Index of

Last updated : Thu Aug 17 01:52:36 JST 2017
Total : 89 (71) in this page
008175037.b3lyp_6-31g(d).inp

008175037.b3lyp_6-31g(d).qchem.inp (generated)

008175037.b3lyp_6-31g(d).gjf (generated)

008175037.b3lyp_6-31g(d).firefly.inp (generated)

008175037.b3lyp_6-31g(d).smash.inp (generated)

008175037.b3lyp_6-31g(d).nwchem.inp (generated) 008175037.b3lyp_6-31g(d).log.xz 008175037.mol 008175037.PUBCHEM 008175037.mol (via Jmol)
008175340.b3lyp_6-31g(d).inp

008175340.b3lyp_6-31g(d).qchem.inp (generated)

008175340.b3lyp_6-31g(d).gjf (generated)

008175340.b3lyp_6-31g(d).firefly.inp (generated)

008175340.b3lyp_6-31g(d).smash.inp (generated)

008175340.b3lyp_6-31g(d).nwchem.inp (generated) 008175340.b3lyp_6-31g(d).log.xz 008175340.td-b3lyp_6-31g+(d).inp 008175340.td-b3lyp_6-31g+(d).log.xz

008175340.td-b3lyp_6-31+g(d).qchem.inp (generated)

008175340.td-b3lyp_6-31+g(d).gjf (generated)

008175340.td-b3lyp_6-31+g(d).firefly.inp (generated)

008175340.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008175340.mol 008175340.PUBCHEM 008175340.mol (via Jmol)
008176371.b3lyp_6-31g(d).inp

008176371.b3lyp_6-31g(d).qchem.inp (generated)

008176371.b3lyp_6-31g(d).gjf (generated)

008176371.b3lyp_6-31g(d).firefly.inp (generated)

008176371.b3lyp_6-31g(d).smash.inp (generated)

008176371.b3lyp_6-31g(d).nwchem.inp (generated) 008176371.b3lyp_6-31g(d).log.xz 008176371.td-b3lyp_6-31g+(d).inp 008176371.td-b3lyp_6-31g+(d).log.xz

008176371.td-b3lyp_6-31+g(d).qchem.inp (generated)

008176371.td-b3lyp_6-31+g(d).gjf (generated)

008176371.td-b3lyp_6-31+g(d).firefly.inp (generated)

008176371.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008176371.mol 008176371.PUBCHEM 008176371.mol (via Jmol)
008176476.b3lyp_6-31g(d).inp

008176476.b3lyp_6-31g(d).qchem.inp (generated)

008176476.b3lyp_6-31g(d).gjf (generated)

008176476.b3lyp_6-31g(d).firefly.inp (generated)

008176476.b3lyp_6-31g(d).smash.inp (generated)

008176476.b3lyp_6-31g(d).nwchem.inp (generated) 008176476.b3lyp_6-31g(d).log.xz 008176476.td-b3lyp_6-31g+(d).inp 008176476.td-b3lyp_6-31g+(d).log.xz

008176476.td-b3lyp_6-31+g(d).qchem.inp (generated)

008176476.td-b3lyp_6-31+g(d).gjf (generated)

008176476.td-b3lyp_6-31+g(d).firefly.inp (generated)

008176476.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008176476.mol 008176476.PUBCHEM 008176476.mol (via Jmol)
008176477.b3lyp_6-31g(d).inp

008176477.b3lyp_6-31g(d).qchem.inp (generated)

008176477.b3lyp_6-31g(d).gjf (generated)

008176477.b3lyp_6-31g(d).firefly.inp (generated)

008176477.b3lyp_6-31g(d).smash.inp (generated)

008176477.b3lyp_6-31g(d).nwchem.inp (generated) 008176477.b3lyp_6-31g(d).log.xz 008176477.td-b3lyp_6-31g+(d).inp 008176477.td-b3lyp_6-31g+(d).log.xz

008176477.td-b3lyp_6-31+g(d).qchem.inp (generated)

008176477.td-b3lyp_6-31+g(d).gjf (generated)

008176477.td-b3lyp_6-31+g(d).firefly.inp (generated)

008176477.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008176477.mol 008176477.PUBCHEM 008176477.mol (via Jmol)
008176516.b3lyp_6-31g(d).inp

008176516.b3lyp_6-31g(d).qchem.inp (generated)

008176516.b3lyp_6-31g(d).gjf (generated)

008176516.b3lyp_6-31g(d).firefly.inp (generated)

008176516.b3lyp_6-31g(d).smash.inp (generated)

008176516.b3lyp_6-31g(d).nwchem.inp (generated) 008176516.b3lyp_6-31g(d).log.xz 008176516.mol 008176516.PUBCHEM 008176516.mol (via Jmol)
008176736.b3lyp_6-31g(d).inp

008176736.b3lyp_6-31g(d).qchem.inp (generated)

008176736.b3lyp_6-31g(d).gjf (generated)

008176736.b3lyp_6-31g(d).firefly.inp (generated)

008176736.b3lyp_6-31g(d).smash.inp (generated)

008176736.b3lyp_6-31g(d).nwchem.inp (generated) 008176736.b3lyp_6-31g(d).log.xz 008176736.td-b3lyp_6-31g+(d).inp 008176736.td-b3lyp_6-31g+(d).log.xz

008176736.td-b3lyp_6-31+g(d).qchem.inp (generated)

008176736.td-b3lyp_6-31+g(d).gjf (generated)

008176736.td-b3lyp_6-31+g(d).firefly.inp (generated)

008176736.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008176736.mol 008176736.PUBCHEM 008176736.mol (via Jmol)
008176846.b3lyp_6-31g(d).inp

008176846.b3lyp_6-31g(d).qchem.inp (generated)

008176846.b3lyp_6-31g(d).gjf (generated)

008176846.b3lyp_6-31g(d).firefly.inp (generated)

008176846.b3lyp_6-31g(d).smash.inp (generated)

008176846.b3lyp_6-31g(d).nwchem.inp (generated) 008176846.b3lyp_6-31g(d).log.xz 008176846.mol 008176846.PUBCHEM 008176846.mol (via Jmol)
008177440.b3lyp_6-31g(d).inp

008177440.b3lyp_6-31g(d).qchem.inp (generated)

008177440.b3lyp_6-31g(d).gjf (generated)

008177440.b3lyp_6-31g(d).firefly.inp (generated)

008177440.b3lyp_6-31g(d).smash.inp (generated)

008177440.b3lyp_6-31g(d).nwchem.inp (generated) 008177440.b3lyp_6-31g(d).log.xz 008177440.td-b3lyp_6-31g+(d).inp 008177440.td-b3lyp_6-31g+(d).log.xz

008177440.td-b3lyp_6-31+g(d).qchem.inp (generated)

008177440.td-b3lyp_6-31+g(d).gjf (generated)

008177440.td-b3lyp_6-31+g(d).firefly.inp (generated)

008177440.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008177440.mol 008177440.PUBCHEM 008177440.mol (via Jmol)
008177633.b3lyp_6-31g(d).inp

008177633.b3lyp_6-31g(d).qchem.inp (generated)

008177633.b3lyp_6-31g(d).gjf (generated)

008177633.b3lyp_6-31g(d).firefly.inp (generated)

008177633.b3lyp_6-31g(d).smash.inp (generated)

008177633.b3lyp_6-31g(d).nwchem.inp (generated) 008177633.b3lyp_6-31g(d).log.xz 008177633.td-b3lyp_6-31g+(d).inp 008177633.td-b3lyp_6-31g+(d).log.xz

008177633.td-b3lyp_6-31+g(d).qchem.inp (generated)

008177633.td-b3lyp_6-31+g(d).gjf (generated)

008177633.td-b3lyp_6-31+g(d).firefly.inp (generated)

008177633.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008177633.mol 008177633.PUBCHEM 008177633.mol (via Jmol)
008177671.b3lyp_6-31g(d).inp

008177671.b3lyp_6-31g(d).qchem.inp (generated)

008177671.b3lyp_6-31g(d).gjf (generated)

008177671.b3lyp_6-31g(d).firefly.inp (generated)

008177671.b3lyp_6-31g(d).smash.inp (generated)

008177671.b3lyp_6-31g(d).nwchem.inp (generated) 008177671.b3lyp_6-31g(d).log.xz 008177671.td-b3lyp_6-31g+(d).inp 008177671.td-b3lyp_6-31g+(d).log.xz

008177671.td-b3lyp_6-31+g(d).qchem.inp (generated)

008177671.td-b3lyp_6-31+g(d).gjf (generated)

008177671.td-b3lyp_6-31+g(d).firefly.inp (generated)

008177671.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008177671.mol 008177671.PUBCHEM 008177671.mol (via Jmol)
008177744.b3lyp_6-31g(d).inp

008177744.b3lyp_6-31g(d).qchem.inp (generated)

008177744.b3lyp_6-31g(d).gjf (generated)

008177744.b3lyp_6-31g(d).firefly.inp (generated)

008177744.b3lyp_6-31g(d).smash.inp (generated)

008177744.b3lyp_6-31g(d).nwchem.inp (generated) 008177744.b3lyp_6-31g(d).log.xz 008177744.td-b3lyp_6-31g+(d).inp 008177744.td-b3lyp_6-31g+(d).log.xz

008177744.td-b3lyp_6-31+g(d).qchem.inp (generated)

008177744.td-b3lyp_6-31+g(d).gjf (generated)

008177744.td-b3lyp_6-31+g(d).firefly.inp (generated)

008177744.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008177744.mol 008177744.PUBCHEM 008177744.mol (via Jmol)
008177753.b3lyp_6-31g(d).inp

008177753.b3lyp_6-31g(d).qchem.inp (generated)

008177753.b3lyp_6-31g(d).gjf (generated)

008177753.b3lyp_6-31g(d).firefly.inp (generated)

008177753.b3lyp_6-31g(d).smash.inp (generated)

008177753.b3lyp_6-31g(d).nwchem.inp (generated) 008177753.b3lyp_6-31g(d).log.xz 008177753.td-b3lyp_6-31g+(d).inp 008177753.td-b3lyp_6-31g+(d).log.xz

008177753.td-b3lyp_6-31+g(d).qchem.inp (generated)

008177753.td-b3lyp_6-31+g(d).gjf (generated)

008177753.td-b3lyp_6-31+g(d).firefly.inp (generated)

008177753.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008177753.mol 008177753.PUBCHEM 008177753.mol (via Jmol)
008178047.b3lyp_6-31g(d).inp

008178047.b3lyp_6-31g(d).qchem.inp (generated)

008178047.b3lyp_6-31g(d).gjf (generated)

008178047.b3lyp_6-31g(d).firefly.inp (generated)

008178047.b3lyp_6-31g(d).smash.inp (generated)

008178047.b3lyp_6-31g(d).nwchem.inp (generated) 008178047.b3lyp_6-31g(d).log.xz 008178047.td-b3lyp_6-31g+(d).inp 008178047.td-b3lyp_6-31g+(d).log.xz

008178047.td-b3lyp_6-31+g(d).qchem.inp (generated)

008178047.td-b3lyp_6-31+g(d).gjf (generated)

008178047.td-b3lyp_6-31+g(d).firefly.inp (generated)

008178047.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008178047.mol 008178047.PUBCHEM 008178047.mol (via Jmol)
008178073.b3lyp_6-31g(d).inp

008178073.b3lyp_6-31g(d).qchem.inp (generated)

008178073.b3lyp_6-31g(d).gjf (generated)

008178073.b3lyp_6-31g(d).firefly.inp (generated)

008178073.b3lyp_6-31g(d).smash.inp (generated)

008178073.b3lyp_6-31g(d).nwchem.inp (generated) 008178073.b3lyp_6-31g(d).log.xz 008178073.td-b3lyp_6-31g+(d).inp 008178073.td-b3lyp_6-31g+(d).log.xz

008178073.td-b3lyp_6-31+g(d).qchem.inp (generated)

008178073.td-b3lyp_6-31+g(d).gjf (generated)

008178073.td-b3lyp_6-31+g(d).firefly.inp (generated)

008178073.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008178073.mol 008178073.PUBCHEM 008178073.mol (via Jmol)
008178074.b3lyp_6-31g(d).inp

008178074.b3lyp_6-31g(d).qchem.inp (generated)

008178074.b3lyp_6-31g(d).gjf (generated)

008178074.b3lyp_6-31g(d).firefly.inp (generated)

008178074.b3lyp_6-31g(d).smash.inp (generated)

008178074.b3lyp_6-31g(d).nwchem.inp (generated) 008178074.b3lyp_6-31g(d).log.xz 008178074.td-b3lyp_6-31g+(d).inp 008178074.td-b3lyp_6-31g+(d).log.xz

008178074.td-b3lyp_6-31+g(d).qchem.inp (generated)

008178074.td-b3lyp_6-31+g(d).gjf (generated)

008178074.td-b3lyp_6-31+g(d).firefly.inp (generated)

008178074.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008178074.mol 008178074.PUBCHEM 008178074.mol (via Jmol)
008178079.b3lyp_6-31g(d).inp

008178079.b3lyp_6-31g(d).qchem.inp (generated)

008178079.b3lyp_6-31g(d).gjf (generated)

008178079.b3lyp_6-31g(d).firefly.inp (generated)

008178079.b3lyp_6-31g(d).smash.inp (generated)

008178079.b3lyp_6-31g(d).nwchem.inp (generated) 008178079.b3lyp_6-31g(d).log.xz 008178079.td-b3lyp_6-31g+(d).inp 008178079.td-b3lyp_6-31g+(d).log.xz

008178079.td-b3lyp_6-31+g(d).qchem.inp (generated)

008178079.td-b3lyp_6-31+g(d).gjf (generated)

008178079.td-b3lyp_6-31+g(d).firefly.inp (generated)

008178079.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008178079.mol 008178079.PUBCHEM 008178079.mol (via Jmol)
008178286.b3lyp_6-31g(d).inp

008178286.b3lyp_6-31g(d).qchem.inp (generated)

008178286.b3lyp_6-31g(d).gjf (generated)

008178286.b3lyp_6-31g(d).firefly.inp (generated)

008178286.b3lyp_6-31g(d).smash.inp (generated)

008178286.b3lyp_6-31g(d).nwchem.inp (generated) 008178286.b3lyp_6-31g(d).log.xz 008178286.td-b3lyp_6-31g+(d).inp 008178286.td-b3lyp_6-31g+(d).log.xz

008178286.td-b3lyp_6-31+g(d).qchem.inp (generated)

008178286.td-b3lyp_6-31+g(d).gjf (generated)

008178286.td-b3lyp_6-31+g(d).firefly.inp (generated)

008178286.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008178286.mol 008178286.PUBCHEM 008178286.mol (via Jmol)
008178325.b3lyp_6-31g(d).inp

008178325.b3lyp_6-31g(d).qchem.inp (generated)

008178325.b3lyp_6-31g(d).gjf (generated)

008178325.b3lyp_6-31g(d).firefly.inp (generated)

008178325.b3lyp_6-31g(d).smash.inp (generated)

008178325.b3lyp_6-31g(d).nwchem.inp (generated) 008178325.b3lyp_6-31g(d).log.xz 008178325.td-b3lyp_6-31g+(d).inp 008178325.td-b3lyp_6-31g+(d).log.xz

008178325.td-b3lyp_6-31+g(d).qchem.inp (generated)

008178325.td-b3lyp_6-31+g(d).gjf (generated)

008178325.td-b3lyp_6-31+g(d).firefly.inp (generated)

008178325.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008178325.mol 008178325.PUBCHEM 008178325.mol (via Jmol)
008178327.b3lyp_6-31g(d).inp

008178327.b3lyp_6-31g(d).qchem.inp (generated)

008178327.b3lyp_6-31g(d).gjf (generated)

008178327.b3lyp_6-31g(d).firefly.inp (generated)

008178327.b3lyp_6-31g(d).smash.inp (generated)

008178327.b3lyp_6-31g(d).nwchem.inp (generated) 008178327.b3lyp_6-31g(d).log.xz 008178327.td-b3lyp_6-31g+(d).inp 008178327.td-b3lyp_6-31g+(d).log.xz

008178327.td-b3lyp_6-31+g(d).qchem.inp (generated)

008178327.td-b3lyp_6-31+g(d).gjf (generated)

008178327.td-b3lyp_6-31+g(d).firefly.inp (generated)

008178327.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008178327.mol 008178327.PUBCHEM 008178327.mol (via Jmol)
008178359.b3lyp_6-31g(d).inp

008178359.b3lyp_6-31g(d).qchem.inp (generated)

008178359.b3lyp_6-31g(d).gjf (generated)

008178359.b3lyp_6-31g(d).firefly.inp (generated)

008178359.b3lyp_6-31g(d).smash.inp (generated)

008178359.b3lyp_6-31g(d).nwchem.inp (generated) 008178359.b3lyp_6-31g(d).log.xz 008178359.td-b3lyp_6-31g+(d).inp 008178359.td-b3lyp_6-31g+(d).log.xz

008178359.td-b3lyp_6-31+g(d).qchem.inp (generated)

008178359.td-b3lyp_6-31+g(d).gjf (generated)

008178359.td-b3lyp_6-31+g(d).firefly.inp (generated)

008178359.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008178359.mol 008178359.PUBCHEM 008178359.mol (via Jmol)
008179216.b3lyp_6-31g(d).inp

008179216.b3lyp_6-31g(d).qchem.inp (generated)

008179216.b3lyp_6-31g(d).gjf (generated)

008179216.b3lyp_6-31g(d).firefly.inp (generated)

008179216.b3lyp_6-31g(d).smash.inp (generated)

008179216.b3lyp_6-31g(d).nwchem.inp (generated) 008179216.b3lyp_6-31g(d).log.xz 008179216.mol 008179216.PUBCHEM 008179216.mol (via Jmol)
008179305.b3lyp_6-31g(d).inp

008179305.b3lyp_6-31g(d).qchem.inp (generated)

008179305.b3lyp_6-31g(d).gjf (generated)

008179305.b3lyp_6-31g(d).firefly.inp (generated)

008179305.b3lyp_6-31g(d).smash.inp (generated)

008179305.b3lyp_6-31g(d).nwchem.inp (generated) 008179305.b3lyp_6-31g(d).log.xz 008179305.td-b3lyp_6-31g+(d).inp 008179305.td-b3lyp_6-31g+(d).log.xz

008179305.td-b3lyp_6-31+g(d).qchem.inp (generated)

008179305.td-b3lyp_6-31+g(d).gjf (generated)

008179305.td-b3lyp_6-31+g(d).firefly.inp (generated)

008179305.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008179305.mol 008179305.PUBCHEM 008179305.mol (via Jmol)
008179314.b3lyp_6-31g(d).inp

008179314.b3lyp_6-31g(d).qchem.inp (generated)

008179314.b3lyp_6-31g(d).gjf (generated)

008179314.b3lyp_6-31g(d).firefly.inp (generated)

008179314.b3lyp_6-31g(d).smash.inp (generated)

008179314.b3lyp_6-31g(d).nwchem.inp (generated) 008179314.b3lyp_6-31g(d).log.xz 008179314.td-b3lyp_6-31g+(d).inp 008179314.td-b3lyp_6-31g+(d).log.xz

008179314.td-b3lyp_6-31+g(d).qchem.inp (generated)

008179314.td-b3lyp_6-31+g(d).gjf (generated)

008179314.td-b3lyp_6-31+g(d).firefly.inp (generated)

008179314.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008179314.mol 008179314.PUBCHEM 008179314.mol (via Jmol)
008179318.b3lyp_6-31g(d).inp

008179318.b3lyp_6-31g(d).qchem.inp (generated)

008179318.b3lyp_6-31g(d).gjf (generated)

008179318.b3lyp_6-31g(d).firefly.inp (generated)

008179318.b3lyp_6-31g(d).smash.inp (generated)

008179318.b3lyp_6-31g(d).nwchem.inp (generated) 008179318.b3lyp_6-31g(d).log.xz 008179318.td-b3lyp_6-31g+(d).inp 008179318.td-b3lyp_6-31g+(d).log.xz

008179318.td-b3lyp_6-31+g(d).qchem.inp (generated)

008179318.td-b3lyp_6-31+g(d).gjf (generated)

008179318.td-b3lyp_6-31+g(d).firefly.inp (generated)

008179318.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008179318.mol 008179318.PUBCHEM 008179318.mol (via Jmol)
008179363.b3lyp_6-31g(d).inp

008179363.b3lyp_6-31g(d).qchem.inp (generated)

008179363.b3lyp_6-31g(d).gjf (generated)

008179363.b3lyp_6-31g(d).firefly.inp (generated)

008179363.b3lyp_6-31g(d).smash.inp (generated)

008179363.b3lyp_6-31g(d).nwchem.inp (generated) 008179363.b3lyp_6-31g(d).log.xz 008179363.mol 008179363.PUBCHEM 008179363.mol (via Jmol)
008180140.b3lyp_6-31g(d).inp

008180140.b3lyp_6-31g(d).qchem.inp (generated)

008180140.b3lyp_6-31g(d).gjf (generated)

008180140.b3lyp_6-31g(d).firefly.inp (generated)

008180140.b3lyp_6-31g(d).smash.inp (generated)

008180140.b3lyp_6-31g(d).nwchem.inp (generated) 008180140.b3lyp_6-31g(d).log.xz 008180140.mol 008180140.PUBCHEM 008180140.mol (via Jmol)
008180143.b3lyp_6-31g(d).inp

008180143.b3lyp_6-31g(d).qchem.inp (generated)

008180143.b3lyp_6-31g(d).gjf (generated)

008180143.b3lyp_6-31g(d).firefly.inp (generated)

008180143.b3lyp_6-31g(d).smash.inp (generated)

008180143.b3lyp_6-31g(d).nwchem.inp (generated) 008180143.b3lyp_6-31g(d).log.xz 008180143.td-b3lyp_6-31g+(d).inp 008180143.td-b3lyp_6-31g+(d).log.xz

008180143.td-b3lyp_6-31+g(d).qchem.inp (generated)

008180143.td-b3lyp_6-31+g(d).gjf (generated)

008180143.td-b3lyp_6-31+g(d).firefly.inp (generated)

008180143.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008180143.mol 008180143.PUBCHEM 008180143.mol (via Jmol)
008180144.b3lyp_6-31g(d).inp

008180144.b3lyp_6-31g(d).qchem.inp (generated)

008180144.b3lyp_6-31g(d).gjf (generated)

008180144.b3lyp_6-31g(d).firefly.inp (generated)

008180144.b3lyp_6-31g(d).smash.inp (generated)

008180144.b3lyp_6-31g(d).nwchem.inp (generated) 008180144.b3lyp_6-31g(d).log.xz 008180144.td-b3lyp_6-31g+(d).inp 008180144.td-b3lyp_6-31g+(d).log.xz

008180144.td-b3lyp_6-31+g(d).qchem.inp (generated)

008180144.td-b3lyp_6-31+g(d).gjf (generated)

008180144.td-b3lyp_6-31+g(d).firefly.inp (generated)

008180144.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008180144.mol 008180144.PUBCHEM 008180144.mol (via Jmol)
008180170.b3lyp_6-31g(d).inp

008180170.b3lyp_6-31g(d).qchem.inp (generated)

008180170.b3lyp_6-31g(d).gjf (generated)

008180170.b3lyp_6-31g(d).firefly.inp (generated)

008180170.b3lyp_6-31g(d).smash.inp (generated)

008180170.b3lyp_6-31g(d).nwchem.inp (generated) 008180170.b3lyp_6-31g(d).log.xz 008180170.td-b3lyp_6-31g+(d).inp 008180170.td-b3lyp_6-31g+(d).log.xz

008180170.td-b3lyp_6-31+g(d).qchem.inp (generated)

008180170.td-b3lyp_6-31+g(d).gjf (generated)

008180170.td-b3lyp_6-31+g(d).firefly.inp (generated)

008180170.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008180170.mol 008180170.PUBCHEM 008180170.mol (via Jmol)
008180171.b3lyp_6-31g(d).inp

008180171.b3lyp_6-31g(d).qchem.inp (generated)

008180171.b3lyp_6-31g(d).gjf (generated)

008180171.b3lyp_6-31g(d).firefly.inp (generated)

008180171.b3lyp_6-31g(d).smash.inp (generated)

008180171.b3lyp_6-31g(d).nwchem.inp (generated) 008180171.b3lyp_6-31g(d).log.xz 008180171.td-b3lyp_6-31g+(d).inp 008180171.td-b3lyp_6-31g+(d).log.xz

008180171.td-b3lyp_6-31+g(d).qchem.inp (generated)

008180171.td-b3lyp_6-31+g(d).gjf (generated)

008180171.td-b3lyp_6-31+g(d).firefly.inp (generated)

008180171.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008180171.mol 008180171.PUBCHEM 008180171.mol (via Jmol)
008180181.b3lyp_6-31g(d).inp

008180181.b3lyp_6-31g(d).qchem.inp (generated)

008180181.b3lyp_6-31g(d).gjf (generated)

008180181.b3lyp_6-31g(d).firefly.inp (generated)

008180181.b3lyp_6-31g(d).smash.inp (generated)

008180181.b3lyp_6-31g(d).nwchem.inp (generated) 008180181.b3lyp_6-31g(d).log.xz 008180181.mol 008180181.PUBCHEM 008180181.mol (via Jmol)
008180183.b3lyp_6-31g(d).inp

008180183.b3lyp_6-31g(d).qchem.inp (generated)

008180183.b3lyp_6-31g(d).gjf (generated)

008180183.b3lyp_6-31g(d).firefly.inp (generated)

008180183.b3lyp_6-31g(d).smash.inp (generated)

008180183.b3lyp_6-31g(d).nwchem.inp (generated) 008180183.b3lyp_6-31g(d).log.xz 008180183.td-b3lyp_6-31g+(d).inp 008180183.td-b3lyp_6-31g+(d).log.xz

008180183.td-b3lyp_6-31+g(d).qchem.inp (generated)

008180183.td-b3lyp_6-31+g(d).gjf (generated)

008180183.td-b3lyp_6-31+g(d).firefly.inp (generated)

008180183.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008180183.mol 008180183.PUBCHEM 008180183.mol (via Jmol)
008180187.b3lyp_6-31g(d).inp

008180187.b3lyp_6-31g(d).qchem.inp (generated)

008180187.b3lyp_6-31g(d).gjf (generated)

008180187.b3lyp_6-31g(d).firefly.inp (generated)

008180187.b3lyp_6-31g(d).smash.inp (generated)

008180187.b3lyp_6-31g(d).nwchem.inp (generated) 008180187.b3lyp_6-31g(d).log.xz 008180187.mol 008180187.PUBCHEM 008180187.mol (via Jmol)
008180191.b3lyp_6-31g(d).inp

008180191.b3lyp_6-31g(d).qchem.inp (generated)

008180191.b3lyp_6-31g(d).gjf (generated)

008180191.b3lyp_6-31g(d).firefly.inp (generated)

008180191.b3lyp_6-31g(d).smash.inp (generated)

008180191.b3lyp_6-31g(d).nwchem.inp (generated) 008180191.b3lyp_6-31g(d).log.xz 008180191.td-b3lyp_6-31g+(d).inp 008180191.td-b3lyp_6-31g+(d).log.xz

008180191.td-b3lyp_6-31+g(d).qchem.inp (generated)

008180191.td-b3lyp_6-31+g(d).gjf (generated)

008180191.td-b3lyp_6-31+g(d).firefly.inp (generated)

008180191.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008180191.mol 008180191.PUBCHEM 008180191.mol (via Jmol)
008180193.b3lyp_6-31g(d).inp

008180193.b3lyp_6-31g(d).qchem.inp (generated)

008180193.b3lyp_6-31g(d).gjf (generated)

008180193.b3lyp_6-31g(d).firefly.inp (generated)

008180193.b3lyp_6-31g(d).smash.inp (generated)

008180193.b3lyp_6-31g(d).nwchem.inp (generated) 008180193.b3lyp_6-31g(d).log.xz 008180193.td-b3lyp_6-31g+(d).inp 008180193.td-b3lyp_6-31g+(d).log.xz

008180193.td-b3lyp_6-31+g(d).qchem.inp (generated)

008180193.td-b3lyp_6-31+g(d).gjf (generated)

008180193.td-b3lyp_6-31+g(d).firefly.inp (generated)

008180193.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008180193.mol 008180193.PUBCHEM 008180193.mol (via Jmol)
008180927.b3lyp_6-31g(d).inp

008180927.b3lyp_6-31g(d).qchem.inp (generated)

008180927.b3lyp_6-31g(d).gjf (generated)

008180927.b3lyp_6-31g(d).firefly.inp (generated)

008180927.b3lyp_6-31g(d).smash.inp (generated)

008180927.b3lyp_6-31g(d).nwchem.inp (generated) 008180927.b3lyp_6-31g(d).log.xz 008180927.td-b3lyp_6-31g+(d).inp 008180927.td-b3lyp_6-31g+(d).log.xz

008180927.td-b3lyp_6-31+g(d).qchem.inp (generated)

008180927.td-b3lyp_6-31+g(d).gjf (generated)

008180927.td-b3lyp_6-31+g(d).firefly.inp (generated)

008180927.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008180927.mol 008180927.PUBCHEM 008180927.mol (via Jmol)
008180931.b3lyp_6-31g(d).inp

008180931.b3lyp_6-31g(d).qchem.inp (generated)

008180931.b3lyp_6-31g(d).gjf (generated)

008180931.b3lyp_6-31g(d).firefly.inp (generated)

008180931.b3lyp_6-31g(d).smash.inp (generated)

008180931.b3lyp_6-31g(d).nwchem.inp (generated) 008180931.b3lyp_6-31g(d).log.xz 008180931.td-b3lyp_6-31g+(d).inp 008180931.td-b3lyp_6-31g+(d).log.xz

008180931.td-b3lyp_6-31+g(d).qchem.inp (generated)

008180931.td-b3lyp_6-31+g(d).gjf (generated)

008180931.td-b3lyp_6-31+g(d).firefly.inp (generated)

008180931.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008180931.mol 008180931.PUBCHEM 008180931.mol (via Jmol)
008181489.b3lyp_6-31g(d).inp

008181489.b3lyp_6-31g(d).qchem.inp (generated)

008181489.b3lyp_6-31g(d).gjf (generated)

008181489.b3lyp_6-31g(d).firefly.inp (generated)

008181489.b3lyp_6-31g(d).smash.inp (generated)

008181489.b3lyp_6-31g(d).nwchem.inp (generated) 008181489.b3lyp_6-31g(d).log.xz 008181489.td-b3lyp_6-31g+(d).inp 008181489.td-b3lyp_6-31g+(d).log.xz

008181489.td-b3lyp_6-31+g(d).qchem.inp (generated)

008181489.td-b3lyp_6-31+g(d).gjf (generated)

008181489.td-b3lyp_6-31+g(d).firefly.inp (generated)

008181489.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008181489.mol 008181489.PUBCHEM 008181489.mol (via Jmol)
008181498.b3lyp_6-31g(d).inp

008181498.b3lyp_6-31g(d).qchem.inp (generated)

008181498.b3lyp_6-31g(d).gjf (generated)

008181498.b3lyp_6-31g(d).firefly.inp (generated)

008181498.b3lyp_6-31g(d).smash.inp (generated)

008181498.b3lyp_6-31g(d).nwchem.inp (generated) 008181498.b3lyp_6-31g(d).log.xz 008181498.td-b3lyp_6-31g+(d).inp 008181498.td-b3lyp_6-31g+(d).log.xz

008181498.td-b3lyp_6-31+g(d).qchem.inp (generated)

008181498.td-b3lyp_6-31+g(d).gjf (generated)

008181498.td-b3lyp_6-31+g(d).firefly.inp (generated)

008181498.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008181498.mol 008181498.PUBCHEM 008181498.mol (via Jmol)
008181612.b3lyp_6-31g(d).inp

008181612.b3lyp_6-31g(d).qchem.inp (generated)

008181612.b3lyp_6-31g(d).gjf (generated)

008181612.b3lyp_6-31g(d).firefly.inp (generated)

008181612.b3lyp_6-31g(d).smash.inp (generated)

008181612.b3lyp_6-31g(d).nwchem.inp (generated) 008181612.b3lyp_6-31g(d).log.xz 008181612.td-b3lyp_6-31g+(d).inp 008181612.td-b3lyp_6-31g+(d).log.xz

008181612.td-b3lyp_6-31+g(d).qchem.inp (generated)

008181612.td-b3lyp_6-31+g(d).gjf (generated)

008181612.td-b3lyp_6-31+g(d).firefly.inp (generated)

008181612.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008181612.mol 008181612.PUBCHEM 008181612.mol (via Jmol)
008181663.b3lyp_6-31g(d).inp

008181663.b3lyp_6-31g(d).qchem.inp (generated)

008181663.b3lyp_6-31g(d).gjf (generated)

008181663.b3lyp_6-31g(d).firefly.inp (generated)

008181663.b3lyp_6-31g(d).smash.inp (generated)

008181663.b3lyp_6-31g(d).nwchem.inp (generated) 008181663.b3lyp_6-31g(d).log.xz 008181663.td-b3lyp_6-31g+(d).inp 008181663.td-b3lyp_6-31g+(d).log.xz

008181663.td-b3lyp_6-31+g(d).qchem.inp (generated)

008181663.td-b3lyp_6-31+g(d).gjf (generated)

008181663.td-b3lyp_6-31+g(d).firefly.inp (generated)

008181663.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008181663.mol 008181663.PUBCHEM 008181663.mol (via Jmol)
008181665.b3lyp_6-31g(d).inp

008181665.b3lyp_6-31g(d).qchem.inp (generated)

008181665.b3lyp_6-31g(d).gjf (generated)

008181665.b3lyp_6-31g(d).firefly.inp (generated)

008181665.b3lyp_6-31g(d).smash.inp (generated)

008181665.b3lyp_6-31g(d).nwchem.inp (generated) 008181665.b3lyp_6-31g(d).log.xz 008181665.td-b3lyp_6-31g+(d).inp 008181665.td-b3lyp_6-31g+(d).log.xz

008181665.td-b3lyp_6-31+g(d).qchem.inp (generated)

008181665.td-b3lyp_6-31+g(d).gjf (generated)

008181665.td-b3lyp_6-31+g(d).firefly.inp (generated)

008181665.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008181665.mol 008181665.PUBCHEM 008181665.mol (via Jmol)
008181666.b3lyp_6-31g(d).inp

008181666.b3lyp_6-31g(d).qchem.inp (generated)

008181666.b3lyp_6-31g(d).gjf (generated)

008181666.b3lyp_6-31g(d).firefly.inp (generated)

008181666.b3lyp_6-31g(d).smash.inp (generated)

008181666.b3lyp_6-31g(d).nwchem.inp (generated) 008181666.b3lyp_6-31g(d).log.xz 008181666.td-b3lyp_6-31g+(d).inp 008181666.td-b3lyp_6-31g+(d).log.xz

008181666.td-b3lyp_6-31+g(d).qchem.inp (generated)

008181666.td-b3lyp_6-31+g(d).gjf (generated)

008181666.td-b3lyp_6-31+g(d).firefly.inp (generated)

008181666.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008181666.mol 008181666.PUBCHEM 008181666.mol (via Jmol)
008182166.b3lyp_6-31g(d).inp

008182166.b3lyp_6-31g(d).qchem.inp (generated)

008182166.b3lyp_6-31g(d).gjf (generated)

008182166.b3lyp_6-31g(d).firefly.inp (generated)

008182166.b3lyp_6-31g(d).smash.inp (generated)

008182166.b3lyp_6-31g(d).nwchem.inp (generated) 008182166.b3lyp_6-31g(d).log.xz 008182166.mol 008182166.PUBCHEM 008182166.mol (via Jmol)
008182170.b3lyp_6-31g(d).inp

008182170.b3lyp_6-31g(d).qchem.inp (generated)

008182170.b3lyp_6-31g(d).gjf (generated)

008182170.b3lyp_6-31g(d).firefly.inp (generated)

008182170.b3lyp_6-31g(d).smash.inp (generated)

008182170.b3lyp_6-31g(d).nwchem.inp (generated) 008182170.b3lyp_6-31g(d).log.xz 008182170.mol 008182170.PUBCHEM 008182170.mol (via Jmol)
008182171.b3lyp_6-31g(d).inp

008182171.b3lyp_6-31g(d).qchem.inp (generated)

008182171.b3lyp_6-31g(d).gjf (generated)

008182171.b3lyp_6-31g(d).firefly.inp (generated)

008182171.b3lyp_6-31g(d).smash.inp (generated)

008182171.b3lyp_6-31g(d).nwchem.inp (generated) 008182171.b3lyp_6-31g(d).log.xz 008182171.mol 008182171.PUBCHEM 008182171.mol (via Jmol)
008182732.b3lyp_6-31g(d).inp

008182732.b3lyp_6-31g(d).qchem.inp (generated)

008182732.b3lyp_6-31g(d).gjf (generated)

008182732.b3lyp_6-31g(d).firefly.inp (generated)

008182732.b3lyp_6-31g(d).smash.inp (generated)

008182732.b3lyp_6-31g(d).nwchem.inp (generated) 008182732.b3lyp_6-31g(d).log.xz 008182732.td-b3lyp_6-31g+(d).inp 008182732.td-b3lyp_6-31g+(d).log.xz

008182732.td-b3lyp_6-31+g(d).qchem.inp (generated)

008182732.td-b3lyp_6-31+g(d).gjf (generated)

008182732.td-b3lyp_6-31+g(d).firefly.inp (generated)

008182732.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008182732.mol 008182732.PUBCHEM 008182732.mol (via Jmol)
008183332.b3lyp_6-31g(d).inp

008183332.b3lyp_6-31g(d).qchem.inp (generated)

008183332.b3lyp_6-31g(d).gjf (generated)

008183332.b3lyp_6-31g(d).firefly.inp (generated)

008183332.b3lyp_6-31g(d).smash.inp (generated)

008183332.b3lyp_6-31g(d).nwchem.inp (generated) 008183332.b3lyp_6-31g(d).log.xz 008183332.td-b3lyp_6-31g+(d).inp 008183332.td-b3lyp_6-31g+(d).log.xz

008183332.td-b3lyp_6-31+g(d).qchem.inp (generated)

008183332.td-b3lyp_6-31+g(d).gjf (generated)

008183332.td-b3lyp_6-31+g(d).firefly.inp (generated)

008183332.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008183332.mol 008183332.PUBCHEM 008183332.mol (via Jmol)
008183334.b3lyp_6-31g(d).inp

008183334.b3lyp_6-31g(d).qchem.inp (generated)

008183334.b3lyp_6-31g(d).gjf (generated)

008183334.b3lyp_6-31g(d).firefly.inp (generated)

008183334.b3lyp_6-31g(d).smash.inp (generated)

008183334.b3lyp_6-31g(d).nwchem.inp (generated) 008183334.b3lyp_6-31g(d).log.xz 008183334.td-b3lyp_6-31g+(d).inp 008183334.td-b3lyp_6-31g+(d).log.xz

008183334.td-b3lyp_6-31+g(d).qchem.inp (generated)

008183334.td-b3lyp_6-31+g(d).gjf (generated)

008183334.td-b3lyp_6-31+g(d).firefly.inp (generated)

008183334.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008183334.mol 008183334.PUBCHEM 008183334.mol (via Jmol)
008183344.b3lyp_6-31g(d).inp

008183344.b3lyp_6-31g(d).qchem.inp (generated)

008183344.b3lyp_6-31g(d).gjf (generated)

008183344.b3lyp_6-31g(d).firefly.inp (generated)

008183344.b3lyp_6-31g(d).smash.inp (generated)

008183344.b3lyp_6-31g(d).nwchem.inp (generated) 008183344.b3lyp_6-31g(d).log.xz 008183344.td-b3lyp_6-31g+(d).inp 008183344.td-b3lyp_6-31g+(d).log.xz

008183344.td-b3lyp_6-31+g(d).qchem.inp (generated)

008183344.td-b3lyp_6-31+g(d).gjf (generated)

008183344.td-b3lyp_6-31+g(d).firefly.inp (generated)

008183344.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008183344.mol 008183344.PUBCHEM 008183344.mol (via Jmol)
008183345.b3lyp_6-31g(d).inp

008183345.b3lyp_6-31g(d).qchem.inp (generated)

008183345.b3lyp_6-31g(d).gjf (generated)

008183345.b3lyp_6-31g(d).firefly.inp (generated)

008183345.b3lyp_6-31g(d).smash.inp (generated)

008183345.b3lyp_6-31g(d).nwchem.inp (generated) 008183345.b3lyp_6-31g(d).log.xz 008183345.td-b3lyp_6-31g+(d).inp 008183345.td-b3lyp_6-31g+(d).log.xz

008183345.td-b3lyp_6-31+g(d).qchem.inp (generated)

008183345.td-b3lyp_6-31+g(d).gjf (generated)

008183345.td-b3lyp_6-31+g(d).firefly.inp (generated)

008183345.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008183345.mol 008183345.PUBCHEM 008183345.mol (via Jmol)
008183420.b3lyp_6-31g(d).inp

008183420.b3lyp_6-31g(d).qchem.inp (generated)

008183420.b3lyp_6-31g(d).gjf (generated)

008183420.b3lyp_6-31g(d).firefly.inp (generated)

008183420.b3lyp_6-31g(d).smash.inp (generated)

008183420.b3lyp_6-31g(d).nwchem.inp (generated) 008183420.b3lyp_6-31g(d).log.xz 008183420.td-b3lyp_6-31g+(d).inp 008183420.td-b3lyp_6-31g+(d).log.xz

008183420.td-b3lyp_6-31+g(d).qchem.inp (generated)

008183420.td-b3lyp_6-31+g(d).gjf (generated)

008183420.td-b3lyp_6-31+g(d).firefly.inp (generated)

008183420.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008183420.mol 008183420.PUBCHEM 008183420.mol (via Jmol)
008183421.b3lyp_6-31g(d).inp

008183421.b3lyp_6-31g(d).qchem.inp (generated)

008183421.b3lyp_6-31g(d).gjf (generated)

008183421.b3lyp_6-31g(d).firefly.inp (generated)

008183421.b3lyp_6-31g(d).smash.inp (generated)

008183421.b3lyp_6-31g(d).nwchem.inp (generated) 008183421.b3lyp_6-31g(d).log.xz 008183421.td-b3lyp_6-31g+(d).inp 008183421.td-b3lyp_6-31g+(d).log.xz

008183421.td-b3lyp_6-31+g(d).qchem.inp (generated)

008183421.td-b3lyp_6-31+g(d).gjf (generated)

008183421.td-b3lyp_6-31+g(d).firefly.inp (generated)

008183421.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008183421.mol 008183421.PUBCHEM 008183421.mol (via Jmol)
008183442.b3lyp_6-31g(d).inp

008183442.b3lyp_6-31g(d).qchem.inp (generated)

008183442.b3lyp_6-31g(d).gjf (generated)

008183442.b3lyp_6-31g(d).firefly.inp (generated)

008183442.b3lyp_6-31g(d).smash.inp (generated)

008183442.b3lyp_6-31g(d).nwchem.inp (generated) 008183442.b3lyp_6-31g(d).log.xz 008183442.td-b3lyp_6-31g+(d).inp 008183442.td-b3lyp_6-31g+(d).log.xz

008183442.td-b3lyp_6-31+g(d).qchem.inp (generated)

008183442.td-b3lyp_6-31+g(d).gjf (generated)

008183442.td-b3lyp_6-31+g(d).firefly.inp (generated)

008183442.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008183442.mol 008183442.PUBCHEM 008183442.mol (via Jmol)
008183534.b3lyp_6-31g(d).inp

008183534.b3lyp_6-31g(d).qchem.inp (generated)

008183534.b3lyp_6-31g(d).gjf (generated)

008183534.b3lyp_6-31g(d).firefly.inp (generated)

008183534.b3lyp_6-31g(d).smash.inp (generated)

008183534.b3lyp_6-31g(d).nwchem.inp (generated) 008183534.b3lyp_6-31g(d).log.xz 008183534.td-b3lyp_6-31g+(d).inp 008183534.td-b3lyp_6-31g+(d).log.xz

008183534.td-b3lyp_6-31+g(d).qchem.inp (generated)

008183534.td-b3lyp_6-31+g(d).gjf (generated)

008183534.td-b3lyp_6-31+g(d).firefly.inp (generated)

008183534.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008183534.mol 008183534.PUBCHEM 008183534.mol (via Jmol)
008183535.b3lyp_6-31g(d).inp

008183535.b3lyp_6-31g(d).qchem.inp (generated)

008183535.b3lyp_6-31g(d).gjf (generated)

008183535.b3lyp_6-31g(d).firefly.inp (generated)

008183535.b3lyp_6-31g(d).smash.inp (generated)

008183535.b3lyp_6-31g(d).nwchem.inp (generated) 008183535.b3lyp_6-31g(d).log.xz 008183535.td-b3lyp_6-31g+(d).inp 008183535.td-b3lyp_6-31g+(d).log.xz

008183535.td-b3lyp_6-31+g(d).qchem.inp (generated)

008183535.td-b3lyp_6-31+g(d).gjf (generated)

008183535.td-b3lyp_6-31+g(d).firefly.inp (generated)

008183535.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008183535.mol 008183535.PUBCHEM 008183535.mol (via Jmol)
008183554.b3lyp_6-31g(d).inp

008183554.b3lyp_6-31g(d).qchem.inp (generated)

008183554.b3lyp_6-31g(d).gjf (generated)

008183554.b3lyp_6-31g(d).firefly.inp (generated)

008183554.b3lyp_6-31g(d).smash.inp (generated)

008183554.b3lyp_6-31g(d).nwchem.inp (generated) 008183554.b3lyp_6-31g(d).log.xz 008183554.td-b3lyp_6-31g+(d).inp 008183554.td-b3lyp_6-31g+(d).log.xz

008183554.td-b3lyp_6-31+g(d).qchem.inp (generated)

008183554.td-b3lyp_6-31+g(d).gjf (generated)

008183554.td-b3lyp_6-31+g(d).firefly.inp (generated)

008183554.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008183554.mol 008183554.PUBCHEM 008183554.mol (via Jmol)
008183673.b3lyp_6-31g(d).inp

008183673.b3lyp_6-31g(d).qchem.inp (generated)

008183673.b3lyp_6-31g(d).gjf (generated)

008183673.b3lyp_6-31g(d).firefly.inp (generated)

008183673.b3lyp_6-31g(d).smash.inp (generated)

008183673.b3lyp_6-31g(d).nwchem.inp (generated) 008183673.b3lyp_6-31g(d).log.xz 008183673.td-b3lyp_6-31g+(d).inp 008183673.td-b3lyp_6-31g+(d).log.xz

008183673.td-b3lyp_6-31+g(d).qchem.inp (generated)

008183673.td-b3lyp_6-31+g(d).gjf (generated)

008183673.td-b3lyp_6-31+g(d).firefly.inp (generated)

008183673.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008183673.mol 008183673.PUBCHEM 008183673.mol (via Jmol)
008183783.b3lyp_6-31g(d).inp

008183783.b3lyp_6-31g(d).qchem.inp (generated)

008183783.b3lyp_6-31g(d).gjf (generated)

008183783.b3lyp_6-31g(d).firefly.inp (generated)

008183783.b3lyp_6-31g(d).smash.inp (generated)

008183783.b3lyp_6-31g(d).nwchem.inp (generated) 008183783.b3lyp_6-31g(d).log.xz 008183783.td-b3lyp_6-31g+(d).inp 008183783.td-b3lyp_6-31g+(d).log.xz

008183783.td-b3lyp_6-31+g(d).qchem.inp (generated)

008183783.td-b3lyp_6-31+g(d).gjf (generated)

008183783.td-b3lyp_6-31+g(d).firefly.inp (generated)

008183783.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008183783.mol 008183783.PUBCHEM 008183783.mol (via Jmol)
008184058.b3lyp_6-31g(d).inp

008184058.b3lyp_6-31g(d).qchem.inp (generated)

008184058.b3lyp_6-31g(d).gjf (generated)

008184058.b3lyp_6-31g(d).firefly.inp (generated)

008184058.b3lyp_6-31g(d).smash.inp (generated)

008184058.b3lyp_6-31g(d).nwchem.inp (generated) 008184058.b3lyp_6-31g(d).log.xz 008184058.td-b3lyp_6-31g+(d).inp 008184058.td-b3lyp_6-31g+(d).log.xz

008184058.td-b3lyp_6-31+g(d).qchem.inp (generated)

008184058.td-b3lyp_6-31+g(d).gjf (generated)

008184058.td-b3lyp_6-31+g(d).firefly.inp (generated)

008184058.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008184058.mol 008184058.PUBCHEM 008184058.mol (via Jmol)
008184061.b3lyp_6-31g(d).inp

008184061.b3lyp_6-31g(d).qchem.inp (generated)

008184061.b3lyp_6-31g(d).gjf (generated)

008184061.b3lyp_6-31g(d).firefly.inp (generated)

008184061.b3lyp_6-31g(d).smash.inp (generated)

008184061.b3lyp_6-31g(d).nwchem.inp (generated) 008184061.b3lyp_6-31g(d).log.xz 008184061.td-b3lyp_6-31g+(d).inp 008184061.td-b3lyp_6-31g+(d).log.xz

008184061.td-b3lyp_6-31+g(d).qchem.inp (generated)

008184061.td-b3lyp_6-31+g(d).gjf (generated)

008184061.td-b3lyp_6-31+g(d).firefly.inp (generated)

008184061.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008184061.mol 008184061.PUBCHEM 008184061.mol (via Jmol)
008184178.b3lyp_6-31g(d).inp

008184178.b3lyp_6-31g(d).qchem.inp (generated)

008184178.b3lyp_6-31g(d).gjf (generated)

008184178.b3lyp_6-31g(d).firefly.inp (generated)

008184178.b3lyp_6-31g(d).smash.inp (generated)

008184178.b3lyp_6-31g(d).nwchem.inp (generated) 008184178.b3lyp_6-31g(d).log.xz 008184178.td-b3lyp_6-31g+(d).inp 008184178.td-b3lyp_6-31g+(d).log.xz

008184178.td-b3lyp_6-31+g(d).qchem.inp (generated)

008184178.td-b3lyp_6-31+g(d).gjf (generated)

008184178.td-b3lyp_6-31+g(d).firefly.inp (generated)

008184178.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008184178.mol 008184178.PUBCHEM 008184178.mol (via Jmol)
008184485.b3lyp_6-31g(d).inp

008184485.b3lyp_6-31g(d).qchem.inp (generated)

008184485.b3lyp_6-31g(d).gjf (generated)

008184485.b3lyp_6-31g(d).firefly.inp (generated)

008184485.b3lyp_6-31g(d).smash.inp (generated)

008184485.b3lyp_6-31g(d).nwchem.inp (generated) 008184485.b3lyp_6-31g(d).log.xz 008184485.mol 008184485.PUBCHEM 008184485.mol (via Jmol)
008184488.b3lyp_6-31g(d).inp

008184488.b3lyp_6-31g(d).qchem.inp (generated)

008184488.b3lyp_6-31g(d).gjf (generated)

008184488.b3lyp_6-31g(d).firefly.inp (generated)

008184488.b3lyp_6-31g(d).smash.inp (generated)

008184488.b3lyp_6-31g(d).nwchem.inp (generated) 008184488.b3lyp_6-31g(d).log.xz 008184488.mol 008184488.PUBCHEM 008184488.mol (via Jmol)
008184934.b3lyp_6-31g(d).inp

008184934.b3lyp_6-31g(d).qchem.inp (generated)

008184934.b3lyp_6-31g(d).gjf (generated)

008184934.b3lyp_6-31g(d).firefly.inp (generated)

008184934.b3lyp_6-31g(d).smash.inp (generated)

008184934.b3lyp_6-31g(d).nwchem.inp (generated) 008184934.b3lyp_6-31g(d).log.xz 008184934.td-b3lyp_6-31g+(d).inp 008184934.td-b3lyp_6-31g+(d).log.xz

008184934.td-b3lyp_6-31+g(d).qchem.inp (generated)

008184934.td-b3lyp_6-31+g(d).gjf (generated)

008184934.td-b3lyp_6-31+g(d).firefly.inp (generated)

008184934.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008184934.mol 008184934.PUBCHEM 008184934.mol (via Jmol)
008185029.b3lyp_6-31g(d).inp

008185029.b3lyp_6-31g(d).qchem.inp (generated)

008185029.b3lyp_6-31g(d).gjf (generated)

008185029.b3lyp_6-31g(d).firefly.inp (generated)

008185029.b3lyp_6-31g(d).smash.inp (generated)

008185029.b3lyp_6-31g(d).nwchem.inp (generated) 008185029.b3lyp_6-31g(d).log.xz 008185029.mol 008185029.PUBCHEM 008185029.mol (via Jmol)
008186795.b3lyp_6-31g(d).inp

008186795.b3lyp_6-31g(d).qchem.inp (generated)

008186795.b3lyp_6-31g(d).gjf (generated)

008186795.b3lyp_6-31g(d).firefly.inp (generated)

008186795.b3lyp_6-31g(d).smash.inp (generated)

008186795.b3lyp_6-31g(d).nwchem.inp (generated) 008186795.b3lyp_6-31g(d).log.xz 008186795.mol 008186795.PUBCHEM 008186795.mol (via Jmol)
008187726.b3lyp_6-31g(d).inp

008187726.b3lyp_6-31g(d).qchem.inp (generated)

008187726.b3lyp_6-31g(d).gjf (generated)

008187726.b3lyp_6-31g(d).firefly.inp (generated)

008187726.b3lyp_6-31g(d).smash.inp (generated)

008187726.b3lyp_6-31g(d).nwchem.inp (generated) 008187726.b3lyp_6-31g(d).log.xz 008187726.mol 008187726.PUBCHEM 008187726.mol (via Jmol)
008193650.b3lyp_6-31g(d).inp

008193650.b3lyp_6-31g(d).qchem.inp (generated)

008193650.b3lyp_6-31g(d).gjf (generated)

008193650.b3lyp_6-31g(d).firefly.inp (generated)

008193650.b3lyp_6-31g(d).smash.inp (generated)

008193650.b3lyp_6-31g(d).nwchem.inp (generated) 008193650.b3lyp_6-31g(d).log.xz 008193650.td-b3lyp_6-31g+(d).inp 008193650.td-b3lyp_6-31g+(d).log.xz

008193650.td-b3lyp_6-31+g(d).qchem.inp (generated)

008193650.td-b3lyp_6-31+g(d).gjf (generated)

008193650.td-b3lyp_6-31+g(d).firefly.inp (generated)

008193650.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008193650.mol 008193650.PUBCHEM 008193650.mol (via Jmol)
008193989.b3lyp_6-31g(d).inp

008193989.b3lyp_6-31g(d).qchem.inp (generated)

008193989.b3lyp_6-31g(d).gjf (generated)

008193989.b3lyp_6-31g(d).firefly.inp (generated)

008193989.b3lyp_6-31g(d).smash.inp (generated)

008193989.b3lyp_6-31g(d).nwchem.inp (generated) 008193989.b3lyp_6-31g(d).log.xz 008193989.td-b3lyp_6-31g+(d).inp 008193989.td-b3lyp_6-31g+(d).log.xz

008193989.td-b3lyp_6-31+g(d).qchem.inp (generated)

008193989.td-b3lyp_6-31+g(d).gjf (generated)

008193989.td-b3lyp_6-31+g(d).firefly.inp (generated)

008193989.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008193989.mol 008193989.PUBCHEM 008193989.mol (via Jmol)
008193992.b3lyp_6-31g(d).inp

008193992.b3lyp_6-31g(d).qchem.inp (generated)

008193992.b3lyp_6-31g(d).gjf (generated)

008193992.b3lyp_6-31g(d).firefly.inp (generated)

008193992.b3lyp_6-31g(d).smash.inp (generated)

008193992.b3lyp_6-31g(d).nwchem.inp (generated) 008193992.b3lyp_6-31g(d).log.xz 008193992.td-b3lyp_6-31g+(d).inp 008193992.td-b3lyp_6-31g+(d).log.xz

008193992.td-b3lyp_6-31+g(d).qchem.inp (generated)

008193992.td-b3lyp_6-31+g(d).gjf (generated)

008193992.td-b3lyp_6-31+g(d).firefly.inp (generated)

008193992.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008193992.mol 008193992.PUBCHEM 008193992.mol (via Jmol)
008194116.b3lyp_6-31g(d).inp

008194116.b3lyp_6-31g(d).qchem.inp (generated)

008194116.b3lyp_6-31g(d).gjf (generated)

008194116.b3lyp_6-31g(d).firefly.inp (generated)

008194116.b3lyp_6-31g(d).smash.inp (generated)

008194116.b3lyp_6-31g(d).nwchem.inp (generated) 008194116.b3lyp_6-31g(d).log.xz 008194116.td-b3lyp_6-31g+(d).inp 008194116.td-b3lyp_6-31g+(d).log.xz

008194116.td-b3lyp_6-31+g(d).qchem.inp (generated)

008194116.td-b3lyp_6-31+g(d).gjf (generated)

008194116.td-b3lyp_6-31+g(d).firefly.inp (generated)

008194116.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008194116.mol 008194116.PUBCHEM 008194116.mol (via Jmol)
008194119.b3lyp_6-31g(d).inp

008194119.b3lyp_6-31g(d).qchem.inp (generated)

008194119.b3lyp_6-31g(d).gjf (generated)

008194119.b3lyp_6-31g(d).firefly.inp (generated)

008194119.b3lyp_6-31g(d).smash.inp (generated)

008194119.b3lyp_6-31g(d).nwchem.inp (generated) 008194119.b3lyp_6-31g(d).log.xz 008194119.td-b3lyp_6-31g+(d).inp 008194119.td-b3lyp_6-31g+(d).log.xz

008194119.td-b3lyp_6-31+g(d).qchem.inp (generated)

008194119.td-b3lyp_6-31+g(d).gjf (generated)

008194119.td-b3lyp_6-31+g(d).firefly.inp (generated)

008194119.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008194119.mol 008194119.PUBCHEM 008194119.mol (via Jmol)
008194284.b3lyp_6-31g(d).inp

008194284.b3lyp_6-31g(d).qchem.inp (generated)

008194284.b3lyp_6-31g(d).gjf (generated)

008194284.b3lyp_6-31g(d).firefly.inp (generated)

008194284.b3lyp_6-31g(d).smash.inp (generated)

008194284.b3lyp_6-31g(d).nwchem.inp (generated) 008194284.b3lyp_6-31g(d).log.xz 008194284.td-b3lyp_6-31g+(d).inp 008194284.td-b3lyp_6-31g+(d).log.xz

008194284.td-b3lyp_6-31+g(d).qchem.inp (generated)

008194284.td-b3lyp_6-31+g(d).gjf (generated)

008194284.td-b3lyp_6-31+g(d).firefly.inp (generated)

008194284.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008194284.mol 008194284.PUBCHEM 008194284.mol (via Jmol)
008196119.b3lyp_6-31g(d).inp

008196119.b3lyp_6-31g(d).qchem.inp (generated)

008196119.b3lyp_6-31g(d).gjf (generated)

008196119.b3lyp_6-31g(d).firefly.inp (generated)

008196119.b3lyp_6-31g(d).smash.inp (generated)

008196119.b3lyp_6-31g(d).nwchem.inp (generated) 008196119.b3lyp_6-31g(d).log.xz 008196119.td-b3lyp_6-31g+(d).inp 008196119.td-b3lyp_6-31g+(d).log.xz

008196119.td-b3lyp_6-31+g(d).qchem.inp (generated)

008196119.td-b3lyp_6-31+g(d).gjf (generated)

008196119.td-b3lyp_6-31+g(d).firefly.inp (generated)

008196119.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008196119.mol 008196119.PUBCHEM 008196119.mol (via Jmol)
008196181.b3lyp_6-31g(d).inp

008196181.b3lyp_6-31g(d).qchem.inp (generated)

008196181.b3lyp_6-31g(d).gjf (generated)

008196181.b3lyp_6-31g(d).firefly.inp (generated)

008196181.b3lyp_6-31g(d).smash.inp (generated)

008196181.b3lyp_6-31g(d).nwchem.inp (generated) 008196181.b3lyp_6-31g(d).log.xz 008196181.td-b3lyp_6-31g+(d).inp 008196181.td-b3lyp_6-31g+(d).log.xz

008196181.td-b3lyp_6-31+g(d).qchem.inp (generated)

008196181.td-b3lyp_6-31+g(d).gjf (generated)

008196181.td-b3lyp_6-31+g(d).firefly.inp (generated)

008196181.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008196181.mol 008196181.PUBCHEM 008196181.mol (via Jmol)
008196188.b3lyp_6-31g(d).inp

008196188.b3lyp_6-31g(d).qchem.inp (generated)

008196188.b3lyp_6-31g(d).gjf (generated)

008196188.b3lyp_6-31g(d).firefly.inp (generated)

008196188.b3lyp_6-31g(d).smash.inp (generated)

008196188.b3lyp_6-31g(d).nwchem.inp (generated) 008196188.b3lyp_6-31g(d).log.xz 008196188.td-b3lyp_6-31g+(d).inp 008196188.td-b3lyp_6-31g+(d).log.xz

008196188.td-b3lyp_6-31+g(d).qchem.inp (generated)

008196188.td-b3lyp_6-31+g(d).gjf (generated)

008196188.td-b3lyp_6-31+g(d).firefly.inp (generated)

008196188.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008196188.mol 008196188.PUBCHEM 008196188.mol (via Jmol)
008196252.b3lyp_6-31g(d).inp

008196252.b3lyp_6-31g(d).qchem.inp (generated)

008196252.b3lyp_6-31g(d).gjf (generated)

008196252.b3lyp_6-31g(d).firefly.inp (generated)

008196252.b3lyp_6-31g(d).smash.inp (generated)

008196252.b3lyp_6-31g(d).nwchem.inp (generated) 008196252.b3lyp_6-31g(d).log.xz 008196252.mol 008196252.PUBCHEM 008196252.mol (via Jmol)
008196313.b3lyp_6-31g(d).inp

008196313.b3lyp_6-31g(d).qchem.inp (generated)

008196313.b3lyp_6-31g(d).gjf (generated)

008196313.b3lyp_6-31g(d).firefly.inp (generated)

008196313.b3lyp_6-31g(d).smash.inp (generated)

008196313.b3lyp_6-31g(d).nwchem.inp (generated) 008196313.b3lyp_6-31g(d).log.xz 008196313.mol 008196313.PUBCHEM 008196313.mol (via Jmol)
008196347.b3lyp_6-31g(d).inp

008196347.b3lyp_6-31g(d).qchem.inp (generated)

008196347.b3lyp_6-31g(d).gjf (generated)

008196347.b3lyp_6-31g(d).firefly.inp (generated)

008196347.b3lyp_6-31g(d).smash.inp (generated)

008196347.b3lyp_6-31g(d).nwchem.inp (generated) 008196347.b3lyp_6-31g(d).log.xz 008196347.td-b3lyp_6-31g+(d).inp 008196347.td-b3lyp_6-31g+(d).log.xz

008196347.td-b3lyp_6-31+g(d).qchem.inp (generated)

008196347.td-b3lyp_6-31+g(d).gjf (generated)

008196347.td-b3lyp_6-31+g(d).firefly.inp (generated)

008196347.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008196347.mol 008196347.PUBCHEM 008196347.mol (via Jmol)
008196559.b3lyp_6-31g(d).inp

008196559.b3lyp_6-31g(d).qchem.inp (generated)

008196559.b3lyp_6-31g(d).gjf (generated)

008196559.b3lyp_6-31g(d).firefly.inp (generated)

008196559.b3lyp_6-31g(d).smash.inp (generated)

008196559.b3lyp_6-31g(d).nwchem.inp (generated) 008196559.b3lyp_6-31g(d).log.xz 008196559.td-b3lyp_6-31g+(d).inp 008196559.td-b3lyp_6-31g+(d).log.xz

008196559.td-b3lyp_6-31+g(d).qchem.inp (generated)

008196559.td-b3lyp_6-31+g(d).gjf (generated)

008196559.td-b3lyp_6-31+g(d).firefly.inp (generated)

008196559.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008196559.mol 008196559.PUBCHEM 008196559.mol (via Jmol)
008198466.b3lyp_6-31g(d).inp

008198466.b3lyp_6-31g(d).qchem.inp (generated)

008198466.b3lyp_6-31g(d).gjf (generated)

008198466.b3lyp_6-31g(d).firefly.inp (generated)

008198466.b3lyp_6-31g(d).smash.inp (generated)

008198466.b3lyp_6-31g(d).nwchem.inp (generated) 008198466.b3lyp_6-31g(d).log.xz 008198466.td-b3lyp_6-31g+(d).inp 008198466.td-b3lyp_6-31g+(d).log.xz

008198466.td-b3lyp_6-31+g(d).qchem.inp (generated)

008198466.td-b3lyp_6-31+g(d).gjf (generated)

008198466.td-b3lyp_6-31+g(d).firefly.inp (generated)

008198466.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008198466.mol 008198466.PUBCHEM 008198466.mol (via Jmol)
008198572.b3lyp_6-31g(d).inp

008198572.b3lyp_6-31g(d).qchem.inp (generated)

008198572.b3lyp_6-31g(d).gjf (generated)

008198572.b3lyp_6-31g(d).firefly.inp (generated)

008198572.b3lyp_6-31g(d).smash.inp (generated)

008198572.b3lyp_6-31g(d).nwchem.inp (generated) 008198572.b3lyp_6-31g(d).log.xz 008198572.td-b3lyp_6-31g+(d).inp 008198572.td-b3lyp_6-31g+(d).log.xz

008198572.td-b3lyp_6-31+g(d).qchem.inp (generated)

008198572.td-b3lyp_6-31+g(d).gjf (generated)

008198572.td-b3lyp_6-31+g(d).firefly.inp (generated)

008198572.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008198572.mol 008198572.PUBCHEM 008198572.mol (via Jmol)
008198592.b3lyp_6-31g(d).inp

008198592.b3lyp_6-31g(d).qchem.inp (generated)

008198592.b3lyp_6-31g(d).gjf (generated)

008198592.b3lyp_6-31g(d).firefly.inp (generated)

008198592.b3lyp_6-31g(d).smash.inp (generated)

008198592.b3lyp_6-31g(d).nwchem.inp (generated) 008198592.b3lyp_6-31g(d).log.xz 008198592.td-b3lyp_6-31g+(d).inp 008198592.td-b3lyp_6-31g+(d).log.xz

008198592.td-b3lyp_6-31+g(d).qchem.inp (generated)

008198592.td-b3lyp_6-31+g(d).gjf (generated)

008198592.td-b3lyp_6-31+g(d).firefly.inp (generated)

008198592.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008198592.mol 008198592.PUBCHEM 008198592.mol (via Jmol)
008198645.b3lyp_6-31g(d).inp

008198645.b3lyp_6-31g(d).qchem.inp (generated)

008198645.b3lyp_6-31g(d).gjf (generated)

008198645.b3lyp_6-31g(d).firefly.inp (generated)

008198645.b3lyp_6-31g(d).smash.inp (generated)

008198645.b3lyp_6-31g(d).nwchem.inp (generated) 008198645.b3lyp_6-31g(d).log.xz 008198645.td-b3lyp_6-31g+(d).inp 008198645.td-b3lyp_6-31g+(d).log.xz

008198645.td-b3lyp_6-31+g(d).qchem.inp (generated)

008198645.td-b3lyp_6-31+g(d).gjf (generated)

008198645.td-b3lyp_6-31+g(d).firefly.inp (generated)

008198645.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008198645.mol 008198645.PUBCHEM 008198645.mol (via Jmol)
008198666.b3lyp_6-31g(d).inp

008198666.b3lyp_6-31g(d).qchem.inp (generated)

008198666.b3lyp_6-31g(d).gjf (generated)

008198666.b3lyp_6-31g(d).firefly.inp (generated)

008198666.b3lyp_6-31g(d).smash.inp (generated)

008198666.b3lyp_6-31g(d).nwchem.inp (generated) 008198666.b3lyp_6-31g(d).log.xz 008198666.td-b3lyp_6-31g+(d).inp 008198666.td-b3lyp_6-31g+(d).log.xz

008198666.td-b3lyp_6-31+g(d).qchem.inp (generated)

008198666.td-b3lyp_6-31+g(d).gjf (generated)

008198666.td-b3lyp_6-31+g(d).firefly.inp (generated)

008198666.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008198666.mol 008198666.PUBCHEM 008198666.mol (via Jmol)
008198829.b3lyp_6-31g(d).inp

008198829.b3lyp_6-31g(d).qchem.inp (generated)

008198829.b3lyp_6-31g(d).gjf (generated)

008198829.b3lyp_6-31g(d).firefly.inp (generated)

008198829.b3lyp_6-31g(d).smash.inp (generated)

008198829.b3lyp_6-31g(d).nwchem.inp (generated) 008198829.b3lyp_6-31g(d).log.xz 008198829.td-b3lyp_6-31g+(d).inp 008198829.td-b3lyp_6-31g+(d).log.xz

008198829.td-b3lyp_6-31+g(d).qchem.inp (generated)

008198829.td-b3lyp_6-31+g(d).gjf (generated)

008198829.td-b3lyp_6-31+g(d).firefly.inp (generated)

008198829.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008198829.mol 008198829.PUBCHEM 008198829.mol (via Jmol)
008199198.b3lyp_6-31g(d).inp

008199198.b3lyp_6-31g(d).qchem.inp (generated)

008199198.b3lyp_6-31g(d).gjf (generated)

008199198.b3lyp_6-31g(d).firefly.inp (generated)

008199198.b3lyp_6-31g(d).smash.inp (generated)

008199198.b3lyp_6-31g(d).nwchem.inp (generated) 008199198.b3lyp_6-31g(d).log.xz 008199198.td-b3lyp_6-31g+(d).inp 008199198.td-b3lyp_6-31g+(d).log.xz

008199198.td-b3lyp_6-31+g(d).qchem.inp (generated)

008199198.td-b3lyp_6-31+g(d).gjf (generated)

008199198.td-b3lyp_6-31+g(d).firefly.inp (generated)

008199198.td-b3lyp_6-31+g(d).nwchem.inp (generated) 008199198.mol 008199198.PUBCHEM 008199198.mol (via Jmol)


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