.b3lyp_6-31g(d).firefly.inp (generated)

060462558.b3lyp_6-31g(d).smash.inp (generated)

060462558.b3lyp_6-31g(d).nwchem.inp (generated) 060462558.b3lyp_6-31g(d).log.xz 060462558.td-b3lyp_6-31g+(d).inp 060462558.td-b3lyp_6-31g+(d).log.xz

060462558.td-b3lyp_6-31+g(d).qchem.inp (generated)

060462558.td-b3lyp_6-31+g(d).gjf (generated)

060462558.td-b3lyp_6-31+g(d).firefly.inp (generated)

060462558.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060462558.mol 060462558.PUBCHEM 060462558.mol (via Jmol)
060462645.b3lyp_6-31g(d).inp

060462645.b3lyp_6-31g(d).qchem.inp (generated)

060462645.b3lyp_6-31g(d).gjf (generated)

060462645.b3lyp_6-31g(d).firefly.inp (generated)

060462645.b3lyp_6-31g(d).smash.inp (generated)

060462645.b3lyp_6-31g(d).nwchem.inp (generated) 060462645.b3lyp_6-31g(d).log.xz 060462645.td-b3lyp_6-31g+(d).inp 060462645.td-b3lyp_6-31g+(d).log.xz

060462645.td-b3lyp_6-31+g(d).qchem.inp (generated)

060462645.td-b3lyp_6-31+g(d).gjf (generated)

060462645.td-b3lyp_6-31+g(d).firefly.inp (generated)

060462645.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060462645.mol 060462645.PUBCHEM 060462645.mol (via Jmol)
060462913.b3lyp_6-31g(d).inp

060462913.b3lyp_6-31g(d).qchem.inp (generated)

060462913.b3lyp_6-31g(d).gjf (generated)

060462913.b3lyp_6-31g(d).firefly.inp (generated)

060462913.b3lyp_6-31g(d).smash.inp (generated)

060462913.b3lyp_6-31g(d).nwchem.inp (generated) 060462913.b3lyp_6-31g(d).log.xz 060462913.td-b3lyp_6-31g+(d).inp 060462913.td-b3lyp_6-31g+(d).log.xz

060462913.td-b3lyp_6-31+g(d).qchem.inp (generated)

060462913.td-b3lyp_6-31+g(d).gjf (generated)

060462913.td-b3lyp_6-31+g(d).firefly.inp (generated)

060462913.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060462913.mol 060462913.PUBCHEM 060462913.mol (via Jmol)
060462928.b3lyp_6-31g(d).inp

060462928.b3lyp_6-31g(d).qchem.inp (generated)

060462928.b3lyp_6-31g(d).gjf (generated)

060462928.b3lyp_6-31g(d).firefly.inp (generated)

060462928.b3lyp_6-31g(d).smash.inp (generated)

060462928.b3lyp_6-31g(d).nwchem.inp (generated) 060462928.b3lyp_6-31g(d).log.xz 060462928.td-b3lyp_6-31g+(d).inp 060462928.td-b3lyp_6-31g+(d).log.xz

060462928.td-b3lyp_6-31+g(d).qchem.inp (generated)

060462928.td-b3lyp_6-31+g(d).gjf (generated)

060462928.td-b3lyp_6-31+g(d).firefly.inp (generated)

060462928.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060462928.mol 060462928.PUBCHEM 060462928.mol (via Jmol)
060463313.b3lyp_6-31g(d).inp

060463313.b3lyp_6-31g(d).qchem.inp (generated)

060463313.b3lyp_6-31g(d).gjf (generated)

060463313.b3lyp_6-31g(d).firefly.inp (generated)

060463313.b3lyp_6-31g(d).smash.inp (generated)

060463313.b3lyp_6-31g(d).nwchem.inp (generated) 060463313.b3lyp_6-31g(d).log.xz 060463313.td-b3lyp_6-31g+(d).inp 060463313.td-b3lyp_6-31g+(d).log.xz

060463313.td-b3lyp_6-31+g(d).qchem.inp (generated)

060463313.td-b3lyp_6-31+g(d).gjf (generated)

060463313.td-b3lyp_6-31+g(d).firefly.inp (generated)

060463313.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060463313.mol 060463313.PUBCHEM 060463313.mol (via Jmol)
060463505.b3lyp_6-31g(d).inp

060463505.b3lyp_6-31g(d).qchem.inp (generated)

060463505.b3lyp_6-31g(d).gjf (generated)

060463505.b3lyp_6-31g(d).firefly.inp (generated)

060463505.b3lyp_6-31g(d).smash.inp (generated)

060463505.b3lyp_6-31g(d).nwchem.inp (generated) 060463505.b3lyp_6-31g(d).log.xz 060463505.td-b3lyp_6-31g+(d).inp 060463505.td-b3lyp_6-31g+(d).log.xz

060463505.td-b3lyp_6-31+g(d).qchem.inp (generated)

060463505.td-b3lyp_6-31+g(d).gjf (generated)

060463505.td-b3lyp_6-31+g(d).firefly.inp (generated)

060463505.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060463505.mol 060463505.PUBCHEM 060463505.mol (via Jmol)
060463875.b3lyp_6-31g(d).inp

060463875.b3lyp_6-31g(d).qchem.inp (generated)

060463875.b3lyp_6-31g(d).gjf (generated)

060463875.b3lyp_6-31g(d).firefly.inp (generated)

060463875.b3lyp_6-31g(d).smash.inp (generated)

060463875.b3lyp_6-31g(d).nwchem.inp (generated) 060463875.b3lyp_6-31g(d).log.xz 060463875.td-b3lyp_6-31g+(d).inp 060463875.td-b3lyp_6-31g+(d).log.xz

060463875.td-b3lyp_6-31+g(d).qchem.inp (generated)

060463875.td-b3lyp_6-31+g(d).gjf (generated)

060463875.td-b3lyp_6-31+g(d).firefly.inp (generated)

060463875.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060463875.mol 060463875.PUBCHEM 060463875.mol (via Jmol)
060464498.b3lyp_6-31g(d).inp

060464498.b3lyp_6-31g(d).qchem.inp (generated)

060464498.b3lyp_6-31g(d).gjf (generated)

060464498.b3lyp_6-31g(d).firefly.inp (generated)

060464498.b3lyp_6-31g(d).smash.inp (generated)

060464498.b3lyp_6-31g(d).nwchem.inp (generated) 060464498.b3lyp_6-31g(d).log.xz 060464498.td-b3lyp_6-31g+(d).inp 060464498.td-b3lyp_6-31g+(d).log.xz

060464498.td-b3lyp_6-31+g(d).qchem.inp (generated)

060464498.td-b3lyp_6-31+g(d).gjf (generated)

060464498.td-b3lyp_6-31+g(d).firefly.inp (generated)

060464498.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060464498.mol 060464498.PUBCHEM 060464498.mol (via Jmol)
060465140.b3lyp_6-31g(d).inp

060465140.b3lyp_6-31g(d).qchem.inp (generated)

060465140.b3lyp_6-31g(d).gjf (generated)

060465140.b3lyp_6-31g(d).firefly.inp (generated)

060465140.b3lyp_6-31g(d).smash.inp (generated)

060465140.b3lyp_6-31g(d).nwchem.inp (generated) 060465140.b3lyp_6-31g(d).log.xz 060465140.td-b3lyp_6-31g+(d).inp 060465140.td-b3lyp_6-31g+(d).log.xz

060465140.td-b3lyp_6-31+g(d).qchem.inp (generated)

060465140.td-b3lyp_6-31+g(d).gjf (generated)

060465140.td-b3lyp_6-31+g(d).firefly.inp (generated)

060465140.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060465140.mol 060465140.PUBCHEM 060465140.mol (via Jmol)
060465141.b3lyp_6-31g(d).inp

060465141.b3lyp_6-31g(d).qchem.inp (generated)

060465141.b3lyp_6-31g(d).gjf (generated)

060465141.b3lyp_6-31g(d).firefly.inp (generated)

060465141.b3lyp_6-31g(d).smash.inp (generated)

060465141.b3lyp_6-31g(d).nwchem.inp (generated) 060465141.b3lyp_6-31g(d).log.xz 060465141.mol 060465141.PUBCHEM 060465141.mol (via Jmol)
060465164.b3lyp_6-31g(d).inp

060465164.b3lyp_6-31g(d).qchem.inp (generated)

060465164.b3lyp_6-31g(d).gjf (generated)

060465164.b3lyp_6-31g(d).firefly.inp (generated)

060465164.b3lyp_6-31g(d).smash.inp (generated)

060465164.b3lyp_6-31g(d).nwchem.inp (generated) 060465164.b3lyp_6-31g(d).log.xz 060465164.td-b3lyp_6-31g+(d).inp 060465164.td-b3lyp_6-31g+(d).log.xz

060465164.td-b3lyp_6-31+g(d).qchem.inp (generated)

060465164.td-b3lyp_6-31+g(d).gjf (generated)

060465164.td-b3lyp_6-31+g(d).firefly.inp (generated)

060465164.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060465164.mol 060465164.PUBCHEM 060465164.mol (via Jmol)
060465325.b3lyp_6-31g(d).inp

060465325.b3lyp_6-31g(d).qchem.inp (generated)

060465325.b3lyp_6-31g(d).gjf (generated)

060465325.b3lyp_6-31g(d).firefly.inp (generated)

060465325.b3lyp_6-31g(d).smash.inp (generated)

060465325.b3lyp_6-31g(d).nwchem.inp (generated) 060465325.b3lyp_6-31g(d).log.xz 060465325.td-b3lyp_6-31g+(d).inp 060465325.td-b3lyp_6-31g+(d).log.xz

060465325.td-b3lyp_6-31+g(d).qchem.inp (generated)

060465325.td-b3lyp_6-31+g(d).gjf (generated)

060465325.td-b3lyp_6-31+g(d).firefly.inp (generated)

060465325.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060465325.mol 060465325.PUBCHEM 060465325.mol (via Jmol)
060467810.b3lyp_6-31g(d).inp

060467810.b3lyp_6-31g(d).qchem.inp (generated)

060467810.b3lyp_6-31g(d).gjf (generated)

060467810.b3lyp_6-31g(d).firefly.inp (generated)

060467810.b3lyp_6-31g(d).smash.inp (generated)

060467810.b3lyp_6-31g(d).nwchem.inp (generated) 060467810.b3lyp_6-31g(d).log.xz 060467810.td-b3lyp_6-31g+(d).inp 060467810.td-b3lyp_6-31g+(d).log.xz

060467810.td-b3lyp_6-31+g(d).qchem.inp (generated)

060467810.td-b3lyp_6-31+g(d).gjf (generated)

060467810.td-b3lyp_6-31+g(d).firefly.inp (generated)

060467810.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060467810.mol 060467810.PUBCHEM 060467810.mol (via Jmol)
060468107.b3lyp_6-31g(d).inp

060468107.b3lyp_6-31g(d).qchem.inp (generated)

060468107.b3lyp_6-31g(d).gjf (generated)

060468107.b3lyp_6-31g(d).firefly.inp (generated)

060468107.b3lyp_6-31g(d).smash.inp (generated)

060468107.b3lyp_6-31g(d).nwchem.inp (generated) 060468107.b3lyp_6-31g(d).log.xz 060468107.mol 060468107.PUBCHEM 060468107.mol (via Jmol)
060468235.b3lyp_6-31g(d).inp

060468235.b3lyp_6-31g(d).qchem.inp (generated)

060468235.b3lyp_6-31g(d).gjf (generated)

060468235.b3lyp_6-31g(d).firefly.inp (generated)

060468235.b3lyp_6-31g(d).smash.inp (generated)

060468235.b3lyp_6-31g(d).nwchem.inp (generated) 060468235.b3lyp_6-31g(d).log.xz 060468235.td-b3lyp_6-31g+(d).inp 060468235.td-b3lyp_6-31g+(d).log.xz

060468235.td-b3lyp_6-31+g(d).qchem.inp (generated)

060468235.td-b3lyp_6-31+g(d).gjf (generated)

060468235.td-b3lyp_6-31+g(d).firefly.inp (generated)

060468235.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060468235.mol 060468235.PUBCHEM 060468235.mol (via Jmol)
060468669.b3lyp_6-31g(d).inp

060468669.b3lyp_6-31g(d).qchem.inp (generated)

060468669.b3lyp_6-31g(d).gjf (generated)

060468669.b3lyp_6-31g(d).firefly.inp (generated)

060468669.b3lyp_6-31g(d).smash.inp (generated)

060468669.b3lyp_6-31g(d).nwchem.inp (generated) 060468669.b3lyp_6-31g(d).log.xz 060468669.td-b3lyp_6-31g+(d).inp 060468669.td-b3lyp_6-31g+(d).log.xz

060468669.td-b3lyp_6-31+g(d).qchem.inp (generated)

060468669.td-b3lyp_6-31+g(d).gjf (generated)

060468669.td-b3lyp_6-31+g(d).firefly.inp (generated)

060468669.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060468669.mol 060468669.PUBCHEM 060468669.mol (via Jmol)
060468682.b3lyp_6-31g(d).inp

060468682.b3lyp_6-31g(d).qchem.inp (generated)

060468682.b3lyp_6-31g(d).gjf (generated)

060468682.b3lyp_6-31g(d).firefly.inp (generated)

060468682.b3lyp_6-31g(d).smash.inp (generated)

060468682.b3lyp_6-31g(d).nwchem.inp (generated) 060468682.b3lyp_6-31g(d).log.xz 060468682.td-b3lyp_6-31g+(d).inp 060468682.td-b3lyp_6-31g+(d).log.xz

060468682.td-b3lyp_6-31+g(d).qchem.inp (generated)

060468682.td-b3lyp_6-31+g(d).gjf (generated)

060468682.td-b3lyp_6-31+g(d).firefly.inp (generated)

060468682.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060468682.mol 060468682.PUBCHEM 060468682.mol (via Jmol)
060468801.b3lyp_6-31g(d).inp

060468801.b3lyp_6-31g(d).qchem.inp (generated)

060468801.b3lyp_6-31g(d).gjf (generated)

060468801.b3lyp_6-31g(d).firefly.inp (generated)

060468801.b3lyp_6-31g(d).smash.inp (generated)

060468801.b3lyp_6-31g(d).nwchem.inp (generated) 060468801.b3lyp_6-31g(d).log.xz 060468801.td-b3lyp_6-31g+(d).inp 060468801.td-b3lyp_6-31g+(d).log.xz

060468801.td-b3lyp_6-31+g(d).qchem.inp (generated)

060468801.td-b3lyp_6-31+g(d).gjf (generated)

060468801.td-b3lyp_6-31+g(d).firefly.inp (generated)

060468801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060468801.mol 060468801.PUBCHEM 060468801.mol (via Jmol)
060469638.b3lyp_6-31g(d).inp

060469638.b3lyp_6-31g(d).qchem.inp (generated)

060469638.b3lyp_6-31g(d).gjf (generated)

060469638.b3lyp_6-31g(d).firefly.inp (generated)

060469638.b3lyp_6-31g(d).smash.inp (generated)

060469638.b3lyp_6-31g(d).nwchem.inp (generated) 060469638.b3lyp_6-31g(d).log.xz 060469638.td-b3lyp_6-31g+(d).inp 060469638.td-b3lyp_6-31g+(d).log.xz

060469638.td-b3lyp_6-31+g(d).qchem.inp (generated)

060469638.td-b3lyp_6-31+g(d).gjf (generated)

060469638.td-b3lyp_6-31+g(d).firefly.inp (generated)

060469638.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060469638.mol 060469638.PUBCHEM 060469638.mol (via Jmol)
060470801.b3lyp_6-31g(d).inp

060470801.b3lyp_6-31g(d).qchem.inp (generated)

060470801.b3lyp_6-31g(d).gjf (generated)

060470801.b3lyp_6-31g(d).firefly.inp (generated)

060470801.b3lyp_6-31g(d).smash.inp (generated)

060470801.b3lyp_6-31g(d).nwchem.inp (generated) 060470801.b3lyp_6-31g(d).log.xz 060470801.td-b3lyp_6-31g+(d).inp 060470801.td-b3lyp_6-31g+(d).log.xz

060470801.td-b3lyp_6-31+g(d).qchem.inp (generated)

060470801.td-b3lyp_6-31+g(d).gjf (generated)

060470801.td-b3lyp_6-31+g(d).firefly.inp (generated)

060470801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060470801.mol 060470801.PUBCHEM 060470801.mol (via Jmol)
060471143.b3lyp_6-31g(d).inp

060471143.b3lyp_6-31g(d).qchem.inp (generated)

060471143.b3lyp_6-31g(d).gjf (generated)

060471143.b3lyp_6-31g(d).firefly.inp (generated)

060471143.b3lyp_6-31g(d).smash.inp (generated)

060471143.b3lyp_6-31g(d).nwchem.inp (generated) 060471143.b3lyp_6-31g(d).log.xz 060471143.td-b3lyp_6-31g+(d).inp 060471143.td-b3lyp_6-31g+(d).log.xz

060471143.td-b3lyp_6-31+g(d).qchem.inp (generated)

060471143.td-b3lyp_6-31+g(d).gjf (generated)

060471143.td-b3lyp_6-31+g(d).firefly.inp (generated)

060471143.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060471143.mol 060471143.PUBCHEM 060471143.mol (via Jmol)
060471263.b3lyp_6-31g(d).inp

060471263.b3lyp_6-31g(d).qchem.inp (generated)

060471263.b3lyp_6-31g(d).gjf (generated)

060471263.b3lyp_6-31g(d).firefly.inp (generated)

060471263.b3lyp_6-31g(d).smash.inp (generated)

060471263.b3lyp_6-31g(d).nwchem.inp (generated) 060471263.b3lyp_6-31g(d).log.xz 060471263.mol 060471263.PUBCHEM 060471263.mol (via Jmol)
060471314.b3lyp_6-31g(d).inp

060471314.b3lyp_6-31g(d).qchem.inp (generated)

060471314.b3lyp_6-31g(d).gjf (generated)

060471314.b3lyp_6-31g(d).firefly.inp (generated)

060471314.b3lyp_6-31g(d).smash.inp (generated)

060471314.b3lyp_6-31g(d).nwchem.inp (generated) 060471314.b3lyp_6-31g(d).log.xz 060471314.mol 060471314.PUBCHEM 060471314.mol (via Jmol)
060471421.b3lyp_6-31g(d).inp

060471421.b3lyp_6-31g(d).qchem.inp (generated)

060471421.b3lyp_6-31g(d).gjf (generated)

060471421.b3lyp_6-31g(d).firefly.inp (generated)

060471421.b3lyp_6-31g(d).smash.inp (generated)

060471421.b3lyp_6-31g(d).nwchem.inp (generated) 060471421.b3lyp_6-31g(d).log.xz 060471421.td-b3lyp_6-31g+(d).inp 060471421.td-b3lyp_6-31g+(d).log.xz

060471421.td-b3lyp_6-31+g(d).qchem.inp (generated)

060471421.td-b3lyp_6-31+g(d).gjf (generated)

060471421.td-b3lyp_6-31+g(d).firefly.inp (generated)

060471421.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060471421.mol 060471421.PUBCHEM 060471421.mol (via Jmol)
060471422.b3lyp_6-31g(d).inp

060471422.b3lyp_6-31g(d).qchem.inp (generated)

060471422.b3lyp_6-31g(d).gjf (generated)

060471422.b3lyp_6-31g(d).firefly.inp (generated)

060471422.b3lyp_6-31g(d).smash.inp (generated)

060471422.b3lyp_6-31g(d).nwchem.inp (generated) 060471422.b3lyp_6-31g(d).log.xz 060471422.td-b3lyp_6-31g+(d).inp 060471422.td-b3lyp_6-31g+(d).log.xz

060471422.td-b3lyp_6-31+g(d).qchem.inp (generated)

060471422.td-b3lyp_6-31+g(d).gjf (generated)

060471422.td-b3lyp_6-31+g(d).firefly.inp (generated)

060471422.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060471422.mol 060471422.PUBCHEM 060471422.mol (via Jmol)
060471507.b3lyp_6-31g(d).inp

060471507.b3lyp_6-31g(d).qchem.inp (generated)

060471507.b3lyp_6-31g(d).gjf (generated)

060471507.b3lyp_6-31g(d).firefly.inp (generated)

060471507.b3lyp_6-31g(d).smash.inp (generated)

060471507.b3lyp_6-31g(d).nwchem.inp (generated) 060471507.b3lyp_6-31g(d).log.xz 060471507.td-b3lyp_6-31g+(d).inp 060471507.td-b3lyp_6-31g+(d).log.xz

060471507.td-b3lyp_6-31+g(d).qchem.inp (generated)

060471507.td-b3lyp_6-31+g(d).gjf (generated)

060471507.td-b3lyp_6-31+g(d).firefly.inp (generated)

060471507.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060471507.mol 060471507.PUBCHEM 060471507.mol (via Jmol)
060471639.b3lyp_6-31g(d).inp

060471639.b3lyp_6-31g(d).qchem.inp (generated)

060471639.b3lyp_6-31g(d).gjf (generated)

060471639.b3lyp_6-31g(d).firefly.inp (generated)

060471639.b3lyp_6-31g(d).smash.inp (generated)

060471639.b3lyp_6-31g(d).nwchem.inp (generated) 060471639.b3lyp_6-31g(d).log.xz 060471639.td-b3lyp_6-31g+(d).inp 060471639.td-b3lyp_6-31g+(d).log.xz

060471639.td-b3lyp_6-31+g(d).qchem.inp (generated)

060471639.td-b3lyp_6-31+g(d).gjf (generated)

060471639.td-b3lyp_6-31+g(d).firefly.inp (generated)

060471639.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060471639.mol 060471639.PUBCHEM 060471639.mol (via Jmol)
060471939.b3lyp_6-31g(d).inp

060471939.b3lyp_6-31g(d).qchem.inp (generated)

060471939.b3lyp_6-31g(d).gjf (generated)

060471939.b3lyp_6-31g(d).firefly.inp (generated)

060471939.b3lyp_6-31g(d).smash.inp (generated)

060471939.b3lyp_6-31g(d).nwchem.inp (generated) 060471939.b3lyp_6-31g(d).log.xz 060471939.td-b3lyp_6-31g+(d).inp 060471939.td-b3lyp_6-31g+(d).log.xz

060471939.td-b3lyp_6-31+g(d).qchem.inp (generated)

060471939.td-b3lyp_6-31+g(d).gjf (generated)

060471939.td-b3lyp_6-31+g(d).firefly.inp (generated)

060471939.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060471939.mol 060471939.PUBCHEM 060471939.mol (via Jmol)
060472614.b3lyp_6-31g(d).inp

060472614.b3lyp_6-31g(d).qchem.inp (generated)

060472614.b3lyp_6-31g(d).gjf (generated)

060472614.b3lyp_6-31g(d).firefly.inp (generated)

060472614.b3lyp_6-31g(d).smash.inp (generated)

060472614.b3lyp_6-31g(d).nwchem.inp (generated) 060472614.b3lyp_6-31g(d).log.xz 060472614.td-b3lyp_6-31g+(d).inp 060472614.td-b3lyp_6-31g+(d).log.xz

060472614.td-b3lyp_6-31+g(d).qchem.inp (generated)

060472614.td-b3lyp_6-31+g(d).gjf (generated)

060472614.td-b3lyp_6-31+g(d).firefly.inp (generated)

060472614.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060472614.mol 060472614.PUBCHEM 060472614.mol (via Jmol)
060472675.b3lyp_6-31g(d).inp

060472675.b3lyp_6-31g(d).qchem.inp (generated)

060472675.b3lyp_6-31g(d).gjf (generated)

060472675.b3lyp_6-31g(d).firefly.inp (generated)

060472675.b3lyp_6-31g(d).smash.inp (generated)

060472675.b3lyp_6-31g(d).nwchem.inp (generated) 060472675.b3lyp_6-31g(d).log.xz 060472675.td-b3lyp_6-31g+(d).inp 060472675.td-b3lyp_6-31g+(d).log.xz

060472675.td-b3lyp_6-31+g(d).qchem.inp (generated)

060472675.td-b3lyp_6-31+g(d).gjf (generated)

060472675.td-b3lyp_6-31+g(d).firefly.inp (generated)

060472675.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060472675.mol 060472675.PUBCHEM 060472675.mol (via Jmol)
060472742.b3lyp_6-31g(d).inp

060472742.b3lyp_6-31g(d).qchem.inp (generated)

060472742.b3lyp_6-31g(d).gjf (generated)

060472742.b3lyp_6-31g(d).firefly.inp (generated)

060472742.b3lyp_6-31g(d).smash.inp (generated)

060472742.b3lyp_6-31g(d).nwchem.inp (generated) 060472742.b3lyp_6-31g(d).log.xz 060472742.td-b3lyp_6-31g+(d).inp 060472742.td-b3lyp_6-31g+(d).log.xz

060472742.td-b3lyp_6-31+g(d).qchem.inp (generated)

060472742.td-b3lyp_6-31+g(d).gjf (generated)

060472742.td-b3lyp_6-31+g(d).firefly.inp (generated)

060472742.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060472742.mol 060472742.PUBCHEM 060472742.mol (via Jmol)
060472823.b3lyp_6-31g(d).inp

060472823.b3lyp_6-31g(d).qchem.inp (generated)

060472823.b3lyp_6-31g(d).gjf (generated)

060472823.b3lyp_6-31g(d).firefly.inp (generated)

060472823.b3lyp_6-31g(d).smash.inp (generated)

060472823.b3lyp_6-31g(d).nwchem.inp (generated) 060472823.b3lyp_6-31g(d).log.xz 060472823.mol 060472823.PUBCHEM 060472823.mol (via Jmol)
060472990.b3lyp_6-31g(d).inp

060472990.b3lyp_6-31g(d).qchem.inp (generated)

060472990.b3lyp_6-31g(d).gjf (generated)

060472990.b3lyp_6-31g(d).firefly.inp (generated)

060472990.b3lyp_6-31g(d).smash.inp (generated)

060472990.b3lyp_6-31g(d).nwchem.inp (generated) 060472990.b3lyp_6-31g(d).log.xz 060472990.mol 060472990.PUBCHEM 060472990.mol (via Jmol)
060472996.b3lyp_6-31g(d).inp

060472996.b3lyp_6-31g(d).qchem.inp (generated)

060472996.b3lyp_6-31g(d).gjf (generated)

060472996.b3lyp_6-31g(d).firefly.inp (generated)

060472996.b3lyp_6-31g(d).smash.inp (generated)

060472996.b3lyp_6-31g(d).nwchem.inp (generated) 060472996.b3lyp_6-31g(d).log.xz 060472996.td-b3lyp_6-31g+(d).inp 060472996.td-b3lyp_6-31g+(d).log.xz

060472996.td-b3lyp_6-31+g(d).qchem.inp (generated)

060472996.td-b3lyp_6-31+g(d).gjf (generated)

060472996.td-b3lyp_6-31+g(d).firefly.inp (generated)

060472996.td-b3lyp_6-31+g(d).nwchem.inp (generated) 060472996.mol 060472996.PUBCHEM 060472996.mol (via Jmol)


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