Index of

Last updated : Thu Aug 17 01:52:36 JST 2017
Total : 2206 (2038) in this page
012500004.b3lyp_6-31g(d).inp

012500004.b3lyp_6-31g(d).qchem.inp (generated)

012500004.b3lyp_6-31g(d).gjf (generated)

012500004.b3lyp_6-31g(d).firefly.inp (generated)

012500004.b3lyp_6-31g(d).smash.inp (generated)

012500004.b3lyp_6-31g(d).nwchem.inp (generated) 012500004.b3lyp_6-31g(d).log.xz 012500004.td-b3lyp_6-31g+(d).inp 012500004.td-b3lyp_6-31g+(d).log.xz

012500004.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500004.td-b3lyp_6-31+g(d).gjf (generated)

012500004.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500004.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500004.mol 012500004.PUBCHEM 012500004.mol (via Jmol)
012500005.b3lyp_6-31g(d).inp

012500005.b3lyp_6-31g(d).qchem.inp (generated)

012500005.b3lyp_6-31g(d).gjf (generated)

012500005.b3lyp_6-31g(d).firefly.inp (generated)

012500005.b3lyp_6-31g(d).smash.inp (generated)

012500005.b3lyp_6-31g(d).nwchem.inp (generated) 012500005.b3lyp_6-31g(d).log.xz 012500005.td-b3lyp_6-31g+(d).inp 012500005.td-b3lyp_6-31g+(d).log.xz

012500005.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500005.td-b3lyp_6-31+g(d).gjf (generated)

012500005.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500005.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500005.mol 012500005.PUBCHEM 012500005.mol (via Jmol)
012500007.b3lyp_6-31g(d).inp

012500007.b3lyp_6-31g(d).qchem.inp (generated)

012500007.b3lyp_6-31g(d).gjf (generated)

012500007.b3lyp_6-31g(d).firefly.inp (generated)

012500007.b3lyp_6-31g(d).smash.inp (generated)

012500007.b3lyp_6-31g(d).nwchem.inp (generated) 012500007.b3lyp_6-31g(d).log.xz 012500007.mol 012500007.PUBCHEM 012500007.mol (via Jmol)
012500011.b3lyp_6-31g(d).inp

012500011.b3lyp_6-31g(d).qchem.inp (generated)

012500011.b3lyp_6-31g(d).gjf (generated)

012500011.b3lyp_6-31g(d).firefly.inp (generated)

012500011.b3lyp_6-31g(d).smash.inp (generated)

012500011.b3lyp_6-31g(d).nwchem.inp (generated) 012500011.b3lyp_6-31g(d).log.xz 012500011.mol 012500011.PUBCHEM 012500011.mol (via Jmol)
012500014.b3lyp_6-31g(d).inp

012500014.b3lyp_6-31g(d).qchem.inp (generated)

012500014.b3lyp_6-31g(d).gjf (generated)

012500014.b3lyp_6-31g(d).firefly.inp (generated)

012500014.b3lyp_6-31g(d).smash.inp (generated)

012500014.b3lyp_6-31g(d).nwchem.inp (generated) 012500014.b3lyp_6-31g(d).log.xz 012500014.td-b3lyp_6-31g+(d).inp 012500014.td-b3lyp_6-31g+(d).log.xz

012500014.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500014.td-b3lyp_6-31+g(d).gjf (generated)

012500014.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500014.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500014.mol 012500014.PUBCHEM 012500014.mol (via Jmol)
012500020.b3lyp_6-31g(d).inp

012500020.b3lyp_6-31g(d).qchem.inp (generated)

012500020.b3lyp_6-31g(d).gjf (generated)

012500020.b3lyp_6-31g(d).firefly.inp (generated)

012500020.b3lyp_6-31g(d).smash.inp (generated)

012500020.b3lyp_6-31g(d).nwchem.inp (generated) 012500020.b3lyp_6-31g(d).log.xz 012500020.td-b3lyp_6-31g+(d).inp 012500020.td-b3lyp_6-31g+(d).log.xz

012500020.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500020.td-b3lyp_6-31+g(d).gjf (generated)

012500020.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500020.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500020.mol 012500020.PUBCHEM 012500020.mol (via Jmol)
012500025.b3lyp_6-31g(d).inp

012500025.b3lyp_6-31g(d).qchem.inp (generated)

012500025.b3lyp_6-31g(d).gjf (generated)

012500025.b3lyp_6-31g(d).firefly.inp (generated)

012500025.b3lyp_6-31g(d).smash.inp (generated)

012500025.b3lyp_6-31g(d).nwchem.inp (generated) 012500025.b3lyp_6-31g(d).log.xz 012500025.td-b3lyp_6-31g+(d).inp 012500025.td-b3lyp_6-31g+(d).log.xz

012500025.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500025.td-b3lyp_6-31+g(d).gjf (generated)

012500025.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500025.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500025.mol 012500025.PUBCHEM 012500025.mol (via Jmol)
012500027.b3lyp_6-31g(d).inp

012500027.b3lyp_6-31g(d).qchem.inp (generated)

012500027.b3lyp_6-31g(d).gjf (generated)

012500027.b3lyp_6-31g(d).firefly.inp (generated)

012500027.b3lyp_6-31g(d).smash.inp (generated)

012500027.b3lyp_6-31g(d).nwchem.inp (generated) 012500027.b3lyp_6-31g(d).log.xz 012500027.td-b3lyp_6-31g+(d).inp 012500027.td-b3lyp_6-31g+(d).log.xz

012500027.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500027.td-b3lyp_6-31+g(d).gjf (generated)

012500027.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500027.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500027.mol 012500027.PUBCHEM 012500027.mol (via Jmol)
012500028.b3lyp_6-31g(d).inp

012500028.b3lyp_6-31g(d).qchem.inp (generated)

012500028.b3lyp_6-31g(d).gjf (generated)

012500028.b3lyp_6-31g(d).firefly.inp (generated)

012500028.b3lyp_6-31g(d).smash.inp (generated)

012500028.b3lyp_6-31g(d).nwchem.inp (generated) 012500028.b3lyp_6-31g(d).log.xz 012500028.mol 012500028.PUBCHEM 012500028.mol (via Jmol)
012500031.b3lyp_6-31g(d).inp

012500031.b3lyp_6-31g(d).qchem.inp (generated)

012500031.b3lyp_6-31g(d).gjf (generated)

012500031.b3lyp_6-31g(d).firefly.inp (generated)

012500031.b3lyp_6-31g(d).smash.inp (generated)

012500031.b3lyp_6-31g(d).nwchem.inp (generated) 012500031.b3lyp_6-31g(d).log.xz 012500031.td-b3lyp_6-31g+(d).inp 012500031.td-b3lyp_6-31g+(d).log.xz

012500031.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500031.td-b3lyp_6-31+g(d).gjf (generated)

012500031.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500031.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500031.mol 012500031.PUBCHEM 012500031.mol (via Jmol)
012500036.b3lyp_6-31g(d).inp

012500036.b3lyp_6-31g(d).qchem.inp (generated)

012500036.b3lyp_6-31g(d).gjf (generated)

012500036.b3lyp_6-31g(d).firefly.inp (generated)

012500036.b3lyp_6-31g(d).smash.inp (generated)

012500036.b3lyp_6-31g(d).nwchem.inp (generated) 012500036.b3lyp_6-31g(d).log.xz 012500036.td-b3lyp_6-31g+(d).inp 012500036.td-b3lyp_6-31g+(d).log.xz

012500036.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500036.td-b3lyp_6-31+g(d).gjf (generated)

012500036.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500036.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500036.mol 012500036.PUBCHEM 012500036.mol (via Jmol)
012500043.b3lyp_6-31g(d).inp

012500043.b3lyp_6-31g(d).qchem.inp (generated)

012500043.b3lyp_6-31g(d).gjf (generated)

012500043.b3lyp_6-31g(d).firefly.inp (generated)

012500043.b3lyp_6-31g(d).smash.inp (generated)

012500043.b3lyp_6-31g(d).nwchem.inp (generated) 012500043.b3lyp_6-31g(d).log.xz 012500043.td-b3lyp_6-31g+(d).inp 012500043.td-b3lyp_6-31g+(d).log.xz

012500043.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500043.td-b3lyp_6-31+g(d).gjf (generated)

012500043.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500043.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500043.mol 012500043.PUBCHEM 012500043.mol (via Jmol)
012500044.b3lyp_6-31g(d).inp

012500044.b3lyp_6-31g(d).qchem.inp (generated)

012500044.b3lyp_6-31g(d).gjf (generated)

012500044.b3lyp_6-31g(d).firefly.inp (generated)

012500044.b3lyp_6-31g(d).smash.inp (generated)

012500044.b3lyp_6-31g(d).nwchem.inp (generated) 012500044.b3lyp_6-31g(d).log.xz 012500044.td-b3lyp_6-31g+(d).inp 012500044.td-b3lyp_6-31g+(d).log.xz

012500044.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500044.td-b3lyp_6-31+g(d).gjf (generated)

012500044.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500044.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500044.mol 012500044.PUBCHEM 012500044.mol (via Jmol)
012500045.b3lyp_6-31g(d).inp

012500045.b3lyp_6-31g(d).qchem.inp (generated)

012500045.b3lyp_6-31g(d).gjf (generated)

012500045.b3lyp_6-31g(d).firefly.inp (generated)

012500045.b3lyp_6-31g(d).smash.inp (generated)

012500045.b3lyp_6-31g(d).nwchem.inp (generated) 012500045.b3lyp_6-31g(d).log.xz 012500045.td-b3lyp_6-31g+(d).inp 012500045.td-b3lyp_6-31g+(d).log.xz

012500045.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500045.td-b3lyp_6-31+g(d).gjf (generated)

012500045.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500045.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500045.mol 012500045.PUBCHEM 012500045.mol (via Jmol)
012500046.b3lyp_6-31g(d).inp

012500046.b3lyp_6-31g(d).qchem.inp (generated)

012500046.b3lyp_6-31g(d).gjf (generated)

012500046.b3lyp_6-31g(d).firefly.inp (generated)

012500046.b3lyp_6-31g(d).smash.inp (generated)

012500046.b3lyp_6-31g(d).nwchem.inp (generated) 012500046.b3lyp_6-31g(d).log.xz 012500046.mol 012500046.PUBCHEM 012500046.mol (via Jmol)
012500061.b3lyp_6-31g(d).inp

012500061.b3lyp_6-31g(d).qchem.inp (generated)

012500061.b3lyp_6-31g(d).gjf (generated)

012500061.b3lyp_6-31g(d).firefly.inp (generated)

012500061.b3lyp_6-31g(d).smash.inp (generated)

012500061.b3lyp_6-31g(d).nwchem.inp (generated) 012500061.b3lyp_6-31g(d).log.xz 012500061.td-b3lyp_6-31g+(d).inp 012500061.td-b3lyp_6-31g+(d).log.xz

012500061.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500061.td-b3lyp_6-31+g(d).gjf (generated)

012500061.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500061.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500061.mol 012500061.PUBCHEM 012500061.mol (via Jmol)
012500091.b3lyp_6-31g(d).inp

012500091.b3lyp_6-31g(d).qchem.inp (generated)

012500091.b3lyp_6-31g(d).gjf (generated)

012500091.b3lyp_6-31g(d).firefly.inp (generated)

012500091.b3lyp_6-31g(d).smash.inp (generated)

012500091.b3lyp_6-31g(d).nwchem.inp (generated) 012500091.b3lyp_6-31g(d).log.xz 012500091.mol 012500091.PUBCHEM 012500091.mol (via Jmol)
012500096.b3lyp_6-31g(d).inp

012500096.b3lyp_6-31g(d).qchem.inp (generated)

012500096.b3lyp_6-31g(d).gjf (generated)

012500096.b3lyp_6-31g(d).firefly.inp (generated)

012500096.b3lyp_6-31g(d).smash.inp (generated)

012500096.b3lyp_6-31g(d).nwchem.inp (generated) 012500096.b3lyp_6-31g(d).log.xz 012500096.mol 012500096.PUBCHEM 012500096.mol (via Jmol)
012500108.b3lyp_6-31g(d).inp

012500108.b3lyp_6-31g(d).qchem.inp (generated)

012500108.b3lyp_6-31g(d).gjf (generated)

012500108.b3lyp_6-31g(d).firefly.inp (generated)

012500108.b3lyp_6-31g(d).smash.inp (generated)

012500108.b3lyp_6-31g(d).nwchem.inp (generated) 012500108.b3lyp_6-31g(d).log.xz 012500108.mol 012500108.PUBCHEM 012500108.mol (via Jmol)
012500110.b3lyp_6-31g(d).inp

012500110.b3lyp_6-31g(d).qchem.inp (generated)

012500110.b3lyp_6-31g(d).gjf (generated)

012500110.b3lyp_6-31g(d).firefly.inp (generated)

012500110.b3lyp_6-31g(d).smash.inp (generated)

012500110.b3lyp_6-31g(d).nwchem.inp (generated) 012500110.b3lyp_6-31g(d).log.xz 012500110.td-b3lyp_6-31g+(d).inp 012500110.td-b3lyp_6-31g+(d).log.xz

012500110.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500110.td-b3lyp_6-31+g(d).gjf (generated)

012500110.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500110.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500110.mol 012500110.PUBCHEM 012500110.mol (via Jmol)
012500112.b3lyp_6-31g(d).inp

012500112.b3lyp_6-31g(d).qchem.inp (generated)

012500112.b3lyp_6-31g(d).gjf (generated)

012500112.b3lyp_6-31g(d).firefly.inp (generated)

012500112.b3lyp_6-31g(d).smash.inp (generated)

012500112.b3lyp_6-31g(d).nwchem.inp (generated) 012500112.b3lyp_6-31g(d).log.xz 012500112.td-b3lyp_6-31g+(d).inp 012500112.td-b3lyp_6-31g+(d).log.xz

012500112.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500112.td-b3lyp_6-31+g(d).gjf (generated)

012500112.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500112.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500112.mol 012500112.PUBCHEM 012500112.mol (via Jmol)
012500114.b3lyp_6-31g(d).inp

012500114.b3lyp_6-31g(d).qchem.inp (generated)

012500114.b3lyp_6-31g(d).gjf (generated)

012500114.b3lyp_6-31g(d).firefly.inp (generated)

012500114.b3lyp_6-31g(d).smash.inp (generated)

012500114.b3lyp_6-31g(d).nwchem.inp (generated) 012500114.b3lyp_6-31g(d).log.xz 012500114.mol 012500114.PUBCHEM 012500114.mol (via Jmol)
012500122.b3lyp_6-31g(d).inp

012500122.b3lyp_6-31g(d).qchem.inp (generated)

012500122.b3lyp_6-31g(d).gjf (generated)

012500122.b3lyp_6-31g(d).firefly.inp (generated)

012500122.b3lyp_6-31g(d).smash.inp (generated)

012500122.b3lyp_6-31g(d).nwchem.inp (generated) 012500122.b3lyp_6-31g(d).log.xz 012500122.td-b3lyp_6-31g+(d).inp 012500122.td-b3lyp_6-31g+(d).log.xz

012500122.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500122.td-b3lyp_6-31+g(d).gjf (generated)

012500122.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500122.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500122.mol 012500122.PUBCHEM 012500122.mol (via Jmol)
012500127.b3lyp_6-31g(d).inp

012500127.b3lyp_6-31g(d).qchem.inp (generated)

012500127.b3lyp_6-31g(d).gjf (generated)

012500127.b3lyp_6-31g(d).firefly.inp (generated)

012500127.b3lyp_6-31g(d).smash.inp (generated)

012500127.b3lyp_6-31g(d).nwchem.inp (generated) 012500127.b3lyp_6-31g(d).log.xz 012500127.td-b3lyp_6-31g+(d).inp 012500127.td-b3lyp_6-31g+(d).log.xz

012500127.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500127.td-b3lyp_6-31+g(d).gjf (generated)

012500127.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500127.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500127.mol 012500127.PUBCHEM 012500127.mol (via Jmol)
012500214.b3lyp_6-31g(d).inp

012500214.b3lyp_6-31g(d).qchem.inp (generated)

012500214.b3lyp_6-31g(d).gjf (generated)

012500214.b3lyp_6-31g(d).firefly.inp (generated)

012500214.b3lyp_6-31g(d).smash.inp (generated)

012500214.b3lyp_6-31g(d).nwchem.inp (generated) 012500214.b3lyp_6-31g(d).log.xz 012500214.td-b3lyp_6-31g+(d).inp 012500214.td-b3lyp_6-31g+(d).log.xz

012500214.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500214.td-b3lyp_6-31+g(d).gjf (generated)

012500214.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500214.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500214.mol 012500214.PUBCHEM 012500214.mol (via Jmol)
012500232.b3lyp_6-31g(d).inp

012500232.b3lyp_6-31g(d).qchem.inp (generated)

012500232.b3lyp_6-31g(d).gjf (generated)

012500232.b3lyp_6-31g(d).firefly.inp (generated)

012500232.b3lyp_6-31g(d).smash.inp (generated)

012500232.b3lyp_6-31g(d).nwchem.inp (generated) 012500232.b3lyp_6-31g(d).log.xz 012500232.td-b3lyp_6-31g+(d).inp 012500232.td-b3lyp_6-31g+(d).log.xz

012500232.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500232.td-b3lyp_6-31+g(d).gjf (generated)

012500232.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500232.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500232.mol 012500232.PUBCHEM 012500232.mol (via Jmol)
012500262.b3lyp_6-31g(d).inp

012500262.b3lyp_6-31g(d).qchem.inp (generated)

012500262.b3lyp_6-31g(d).gjf (generated)

012500262.b3lyp_6-31g(d).firefly.inp (generated)

012500262.b3lyp_6-31g(d).smash.inp (generated)

012500262.b3lyp_6-31g(d).nwchem.inp (generated) 012500262.b3lyp_6-31g(d).log.xz 012500262.td-b3lyp_6-31g+(d).inp 012500262.td-b3lyp_6-31g+(d).log.xz

012500262.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500262.td-b3lyp_6-31+g(d).gjf (generated)

012500262.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500262.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500262.mol 012500262.PUBCHEM 012500262.mol (via Jmol)
012500263.b3lyp_6-31g(d).inp

012500263.b3lyp_6-31g(d).qchem.inp (generated)

012500263.b3lyp_6-31g(d).gjf (generated)

012500263.b3lyp_6-31g(d).firefly.inp (generated)

012500263.b3lyp_6-31g(d).smash.inp (generated)

012500263.b3lyp_6-31g(d).nwchem.inp (generated) 012500263.b3lyp_6-31g(d).log.xz 012500263.td-b3lyp_6-31g+(d).inp 012500263.td-b3lyp_6-31g+(d).log.xz

012500263.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500263.td-b3lyp_6-31+g(d).gjf (generated)

012500263.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500263.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500263.mol 012500263.PUBCHEM 012500263.mol (via Jmol)
012500265.b3lyp_6-31g(d).inp

012500265.b3lyp_6-31g(d).qchem.inp (generated)

012500265.b3lyp_6-31g(d).gjf (generated)

012500265.b3lyp_6-31g(d).firefly.inp (generated)

012500265.b3lyp_6-31g(d).smash.inp (generated)

012500265.b3lyp_6-31g(d).nwchem.inp (generated) 012500265.b3lyp_6-31g(d).log.xz 012500265.td-b3lyp_6-31g+(d).inp 012500265.td-b3lyp_6-31g+(d).log.xz

012500265.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500265.td-b3lyp_6-31+g(d).gjf (generated)

012500265.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500265.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500265.mol 012500265.PUBCHEM 012500265.mol (via Jmol)
012500266.b3lyp_6-31g(d).inp

012500266.b3lyp_6-31g(d).qchem.inp (generated)

012500266.b3lyp_6-31g(d).gjf (generated)

012500266.b3lyp_6-31g(d).firefly.inp (generated)

012500266.b3lyp_6-31g(d).smash.inp (generated)

012500266.b3lyp_6-31g(d).nwchem.inp (generated) 012500266.b3lyp_6-31g(d).log.xz 012500266.td-b3lyp_6-31g+(d).inp 012500266.td-b3lyp_6-31g+(d).log.xz

012500266.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500266.td-b3lyp_6-31+g(d).gjf (generated)

012500266.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500266.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500266.mol 012500266.PUBCHEM 012500266.mol (via Jmol)
012500269.b3lyp_6-31g(d).inp

012500269.b3lyp_6-31g(d).qchem.inp (generated)

012500269.b3lyp_6-31g(d).gjf (generated)

012500269.b3lyp_6-31g(d).firefly.inp (generated)

012500269.b3lyp_6-31g(d).smash.inp (generated)

012500269.b3lyp_6-31g(d).nwchem.inp (generated) 012500269.b3lyp_6-31g(d).log.xz 012500269.td-b3lyp_6-31g+(d).inp 012500269.td-b3lyp_6-31g+(d).log.xz

012500269.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500269.td-b3lyp_6-31+g(d).gjf (generated)

012500269.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500269.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500269.mol 012500269.PUBCHEM 012500269.mol (via Jmol)
012500273.b3lyp_6-31g(d).inp

012500273.b3lyp_6-31g(d).qchem.inp (generated)

012500273.b3lyp_6-31g(d).gjf (generated)

012500273.b3lyp_6-31g(d).firefly.inp (generated)

012500273.b3lyp_6-31g(d).smash.inp (generated)

012500273.b3lyp_6-31g(d).nwchem.inp (generated) 012500273.b3lyp_6-31g(d).log.xz 012500273.td-b3lyp_6-31g+(d).inp 012500273.td-b3lyp_6-31g+(d).log.xz

012500273.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500273.td-b3lyp_6-31+g(d).gjf (generated)

012500273.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500273.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500273.mol 012500273.PUBCHEM 012500273.mol (via Jmol)
012500285.b3lyp_6-31g(d).inp

012500285.b3lyp_6-31g(d).qchem.inp (generated)

012500285.b3lyp_6-31g(d).gjf (generated)

012500285.b3lyp_6-31g(d).firefly.inp (generated)

012500285.b3lyp_6-31g(d).smash.inp (generated)

012500285.b3lyp_6-31g(d).nwchem.inp (generated) 012500285.b3lyp_6-31g(d).log.xz 012500285.mol 012500285.PUBCHEM 012500285.mol (via Jmol)
012500311.b3lyp_6-31g(d).inp

012500311.b3lyp_6-31g(d).qchem.inp (generated)

012500311.b3lyp_6-31g(d).gjf (generated)

012500311.b3lyp_6-31g(d).firefly.inp (generated)

012500311.b3lyp_6-31g(d).smash.inp (generated)

012500311.b3lyp_6-31g(d).nwchem.inp (generated) 012500311.b3lyp_6-31g(d).log.xz 012500311.td-b3lyp_6-31g+(d).inp 012500311.td-b3lyp_6-31g+(d).log.xz

012500311.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500311.td-b3lyp_6-31+g(d).gjf (generated)

012500311.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500311.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500311.mol 012500311.PUBCHEM 012500311.mol (via Jmol)
012500386.b3lyp_6-31g(d).inp

012500386.b3lyp_6-31g(d).qchem.inp (generated)

012500386.b3lyp_6-31g(d).gjf (generated)

012500386.b3lyp_6-31g(d).firefly.inp (generated)

012500386.b3lyp_6-31g(d).smash.inp (generated)

012500386.b3lyp_6-31g(d).nwchem.inp (generated) 012500386.b3lyp_6-31g(d).log.xz 012500386.td-b3lyp_6-31g+(d).inp 012500386.td-b3lyp_6-31g+(d).log.xz

012500386.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500386.td-b3lyp_6-31+g(d).gjf (generated)

012500386.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500386.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500386.mol 012500386.PUBCHEM 012500386.mol (via Jmol)
012500430.b3lyp_6-31g(d).inp

012500430.b3lyp_6-31g(d).qchem.inp (generated)

012500430.b3lyp_6-31g(d).gjf (generated)

012500430.b3lyp_6-31g(d).firefly.inp (generated)

012500430.b3lyp_6-31g(d).smash.inp (generated)

012500430.b3lyp_6-31g(d).nwchem.inp (generated) 012500430.b3lyp_6-31g(d).log.xz 012500430.td-b3lyp_6-31g+(d).inp 012500430.td-b3lyp_6-31g+(d).log.xz

012500430.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500430.td-b3lyp_6-31+g(d).gjf (generated)

012500430.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500430.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500430.mol 012500430.PUBCHEM 012500430.mol (via Jmol)
012500437.b3lyp_6-31g(d).inp

012500437.b3lyp_6-31g(d).qchem.inp (generated)

012500437.b3lyp_6-31g(d).gjf (generated)

012500437.b3lyp_6-31g(d).firefly.inp (generated)

012500437.b3lyp_6-31g(d).smash.inp (generated)

012500437.b3lyp_6-31g(d).nwchem.inp (generated) 012500437.b3lyp_6-31g(d).log.xz 012500437.td-b3lyp_6-31g+(d).inp 012500437.td-b3lyp_6-31g+(d).log.xz

012500437.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500437.td-b3lyp_6-31+g(d).gjf (generated)

012500437.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500437.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500437.mol 012500437.PUBCHEM 012500437.mol (via Jmol)
012500438.b3lyp_6-31g(d).inp

012500438.b3lyp_6-31g(d).qchem.inp (generated)

012500438.b3lyp_6-31g(d).gjf (generated)

012500438.b3lyp_6-31g(d).firefly.inp (generated)

012500438.b3lyp_6-31g(d).smash.inp (generated)

012500438.b3lyp_6-31g(d).nwchem.inp (generated) 012500438.b3lyp_6-31g(d).log.xz 012500438.td-b3lyp_6-31g+(d).inp 012500438.td-b3lyp_6-31g+(d).log.xz

012500438.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500438.td-b3lyp_6-31+g(d).gjf (generated)

012500438.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500438.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500438.mol 012500438.PUBCHEM 012500438.mol (via Jmol)
012500441.b3lyp_6-31g(d).inp

012500441.b3lyp_6-31g(d).qchem.inp (generated)

012500441.b3lyp_6-31g(d).gjf (generated)

012500441.b3lyp_6-31g(d).firefly.inp (generated)

012500441.b3lyp_6-31g(d).smash.inp (generated)

012500441.b3lyp_6-31g(d).nwchem.inp (generated) 012500441.b3lyp_6-31g(d).log.xz 012500441.td-b3lyp_6-31g+(d).inp 012500441.td-b3lyp_6-31g+(d).log.xz

012500441.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500441.td-b3lyp_6-31+g(d).gjf (generated)

012500441.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500441.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500441.mol 012500441.PUBCHEM 012500441.mol (via Jmol)
012500491.b3lyp_6-31g(d).inp

012500491.b3lyp_6-31g(d).qchem.inp (generated)

012500491.b3lyp_6-31g(d).gjf (generated)

012500491.b3lyp_6-31g(d).firefly.inp (generated)

012500491.b3lyp_6-31g(d).smash.inp (generated)

012500491.b3lyp_6-31g(d).nwchem.inp (generated) 012500491.b3lyp_6-31g(d).log.xz 012500491.td-b3lyp_6-31g+(d).inp 012500491.td-b3lyp_6-31g+(d).log.xz

012500491.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500491.td-b3lyp_6-31+g(d).gjf (generated)

012500491.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500491.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500491.mol 012500491.PUBCHEM 012500491.mol (via Jmol)
012500492.b3lyp_6-31g(d).inp

012500492.b3lyp_6-31g(d).qchem.inp (generated)

012500492.b3lyp_6-31g(d).gjf (generated)

012500492.b3lyp_6-31g(d).firefly.inp (generated)

012500492.b3lyp_6-31g(d).smash.inp (generated)

012500492.b3lyp_6-31g(d).nwchem.inp (generated) 012500492.b3lyp_6-31g(d).log.xz 012500492.td-b3lyp_6-31g+(d).inp 012500492.td-b3lyp_6-31g+(d).log.xz

012500492.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500492.td-b3lyp_6-31+g(d).gjf (generated)

012500492.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500492.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500492.mol 012500492.PUBCHEM 012500492.mol (via Jmol)
012500493.b3lyp_6-31g(d).inp

012500493.b3lyp_6-31g(d).qchem.inp (generated)

012500493.b3lyp_6-31g(d).gjf (generated)

012500493.b3lyp_6-31g(d).firefly.inp (generated)

012500493.b3lyp_6-31g(d).smash.inp (generated)

012500493.b3lyp_6-31g(d).nwchem.inp (generated) 012500493.b3lyp_6-31g(d).log.xz 012500493.td-b3lyp_6-31g+(d).inp 012500493.td-b3lyp_6-31g+(d).log.xz

012500493.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500493.td-b3lyp_6-31+g(d).gjf (generated)

012500493.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500493.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500493.mol 012500493.PUBCHEM 012500493.mol (via Jmol)
012500494.b3lyp_6-31g(d).inp

012500494.b3lyp_6-31g(d).qchem.inp (generated)

012500494.b3lyp_6-31g(d).gjf (generated)

012500494.b3lyp_6-31g(d).firefly.inp (generated)

012500494.b3lyp_6-31g(d).smash.inp (generated)

012500494.b3lyp_6-31g(d).nwchem.inp (generated) 012500494.b3lyp_6-31g(d).log.xz 012500494.td-b3lyp_6-31g+(d).inp 012500494.td-b3lyp_6-31g+(d).log.xz

012500494.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500494.td-b3lyp_6-31+g(d).gjf (generated)

012500494.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500494.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500494.mol 012500494.PUBCHEM 012500494.mol (via Jmol)
012500499.b3lyp_6-31g(d).inp

012500499.b3lyp_6-31g(d).qchem.inp (generated)

012500499.b3lyp_6-31g(d).gjf (generated)

012500499.b3lyp_6-31g(d).firefly.inp (generated)

012500499.b3lyp_6-31g(d).smash.inp (generated)

012500499.b3lyp_6-31g(d).nwchem.inp (generated) 012500499.b3lyp_6-31g(d).log.xz 012500499.td-b3lyp_6-31g+(d).inp 012500499.td-b3lyp_6-31g+(d).log.xz

012500499.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500499.td-b3lyp_6-31+g(d).gjf (generated)

012500499.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500499.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500499.mol 012500499.PUBCHEM 012500499.mol (via Jmol)
012500500.b3lyp_6-31g(d).inp

012500500.b3lyp_6-31g(d).qchem.inp (generated)

012500500.b3lyp_6-31g(d).gjf (generated)

012500500.b3lyp_6-31g(d).firefly.inp (generated)

012500500.b3lyp_6-31g(d).smash.inp (generated)

012500500.b3lyp_6-31g(d).nwchem.inp (generated) 012500500.b3lyp_6-31g(d).log.xz 012500500.td-b3lyp_6-31g+(d).inp 012500500.td-b3lyp_6-31g+(d).log.xz

012500500.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500500.td-b3lyp_6-31+g(d).gjf (generated)

012500500.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500500.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500500.mol 012500500.PUBCHEM 012500500.mol (via Jmol)
012500609.b3lyp_6-31g(d).inp

012500609.b3lyp_6-31g(d).qchem.inp (generated)

012500609.b3lyp_6-31g(d).gjf (generated)

012500609.b3lyp_6-31g(d).firefly.inp (generated)

012500609.b3lyp_6-31g(d).smash.inp (generated)

012500609.b3lyp_6-31g(d).nwchem.inp (generated) 012500609.b3lyp_6-31g(d).log.xz 012500609.td-b3lyp_6-31g+(d).inp 012500609.td-b3lyp_6-31g+(d).log.xz

012500609.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500609.td-b3lyp_6-31+g(d).gjf (generated)

012500609.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500609.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500609.mol 012500609.PUBCHEM 012500609.mol (via Jmol)
012500628.b3lyp_6-31g(d).inp

012500628.b3lyp_6-31g(d).qchem.inp (generated)

012500628.b3lyp_6-31g(d).gjf (generated)

012500628.b3lyp_6-31g(d).firefly.inp (generated)

012500628.b3lyp_6-31g(d).smash.inp (generated)

012500628.b3lyp_6-31g(d).nwchem.inp (generated) 012500628.b3lyp_6-31g(d).log.xz 012500628.td-b3lyp_6-31g+(d).inp 012500628.td-b3lyp_6-31g+(d).log.xz

012500628.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500628.td-b3lyp_6-31+g(d).gjf (generated)

012500628.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500628.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500628.mol 012500628.PUBCHEM 012500628.mol (via Jmol)
012500644.b3lyp_6-31g(d).inp

012500644.b3lyp_6-31g(d).qchem.inp (generated)

012500644.b3lyp_6-31g(d).gjf (generated)

012500644.b3lyp_6-31g(d).firefly.inp (generated)

012500644.b3lyp_6-31g(d).smash.inp (generated)

012500644.b3lyp_6-31g(d).nwchem.inp (generated) 012500644.b3lyp_6-31g(d).log.xz 012500644.td-b3lyp_6-31g+(d).inp 012500644.td-b3lyp_6-31g+(d).log.xz

012500644.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500644.td-b3lyp_6-31+g(d).gjf (generated)

012500644.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500644.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500644.mol 012500644.PUBCHEM 012500644.mol (via Jmol)
012500656.b3lyp_6-31g(d).inp

012500656.b3lyp_6-31g(d).qchem.inp (generated)

012500656.b3lyp_6-31g(d).gjf (generated)

012500656.b3lyp_6-31g(d).firefly.inp (generated)

012500656.b3lyp_6-31g(d).smash.inp (generated)

012500656.b3lyp_6-31g(d).nwchem.inp (generated) 012500656.b3lyp_6-31g(d).log.xz 012500656.td-b3lyp_6-31g+(d).inp 012500656.td-b3lyp_6-31g+(d).log.xz

012500656.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500656.td-b3lyp_6-31+g(d).gjf (generated)

012500656.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500656.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500656.mol 012500656.PUBCHEM 012500656.mol (via Jmol)
012500661.b3lyp_6-31g(d).inp

012500661.b3lyp_6-31g(d).qchem.inp (generated)

012500661.b3lyp_6-31g(d).gjf (generated)

012500661.b3lyp_6-31g(d).firefly.inp (generated)

012500661.b3lyp_6-31g(d).smash.inp (generated)

012500661.b3lyp_6-31g(d).nwchem.inp (generated) 012500661.b3lyp_6-31g(d).log.xz 012500661.td-b3lyp_6-31g+(d).inp 012500661.td-b3lyp_6-31g+(d).log.xz

012500661.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500661.td-b3lyp_6-31+g(d).gjf (generated)

012500661.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500661.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500661.mol 012500661.PUBCHEM 012500661.mol (via Jmol)
012500664.b3lyp_6-31g(d).inp

012500664.b3lyp_6-31g(d).qchem.inp (generated)

012500664.b3lyp_6-31g(d).gjf (generated)

012500664.b3lyp_6-31g(d).firefly.inp (generated)

012500664.b3lyp_6-31g(d).smash.inp (generated)

012500664.b3lyp_6-31g(d).nwchem.inp (generated) 012500664.b3lyp_6-31g(d).log.xz 012500664.td-b3lyp_6-31g+(d).inp 012500664.td-b3lyp_6-31g+(d).log.xz

012500664.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500664.td-b3lyp_6-31+g(d).gjf (generated)

012500664.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500664.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500664.mol 012500664.PUBCHEM 012500664.mol (via Jmol)
012500702.b3lyp_6-31g(d).inp

012500702.b3lyp_6-31g(d).qchem.inp (generated)

012500702.b3lyp_6-31g(d).gjf (generated)

012500702.b3lyp_6-31g(d).firefly.inp (generated)

012500702.b3lyp_6-31g(d).smash.inp (generated)

012500702.b3lyp_6-31g(d).nwchem.inp (generated) 012500702.b3lyp_6-31g(d).log.xz 012500702.td-b3lyp_6-31g+(d).inp 012500702.td-b3lyp_6-31g+(d).log.xz

012500702.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500702.td-b3lyp_6-31+g(d).gjf (generated)

012500702.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500702.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500702.mol 012500702.PUBCHEM 012500702.mol (via Jmol)
012500705.b3lyp_6-31g(d).inp

012500705.b3lyp_6-31g(d).qchem.inp (generated)

012500705.b3lyp_6-31g(d).gjf (generated)

012500705.b3lyp_6-31g(d).firefly.inp (generated)

012500705.b3lyp_6-31g(d).smash.inp (generated)

012500705.b3lyp_6-31g(d).nwchem.inp (generated) 012500705.b3lyp_6-31g(d).log.xz 012500705.mol 012500705.PUBCHEM 012500705.mol (via Jmol)
012500709.b3lyp_6-31g(d).inp

012500709.b3lyp_6-31g(d).qchem.inp (generated)

012500709.b3lyp_6-31g(d).gjf (generated)

012500709.b3lyp_6-31g(d).firefly.inp (generated)

012500709.b3lyp_6-31g(d).smash.inp (generated)

012500709.b3lyp_6-31g(d).nwchem.inp (generated) 012500709.b3lyp_6-31g(d).log.xz 012500709.mol 012500709.PUBCHEM 012500709.mol (via Jmol)
012500711.b3lyp_6-31g(d).inp

012500711.b3lyp_6-31g(d).qchem.inp (generated)

012500711.b3lyp_6-31g(d).gjf (generated)

012500711.b3lyp_6-31g(d).firefly.inp (generated)

012500711.b3lyp_6-31g(d).smash.inp (generated)

012500711.b3lyp_6-31g(d).nwchem.inp (generated) 012500711.b3lyp_6-31g(d).log.xz 012500711.td-b3lyp_6-31g+(d).inp 012500711.td-b3lyp_6-31g+(d).log.xz

012500711.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500711.td-b3lyp_6-31+g(d).gjf (generated)

012500711.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500711.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500711.mol 012500711.PUBCHEM 012500711.mol (via Jmol)
012500712.b3lyp_6-31g(d).inp

012500712.b3lyp_6-31g(d).qchem.inp (generated)

012500712.b3lyp_6-31g(d).gjf (generated)

012500712.b3lyp_6-31g(d).firefly.inp (generated)

012500712.b3lyp_6-31g(d).smash.inp (generated)

012500712.b3lyp_6-31g(d).nwchem.inp (generated) 012500712.b3lyp_6-31g(d).log.xz 012500712.td-b3lyp_6-31g+(d).inp 012500712.td-b3lyp_6-31g+(d).log.xz

012500712.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500712.td-b3lyp_6-31+g(d).gjf (generated)

012500712.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500712.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500712.mol 012500712.PUBCHEM 012500712.mol (via Jmol)
012500714.b3lyp_6-31g(d).inp

012500714.b3lyp_6-31g(d).qchem.inp (generated)

012500714.b3lyp_6-31g(d).gjf (generated)

012500714.b3lyp_6-31g(d).firefly.inp (generated)

012500714.b3lyp_6-31g(d).smash.inp (generated)

012500714.b3lyp_6-31g(d).nwchem.inp (generated) 012500714.b3lyp_6-31g(d).log.xz 012500714.td-b3lyp_6-31g+(d).inp 012500714.td-b3lyp_6-31g+(d).log.xz

012500714.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500714.td-b3lyp_6-31+g(d).gjf (generated)

012500714.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500714.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500714.mol 012500714.PUBCHEM 012500714.mol (via Jmol)
012500715.b3lyp_6-31g(d).inp

012500715.b3lyp_6-31g(d).qchem.inp (generated)

012500715.b3lyp_6-31g(d).gjf (generated)

012500715.b3lyp_6-31g(d).firefly.inp (generated)

012500715.b3lyp_6-31g(d).smash.inp (generated)

012500715.b3lyp_6-31g(d).nwchem.inp (generated) 012500715.b3lyp_6-31g(d).log.xz 012500715.td-b3lyp_6-31g+(d).inp 012500715.td-b3lyp_6-31g+(d).log.xz

012500715.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500715.td-b3lyp_6-31+g(d).gjf (generated)

012500715.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500715.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500715.mol 012500715.PUBCHEM 012500715.mol (via Jmol)
012500716.b3lyp_6-31g(d).inp

012500716.b3lyp_6-31g(d).qchem.inp (generated)

012500716.b3lyp_6-31g(d).gjf (generated)

012500716.b3lyp_6-31g(d).firefly.inp (generated)

012500716.b3lyp_6-31g(d).smash.inp (generated)

012500716.b3lyp_6-31g(d).nwchem.inp (generated) 012500716.b3lyp_6-31g(d).log.xz 012500716.td-b3lyp_6-31g+(d).inp 012500716.td-b3lyp_6-31g+(d).log.xz

012500716.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500716.td-b3lyp_6-31+g(d).gjf (generated)

012500716.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500716.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500716.mol 012500716.PUBCHEM 012500716.mol (via Jmol)
012500717.b3lyp_6-31g(d).inp

012500717.b3lyp_6-31g(d).qchem.inp (generated)

012500717.b3lyp_6-31g(d).gjf (generated)

012500717.b3lyp_6-31g(d).firefly.inp (generated)

012500717.b3lyp_6-31g(d).smash.inp (generated)

012500717.b3lyp_6-31g(d).nwchem.inp (generated) 012500717.b3lyp_6-31g(d).log.xz 012500717.td-b3lyp_6-31g+(d).inp 012500717.td-b3lyp_6-31g+(d).log.xz

012500717.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500717.td-b3lyp_6-31+g(d).gjf (generated)

012500717.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500717.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500717.mol 012500717.PUBCHEM 012500717.mol (via Jmol)
012500718.b3lyp_6-31g(d).inp

012500718.b3lyp_6-31g(d).qchem.inp (generated)

012500718.b3lyp_6-31g(d).gjf (generated)

012500718.b3lyp_6-31g(d).firefly.inp (generated)

012500718.b3lyp_6-31g(d).smash.inp (generated)

012500718.b3lyp_6-31g(d).nwchem.inp (generated) 012500718.b3lyp_6-31g(d).log.xz 012500718.td-b3lyp_6-31g+(d).inp 012500718.td-b3lyp_6-31g+(d).log.xz

012500718.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500718.td-b3lyp_6-31+g(d).gjf (generated)

012500718.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500718.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500718.mol 012500718.PUBCHEM 012500718.mol (via Jmol)
012500720.b3lyp_6-31g(d).inp

012500720.b3lyp_6-31g(d).qchem.inp (generated)

012500720.b3lyp_6-31g(d).gjf (generated)

012500720.b3lyp_6-31g(d).firefly.inp (generated)

012500720.b3lyp_6-31g(d).smash.inp (generated)

012500720.b3lyp_6-31g(d).nwchem.inp (generated) 012500720.b3lyp_6-31g(d).log.xz 012500720.td-b3lyp_6-31g+(d).inp 012500720.td-b3lyp_6-31g+(d).log.xz

012500720.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500720.td-b3lyp_6-31+g(d).gjf (generated)

012500720.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500720.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500720.mol 012500720.PUBCHEM 012500720.mol (via Jmol)
012500721.b3lyp_6-31g(d).inp

012500721.b3lyp_6-31g(d).qchem.inp (generated)

012500721.b3lyp_6-31g(d).gjf (generated)

012500721.b3lyp_6-31g(d).firefly.inp (generated)

012500721.b3lyp_6-31g(d).smash.inp (generated)

012500721.b3lyp_6-31g(d).nwchem.inp (generated) 012500721.b3lyp_6-31g(d).log.xz 012500721.td-b3lyp_6-31g+(d).inp 012500721.td-b3lyp_6-31g+(d).log.xz

012500721.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500721.td-b3lyp_6-31+g(d).gjf (generated)

012500721.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500721.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500721.mol 012500721.PUBCHEM 012500721.mol (via Jmol)
012500727.b3lyp_6-31g(d).inp

012500727.b3lyp_6-31g(d).qchem.inp (generated)

012500727.b3lyp_6-31g(d).gjf (generated)

012500727.b3lyp_6-31g(d).firefly.inp (generated)

012500727.b3lyp_6-31g(d).smash.inp (generated)

012500727.b3lyp_6-31g(d).nwchem.inp (generated) 012500727.b3lyp_6-31g(d).log.xz 012500727.td-b3lyp_6-31g+(d).inp 012500727.td-b3lyp_6-31g+(d).log.xz

012500727.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500727.td-b3lyp_6-31+g(d).gjf (generated)

012500727.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500727.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500727.mol 012500727.PUBCHEM 012500727.mol (via Jmol)
012500728.b3lyp_6-31g(d).inp

012500728.b3lyp_6-31g(d).qchem.inp (generated)

012500728.b3lyp_6-31g(d).gjf (generated)

012500728.b3lyp_6-31g(d).firefly.inp (generated)

012500728.b3lyp_6-31g(d).smash.inp (generated)

012500728.b3lyp_6-31g(d).nwchem.inp (generated) 012500728.b3lyp_6-31g(d).log.xz 012500728.td-b3lyp_6-31g+(d).inp 012500728.td-b3lyp_6-31g+(d).log.xz

012500728.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500728.td-b3lyp_6-31+g(d).gjf (generated)

012500728.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500728.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500728.mol 012500728.PUBCHEM 012500728.mol (via Jmol)
012500773.b3lyp_6-31g(d).inp

012500773.b3lyp_6-31g(d).qchem.inp (generated)

012500773.b3lyp_6-31g(d).gjf (generated)

012500773.b3lyp_6-31g(d).firefly.inp (generated)

012500773.b3lyp_6-31g(d).smash.inp (generated)

012500773.b3lyp_6-31g(d).nwchem.inp (generated) 012500773.b3lyp_6-31g(d).log.xz 012500773.td-b3lyp_6-31g+(d).inp 012500773.td-b3lyp_6-31g+(d).log.xz

012500773.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500773.td-b3lyp_6-31+g(d).gjf (generated)

012500773.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500773.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500773.mol 012500773.PUBCHEM 012500773.mol (via Jmol)
012500777.b3lyp_6-31g(d).inp

012500777.b3lyp_6-31g(d).qchem.inp (generated)

012500777.b3lyp_6-31g(d).gjf (generated)

012500777.b3lyp_6-31g(d).firefly.inp (generated)

012500777.b3lyp_6-31g(d).smash.inp (generated)

012500777.b3lyp_6-31g(d).nwchem.inp (generated) 012500777.b3lyp_6-31g(d).log.xz 012500777.td-b3lyp_6-31g+(d).inp 012500777.td-b3lyp_6-31g+(d).log.xz

012500777.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500777.td-b3lyp_6-31+g(d).gjf (generated)

012500777.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500777.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500777.mol 012500777.PUBCHEM 012500777.mol (via Jmol)
012500806.b3lyp_6-31g(d).inp

012500806.b3lyp_6-31g(d).qchem.inp (generated)

012500806.b3lyp_6-31g(d).gjf (generated)

012500806.b3lyp_6-31g(d).firefly.inp (generated)

012500806.b3lyp_6-31g(d).smash.inp (generated)

012500806.b3lyp_6-31g(d).nwchem.inp (generated) 012500806.b3lyp_6-31g(d).log.xz 012500806.td-b3lyp_6-31g+(d).inp 012500806.td-b3lyp_6-31g+(d).log.xz

012500806.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500806.td-b3lyp_6-31+g(d).gjf (generated)

012500806.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500806.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500806.mol 012500806.PUBCHEM 012500806.mol (via Jmol)
012500856.b3lyp_6-31g(d).inp

012500856.b3lyp_6-31g(d).qchem.inp (generated)

012500856.b3lyp_6-31g(d).gjf (generated)

012500856.b3lyp_6-31g(d).firefly.inp (generated)

012500856.b3lyp_6-31g(d).smash.inp (generated)

012500856.b3lyp_6-31g(d).nwchem.inp (generated) 012500856.b3lyp_6-31g(d).log.xz 012500856.mol 012500856.PUBCHEM 012500856.mol (via Jmol)
012500862.b3lyp_6-31g(d).inp

012500862.b3lyp_6-31g(d).qchem.inp (generated)

012500862.b3lyp_6-31g(d).gjf (generated)

012500862.b3lyp_6-31g(d).firefly.inp (generated)

012500862.b3lyp_6-31g(d).smash.inp (generated)

012500862.b3lyp_6-31g(d).nwchem.inp (generated) 012500862.b3lyp_6-31g(d).log.xz 012500862.td-b3lyp_6-31g+(d).inp 012500862.td-b3lyp_6-31g+(d).log.xz

012500862.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500862.td-b3lyp_6-31+g(d).gjf (generated)

012500862.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500862.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500862.mol 012500862.PUBCHEM 012500862.mol (via Jmol)
012500867.b3lyp_6-31g(d).inp

012500867.b3lyp_6-31g(d).qchem.inp (generated)

012500867.b3lyp_6-31g(d).gjf (generated)

012500867.b3lyp_6-31g(d).firefly.inp (generated)

012500867.b3lyp_6-31g(d).smash.inp (generated)

012500867.b3lyp_6-31g(d).nwchem.inp (generated) 012500867.b3lyp_6-31g(d).log.xz 012500867.td-b3lyp_6-31g+(d).inp 012500867.td-b3lyp_6-31g+(d).log.xz

012500867.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500867.td-b3lyp_6-31+g(d).gjf (generated)

012500867.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500867.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500867.mol 012500867.PUBCHEM 012500867.mol (via Jmol)
012500869.b3lyp_6-31g(d).inp

012500869.b3lyp_6-31g(d).qchem.inp (generated)

012500869.b3lyp_6-31g(d).gjf (generated)

012500869.b3lyp_6-31g(d).firefly.inp (generated)

012500869.b3lyp_6-31g(d).smash.inp (generated)

012500869.b3lyp_6-31g(d).nwchem.inp (generated) 012500869.b3lyp_6-31g(d).log.xz 012500869.td-b3lyp_6-31g+(d).inp 012500869.td-b3lyp_6-31g+(d).log.xz

012500869.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500869.td-b3lyp_6-31+g(d).gjf (generated)

012500869.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500869.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500869.mol 012500869.PUBCHEM 012500869.mol (via Jmol)
012500870.b3lyp_6-31g(d).inp

012500870.b3lyp_6-31g(d).qchem.inp (generated)

012500870.b3lyp_6-31g(d).gjf (generated)

012500870.b3lyp_6-31g(d).firefly.inp (generated)

012500870.b3lyp_6-31g(d).smash.inp (generated)

012500870.b3lyp_6-31g(d).nwchem.inp (generated) 012500870.b3lyp_6-31g(d).log.xz 012500870.td-b3lyp_6-31g+(d).inp 012500870.td-b3lyp_6-31g+(d).log.xz

012500870.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500870.td-b3lyp_6-31+g(d).gjf (generated)

012500870.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500870.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500870.mol 012500870.PUBCHEM 012500870.mol (via Jmol)
012500871.b3lyp_6-31g(d).inp

012500871.b3lyp_6-31g(d).qchem.inp (generated)

012500871.b3lyp_6-31g(d).gjf (generated)

012500871.b3lyp_6-31g(d).firefly.inp (generated)

012500871.b3lyp_6-31g(d).smash.inp (generated)

012500871.b3lyp_6-31g(d).nwchem.inp (generated) 012500871.b3lyp_6-31g(d).log.xz 012500871.td-b3lyp_6-31g+(d).inp 012500871.td-b3lyp_6-31g+(d).log.xz

012500871.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500871.td-b3lyp_6-31+g(d).gjf (generated)

012500871.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500871.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500871.mol 012500871.PUBCHEM 012500871.mol (via Jmol)
012500872.b3lyp_6-31g(d).inp

012500872.b3lyp_6-31g(d).qchem.inp (generated)

012500872.b3lyp_6-31g(d).gjf (generated)

012500872.b3lyp_6-31g(d).firefly.inp (generated)

012500872.b3lyp_6-31g(d).smash.inp (generated)

012500872.b3lyp_6-31g(d).nwchem.inp (generated) 012500872.b3lyp_6-31g(d).log.xz 012500872.td-b3lyp_6-31g+(d).inp 012500872.td-b3lyp_6-31g+(d).log.xz

012500872.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500872.td-b3lyp_6-31+g(d).gjf (generated)

012500872.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500872.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500872.mol 012500872.PUBCHEM 012500872.mol (via Jmol)
012500884.b3lyp_6-31g(d).inp

012500884.b3lyp_6-31g(d).qchem.inp (generated)

012500884.b3lyp_6-31g(d).gjf (generated)

012500884.b3lyp_6-31g(d).firefly.inp (generated)

012500884.b3lyp_6-31g(d).smash.inp (generated)

012500884.b3lyp_6-31g(d).nwchem.inp (generated) 012500884.b3lyp_6-31g(d).log.xz 012500884.td-b3lyp_6-31g+(d).inp 012500884.td-b3lyp_6-31g+(d).log.xz

012500884.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500884.td-b3lyp_6-31+g(d).gjf (generated)

012500884.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500884.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500884.mol 012500884.PUBCHEM 012500884.mol (via Jmol)
012500886.b3lyp_6-31g(d).inp

012500886.b3lyp_6-31g(d).qchem.inp (generated)

012500886.b3lyp_6-31g(d).gjf (generated)

012500886.b3lyp_6-31g(d).firefly.inp (generated)

012500886.b3lyp_6-31g(d).smash.inp (generated)

012500886.b3lyp_6-31g(d).nwchem.inp (generated) 012500886.b3lyp_6-31g(d).log.xz 012500886.td-b3lyp_6-31g+(d).inp 012500886.td-b3lyp_6-31g+(d).log.xz

012500886.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500886.td-b3lyp_6-31+g(d).gjf (generated)

012500886.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500886.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500886.mol 012500886.PUBCHEM 012500886.mol (via Jmol)
012500888.b3lyp_6-31g(d).inp

012500888.b3lyp_6-31g(d).qchem.inp (generated)

012500888.b3lyp_6-31g(d).gjf (generated)

012500888.b3lyp_6-31g(d).firefly.inp (generated)

012500888.b3lyp_6-31g(d).smash.inp (generated)

012500888.b3lyp_6-31g(d).nwchem.inp (generated) 012500888.b3lyp_6-31g(d).log.xz 012500888.td-b3lyp_6-31g+(d).inp 012500888.td-b3lyp_6-31g+(d).log.xz

012500888.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500888.td-b3lyp_6-31+g(d).gjf (generated)

012500888.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500888.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500888.mol 012500888.PUBCHEM 012500888.mol (via Jmol)
012500895.b3lyp_6-31g(d).inp

012500895.b3lyp_6-31g(d).qchem.inp (generated)

012500895.b3lyp_6-31g(d).gjf (generated)

012500895.b3lyp_6-31g(d).firefly.inp (generated)

012500895.b3lyp_6-31g(d).smash.inp (generated)

012500895.b3lyp_6-31g(d).nwchem.inp (generated) 012500895.b3lyp_6-31g(d).log.xz 012500895.td-b3lyp_6-31g+(d).inp 012500895.td-b3lyp_6-31g+(d).log.xz

012500895.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500895.td-b3lyp_6-31+g(d).gjf (generated)

012500895.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500895.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500895.mol 012500895.PUBCHEM 012500895.mol (via Jmol)
012500897.b3lyp_6-31g(d).inp

012500897.b3lyp_6-31g(d).qchem.inp (generated)

012500897.b3lyp_6-31g(d).gjf (generated)

012500897.b3lyp_6-31g(d).firefly.inp (generated)

012500897.b3lyp_6-31g(d).smash.inp (generated)

012500897.b3lyp_6-31g(d).nwchem.inp (generated) 012500897.b3lyp_6-31g(d).log.xz 012500897.td-b3lyp_6-31g+(d).inp 012500897.td-b3lyp_6-31g+(d).log.xz

012500897.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500897.td-b3lyp_6-31+g(d).gjf (generated)

012500897.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500897.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500897.mol 012500897.PUBCHEM 012500897.mol (via Jmol)
012500898.b3lyp_6-31g(d).inp

012500898.b3lyp_6-31g(d).qchem.inp (generated)

012500898.b3lyp_6-31g(d).gjf (generated)

012500898.b3lyp_6-31g(d).firefly.inp (generated)

012500898.b3lyp_6-31g(d).smash.inp (generated)

012500898.b3lyp_6-31g(d).nwchem.inp (generated) 012500898.b3lyp_6-31g(d).log.xz 012500898.td-b3lyp_6-31g+(d).inp 012500898.td-b3lyp_6-31g+(d).log.xz

012500898.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500898.td-b3lyp_6-31+g(d).gjf (generated)

012500898.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500898.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500898.mol 012500898.PUBCHEM 012500898.mol (via Jmol)
012500899.b3lyp_6-31g(d).inp

012500899.b3lyp_6-31g(d).qchem.inp (generated)

012500899.b3lyp_6-31g(d).gjf (generated)

012500899.b3lyp_6-31g(d).firefly.inp (generated)

012500899.b3lyp_6-31g(d).smash.inp (generated)

012500899.b3lyp_6-31g(d).nwchem.inp (generated) 012500899.b3lyp_6-31g(d).log.xz 012500899.td-b3lyp_6-31g+(d).inp 012500899.td-b3lyp_6-31g+(d).log.xz

012500899.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500899.td-b3lyp_6-31+g(d).gjf (generated)

012500899.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500899.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500899.mol 012500899.PUBCHEM 012500899.mol (via Jmol)
012500902.b3lyp_6-31g(d).inp

012500902.b3lyp_6-31g(d).qchem.inp (generated)

012500902.b3lyp_6-31g(d).gjf (generated)

012500902.b3lyp_6-31g(d).firefly.inp (generated)

012500902.b3lyp_6-31g(d).smash.inp (generated)

012500902.b3lyp_6-31g(d).nwchem.inp (generated) 012500902.b3lyp_6-31g(d).log.xz 012500902.td-b3lyp_6-31g+(d).inp 012500902.td-b3lyp_6-31g+(d).log.xz

012500902.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500902.td-b3lyp_6-31+g(d).gjf (generated)

012500902.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500902.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500902.mol 012500902.PUBCHEM 012500902.mol (via Jmol)
012500903.b3lyp_6-31g(d).inp

012500903.b3lyp_6-31g(d).qchem.inp (generated)

012500903.b3lyp_6-31g(d).gjf (generated)

012500903.b3lyp_6-31g(d).firefly.inp (generated)

012500903.b3lyp_6-31g(d).smash.inp (generated)

012500903.b3lyp_6-31g(d).nwchem.inp (generated) 012500903.b3lyp_6-31g(d).log.xz 012500903.td-b3lyp_6-31g+(d).inp 012500903.td-b3lyp_6-31g+(d).log.xz

012500903.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500903.td-b3lyp_6-31+g(d).gjf (generated)

012500903.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500903.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500903.mol 012500903.PUBCHEM 012500903.mol (via Jmol)
012500905.b3lyp_6-31g(d).inp

012500905.b3lyp_6-31g(d).qchem.inp (generated)

012500905.b3lyp_6-31g(d).gjf (generated)

012500905.b3lyp_6-31g(d).firefly.inp (generated)

012500905.b3lyp_6-31g(d).smash.inp (generated)

012500905.b3lyp_6-31g(d).nwchem.inp (generated) 012500905.b3lyp_6-31g(d).log.xz 012500905.td-b3lyp_6-31g+(d).inp 012500905.td-b3lyp_6-31g+(d).log.xz

012500905.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500905.td-b3lyp_6-31+g(d).gjf (generated)

012500905.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500905.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500905.mol 012500905.PUBCHEM 012500905.mol (via Jmol)
012500921.b3lyp_6-31g(d).inp

012500921.b3lyp_6-31g(d).qchem.inp (generated)

012500921.b3lyp_6-31g(d).gjf (generated)

012500921.b3lyp_6-31g(d).firefly.inp (generated)

012500921.b3lyp_6-31g(d).smash.inp (generated)

012500921.b3lyp_6-31g(d).nwchem.inp (generated) 012500921.b3lyp_6-31g(d).log.xz 012500921.td-b3lyp_6-31g+(d).inp 012500921.td-b3lyp_6-31g+(d).log.xz

012500921.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500921.td-b3lyp_6-31+g(d).gjf (generated)

012500921.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500921.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500921.mol 012500921.PUBCHEM 012500921.mol (via Jmol)
012500939.b3lyp_6-31g(d).inp

012500939.b3lyp_6-31g(d).qchem.inp (generated)

012500939.b3lyp_6-31g(d).gjf (generated)

012500939.b3lyp_6-31g(d).firefly.inp (generated)

012500939.b3lyp_6-31g(d).smash.inp (generated)

012500939.b3lyp_6-31g(d).nwchem.inp (generated) 012500939.b3lyp_6-31g(d).log.xz 012500939.td-b3lyp_6-31g+(d).inp 012500939.td-b3lyp_6-31g+(d).log.xz

012500939.td-b3lyp_6-31+g(d).qchem.inp (generated)

012500939.td-b3lyp_6-31+g(d).gjf (generated)

012500939.td-b3lyp_6-31+g(d).firefly.inp (generated)

012500939.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012500939.mol 012500939.PUBCHEM 012500939.mol (via Jmol)
012501002.b3lyp_6-31g(d).inp

012501002.b3lyp_6-31g(d).qchem.inp (generated)

012501002.b3lyp_6-31g(d).gjf (generated)

012501002.b3lyp_6-31g(d).firefly.inp (generated)

012501002.b3lyp_6-31g(d).smash.inp (generated)

012501002.b3lyp_6-31g(d).nwchem.inp (generated) 012501002.b3lyp_6-31g(d).log.xz 012501002.td-b3lyp_6-31g+(d).inp 012501002.td-b3lyp_6-31g+(d).log.xz

012501002.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501002.td-b3lyp_6-31+g(d).gjf (generated)

012501002.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501002.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501002.mol 012501002.PUBCHEM 012501002.mol (via Jmol)
012501031.b3lyp_6-31g(d).inp

012501031.b3lyp_6-31g(d).qchem.inp (generated)

012501031.b3lyp_6-31g(d).gjf (generated)

012501031.b3lyp_6-31g(d).firefly.inp (generated)

012501031.b3lyp_6-31g(d).smash.inp (generated)

012501031.b3lyp_6-31g(d).nwchem.inp (generated) 012501031.b3lyp_6-31g(d).log.xz 012501031.td-b3lyp_6-31g+(d).inp 012501031.td-b3lyp_6-31g+(d).log.xz

012501031.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501031.td-b3lyp_6-31+g(d).gjf (generated)

012501031.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501031.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501031.mol 012501031.PUBCHEM 012501031.mol (via Jmol)
012501033.b3lyp_6-31g(d).inp

012501033.b3lyp_6-31g(d).qchem.inp (generated)

012501033.b3lyp_6-31g(d).gjf (generated)

012501033.b3lyp_6-31g(d).firefly.inp (generated)

012501033.b3lyp_6-31g(d).smash.inp (generated)

012501033.b3lyp_6-31g(d).nwchem.inp (generated) 012501033.b3lyp_6-31g(d).log.xz 012501033.td-b3lyp_6-31g+(d).inp 012501033.td-b3lyp_6-31g+(d).log.xz

012501033.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501033.td-b3lyp_6-31+g(d).gjf (generated)

012501033.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501033.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501033.mol 012501033.PUBCHEM 012501033.mol (via Jmol)
012501034.b3lyp_6-31g(d).inp

012501034.b3lyp_6-31g(d).qchem.inp (generated)

012501034.b3lyp_6-31g(d).gjf (generated)

012501034.b3lyp_6-31g(d).firefly.inp (generated)

012501034.b3lyp_6-31g(d).smash.inp (generated)

012501034.b3lyp_6-31g(d).nwchem.inp (generated) 012501034.b3lyp_6-31g(d).log.xz 012501034.td-b3lyp_6-31g+(d).inp 012501034.td-b3lyp_6-31g+(d).log.xz

012501034.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501034.td-b3lyp_6-31+g(d).gjf (generated)

012501034.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501034.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501034.mol 012501034.PUBCHEM 012501034.mol (via Jmol)
012501054.b3lyp_6-31g(d).inp

012501054.b3lyp_6-31g(d).qchem.inp (generated)

012501054.b3lyp_6-31g(d).gjf (generated)

012501054.b3lyp_6-31g(d).firefly.inp (generated)

012501054.b3lyp_6-31g(d).smash.inp (generated)

012501054.b3lyp_6-31g(d).nwchem.inp (generated) 012501054.b3lyp_6-31g(d).log.xz 012501054.td-b3lyp_6-31g+(d).inp 012501054.td-b3lyp_6-31g+(d).log.xz

012501054.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501054.td-b3lyp_6-31+g(d).gjf (generated)

012501054.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501054.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501054.mol 012501054.PUBCHEM 012501054.mol (via Jmol)
012501055.b3lyp_6-31g(d).inp

012501055.b3lyp_6-31g(d).qchem.inp (generated)

012501055.b3lyp_6-31g(d).gjf (generated)

012501055.b3lyp_6-31g(d).firefly.inp (generated)

012501055.b3lyp_6-31g(d).smash.inp (generated)

012501055.b3lyp_6-31g(d).nwchem.inp (generated) 012501055.b3lyp_6-31g(d).log.xz 012501055.td-b3lyp_6-31g+(d).inp 012501055.td-b3lyp_6-31g+(d).log.xz

012501055.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501055.td-b3lyp_6-31+g(d).gjf (generated)

012501055.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501055.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501055.mol 012501055.PUBCHEM 012501055.mol (via Jmol)
012501056.b3lyp_6-31g(d).inp

012501056.b3lyp_6-31g(d).qchem.inp (generated)

012501056.b3lyp_6-31g(d).gjf (generated)

012501056.b3lyp_6-31g(d).firefly.inp (generated)

012501056.b3lyp_6-31g(d).smash.inp (generated)

012501056.b3lyp_6-31g(d).nwchem.inp (generated) 012501056.b3lyp_6-31g(d).log.xz 012501056.td-b3lyp_6-31g+(d).inp 012501056.td-b3lyp_6-31g+(d).log.xz

012501056.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501056.td-b3lyp_6-31+g(d).gjf (generated)

012501056.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501056.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501056.mol 012501056.PUBCHEM 012501056.mol (via Jmol)
012501058.b3lyp_6-31g(d).inp

012501058.b3lyp_6-31g(d).qchem.inp (generated)

012501058.b3lyp_6-31g(d).gjf (generated)

012501058.b3lyp_6-31g(d).firefly.inp (generated)

012501058.b3lyp_6-31g(d).smash.inp (generated)

012501058.b3lyp_6-31g(d).nwchem.inp (generated) 012501058.b3lyp_6-31g(d).log.xz 012501058.td-b3lyp_6-31g+(d).inp 012501058.td-b3lyp_6-31g+(d).log.xz

012501058.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501058.td-b3lyp_6-31+g(d).gjf (generated)

012501058.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501058.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501058.mol 012501058.PUBCHEM 012501058.mol (via Jmol)
012501064.b3lyp_6-31g(d).inp

012501064.b3lyp_6-31g(d).qchem.inp (generated)

012501064.b3lyp_6-31g(d).gjf (generated)

012501064.b3lyp_6-31g(d).firefly.inp (generated)

012501064.b3lyp_6-31g(d).smash.inp (generated)

012501064.b3lyp_6-31g(d).nwchem.inp (generated) 012501064.b3lyp_6-31g(d).log.xz 012501064.td-b3lyp_6-31g+(d).inp 012501064.td-b3lyp_6-31g+(d).log.xz

012501064.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501064.td-b3lyp_6-31+g(d).gjf (generated)

012501064.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501064.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501064.mol 012501064.PUBCHEM 012501064.mol (via Jmol)
012501065.b3lyp_6-31g(d).inp

012501065.b3lyp_6-31g(d).qchem.inp (generated)

012501065.b3lyp_6-31g(d).gjf (generated)

012501065.b3lyp_6-31g(d).firefly.inp (generated)

012501065.b3lyp_6-31g(d).smash.inp (generated)

012501065.b3lyp_6-31g(d).nwchem.inp (generated) 012501065.b3lyp_6-31g(d).log.xz 012501065.td-b3lyp_6-31g+(d).inp 012501065.td-b3lyp_6-31g+(d).log.xz

012501065.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501065.td-b3lyp_6-31+g(d).gjf (generated)

012501065.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501065.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501065.mol 012501065.PUBCHEM 012501065.mol (via Jmol)
012501066.b3lyp_6-31g(d).inp

012501066.b3lyp_6-31g(d).qchem.inp (generated)

012501066.b3lyp_6-31g(d).gjf (generated)

012501066.b3lyp_6-31g(d).firefly.inp (generated)

012501066.b3lyp_6-31g(d).smash.inp (generated)

012501066.b3lyp_6-31g(d).nwchem.inp (generated) 012501066.b3lyp_6-31g(d).log.xz 012501066.td-b3lyp_6-31g+(d).inp 012501066.td-b3lyp_6-31g+(d).log.xz

012501066.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501066.td-b3lyp_6-31+g(d).gjf (generated)

012501066.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501066.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501066.mol 012501066.PUBCHEM 012501066.mol (via Jmol)
012501067.b3lyp_6-31g(d).inp

012501067.b3lyp_6-31g(d).qchem.inp (generated)

012501067.b3lyp_6-31g(d).gjf (generated)

012501067.b3lyp_6-31g(d).firefly.inp (generated)

012501067.b3lyp_6-31g(d).smash.inp (generated)

012501067.b3lyp_6-31g(d).nwchem.inp (generated) 012501067.b3lyp_6-31g(d).log.xz 012501067.td-b3lyp_6-31g+(d).inp 012501067.td-b3lyp_6-31g+(d).log.xz

012501067.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501067.td-b3lyp_6-31+g(d).gjf (generated)

012501067.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501067.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501067.mol 012501067.PUBCHEM 012501067.mol (via Jmol)
012501068.b3lyp_6-31g(d).inp

012501068.b3lyp_6-31g(d).qchem.inp (generated)

012501068.b3lyp_6-31g(d).gjf (generated)

012501068.b3lyp_6-31g(d).firefly.inp (generated)

012501068.b3lyp_6-31g(d).smash.inp (generated)

012501068.b3lyp_6-31g(d).nwchem.inp (generated) 012501068.b3lyp_6-31g(d).log.xz 012501068.td-b3lyp_6-31g+(d).inp 012501068.td-b3lyp_6-31g+(d).log.xz

012501068.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501068.td-b3lyp_6-31+g(d).gjf (generated)

012501068.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501068.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501068.mol 012501068.PUBCHEM 012501068.mol (via Jmol)
012501069.b3lyp_6-31g(d).inp

012501069.b3lyp_6-31g(d).qchem.inp (generated)

012501069.b3lyp_6-31g(d).gjf (generated)

012501069.b3lyp_6-31g(d).firefly.inp (generated)

012501069.b3lyp_6-31g(d).smash.inp (generated)

012501069.b3lyp_6-31g(d).nwchem.inp (generated) 012501069.b3lyp_6-31g(d).log.xz 012501069.td-b3lyp_6-31g+(d).inp 012501069.td-b3lyp_6-31g+(d).log.xz

012501069.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501069.td-b3lyp_6-31+g(d).gjf (generated)

012501069.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501069.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501069.mol 012501069.PUBCHEM 012501069.mol (via Jmol)
012501072.b3lyp_6-31g(d).inp

012501072.b3lyp_6-31g(d).qchem.inp (generated)

012501072.b3lyp_6-31g(d).gjf (generated)

012501072.b3lyp_6-31g(d).firefly.inp (generated)

012501072.b3lyp_6-31g(d).smash.inp (generated)

012501072.b3lyp_6-31g(d).nwchem.inp (generated) 012501072.b3lyp_6-31g(d).log.xz 012501072.td-b3lyp_6-31g+(d).inp 012501072.td-b3lyp_6-31g+(d).log.xz

012501072.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501072.td-b3lyp_6-31+g(d).gjf (generated)

012501072.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501072.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501072.mol 012501072.PUBCHEM 012501072.mol (via Jmol)
012501073.b3lyp_6-31g(d).inp

012501073.b3lyp_6-31g(d).qchem.inp (generated)

012501073.b3lyp_6-31g(d).gjf (generated)

012501073.b3lyp_6-31g(d).firefly.inp (generated)

012501073.b3lyp_6-31g(d).smash.inp (generated)

012501073.b3lyp_6-31g(d).nwchem.inp (generated) 012501073.b3lyp_6-31g(d).log.xz 012501073.td-b3lyp_6-31g+(d).inp 012501073.td-b3lyp_6-31g+(d).log.xz

012501073.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501073.td-b3lyp_6-31+g(d).gjf (generated)

012501073.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501073.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501073.mol 012501073.PUBCHEM 012501073.mol (via Jmol)
012501074.b3lyp_6-31g(d).inp

012501074.b3lyp_6-31g(d).qchem.inp (generated)

012501074.b3lyp_6-31g(d).gjf (generated)

012501074.b3lyp_6-31g(d).firefly.inp (generated)

012501074.b3lyp_6-31g(d).smash.inp (generated)

012501074.b3lyp_6-31g(d).nwchem.inp (generated) 012501074.b3lyp_6-31g(d).log.xz 012501074.td-b3lyp_6-31g+(d).inp 012501074.td-b3lyp_6-31g+(d).log.xz

012501074.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501074.td-b3lyp_6-31+g(d).gjf (generated)

012501074.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501074.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501074.mol 012501074.PUBCHEM 012501074.mol (via Jmol)
012501075.b3lyp_6-31g(d).inp

012501075.b3lyp_6-31g(d).qchem.inp (generated)

012501075.b3lyp_6-31g(d).gjf (generated)

012501075.b3lyp_6-31g(d).firefly.inp (generated)

012501075.b3lyp_6-31g(d).smash.inp (generated)

012501075.b3lyp_6-31g(d).nwchem.inp (generated) 012501075.b3lyp_6-31g(d).log.xz 012501075.td-b3lyp_6-31g+(d).inp 012501075.td-b3lyp_6-31g+(d).log.xz

012501075.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501075.td-b3lyp_6-31+g(d).gjf (generated)

012501075.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501075.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501075.mol 012501075.PUBCHEM 012501075.mol (via Jmol)
012501076.b3lyp_6-31g(d).inp

012501076.b3lyp_6-31g(d).qchem.inp (generated)

012501076.b3lyp_6-31g(d).gjf (generated)

012501076.b3lyp_6-31g(d).firefly.inp (generated)

012501076.b3lyp_6-31g(d).smash.inp (generated)

012501076.b3lyp_6-31g(d).nwchem.inp (generated) 012501076.b3lyp_6-31g(d).log.xz 012501076.td-b3lyp_6-31g+(d).inp 012501076.td-b3lyp_6-31g+(d).log.xz

012501076.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501076.td-b3lyp_6-31+g(d).gjf (generated)

012501076.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501076.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501076.mol 012501076.PUBCHEM 012501076.mol (via Jmol)
012501079.b3lyp_6-31g(d).inp

012501079.b3lyp_6-31g(d).qchem.inp (generated)

012501079.b3lyp_6-31g(d).gjf (generated)

012501079.b3lyp_6-31g(d).firefly.inp (generated)

012501079.b3lyp_6-31g(d).smash.inp (generated)

012501079.b3lyp_6-31g(d).nwchem.inp (generated) 012501079.b3lyp_6-31g(d).log.xz 012501079.td-b3lyp_6-31g+(d).inp 012501079.td-b3lyp_6-31g+(d).log.xz

012501079.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501079.td-b3lyp_6-31+g(d).gjf (generated)

012501079.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501079.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501079.mol 012501079.PUBCHEM 012501079.mol (via Jmol)
012501080.b3lyp_6-31g(d).inp

012501080.b3lyp_6-31g(d).qchem.inp (generated)

012501080.b3lyp_6-31g(d).gjf (generated)

012501080.b3lyp_6-31g(d).firefly.inp (generated)

012501080.b3lyp_6-31g(d).smash.inp (generated)

012501080.b3lyp_6-31g(d).nwchem.inp (generated) 012501080.b3lyp_6-31g(d).log.xz 012501080.td-b3lyp_6-31g+(d).inp 012501080.td-b3lyp_6-31g+(d).log.xz

012501080.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501080.td-b3lyp_6-31+g(d).gjf (generated)

012501080.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501080.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501080.mol 012501080.PUBCHEM 012501080.mol (via Jmol)
012501081.b3lyp_6-31g(d).inp

012501081.b3lyp_6-31g(d).qchem.inp (generated)

012501081.b3lyp_6-31g(d).gjf (generated)

012501081.b3lyp_6-31g(d).firefly.inp (generated)

012501081.b3lyp_6-31g(d).smash.inp (generated)

012501081.b3lyp_6-31g(d).nwchem.inp (generated) 012501081.b3lyp_6-31g(d).log.xz 012501081.td-b3lyp_6-31g+(d).inp 012501081.td-b3lyp_6-31g+(d).log.xz

012501081.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501081.td-b3lyp_6-31+g(d).gjf (generated)

012501081.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501081.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501081.mol 012501081.PUBCHEM 012501081.mol (via Jmol)
012501087.b3lyp_6-31g(d).inp

012501087.b3lyp_6-31g(d).qchem.inp (generated)

012501087.b3lyp_6-31g(d).gjf (generated)

012501087.b3lyp_6-31g(d).firefly.inp (generated)

012501087.b3lyp_6-31g(d).smash.inp (generated)

012501087.b3lyp_6-31g(d).nwchem.inp (generated) 012501087.b3lyp_6-31g(d).log.xz 012501087.td-b3lyp_6-31g+(d).inp 012501087.td-b3lyp_6-31g+(d).log.xz

012501087.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501087.td-b3lyp_6-31+g(d).gjf (generated)

012501087.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501087.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501087.mol 012501087.PUBCHEM 012501087.mol (via Jmol)
012501088.b3lyp_6-31g(d).inp

012501088.b3lyp_6-31g(d).qchem.inp (generated)

012501088.b3lyp_6-31g(d).gjf (generated)

012501088.b3lyp_6-31g(d).firefly.inp (generated)

012501088.b3lyp_6-31g(d).smash.inp (generated)

012501088.b3lyp_6-31g(d).nwchem.inp (generated) 012501088.b3lyp_6-31g(d).log.xz 012501088.td-b3lyp_6-31g+(d).inp 012501088.td-b3lyp_6-31g+(d).log.xz

012501088.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501088.td-b3lyp_6-31+g(d).gjf (generated)

012501088.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501088.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501088.mol 012501088.PUBCHEM 012501088.mol (via Jmol)
012501093.b3lyp_6-31g(d).inp

012501093.b3lyp_6-31g(d).qchem.inp (generated)

012501093.b3lyp_6-31g(d).gjf (generated)

012501093.b3lyp_6-31g(d).firefly.inp (generated)

012501093.b3lyp_6-31g(d).smash.inp (generated)

012501093.b3lyp_6-31g(d).nwchem.inp (generated) 012501093.b3lyp_6-31g(d).log.xz 012501093.td-b3lyp_6-31g+(d).inp 012501093.td-b3lyp_6-31g+(d).log.xz

012501093.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501093.td-b3lyp_6-31+g(d).gjf (generated)

012501093.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501093.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501093.mol 012501093.PUBCHEM 012501093.mol (via Jmol)
012501095.b3lyp_6-31g(d).inp

012501095.b3lyp_6-31g(d).qchem.inp (generated)

012501095.b3lyp_6-31g(d).gjf (generated)

012501095.b3lyp_6-31g(d).firefly.inp (generated)

012501095.b3lyp_6-31g(d).smash.inp (generated)

012501095.b3lyp_6-31g(d).nwchem.inp (generated) 012501095.b3lyp_6-31g(d).log.xz 012501095.td-b3lyp_6-31g+(d).inp 012501095.td-b3lyp_6-31g+(d).log.xz

012501095.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501095.td-b3lyp_6-31+g(d).gjf (generated)

012501095.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501095.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501095.mol 012501095.PUBCHEM 012501095.mol (via Jmol)
012501096.b3lyp_6-31g(d).inp

012501096.b3lyp_6-31g(d).qchem.inp (generated)

012501096.b3lyp_6-31g(d).gjf (generated)

012501096.b3lyp_6-31g(d).firefly.inp (generated)

012501096.b3lyp_6-31g(d).smash.inp (generated)

012501096.b3lyp_6-31g(d).nwchem.inp (generated) 012501096.b3lyp_6-31g(d).log.xz 012501096.td-b3lyp_6-31g+(d).inp 012501096.td-b3lyp_6-31g+(d).log.xz

012501096.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501096.td-b3lyp_6-31+g(d).gjf (generated)

012501096.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501096.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501096.mol 012501096.PUBCHEM 012501096.mol (via Jmol)
012501146.b3lyp_6-31g(d).inp

012501146.b3lyp_6-31g(d).qchem.inp (generated)

012501146.b3lyp_6-31g(d).gjf (generated)

012501146.b3lyp_6-31g(d).firefly.inp (generated)

012501146.b3lyp_6-31g(d).smash.inp (generated)

012501146.b3lyp_6-31g(d).nwchem.inp (generated) 012501146.b3lyp_6-31g(d).log.xz 012501146.td-b3lyp_6-31g+(d).inp 012501146.td-b3lyp_6-31g+(d).log.xz

012501146.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501146.td-b3lyp_6-31+g(d).gjf (generated)

012501146.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501146.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501146.mol 012501146.PUBCHEM 012501146.mol (via Jmol)
012501188.b3lyp_6-31g(d).inp

012501188.b3lyp_6-31g(d).qchem.inp (generated)

012501188.b3lyp_6-31g(d).gjf (generated)

012501188.b3lyp_6-31g(d).firefly.inp (generated)

012501188.b3lyp_6-31g(d).smash.inp (generated)

012501188.b3lyp_6-31g(d).nwchem.inp (generated) 012501188.b3lyp_6-31g(d).log.xz 012501188.td-b3lyp_6-31g+(d).inp 012501188.td-b3lyp_6-31g+(d).log.xz

012501188.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501188.td-b3lyp_6-31+g(d).gjf (generated)

012501188.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501188.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501188.mol 012501188.PUBCHEM 012501188.mol (via Jmol)
012501233.b3lyp_6-31g(d).inp

012501233.b3lyp_6-31g(d).qchem.inp (generated)

012501233.b3lyp_6-31g(d).gjf (generated)

012501233.b3lyp_6-31g(d).firefly.inp (generated)

012501233.b3lyp_6-31g(d).smash.inp (generated)

012501233.b3lyp_6-31g(d).nwchem.inp (generated) 012501233.b3lyp_6-31g(d).log.xz 012501233.td-b3lyp_6-31g+(d).inp 012501233.td-b3lyp_6-31g+(d).log.xz

012501233.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501233.td-b3lyp_6-31+g(d).gjf (generated)

012501233.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501233.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501233.mol 012501233.PUBCHEM 012501233.mol (via Jmol)
012501235.b3lyp_6-31g(d).inp

012501235.b3lyp_6-31g(d).qchem.inp (generated)

012501235.b3lyp_6-31g(d).gjf (generated)

012501235.b3lyp_6-31g(d).firefly.inp (generated)

012501235.b3lyp_6-31g(d).smash.inp (generated)

012501235.b3lyp_6-31g(d).nwchem.inp (generated) 012501235.b3lyp_6-31g(d).log.xz 012501235.td-b3lyp_6-31g+(d).inp 012501235.td-b3lyp_6-31g+(d).log.xz

012501235.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501235.td-b3lyp_6-31+g(d).gjf (generated)

012501235.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501235.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501235.mol 012501235.PUBCHEM 012501235.mol (via Jmol)
012501246.b3lyp_6-31g(d).inp

012501246.b3lyp_6-31g(d).qchem.inp (generated)

012501246.b3lyp_6-31g(d).gjf (generated)

012501246.b3lyp_6-31g(d).firefly.inp (generated)

012501246.b3lyp_6-31g(d).smash.inp (generated)

012501246.b3lyp_6-31g(d).nwchem.inp (generated) 012501246.b3lyp_6-31g(d).log.xz 012501246.td-b3lyp_6-31g+(d).inp 012501246.td-b3lyp_6-31g+(d).log.xz

012501246.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501246.td-b3lyp_6-31+g(d).gjf (generated)

012501246.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501246.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501246.mol 012501246.PUBCHEM 012501246.mol (via Jmol)
012501247.b3lyp_6-31g(d).inp

012501247.b3lyp_6-31g(d).qchem.inp (generated)

012501247.b3lyp_6-31g(d).gjf (generated)

012501247.b3lyp_6-31g(d).firefly.inp (generated)

012501247.b3lyp_6-31g(d).smash.inp (generated)

012501247.b3lyp_6-31g(d).nwchem.inp (generated) 012501247.b3lyp_6-31g(d).log.xz 012501247.td-b3lyp_6-31g+(d).inp 012501247.td-b3lyp_6-31g+(d).log.xz

012501247.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501247.td-b3lyp_6-31+g(d).gjf (generated)

012501247.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501247.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501247.mol 012501247.PUBCHEM 012501247.mol (via Jmol)
012501262.b3lyp_6-31g(d).inp

012501262.b3lyp_6-31g(d).qchem.inp (generated)

012501262.b3lyp_6-31g(d).gjf (generated)

012501262.b3lyp_6-31g(d).firefly.inp (generated)

012501262.b3lyp_6-31g(d).smash.inp (generated)

012501262.b3lyp_6-31g(d).nwchem.inp (generated) 012501262.b3lyp_6-31g(d).log.xz 012501262.td-b3lyp_6-31g+(d).inp 012501262.td-b3lyp_6-31g+(d).log.xz

012501262.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501262.td-b3lyp_6-31+g(d).gjf (generated)

012501262.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501262.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501262.mol 012501262.PUBCHEM 012501262.mol (via Jmol)
012501264.b3lyp_6-31g(d).inp

012501264.b3lyp_6-31g(d).qchem.inp (generated)

012501264.b3lyp_6-31g(d).gjf (generated)

012501264.b3lyp_6-31g(d).firefly.inp (generated)

012501264.b3lyp_6-31g(d).smash.inp (generated)

012501264.b3lyp_6-31g(d).nwchem.inp (generated) 012501264.b3lyp_6-31g(d).log.xz 012501264.td-b3lyp_6-31g+(d).inp 012501264.td-b3lyp_6-31g+(d).log.xz

012501264.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501264.td-b3lyp_6-31+g(d).gjf (generated)

012501264.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501264.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501264.mol 012501264.PUBCHEM 012501264.mol (via Jmol)
012501268.b3lyp_6-31g(d).inp

012501268.b3lyp_6-31g(d).qchem.inp (generated)

012501268.b3lyp_6-31g(d).gjf (generated)

012501268.b3lyp_6-31g(d).firefly.inp (generated)

012501268.b3lyp_6-31g(d).smash.inp (generated)

012501268.b3lyp_6-31g(d).nwchem.inp (generated) 012501268.b3lyp_6-31g(d).log.xz 012501268.td-b3lyp_6-31g+(d).inp 012501268.td-b3lyp_6-31g+(d).log.xz

012501268.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501268.td-b3lyp_6-31+g(d).gjf (generated)

012501268.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501268.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501268.mol 012501268.PUBCHEM 012501268.mol (via Jmol)
012501269.b3lyp_6-31g(d).inp

012501269.b3lyp_6-31g(d).qchem.inp (generated)

012501269.b3lyp_6-31g(d).gjf (generated)

012501269.b3lyp_6-31g(d).firefly.inp (generated)

012501269.b3lyp_6-31g(d).smash.inp (generated)

012501269.b3lyp_6-31g(d).nwchem.inp (generated) 012501269.b3lyp_6-31g(d).log.xz 012501269.td-b3lyp_6-31g+(d).inp 012501269.td-b3lyp_6-31g+(d).log.xz

012501269.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501269.td-b3lyp_6-31+g(d).gjf (generated)

012501269.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501269.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501269.mol 012501269.PUBCHEM 012501269.mol (via Jmol)
012501270.b3lyp_6-31g(d).inp

012501270.b3lyp_6-31g(d).qchem.inp (generated)

012501270.b3lyp_6-31g(d).gjf (generated)

012501270.b3lyp_6-31g(d).firefly.inp (generated)

012501270.b3lyp_6-31g(d).smash.inp (generated)

012501270.b3lyp_6-31g(d).nwchem.inp (generated) 012501270.b3lyp_6-31g(d).log.xz 012501270.td-b3lyp_6-31g+(d).inp 012501270.td-b3lyp_6-31g+(d).log.xz

012501270.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501270.td-b3lyp_6-31+g(d).gjf (generated)

012501270.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501270.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501270.mol 012501270.PUBCHEM 012501270.mol (via Jmol)
012501271.b3lyp_6-31g(d).inp

012501271.b3lyp_6-31g(d).qchem.inp (generated)

012501271.b3lyp_6-31g(d).gjf (generated)

012501271.b3lyp_6-31g(d).firefly.inp (generated)

012501271.b3lyp_6-31g(d).smash.inp (generated)

012501271.b3lyp_6-31g(d).nwchem.inp (generated) 012501271.b3lyp_6-31g(d).log.xz 012501271.td-b3lyp_6-31g+(d).inp 012501271.td-b3lyp_6-31g+(d).log.xz

012501271.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501271.td-b3lyp_6-31+g(d).gjf (generated)

012501271.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501271.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501271.mol 012501271.PUBCHEM 012501271.mol (via Jmol)
012501272.b3lyp_6-31g(d).inp

012501272.b3lyp_6-31g(d).qchem.inp (generated)

012501272.b3lyp_6-31g(d).gjf (generated)

012501272.b3lyp_6-31g(d).firefly.inp (generated)

012501272.b3lyp_6-31g(d).smash.inp (generated)

012501272.b3lyp_6-31g(d).nwchem.inp (generated) 012501272.b3lyp_6-31g(d).log.xz 012501272.td-b3lyp_6-31g+(d).inp 012501272.td-b3lyp_6-31g+(d).log.xz

012501272.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501272.td-b3lyp_6-31+g(d).gjf (generated)

012501272.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501272.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501272.mol 012501272.PUBCHEM 012501272.mol (via Jmol)
012501273.b3lyp_6-31g(d).inp

012501273.b3lyp_6-31g(d).qchem.inp (generated)

012501273.b3lyp_6-31g(d).gjf (generated)

012501273.b3lyp_6-31g(d).firefly.inp (generated)

012501273.b3lyp_6-31g(d).smash.inp (generated)

012501273.b3lyp_6-31g(d).nwchem.inp (generated) 012501273.b3lyp_6-31g(d).log.xz 012501273.td-b3lyp_6-31g+(d).inp 012501273.td-b3lyp_6-31g+(d).log.xz

012501273.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501273.td-b3lyp_6-31+g(d).gjf (generated)

012501273.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501273.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501273.mol 012501273.PUBCHEM 012501273.mol (via Jmol)
012501274.b3lyp_6-31g(d).inp

012501274.b3lyp_6-31g(d).qchem.inp (generated)

012501274.b3lyp_6-31g(d).gjf (generated)

012501274.b3lyp_6-31g(d).firefly.inp (generated)

012501274.b3lyp_6-31g(d).smash.inp (generated)

012501274.b3lyp_6-31g(d).nwchem.inp (generated) 012501274.b3lyp_6-31g(d).log.xz 012501274.td-b3lyp_6-31g+(d).inp 012501274.td-b3lyp_6-31g+(d).log.xz

012501274.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501274.td-b3lyp_6-31+g(d).gjf (generated)

012501274.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501274.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501274.mol 012501274.PUBCHEM 012501274.mol (via Jmol)
012501275.b3lyp_6-31g(d).inp

012501275.b3lyp_6-31g(d).qchem.inp (generated)

012501275.b3lyp_6-31g(d).gjf (generated)

012501275.b3lyp_6-31g(d).firefly.inp (generated)

012501275.b3lyp_6-31g(d).smash.inp (generated)

012501275.b3lyp_6-31g(d).nwchem.inp (generated) 012501275.b3lyp_6-31g(d).log.xz 012501275.td-b3lyp_6-31g+(d).inp 012501275.td-b3lyp_6-31g+(d).log.xz

012501275.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501275.td-b3lyp_6-31+g(d).gjf (generated)

012501275.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501275.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501275.mol 012501275.PUBCHEM 012501275.mol (via Jmol)
012501276.b3lyp_6-31g(d).inp

012501276.b3lyp_6-31g(d).qchem.inp (generated)

012501276.b3lyp_6-31g(d).gjf (generated)

012501276.b3lyp_6-31g(d).firefly.inp (generated)

012501276.b3lyp_6-31g(d).smash.inp (generated)

012501276.b3lyp_6-31g(d).nwchem.inp (generated) 012501276.b3lyp_6-31g(d).log.xz 012501276.td-b3lyp_6-31g+(d).inp 012501276.td-b3lyp_6-31g+(d).log.xz

012501276.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501276.td-b3lyp_6-31+g(d).gjf (generated)

012501276.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501276.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501276.mol 012501276.PUBCHEM 012501276.mol (via Jmol)
012501277.b3lyp_6-31g(d).inp

012501277.b3lyp_6-31g(d).qchem.inp (generated)

012501277.b3lyp_6-31g(d).gjf (generated)

012501277.b3lyp_6-31g(d).firefly.inp (generated)

012501277.b3lyp_6-31g(d).smash.inp (generated)

012501277.b3lyp_6-31g(d).nwchem.inp (generated) 012501277.b3lyp_6-31g(d).log.xz 012501277.td-b3lyp_6-31g+(d).inp 012501277.td-b3lyp_6-31g+(d).log.xz

012501277.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501277.td-b3lyp_6-31+g(d).gjf (generated)

012501277.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501277.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501277.mol 012501277.PUBCHEM 012501277.mol (via Jmol)
012501278.b3lyp_6-31g(d).inp

012501278.b3lyp_6-31g(d).qchem.inp (generated)

012501278.b3lyp_6-31g(d).gjf (generated)

012501278.b3lyp_6-31g(d).firefly.inp (generated)

012501278.b3lyp_6-31g(d).smash.inp (generated)

012501278.b3lyp_6-31g(d).nwchem.inp (generated) 012501278.b3lyp_6-31g(d).log.xz 012501278.td-b3lyp_6-31g+(d).inp 012501278.td-b3lyp_6-31g+(d).log.xz

012501278.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501278.td-b3lyp_6-31+g(d).gjf (generated)

012501278.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501278.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501278.mol 012501278.PUBCHEM 012501278.mol (via Jmol)
012501279.b3lyp_6-31g(d).inp

012501279.b3lyp_6-31g(d).qchem.inp (generated)

012501279.b3lyp_6-31g(d).gjf (generated)

012501279.b3lyp_6-31g(d).firefly.inp (generated)

012501279.b3lyp_6-31g(d).smash.inp (generated)

012501279.b3lyp_6-31g(d).nwchem.inp (generated) 012501279.b3lyp_6-31g(d).log.xz 012501279.td-b3lyp_6-31g+(d).inp 012501279.td-b3lyp_6-31g+(d).log.xz

012501279.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501279.td-b3lyp_6-31+g(d).gjf (generated)

012501279.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501279.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501279.mol 012501279.PUBCHEM 012501279.mol (via Jmol)
012501280.b3lyp_6-31g(d).inp

012501280.b3lyp_6-31g(d).qchem.inp (generated)

012501280.b3lyp_6-31g(d).gjf (generated)

012501280.b3lyp_6-31g(d).firefly.inp (generated)

012501280.b3lyp_6-31g(d).smash.inp (generated)

012501280.b3lyp_6-31g(d).nwchem.inp (generated) 012501280.b3lyp_6-31g(d).log.xz 012501280.td-b3lyp_6-31g+(d).inp 012501280.td-b3lyp_6-31g+(d).log.xz

012501280.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501280.td-b3lyp_6-31+g(d).gjf (generated)

012501280.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501280.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501280.mol 012501280.PUBCHEM 012501280.mol (via Jmol)
012501282.b3lyp_6-31g(d).inp

012501282.b3lyp_6-31g(d).qchem.inp (generated)

012501282.b3lyp_6-31g(d).gjf (generated)

012501282.b3lyp_6-31g(d).firefly.inp (generated)

012501282.b3lyp_6-31g(d).smash.inp (generated)

012501282.b3lyp_6-31g(d).nwchem.inp (generated) 012501282.b3lyp_6-31g(d).log.xz 012501282.td-b3lyp_6-31g+(d).inp 012501282.td-b3lyp_6-31g+(d).log.xz

012501282.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501282.td-b3lyp_6-31+g(d).gjf (generated)

012501282.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501282.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501282.mol 012501282.PUBCHEM 012501282.mol (via Jmol)
012501283.b3lyp_6-31g(d).inp

012501283.b3lyp_6-31g(d).qchem.inp (generated)

012501283.b3lyp_6-31g(d).gjf (generated)

012501283.b3lyp_6-31g(d).firefly.inp (generated)

012501283.b3lyp_6-31g(d).smash.inp (generated)

012501283.b3lyp_6-31g(d).nwchem.inp (generated) 012501283.b3lyp_6-31g(d).log.xz 012501283.td-b3lyp_6-31g+(d).inp 012501283.td-b3lyp_6-31g+(d).log.xz

012501283.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501283.td-b3lyp_6-31+g(d).gjf (generated)

012501283.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501283.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501283.mol 012501283.PUBCHEM 012501283.mol (via Jmol)
012501300.b3lyp_6-31g(d).inp

012501300.b3lyp_6-31g(d).qchem.inp (generated)

012501300.b3lyp_6-31g(d).gjf (generated)

012501300.b3lyp_6-31g(d).firefly.inp (generated)

012501300.b3lyp_6-31g(d).smash.inp (generated)

012501300.b3lyp_6-31g(d).nwchem.inp (generated) 012501300.b3lyp_6-31g(d).log.xz 012501300.td-b3lyp_6-31g+(d).inp 012501300.td-b3lyp_6-31g+(d).log.xz

012501300.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501300.td-b3lyp_6-31+g(d).gjf (generated)

012501300.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501300.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501300.mol 012501300.PUBCHEM 012501300.mol (via Jmol)
012501305.b3lyp_6-31g(d).inp

012501305.b3lyp_6-31g(d).qchem.inp (generated)

012501305.b3lyp_6-31g(d).gjf (generated)

012501305.b3lyp_6-31g(d).firefly.inp (generated)

012501305.b3lyp_6-31g(d).smash.inp (generated)

012501305.b3lyp_6-31g(d).nwchem.inp (generated) 012501305.b3lyp_6-31g(d).log.xz 012501305.td-b3lyp_6-31g+(d).inp 012501305.td-b3lyp_6-31g+(d).log.xz

012501305.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501305.td-b3lyp_6-31+g(d).gjf (generated)

012501305.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501305.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501305.mol 012501305.PUBCHEM 012501305.mol (via Jmol)
012501307.b3lyp_6-31g(d).inp

012501307.b3lyp_6-31g(d).qchem.inp (generated)

012501307.b3lyp_6-31g(d).gjf (generated)

012501307.b3lyp_6-31g(d).firefly.inp (generated)

012501307.b3lyp_6-31g(d).smash.inp (generated)

012501307.b3lyp_6-31g(d).nwchem.inp (generated) 012501307.b3lyp_6-31g(d).log.xz 012501307.td-b3lyp_6-31g+(d).inp 012501307.td-b3lyp_6-31g+(d).log.xz

012501307.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501307.td-b3lyp_6-31+g(d).gjf (generated)

012501307.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501307.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501307.mol 012501307.PUBCHEM 012501307.mol (via Jmol)
012501358.b3lyp_6-31g(d).inp

012501358.b3lyp_6-31g(d).qchem.inp (generated)

012501358.b3lyp_6-31g(d).gjf (generated)

012501358.b3lyp_6-31g(d).firefly.inp (generated)

012501358.b3lyp_6-31g(d).smash.inp (generated)

012501358.b3lyp_6-31g(d).nwchem.inp (generated) 012501358.b3lyp_6-31g(d).log.xz 012501358.mol 012501358.PUBCHEM 012501358.mol (via Jmol)
012501390.b3lyp_6-31g(d).inp

012501390.b3lyp_6-31g(d).qchem.inp (generated)

012501390.b3lyp_6-31g(d).gjf (generated)

012501390.b3lyp_6-31g(d).firefly.inp (generated)

012501390.b3lyp_6-31g(d).smash.inp (generated)

012501390.b3lyp_6-31g(d).nwchem.inp (generated) 012501390.b3lyp_6-31g(d).log.xz 012501390.td-b3lyp_6-31g+(d).inp 012501390.td-b3lyp_6-31g+(d).log.xz

012501390.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501390.td-b3lyp_6-31+g(d).gjf (generated)

012501390.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501390.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501390.mol 012501390.PUBCHEM 012501390.mol (via Jmol)
012501431.b3lyp_6-31g(d).inp

012501431.b3lyp_6-31g(d).qchem.inp (generated)

012501431.b3lyp_6-31g(d).gjf (generated)

012501431.b3lyp_6-31g(d).firefly.inp (generated)

012501431.b3lyp_6-31g(d).smash.inp (generated)

012501431.b3lyp_6-31g(d).nwchem.inp (generated) 012501431.b3lyp_6-31g(d).log.xz 012501431.td-b3lyp_6-31g+(d).inp 012501431.td-b3lyp_6-31g+(d).log.xz

012501431.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501431.td-b3lyp_6-31+g(d).gjf (generated)

012501431.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501431.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501431.mol 012501431.PUBCHEM 012501431.mol (via Jmol)
012501432.b3lyp_6-31g(d).inp

012501432.b3lyp_6-31g(d).qchem.inp (generated)

012501432.b3lyp_6-31g(d).gjf (generated)

012501432.b3lyp_6-31g(d).firefly.inp (generated)

012501432.b3lyp_6-31g(d).smash.inp (generated)

012501432.b3lyp_6-31g(d).nwchem.inp (generated) 012501432.b3lyp_6-31g(d).log.xz 012501432.td-b3lyp_6-31g+(d).inp 012501432.td-b3lyp_6-31g+(d).log.xz

012501432.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501432.td-b3lyp_6-31+g(d).gjf (generated)

012501432.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501432.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501432.mol 012501432.PUBCHEM 012501432.mol (via Jmol)
012501433.b3lyp_6-31g(d).inp

012501433.b3lyp_6-31g(d).qchem.inp (generated)

012501433.b3lyp_6-31g(d).gjf (generated)

012501433.b3lyp_6-31g(d).firefly.inp (generated)

012501433.b3lyp_6-31g(d).smash.inp (generated)

012501433.b3lyp_6-31g(d).nwchem.inp (generated) 012501433.b3lyp_6-31g(d).log.xz 012501433.td-b3lyp_6-31g+(d).inp 012501433.td-b3lyp_6-31g+(d).log.xz

012501433.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501433.td-b3lyp_6-31+g(d).gjf (generated)

012501433.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501433.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501433.mol 012501433.PUBCHEM 012501433.mol (via Jmol)
012501434.b3lyp_6-31g(d).inp

012501434.b3lyp_6-31g(d).qchem.inp (generated)

012501434.b3lyp_6-31g(d).gjf (generated)

012501434.b3lyp_6-31g(d).firefly.inp (generated)

012501434.b3lyp_6-31g(d).smash.inp (generated)

012501434.b3lyp_6-31g(d).nwchem.inp (generated) 012501434.b3lyp_6-31g(d).log.xz 012501434.td-b3lyp_6-31g+(d).inp 012501434.td-b3lyp_6-31g+(d).log.xz

012501434.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501434.td-b3lyp_6-31+g(d).gjf (generated)

012501434.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501434.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501434.mol 012501434.PUBCHEM 012501434.mol (via Jmol)
012501436.b3lyp_6-31g(d).inp

012501436.b3lyp_6-31g(d).qchem.inp (generated)

012501436.b3lyp_6-31g(d).gjf (generated)

012501436.b3lyp_6-31g(d).firefly.inp (generated)

012501436.b3lyp_6-31g(d).smash.inp (generated)

012501436.b3lyp_6-31g(d).nwchem.inp (generated) 012501436.b3lyp_6-31g(d).log.xz 012501436.td-b3lyp_6-31g+(d).inp 012501436.td-b3lyp_6-31g+(d).log.xz

012501436.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501436.td-b3lyp_6-31+g(d).gjf (generated)

012501436.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501436.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501436.mol 012501436.PUBCHEM 012501436.mol (via Jmol)
012501444.b3lyp_6-31g(d).inp

012501444.b3lyp_6-31g(d).qchem.inp (generated)

012501444.b3lyp_6-31g(d).gjf (generated)

012501444.b3lyp_6-31g(d).firefly.inp (generated)

012501444.b3lyp_6-31g(d).smash.inp (generated)

012501444.b3lyp_6-31g(d).nwchem.inp (generated) 012501444.b3lyp_6-31g(d).log.xz 012501444.td-b3lyp_6-31g+(d).inp 012501444.td-b3lyp_6-31g+(d).log.xz

012501444.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501444.td-b3lyp_6-31+g(d).gjf (generated)

012501444.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501444.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501444.mol 012501444.PUBCHEM 012501444.mol (via Jmol)
012501447.b3lyp_6-31g(d).inp

012501447.b3lyp_6-31g(d).qchem.inp (generated)

012501447.b3lyp_6-31g(d).gjf (generated)

012501447.b3lyp_6-31g(d).firefly.inp (generated)

012501447.b3lyp_6-31g(d).smash.inp (generated)

012501447.b3lyp_6-31g(d).nwchem.inp (generated) 012501447.b3lyp_6-31g(d).log.xz 012501447.td-b3lyp_6-31g+(d).inp 012501447.td-b3lyp_6-31g+(d).log.xz

012501447.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501447.td-b3lyp_6-31+g(d).gjf (generated)

012501447.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501447.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501447.mol 012501447.PUBCHEM 012501447.mol (via Jmol)
012501450.b3lyp_6-31g(d).inp

012501450.b3lyp_6-31g(d).qchem.inp (generated)

012501450.b3lyp_6-31g(d).gjf (generated)

012501450.b3lyp_6-31g(d).firefly.inp (generated)

012501450.b3lyp_6-31g(d).smash.inp (generated)

012501450.b3lyp_6-31g(d).nwchem.inp (generated) 012501450.b3lyp_6-31g(d).log.xz 012501450.td-b3lyp_6-31g+(d).inp 012501450.td-b3lyp_6-31g+(d).log.xz

012501450.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501450.td-b3lyp_6-31+g(d).gjf (generated)

012501450.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501450.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501450.mol 012501450.PUBCHEM 012501450.mol (via Jmol)
012501451.b3lyp_6-31g(d).inp

012501451.b3lyp_6-31g(d).qchem.inp (generated)

012501451.b3lyp_6-31g(d).gjf (generated)

012501451.b3lyp_6-31g(d).firefly.inp (generated)

012501451.b3lyp_6-31g(d).smash.inp (generated)

012501451.b3lyp_6-31g(d).nwchem.inp (generated) 012501451.b3lyp_6-31g(d).log.xz 012501451.td-b3lyp_6-31g+(d).inp 012501451.td-b3lyp_6-31g+(d).log.xz

012501451.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501451.td-b3lyp_6-31+g(d).gjf (generated)

012501451.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501451.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501451.mol 012501451.PUBCHEM 012501451.mol (via Jmol)
012501460.b3lyp_6-31g(d).inp

012501460.b3lyp_6-31g(d).qchem.inp (generated)

012501460.b3lyp_6-31g(d).gjf (generated)

012501460.b3lyp_6-31g(d).firefly.inp (generated)

012501460.b3lyp_6-31g(d).smash.inp (generated)

012501460.b3lyp_6-31g(d).nwchem.inp (generated) 012501460.b3lyp_6-31g(d).log.xz 012501460.td-b3lyp_6-31g+(d).inp 012501460.td-b3lyp_6-31g+(d).log.xz

012501460.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501460.td-b3lyp_6-31+g(d).gjf (generated)

012501460.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501460.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501460.mol 012501460.PUBCHEM 012501460.mol (via Jmol)
012501466.b3lyp_6-31g(d).inp

012501466.b3lyp_6-31g(d).qchem.inp (generated)

012501466.b3lyp_6-31g(d).gjf (generated)

012501466.b3lyp_6-31g(d).firefly.inp (generated)

012501466.b3lyp_6-31g(d).smash.inp (generated)

012501466.b3lyp_6-31g(d).nwchem.inp (generated) 012501466.b3lyp_6-31g(d).log.xz 012501466.td-b3lyp_6-31g+(d).inp 012501466.td-b3lyp_6-31g+(d).log.xz

012501466.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501466.td-b3lyp_6-31+g(d).gjf (generated)

012501466.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501466.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501466.mol 012501466.PUBCHEM 012501466.mol (via Jmol)
012501467.b3lyp_6-31g(d).inp

012501467.b3lyp_6-31g(d).qchem.inp (generated)

012501467.b3lyp_6-31g(d).gjf (generated)

012501467.b3lyp_6-31g(d).firefly.inp (generated)

012501467.b3lyp_6-31g(d).smash.inp (generated)

012501467.b3lyp_6-31g(d).nwchem.inp (generated) 012501467.b3lyp_6-31g(d).log.xz 012501467.td-b3lyp_6-31g+(d).inp 012501467.td-b3lyp_6-31g+(d).log.xz

012501467.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501467.td-b3lyp_6-31+g(d).gjf (generated)

012501467.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501467.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501467.mol 012501467.PUBCHEM 012501467.mol (via Jmol)
012501468.b3lyp_6-31g(d).inp

012501468.b3lyp_6-31g(d).qchem.inp (generated)

012501468.b3lyp_6-31g(d).gjf (generated)

012501468.b3lyp_6-31g(d).firefly.inp (generated)

012501468.b3lyp_6-31g(d).smash.inp (generated)

012501468.b3lyp_6-31g(d).nwchem.inp (generated) 012501468.b3lyp_6-31g(d).log.xz 012501468.td-b3lyp_6-31g+(d).inp 012501468.td-b3lyp_6-31g+(d).log.xz

012501468.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501468.td-b3lyp_6-31+g(d).gjf (generated)

012501468.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501468.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501468.mol 012501468.PUBCHEM 012501468.mol (via Jmol)
012501471.b3lyp_6-31g(d).inp

012501471.b3lyp_6-31g(d).qchem.inp (generated)

012501471.b3lyp_6-31g(d).gjf (generated)

012501471.b3lyp_6-31g(d).firefly.inp (generated)

012501471.b3lyp_6-31g(d).smash.inp (generated)

012501471.b3lyp_6-31g(d).nwchem.inp (generated) 012501471.b3lyp_6-31g(d).log.xz 012501471.td-b3lyp_6-31g+(d).inp 012501471.td-b3lyp_6-31g+(d).log.xz

012501471.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501471.td-b3lyp_6-31+g(d).gjf (generated)

012501471.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501471.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501471.mol 012501471.PUBCHEM 012501471.mol (via Jmol)
012501489.b3lyp_6-31g(d).inp

012501489.b3lyp_6-31g(d).qchem.inp (generated)

012501489.b3lyp_6-31g(d).gjf (generated)

012501489.b3lyp_6-31g(d).firefly.inp (generated)

012501489.b3lyp_6-31g(d).smash.inp (generated)

012501489.b3lyp_6-31g(d).nwchem.inp (generated) 012501489.b3lyp_6-31g(d).log.xz 012501489.td-b3lyp_6-31g+(d).inp 012501489.td-b3lyp_6-31g+(d).log.xz

012501489.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501489.td-b3lyp_6-31+g(d).gjf (generated)

012501489.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501489.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501489.mol 012501489.PUBCHEM 012501489.mol (via Jmol)
012501499.b3lyp_6-31g(d).inp

012501499.b3lyp_6-31g(d).qchem.inp (generated)

012501499.b3lyp_6-31g(d).gjf (generated)

012501499.b3lyp_6-31g(d).firefly.inp (generated)

012501499.b3lyp_6-31g(d).smash.inp (generated)

012501499.b3lyp_6-31g(d).nwchem.inp (generated) 012501499.b3lyp_6-31g(d).log.xz 012501499.td-b3lyp_6-31g+(d).inp 012501499.td-b3lyp_6-31g+(d).log.xz

012501499.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501499.td-b3lyp_6-31+g(d).gjf (generated)

012501499.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501499.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501499.mol 012501499.PUBCHEM 012501499.mol (via Jmol)
012501500.b3lyp_6-31g(d).inp

012501500.b3lyp_6-31g(d).qchem.inp (generated)

012501500.b3lyp_6-31g(d).gjf (generated)

012501500.b3lyp_6-31g(d).firefly.inp (generated)

012501500.b3lyp_6-31g(d).smash.inp (generated)

012501500.b3lyp_6-31g(d).nwchem.inp (generated) 012501500.b3lyp_6-31g(d).log.xz 012501500.td-b3lyp_6-31g+(d).inp 012501500.td-b3lyp_6-31g+(d).log.xz

012501500.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501500.td-b3lyp_6-31+g(d).gjf (generated)

012501500.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501500.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501500.mol 012501500.PUBCHEM 012501500.mol (via Jmol)
012501502.b3lyp_6-31g(d).inp

012501502.b3lyp_6-31g(d).qchem.inp (generated)

012501502.b3lyp_6-31g(d).gjf (generated)

012501502.b3lyp_6-31g(d).firefly.inp (generated)

012501502.b3lyp_6-31g(d).smash.inp (generated)

012501502.b3lyp_6-31g(d).nwchem.inp (generated) 012501502.b3lyp_6-31g(d).log.xz 012501502.td-b3lyp_6-31g+(d).inp 012501502.td-b3lyp_6-31g+(d).log.xz

012501502.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501502.td-b3lyp_6-31+g(d).gjf (generated)

012501502.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501502.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501502.mol 012501502.PUBCHEM 012501502.mol (via Jmol)
012501504.b3lyp_6-31g(d).inp

012501504.b3lyp_6-31g(d).qchem.inp (generated)

012501504.b3lyp_6-31g(d).gjf (generated)

012501504.b3lyp_6-31g(d).firefly.inp (generated)

012501504.b3lyp_6-31g(d).smash.inp (generated)

012501504.b3lyp_6-31g(d).nwchem.inp (generated) 012501504.b3lyp_6-31g(d).log.xz 012501504.td-b3lyp_6-31g+(d).inp 012501504.td-b3lyp_6-31g+(d).log.xz

012501504.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501504.td-b3lyp_6-31+g(d).gjf (generated)

012501504.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501504.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501504.mol 012501504.PUBCHEM 012501504.mol (via Jmol)
012501506.b3lyp_6-31g(d).inp

012501506.b3lyp_6-31g(d).qchem.inp (generated)

012501506.b3lyp_6-31g(d).gjf (generated)

012501506.b3lyp_6-31g(d).firefly.inp (generated)

012501506.b3lyp_6-31g(d).smash.inp (generated)

012501506.b3lyp_6-31g(d).nwchem.inp (generated) 012501506.b3lyp_6-31g(d).log.xz 012501506.td-b3lyp_6-31g+(d).inp 012501506.td-b3lyp_6-31g+(d).log.xz

012501506.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501506.td-b3lyp_6-31+g(d).gjf (generated)

012501506.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501506.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501506.mol 012501506.PUBCHEM 012501506.mol (via Jmol)
012501523.b3lyp_6-31g(d).inp

012501523.b3lyp_6-31g(d).qchem.inp (generated)

012501523.b3lyp_6-31g(d).gjf (generated)

012501523.b3lyp_6-31g(d).firefly.inp (generated)

012501523.b3lyp_6-31g(d).smash.inp (generated)

012501523.b3lyp_6-31g(d).nwchem.inp (generated) 012501523.b3lyp_6-31g(d).log.xz 012501523.td-b3lyp_6-31g+(d).inp 012501523.td-b3lyp_6-31g+(d).log.xz

012501523.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501523.td-b3lyp_6-31+g(d).gjf (generated)

012501523.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501523.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501523.mol 012501523.PUBCHEM 012501523.mol (via Jmol)
012501540.b3lyp_6-31g(d).inp

012501540.b3lyp_6-31g(d).qchem.inp (generated)

012501540.b3lyp_6-31g(d).gjf (generated)

012501540.b3lyp_6-31g(d).firefly.inp (generated)

012501540.b3lyp_6-31g(d).smash.inp (generated)

012501540.b3lyp_6-31g(d).nwchem.inp (generated) 012501540.b3lyp_6-31g(d).log.xz 012501540.td-b3lyp_6-31g+(d).inp 012501540.td-b3lyp_6-31g+(d).log.xz

012501540.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501540.td-b3lyp_6-31+g(d).gjf (generated)

012501540.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501540.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501540.mol 012501540.PUBCHEM 012501540.mol (via Jmol)
012501555.b3lyp_6-31g(d).inp

012501555.b3lyp_6-31g(d).qchem.inp (generated)

012501555.b3lyp_6-31g(d).gjf (generated)

012501555.b3lyp_6-31g(d).firefly.inp (generated)

012501555.b3lyp_6-31g(d).smash.inp (generated)

012501555.b3lyp_6-31g(d).nwchem.inp (generated) 012501555.b3lyp_6-31g(d).log.xz 012501555.td-b3lyp_6-31g+(d).inp 012501555.td-b3lyp_6-31g+(d).log.xz

012501555.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501555.td-b3lyp_6-31+g(d).gjf (generated)

012501555.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501555.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501555.mol 012501555.PUBCHEM 012501555.mol (via Jmol)
012501557.b3lyp_6-31g(d).inp

012501557.b3lyp_6-31g(d).qchem.inp (generated)

012501557.b3lyp_6-31g(d).gjf (generated)

012501557.b3lyp_6-31g(d).firefly.inp (generated)

012501557.b3lyp_6-31g(d).smash.inp (generated)

012501557.b3lyp_6-31g(d).nwchem.inp (generated) 012501557.b3lyp_6-31g(d).log.xz 012501557.td-b3lyp_6-31g+(d).inp 012501557.td-b3lyp_6-31g+(d).log.xz

012501557.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501557.td-b3lyp_6-31+g(d).gjf (generated)

012501557.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501557.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501557.mol 012501557.PUBCHEM 012501557.mol (via Jmol)
012501564.b3lyp_6-31g(d).inp

012501564.b3lyp_6-31g(d).qchem.inp (generated)

012501564.b3lyp_6-31g(d).gjf (generated)

012501564.b3lyp_6-31g(d).firefly.inp (generated)

012501564.b3lyp_6-31g(d).smash.inp (generated)

012501564.b3lyp_6-31g(d).nwchem.inp (generated) 012501564.b3lyp_6-31g(d).log.xz 012501564.td-b3lyp_6-31g+(d).inp 012501564.td-b3lyp_6-31g+(d).log.xz

012501564.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501564.td-b3lyp_6-31+g(d).gjf (generated)

012501564.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501564.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501564.mol 012501564.PUBCHEM 012501564.mol (via Jmol)
012501566.b3lyp_6-31g(d).inp

012501566.b3lyp_6-31g(d).qchem.inp (generated)

012501566.b3lyp_6-31g(d).gjf (generated)

012501566.b3lyp_6-31g(d).firefly.inp (generated)

012501566.b3lyp_6-31g(d).smash.inp (generated)

012501566.b3lyp_6-31g(d).nwchem.inp (generated) 012501566.b3lyp_6-31g(d).log.xz 012501566.td-b3lyp_6-31g+(d).inp 012501566.td-b3lyp_6-31g+(d).log.xz

012501566.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501566.td-b3lyp_6-31+g(d).gjf (generated)

012501566.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501566.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501566.mol 012501566.PUBCHEM 012501566.mol (via Jmol)
012501573.b3lyp_6-31g(d).inp

012501573.b3lyp_6-31g(d).qchem.inp (generated)

012501573.b3lyp_6-31g(d).gjf (generated)

012501573.b3lyp_6-31g(d).firefly.inp (generated)

012501573.b3lyp_6-31g(d).smash.inp (generated)

012501573.b3lyp_6-31g(d).nwchem.inp (generated) 012501573.b3lyp_6-31g(d).log.xz 012501573.td-b3lyp_6-31g+(d).inp 012501573.td-b3lyp_6-31g+(d).log.xz

012501573.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501573.td-b3lyp_6-31+g(d).gjf (generated)

012501573.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501573.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501573.mol 012501573.PUBCHEM 012501573.mol (via Jmol)
012501597.b3lyp_6-31g(d).inp

012501597.b3lyp_6-31g(d).qchem.inp (generated)

012501597.b3lyp_6-31g(d).gjf (generated)

012501597.b3lyp_6-31g(d).firefly.inp (generated)

012501597.b3lyp_6-31g(d).smash.inp (generated)

012501597.b3lyp_6-31g(d).nwchem.inp (generated) 012501597.b3lyp_6-31g(d).log.xz 012501597.mol 012501597.PUBCHEM 012501597.mol (via Jmol)
012501601.b3lyp_6-31g(d).inp

012501601.b3lyp_6-31g(d).qchem.inp (generated)

012501601.b3lyp_6-31g(d).gjf (generated)

012501601.b3lyp_6-31g(d).firefly.inp (generated)

012501601.b3lyp_6-31g(d).smash.inp (generated)

012501601.b3lyp_6-31g(d).nwchem.inp (generated) 012501601.b3lyp_6-31g(d).log.xz 012501601.mol 012501601.PUBCHEM 012501601.mol (via Jmol)
012501620.b3lyp_6-31g(d).inp

012501620.b3lyp_6-31g(d).qchem.inp (generated)

012501620.b3lyp_6-31g(d).gjf (generated)

012501620.b3lyp_6-31g(d).firefly.inp (generated)

012501620.b3lyp_6-31g(d).smash.inp (generated)

012501620.b3lyp_6-31g(d).nwchem.inp (generated) 012501620.b3lyp_6-31g(d).log.xz 012501620.td-b3lyp_6-31g+(d).inp 012501620.td-b3lyp_6-31g+(d).log.xz

012501620.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501620.td-b3lyp_6-31+g(d).gjf (generated)

012501620.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501620.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501620.mol 012501620.PUBCHEM 012501620.mol (via Jmol)
012501629.b3lyp_6-31g(d).inp

012501629.b3lyp_6-31g(d).qchem.inp (generated)

012501629.b3lyp_6-31g(d).gjf (generated)

012501629.b3lyp_6-31g(d).firefly.inp (generated)

012501629.b3lyp_6-31g(d).smash.inp (generated)

012501629.b3lyp_6-31g(d).nwchem.inp (generated) 012501629.b3lyp_6-31g(d).log.xz 012501629.td-b3lyp_6-31g+(d).inp 012501629.td-b3lyp_6-31g+(d).log.xz

012501629.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501629.td-b3lyp_6-31+g(d).gjf (generated)

012501629.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501629.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501629.mol 012501629.PUBCHEM 012501629.mol (via Jmol)
012501630.b3lyp_6-31g(d).inp

012501630.b3lyp_6-31g(d).qchem.inp (generated)

012501630.b3lyp_6-31g(d).gjf (generated)

012501630.b3lyp_6-31g(d).firefly.inp (generated)

012501630.b3lyp_6-31g(d).smash.inp (generated)

012501630.b3lyp_6-31g(d).nwchem.inp (generated) 012501630.b3lyp_6-31g(d).log.xz 012501630.td-b3lyp_6-31g+(d).inp 012501630.td-b3lyp_6-31g+(d).log.xz

012501630.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501630.td-b3lyp_6-31+g(d).gjf (generated)

012501630.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501630.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501630.mol 012501630.PUBCHEM 012501630.mol (via Jmol)
012501745.b3lyp_6-31g(d).inp

012501745.b3lyp_6-31g(d).qchem.inp (generated)

012501745.b3lyp_6-31g(d).gjf (generated)

012501745.b3lyp_6-31g(d).firefly.inp (generated)

012501745.b3lyp_6-31g(d).smash.inp (generated)

012501745.b3lyp_6-31g(d).nwchem.inp (generated) 012501745.b3lyp_6-31g(d).log.xz 012501745.td-b3lyp_6-31g+(d).inp 012501745.td-b3lyp_6-31g+(d).log.xz

012501745.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501745.td-b3lyp_6-31+g(d).gjf (generated)

012501745.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501745.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501745.mol 012501745.PUBCHEM 012501745.mol (via Jmol)
012501746.b3lyp_6-31g(d).inp

012501746.b3lyp_6-31g(d).qchem.inp (generated)

012501746.b3lyp_6-31g(d).gjf (generated)

012501746.b3lyp_6-31g(d).firefly.inp (generated)

012501746.b3lyp_6-31g(d).smash.inp (generated)

012501746.b3lyp_6-31g(d).nwchem.inp (generated) 012501746.b3lyp_6-31g(d).log.xz 012501746.td-b3lyp_6-31g+(d).inp 012501746.td-b3lyp_6-31g+(d).log.xz

012501746.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501746.td-b3lyp_6-31+g(d).gjf (generated)

012501746.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501746.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501746.mol 012501746.PUBCHEM 012501746.mol (via Jmol)
012501765.b3lyp_6-31g(d).inp

012501765.b3lyp_6-31g(d).qchem.inp (generated)

012501765.b3lyp_6-31g(d).gjf (generated)

012501765.b3lyp_6-31g(d).firefly.inp (generated)

012501765.b3lyp_6-31g(d).smash.inp (generated)

012501765.b3lyp_6-31g(d).nwchem.inp (generated) 012501765.b3lyp_6-31g(d).log.xz 012501765.td-b3lyp_6-31g+(d).inp 012501765.td-b3lyp_6-31g+(d).log.xz

012501765.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501765.td-b3lyp_6-31+g(d).gjf (generated)

012501765.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501765.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501765.mol 012501765.PUBCHEM 012501765.mol (via Jmol)
012501766.b3lyp_6-31g(d).inp

012501766.b3lyp_6-31g(d).qchem.inp (generated)

012501766.b3lyp_6-31g(d).gjf (generated)

012501766.b3lyp_6-31g(d).firefly.inp (generated)

012501766.b3lyp_6-31g(d).smash.inp (generated)

012501766.b3lyp_6-31g(d).nwchem.inp (generated) 012501766.b3lyp_6-31g(d).log.xz 012501766.td-b3lyp_6-31g+(d).inp 012501766.td-b3lyp_6-31g+(d).log.xz

012501766.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501766.td-b3lyp_6-31+g(d).gjf (generated)

012501766.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501766.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501766.mol 012501766.PUBCHEM 012501766.mol (via Jmol)
012501800.b3lyp_6-31g(d).inp

012501800.b3lyp_6-31g(d).qchem.inp (generated)

012501800.b3lyp_6-31g(d).gjf (generated)

012501800.b3lyp_6-31g(d).firefly.inp (generated)

012501800.b3lyp_6-31g(d).smash.inp (generated)

012501800.b3lyp_6-31g(d).nwchem.inp (generated) 012501800.b3lyp_6-31g(d).log.xz 012501800.td-b3lyp_6-31g+(d).inp 012501800.td-b3lyp_6-31g+(d).log.xz

012501800.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501800.td-b3lyp_6-31+g(d).gjf (generated)

012501800.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501800.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501800.mol 012501800.PUBCHEM 012501800.mol (via Jmol)
012501818.b3lyp_6-31g(d).inp

012501818.b3lyp_6-31g(d).qchem.inp (generated)

012501818.b3lyp_6-31g(d).gjf (generated)

012501818.b3lyp_6-31g(d).firefly.inp (generated)

012501818.b3lyp_6-31g(d).smash.inp (generated)

012501818.b3lyp_6-31g(d).nwchem.inp (generated) 012501818.b3lyp_6-31g(d).log.xz 012501818.td-b3lyp_6-31g+(d).inp 012501818.td-b3lyp_6-31g+(d).log.xz

012501818.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501818.td-b3lyp_6-31+g(d).gjf (generated)

012501818.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501818.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501818.mol 012501818.PUBCHEM 012501818.mol (via Jmol)
012501820.b3lyp_6-31g(d).inp

012501820.b3lyp_6-31g(d).qchem.inp (generated)

012501820.b3lyp_6-31g(d).gjf (generated)

012501820.b3lyp_6-31g(d).firefly.inp (generated)

012501820.b3lyp_6-31g(d).smash.inp (generated)

012501820.b3lyp_6-31g(d).nwchem.inp (generated) 012501820.b3lyp_6-31g(d).log.xz 012501820.td-b3lyp_6-31g+(d).inp 012501820.td-b3lyp_6-31g+(d).log.xz

012501820.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501820.td-b3lyp_6-31+g(d).gjf (generated)

012501820.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501820.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501820.mol 012501820.PUBCHEM 012501820.mol (via Jmol)
012501869.b3lyp_6-31g(d).inp

012501869.b3lyp_6-31g(d).qchem.inp (generated)

012501869.b3lyp_6-31g(d).gjf (generated)

012501869.b3lyp_6-31g(d).firefly.inp (generated)

012501869.b3lyp_6-31g(d).smash.inp (generated)

012501869.b3lyp_6-31g(d).nwchem.inp (generated) 012501869.b3lyp_6-31g(d).log.xz 012501869.td-b3lyp_6-31g+(d).inp 012501869.td-b3lyp_6-31g+(d).log.xz

012501869.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501869.td-b3lyp_6-31+g(d).gjf (generated)

012501869.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501869.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501869.mol 012501869.PUBCHEM 012501869.mol (via Jmol)
012501902.b3lyp_6-31g(d).inp

012501902.b3lyp_6-31g(d).qchem.inp (generated)

012501902.b3lyp_6-31g(d).gjf (generated)

012501902.b3lyp_6-31g(d).firefly.inp (generated)

012501902.b3lyp_6-31g(d).smash.inp (generated)

012501902.b3lyp_6-31g(d).nwchem.inp (generated) 012501902.b3lyp_6-31g(d).log.xz 012501902.td-b3lyp_6-31g+(d).inp 012501902.td-b3lyp_6-31g+(d).log.xz

012501902.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501902.td-b3lyp_6-31+g(d).gjf (generated)

012501902.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501902.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501902.mol 012501902.PUBCHEM 012501902.mol (via Jmol)
012501906.b3lyp_6-31g(d).inp

012501906.b3lyp_6-31g(d).qchem.inp (generated)

012501906.b3lyp_6-31g(d).gjf (generated)

012501906.b3lyp_6-31g(d).firefly.inp (generated)

012501906.b3lyp_6-31g(d).smash.inp (generated)

012501906.b3lyp_6-31g(d).nwchem.inp (generated) 012501906.b3lyp_6-31g(d).log.xz 012501906.td-b3lyp_6-31g+(d).inp 012501906.td-b3lyp_6-31g+(d).log.xz

012501906.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501906.td-b3lyp_6-31+g(d).gjf (generated)

012501906.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501906.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501906.mol 012501906.PUBCHEM 012501906.mol (via Jmol)
012501907.b3lyp_6-31g(d).inp

012501907.b3lyp_6-31g(d).qchem.inp (generated)

012501907.b3lyp_6-31g(d).gjf (generated)

012501907.b3lyp_6-31g(d).firefly.inp (generated)

012501907.b3lyp_6-31g(d).smash.inp (generated)

012501907.b3lyp_6-31g(d).nwchem.inp (generated) 012501907.b3lyp_6-31g(d).log.xz 012501907.td-b3lyp_6-31g+(d).inp 012501907.td-b3lyp_6-31g+(d).log.xz

012501907.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501907.td-b3lyp_6-31+g(d).gjf (generated)

012501907.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501907.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501907.mol 012501907.PUBCHEM 012501907.mol (via Jmol)
012501908.b3lyp_6-31g(d).inp

012501908.b3lyp_6-31g(d).qchem.inp (generated)

012501908.b3lyp_6-31g(d).gjf (generated)

012501908.b3lyp_6-31g(d).firefly.inp (generated)

012501908.b3lyp_6-31g(d).smash.inp (generated)

012501908.b3lyp_6-31g(d).nwchem.inp (generated) 012501908.b3lyp_6-31g(d).log.xz 012501908.td-b3lyp_6-31g+(d).inp 012501908.td-b3lyp_6-31g+(d).log.xz

012501908.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501908.td-b3lyp_6-31+g(d).gjf (generated)

012501908.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501908.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501908.mol 012501908.PUBCHEM 012501908.mol (via Jmol)
012501909.b3lyp_6-31g(d).inp

012501909.b3lyp_6-31g(d).qchem.inp (generated)

012501909.b3lyp_6-31g(d).gjf (generated)

012501909.b3lyp_6-31g(d).firefly.inp (generated)

012501909.b3lyp_6-31g(d).smash.inp (generated)

012501909.b3lyp_6-31g(d).nwchem.inp (generated) 012501909.b3lyp_6-31g(d).log.xz 012501909.td-b3lyp_6-31g+(d).inp 012501909.td-b3lyp_6-31g+(d).log.xz

012501909.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501909.td-b3lyp_6-31+g(d).gjf (generated)

012501909.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501909.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501909.mol 012501909.PUBCHEM 012501909.mol (via Jmol)
012501913.b3lyp_6-31g(d).inp

012501913.b3lyp_6-31g(d).qchem.inp (generated)

012501913.b3lyp_6-31g(d).gjf (generated)

012501913.b3lyp_6-31g(d).firefly.inp (generated)

012501913.b3lyp_6-31g(d).smash.inp (generated)

012501913.b3lyp_6-31g(d).nwchem.inp (generated) 012501913.b3lyp_6-31g(d).log.xz 012501913.td-b3lyp_6-31g+(d).inp 012501913.td-b3lyp_6-31g+(d).log.xz

012501913.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501913.td-b3lyp_6-31+g(d).gjf (generated)

012501913.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501913.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501913.mol 012501913.PUBCHEM 012501913.mol (via Jmol)
012501932.b3lyp_6-31g(d).inp

012501932.b3lyp_6-31g(d).qchem.inp (generated)

012501932.b3lyp_6-31g(d).gjf (generated)

012501932.b3lyp_6-31g(d).firefly.inp (generated)

012501932.b3lyp_6-31g(d).smash.inp (generated)

012501932.b3lyp_6-31g(d).nwchem.inp (generated) 012501932.b3lyp_6-31g(d).log.xz 012501932.td-b3lyp_6-31g+(d).inp 012501932.td-b3lyp_6-31g+(d).log.xz

012501932.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501932.td-b3lyp_6-31+g(d).gjf (generated)

012501932.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501932.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501932.mol 012501932.PUBCHEM 012501932.mol (via Jmol)
012501973.b3lyp_6-31g(d).inp

012501973.b3lyp_6-31g(d).qchem.inp (generated)

012501973.b3lyp_6-31g(d).gjf (generated)

012501973.b3lyp_6-31g(d).firefly.inp (generated)

012501973.b3lyp_6-31g(d).smash.inp (generated)

012501973.b3lyp_6-31g(d).nwchem.inp (generated) 012501973.b3lyp_6-31g(d).log.xz 012501973.td-b3lyp_6-31g+(d).inp 012501973.td-b3lyp_6-31g+(d).log.xz

012501973.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501973.td-b3lyp_6-31+g(d).gjf (generated)

012501973.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501973.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501973.mol 012501973.PUBCHEM 012501973.mol (via Jmol)
012501974.b3lyp_6-31g(d).inp

012501974.b3lyp_6-31g(d).qchem.inp (generated)

012501974.b3lyp_6-31g(d).gjf (generated)

012501974.b3lyp_6-31g(d).firefly.inp (generated)

012501974.b3lyp_6-31g(d).smash.inp (generated)

012501974.b3lyp_6-31g(d).nwchem.inp (generated) 012501974.b3lyp_6-31g(d).log.xz 012501974.td-b3lyp_6-31g+(d).inp 012501974.td-b3lyp_6-31g+(d).log.xz

012501974.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501974.td-b3lyp_6-31+g(d).gjf (generated)

012501974.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501974.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501974.mol 012501974.PUBCHEM 012501974.mol (via Jmol)
012501987.b3lyp_6-31g(d).inp

012501987.b3lyp_6-31g(d).qchem.inp (generated)

012501987.b3lyp_6-31g(d).gjf (generated)

012501987.b3lyp_6-31g(d).firefly.inp (generated)

012501987.b3lyp_6-31g(d).smash.inp (generated)

012501987.b3lyp_6-31g(d).nwchem.inp (generated) 012501987.b3lyp_6-31g(d).log.xz 012501987.td-b3lyp_6-31g+(d).inp 012501987.td-b3lyp_6-31g+(d).log.xz

012501987.td-b3lyp_6-31+g(d).qchem.inp (generated)

012501987.td-b3lyp_6-31+g(d).gjf (generated)

012501987.td-b3lyp_6-31+g(d).firefly.inp (generated)

012501987.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012501987.mol 012501987.PUBCHEM 012501987.mol (via Jmol)
012502006.b3lyp_6-31g(d).inp

012502006.b3lyp_6-31g(d).qchem.inp (generated)

012502006.b3lyp_6-31g(d).gjf (generated)

012502006.b3lyp_6-31g(d).firefly.inp (generated)

012502006.b3lyp_6-31g(d).smash.inp (generated)

012502006.b3lyp_6-31g(d).nwchem.inp (generated) 012502006.b3lyp_6-31g(d).log.xz 012502006.mol 012502006.PUBCHEM 012502006.mol (via Jmol)
012502008.b3lyp_6-31g(d).inp

012502008.b3lyp_6-31g(d).qchem.inp (generated)

012502008.b3lyp_6-31g(d).gjf (generated)

012502008.b3lyp_6-31g(d).firefly.inp (generated)

012502008.b3lyp_6-31g(d).smash.inp (generated)

012502008.b3lyp_6-31g(d).nwchem.inp (generated) 012502008.b3lyp_6-31g(d).log.xz 012502008.td-b3lyp_6-31g+(d).inp 012502008.td-b3lyp_6-31g+(d).log.xz

012502008.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502008.td-b3lyp_6-31+g(d).gjf (generated)

012502008.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502008.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502008.mol 012502008.PUBCHEM 012502008.mol (via Jmol)
012502010.b3lyp_6-31g(d).inp

012502010.b3lyp_6-31g(d).qchem.inp (generated)

012502010.b3lyp_6-31g(d).gjf (generated)

012502010.b3lyp_6-31g(d).firefly.inp (generated)

012502010.b3lyp_6-31g(d).smash.inp (generated)

012502010.b3lyp_6-31g(d).nwchem.inp (generated) 012502010.b3lyp_6-31g(d).log.xz 012502010.mol 012502010.PUBCHEM 012502010.mol (via Jmol)
012502012.b3lyp_6-31g(d).inp

012502012.b3lyp_6-31g(d).qchem.inp (generated)

012502012.b3lyp_6-31g(d).gjf (generated)

012502012.b3lyp_6-31g(d).firefly.inp (generated)

012502012.b3lyp_6-31g(d).smash.inp (generated)

012502012.b3lyp_6-31g(d).nwchem.inp (generated) 012502012.b3lyp_6-31g(d).log.xz 012502012.td-b3lyp_6-31g+(d).inp 012502012.td-b3lyp_6-31g+(d).log.xz

012502012.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502012.td-b3lyp_6-31+g(d).gjf (generated)

012502012.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502012.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502012.mol 012502012.PUBCHEM 012502012.mol (via Jmol)
012502021.b3lyp_6-31g(d).inp

012502021.b3lyp_6-31g(d).qchem.inp (generated)

012502021.b3lyp_6-31g(d).gjf (generated)

012502021.b3lyp_6-31g(d).firefly.inp (generated)

012502021.b3lyp_6-31g(d).smash.inp (generated)

012502021.b3lyp_6-31g(d).nwchem.inp (generated) 012502021.b3lyp_6-31g(d).log.xz 012502021.td-b3lyp_6-31g+(d).inp 012502021.td-b3lyp_6-31g+(d).log.xz

012502021.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502021.td-b3lyp_6-31+g(d).gjf (generated)

012502021.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502021.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502021.mol 012502021.PUBCHEM 012502021.mol (via Jmol)
012502023.b3lyp_6-31g(d).inp

012502023.b3lyp_6-31g(d).qchem.inp (generated)

012502023.b3lyp_6-31g(d).gjf (generated)

012502023.b3lyp_6-31g(d).firefly.inp (generated)

012502023.b3lyp_6-31g(d).smash.inp (generated)

012502023.b3lyp_6-31g(d).nwchem.inp (generated) 012502023.b3lyp_6-31g(d).log.xz 012502023.td-b3lyp_6-31g+(d).inp 012502023.td-b3lyp_6-31g+(d).log.xz

012502023.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502023.td-b3lyp_6-31+g(d).gjf (generated)

012502023.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502023.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502023.mol 012502023.PUBCHEM 012502023.mol (via Jmol)
012502026.b3lyp_6-31g(d).inp

012502026.b3lyp_6-31g(d).qchem.inp (generated)

012502026.b3lyp_6-31g(d).gjf (generated)

012502026.b3lyp_6-31g(d).firefly.inp (generated)

012502026.b3lyp_6-31g(d).smash.inp (generated)

012502026.b3lyp_6-31g(d).nwchem.inp (generated) 012502026.b3lyp_6-31g(d).log.xz 012502026.td-b3lyp_6-31g+(d).inp 012502026.td-b3lyp_6-31g+(d).log.xz

012502026.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502026.td-b3lyp_6-31+g(d).gjf (generated)

012502026.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502026.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502026.mol 012502026.PUBCHEM 012502026.mol (via Jmol)
012502027.b3lyp_6-31g(d).inp

012502027.b3lyp_6-31g(d).qchem.inp (generated)

012502027.b3lyp_6-31g(d).gjf (generated)

012502027.b3lyp_6-31g(d).firefly.inp (generated)

012502027.b3lyp_6-31g(d).smash.inp (generated)

012502027.b3lyp_6-31g(d).nwchem.inp (generated) 012502027.b3lyp_6-31g(d).log.xz 012502027.td-b3lyp_6-31g+(d).inp 012502027.td-b3lyp_6-31g+(d).log.xz

012502027.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502027.td-b3lyp_6-31+g(d).gjf (generated)

012502027.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502027.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502027.mol 012502027.PUBCHEM 012502027.mol (via Jmol)
012502028.b3lyp_6-31g(d).inp

012502028.b3lyp_6-31g(d).qchem.inp (generated)

012502028.b3lyp_6-31g(d).gjf (generated)

012502028.b3lyp_6-31g(d).firefly.inp (generated)

012502028.b3lyp_6-31g(d).smash.inp (generated)

012502028.b3lyp_6-31g(d).nwchem.inp (generated) 012502028.b3lyp_6-31g(d).log.xz 012502028.td-b3lyp_6-31g+(d).inp 012502028.td-b3lyp_6-31g+(d).log.xz

012502028.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502028.td-b3lyp_6-31+g(d).gjf (generated)

012502028.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502028.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502028.mol 012502028.PUBCHEM 012502028.mol (via Jmol)
012502029.b3lyp_6-31g(d).inp

012502029.b3lyp_6-31g(d).qchem.inp (generated)

012502029.b3lyp_6-31g(d).gjf (generated)

012502029.b3lyp_6-31g(d).firefly.inp (generated)

012502029.b3lyp_6-31g(d).smash.inp (generated)

012502029.b3lyp_6-31g(d).nwchem.inp (generated) 012502029.b3lyp_6-31g(d).log.xz 012502029.td-b3lyp_6-31g+(d).inp 012502029.td-b3lyp_6-31g+(d).log.xz

012502029.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502029.td-b3lyp_6-31+g(d).gjf (generated)

012502029.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502029.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502029.mol 012502029.PUBCHEM 012502029.mol (via Jmol)
012502031.b3lyp_6-31g(d).inp

012502031.b3lyp_6-31g(d).qchem.inp (generated)

012502031.b3lyp_6-31g(d).gjf (generated)

012502031.b3lyp_6-31g(d).firefly.inp (generated)

012502031.b3lyp_6-31g(d).smash.inp (generated)

012502031.b3lyp_6-31g(d).nwchem.inp (generated) 012502031.b3lyp_6-31g(d).log.xz 012502031.td-b3lyp_6-31g+(d).inp 012502031.td-b3lyp_6-31g+(d).log.xz

012502031.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502031.td-b3lyp_6-31+g(d).gjf (generated)

012502031.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502031.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502031.mol 012502031.PUBCHEM 012502031.mol (via Jmol)
012502034.b3lyp_6-31g(d).inp

012502034.b3lyp_6-31g(d).qchem.inp (generated)

012502034.b3lyp_6-31g(d).gjf (generated)

012502034.b3lyp_6-31g(d).firefly.inp (generated)

012502034.b3lyp_6-31g(d).smash.inp (generated)

012502034.b3lyp_6-31g(d).nwchem.inp (generated) 012502034.b3lyp_6-31g(d).log.xz 012502034.td-b3lyp_6-31g+(d).inp 012502034.td-b3lyp_6-31g+(d).log.xz

012502034.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502034.td-b3lyp_6-31+g(d).gjf (generated)

012502034.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502034.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502034.mol 012502034.PUBCHEM 012502034.mol (via Jmol)
012502035.b3lyp_6-31g(d).inp

012502035.b3lyp_6-31g(d).qchem.inp (generated)

012502035.b3lyp_6-31g(d).gjf (generated)

012502035.b3lyp_6-31g(d).firefly.inp (generated)

012502035.b3lyp_6-31g(d).smash.inp (generated)

012502035.b3lyp_6-31g(d).nwchem.inp (generated) 012502035.b3lyp_6-31g(d).log.xz 012502035.td-b3lyp_6-31g+(d).inp 012502035.td-b3lyp_6-31g+(d).log.xz

012502035.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502035.td-b3lyp_6-31+g(d).gjf (generated)

012502035.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502035.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502035.mol 012502035.PUBCHEM 012502035.mol (via Jmol)
012502036.b3lyp_6-31g(d).inp

012502036.b3lyp_6-31g(d).qchem.inp (generated)

012502036.b3lyp_6-31g(d).gjf (generated)

012502036.b3lyp_6-31g(d).firefly.inp (generated)

012502036.b3lyp_6-31g(d).smash.inp (generated)

012502036.b3lyp_6-31g(d).nwchem.inp (generated) 012502036.b3lyp_6-31g(d).log.xz 012502036.td-b3lyp_6-31g+(d).inp 012502036.td-b3lyp_6-31g+(d).log.xz

012502036.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502036.td-b3lyp_6-31+g(d).gjf (generated)

012502036.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502036.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502036.mol 012502036.PUBCHEM 012502036.mol (via Jmol)
012502037.b3lyp_6-31g(d).inp

012502037.b3lyp_6-31g(d).qchem.inp (generated)

012502037.b3lyp_6-31g(d).gjf (generated)

012502037.b3lyp_6-31g(d).firefly.inp (generated)

012502037.b3lyp_6-31g(d).smash.inp (generated)

012502037.b3lyp_6-31g(d).nwchem.inp (generated) 012502037.b3lyp_6-31g(d).log.xz 012502037.td-b3lyp_6-31g+(d).inp 012502037.td-b3lyp_6-31g+(d).log.xz

012502037.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502037.td-b3lyp_6-31+g(d).gjf (generated)

012502037.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502037.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502037.mol 012502037.PUBCHEM 012502037.mol (via Jmol)
012502038.b3lyp_6-31g(d).inp

012502038.b3lyp_6-31g(d).qchem.inp (generated)

012502038.b3lyp_6-31g(d).gjf (generated)

012502038.b3lyp_6-31g(d).firefly.inp (generated)

012502038.b3lyp_6-31g(d).smash.inp (generated)

012502038.b3lyp_6-31g(d).nwchem.inp (generated) 012502038.b3lyp_6-31g(d).log.xz 012502038.td-b3lyp_6-31g+(d).inp 012502038.td-b3lyp_6-31g+(d).log.xz

012502038.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502038.td-b3lyp_6-31+g(d).gjf (generated)

012502038.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502038.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502038.mol 012502038.PUBCHEM 012502038.mol (via Jmol)
012502067.b3lyp_6-31g(d).inp

012502067.b3lyp_6-31g(d).qchem.inp (generated)

012502067.b3lyp_6-31g(d).gjf (generated)

012502067.b3lyp_6-31g(d).firefly.inp (generated)

012502067.b3lyp_6-31g(d).smash.inp (generated)

012502067.b3lyp_6-31g(d).nwchem.inp (generated) 012502067.b3lyp_6-31g(d).log.xz 012502067.td-b3lyp_6-31g+(d).inp 012502067.td-b3lyp_6-31g+(d).log.xz

012502067.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502067.td-b3lyp_6-31+g(d).gjf (generated)

012502067.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502067.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502067.mol 012502067.PUBCHEM 012502067.mol (via Jmol)
012502080.b3lyp_6-31g(d).inp

012502080.b3lyp_6-31g(d).qchem.inp (generated)

012502080.b3lyp_6-31g(d).gjf (generated)

012502080.b3lyp_6-31g(d).firefly.inp (generated)

012502080.b3lyp_6-31g(d).smash.inp (generated)

012502080.b3lyp_6-31g(d).nwchem.inp (generated) 012502080.b3lyp_6-31g(d).log.xz 012502080.td-b3lyp_6-31g+(d).inp 012502080.td-b3lyp_6-31g+(d).log.xz

012502080.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502080.td-b3lyp_6-31+g(d).gjf (generated)

012502080.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502080.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502080.mol 012502080.PUBCHEM 012502080.mol (via Jmol)
012502115.b3lyp_6-31g(d).inp

012502115.b3lyp_6-31g(d).qchem.inp (generated)

012502115.b3lyp_6-31g(d).gjf (generated)

012502115.b3lyp_6-31g(d).firefly.inp (generated)

012502115.b3lyp_6-31g(d).smash.inp (generated)

012502115.b3lyp_6-31g(d).nwchem.inp (generated) 012502115.b3lyp_6-31g(d).log.xz 012502115.td-b3lyp_6-31g+(d).inp 012502115.td-b3lyp_6-31g+(d).log.xz

012502115.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502115.td-b3lyp_6-31+g(d).gjf (generated)

012502115.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502115.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502115.mol 012502115.PUBCHEM 012502115.mol (via Jmol)
012502119.b3lyp_6-31g(d).inp

012502119.b3lyp_6-31g(d).qchem.inp (generated)

012502119.b3lyp_6-31g(d).gjf (generated)

012502119.b3lyp_6-31g(d).firefly.inp (generated)

012502119.b3lyp_6-31g(d).smash.inp (generated)

012502119.b3lyp_6-31g(d).nwchem.inp (generated) 012502119.b3lyp_6-31g(d).log.xz 012502119.mol 012502119.PUBCHEM 012502119.mol (via Jmol)
012502123.b3lyp_6-31g(d).inp

012502123.b3lyp_6-31g(d).qchem.inp (generated)

012502123.b3lyp_6-31g(d).gjf (generated)

012502123.b3lyp_6-31g(d).firefly.inp (generated)

012502123.b3lyp_6-31g(d).smash.inp (generated)

012502123.b3lyp_6-31g(d).nwchem.inp (generated) 012502123.b3lyp_6-31g(d).log.xz 012502123.td-b3lyp_6-31g+(d).inp 012502123.td-b3lyp_6-31g+(d).log.xz

012502123.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502123.td-b3lyp_6-31+g(d).gjf (generated)

012502123.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502123.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502123.mol 012502123.PUBCHEM 012502123.mol (via Jmol)
012502126.b3lyp_6-31g(d).inp

012502126.b3lyp_6-31g(d).qchem.inp (generated)

012502126.b3lyp_6-31g(d).gjf (generated)

012502126.b3lyp_6-31g(d).firefly.inp (generated)

012502126.b3lyp_6-31g(d).smash.inp (generated)

012502126.b3lyp_6-31g(d).nwchem.inp (generated) 012502126.b3lyp_6-31g(d).log.xz 012502126.td-b3lyp_6-31g+(d).inp 012502126.td-b3lyp_6-31g+(d).log.xz

012502126.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502126.td-b3lyp_6-31+g(d).gjf (generated)

012502126.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502126.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502126.mol 012502126.PUBCHEM 012502126.mol (via Jmol)
012502128.b3lyp_6-31g(d).inp

012502128.b3lyp_6-31g(d).qchem.inp (generated)

012502128.b3lyp_6-31g(d).gjf (generated)

012502128.b3lyp_6-31g(d).firefly.inp (generated)

012502128.b3lyp_6-31g(d).smash.inp (generated)

012502128.b3lyp_6-31g(d).nwchem.inp (generated) 012502128.b3lyp_6-31g(d).log.xz 012502128.td-b3lyp_6-31g+(d).inp 012502128.td-b3lyp_6-31g+(d).log.xz

012502128.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502128.td-b3lyp_6-31+g(d).gjf (generated)

012502128.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502128.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502128.mol 012502128.PUBCHEM 012502128.mol (via Jmol)
012502132.b3lyp_6-31g(d).inp

012502132.b3lyp_6-31g(d).qchem.inp (generated)

012502132.b3lyp_6-31g(d).gjf (generated)

012502132.b3lyp_6-31g(d).firefly.inp (generated)

012502132.b3lyp_6-31g(d).smash.inp (generated)

012502132.b3lyp_6-31g(d).nwchem.inp (generated) 012502132.b3lyp_6-31g(d).log.xz 012502132.td-b3lyp_6-31g+(d).inp 012502132.td-b3lyp_6-31g+(d).log.xz

012502132.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502132.td-b3lyp_6-31+g(d).gjf (generated)

012502132.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502132.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502132.mol 012502132.PUBCHEM 012502132.mol (via Jmol)
012502133.b3lyp_6-31g(d).inp

012502133.b3lyp_6-31g(d).qchem.inp (generated)

012502133.b3lyp_6-31g(d).gjf (generated)

012502133.b3lyp_6-31g(d).firefly.inp (generated)

012502133.b3lyp_6-31g(d).smash.inp (generated)

012502133.b3lyp_6-31g(d).nwchem.inp (generated) 012502133.b3lyp_6-31g(d).log.xz 012502133.td-b3lyp_6-31g+(d).inp 012502133.td-b3lyp_6-31g+(d).log.xz

012502133.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502133.td-b3lyp_6-31+g(d).gjf (generated)

012502133.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502133.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502133.mol 012502133.PUBCHEM 012502133.mol (via Jmol)
012502134.b3lyp_6-31g(d).inp

012502134.b3lyp_6-31g(d).qchem.inp (generated)

012502134.b3lyp_6-31g(d).gjf (generated)

012502134.b3lyp_6-31g(d).firefly.inp (generated)

012502134.b3lyp_6-31g(d).smash.inp (generated)

012502134.b3lyp_6-31g(d).nwchem.inp (generated) 012502134.b3lyp_6-31g(d).log.xz 012502134.mol 012502134.PUBCHEM 012502134.mol (via Jmol)
012502143.b3lyp_6-31g(d).inp

012502143.b3lyp_6-31g(d).qchem.inp (generated)

012502143.b3lyp_6-31g(d).gjf (generated)

012502143.b3lyp_6-31g(d).firefly.inp (generated)

012502143.b3lyp_6-31g(d).smash.inp (generated)

012502143.b3lyp_6-31g(d).nwchem.inp (generated) 012502143.b3lyp_6-31g(d).log.xz 012502143.td-b3lyp_6-31g+(d).inp 012502143.td-b3lyp_6-31g+(d).log.xz

012502143.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502143.td-b3lyp_6-31+g(d).gjf (generated)

012502143.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502143.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502143.mol 012502143.PUBCHEM 012502143.mol (via Jmol)
012502176.b3lyp_6-31g(d).inp

012502176.b3lyp_6-31g(d).qchem.inp (generated)

012502176.b3lyp_6-31g(d).gjf (generated)

012502176.b3lyp_6-31g(d).firefly.inp (generated)

012502176.b3lyp_6-31g(d).smash.inp (generated)

012502176.b3lyp_6-31g(d).nwchem.inp (generated) 012502176.b3lyp_6-31g(d).log.xz 012502176.td-b3lyp_6-31g+(d).inp 012502176.td-b3lyp_6-31g+(d).log.xz

012502176.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502176.td-b3lyp_6-31+g(d).gjf (generated)

012502176.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502176.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502176.mol 012502176.PUBCHEM 012502176.mol (via Jmol)
012502198.b3lyp_6-31g(d).inp

012502198.b3lyp_6-31g(d).qchem.inp (generated)

012502198.b3lyp_6-31g(d).gjf (generated)

012502198.b3lyp_6-31g(d).firefly.inp (generated)

012502198.b3lyp_6-31g(d).smash.inp (generated)

012502198.b3lyp_6-31g(d).nwchem.inp (generated) 012502198.b3lyp_6-31g(d).log.xz 012502198.td-b3lyp_6-31g+(d).inp 012502198.td-b3lyp_6-31g+(d).log.xz

012502198.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502198.td-b3lyp_6-31+g(d).gjf (generated)

012502198.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502198.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502198.mol 012502198.PUBCHEM 012502198.mol (via Jmol)
012502200.b3lyp_6-31g(d).inp

012502200.b3lyp_6-31g(d).qchem.inp (generated)

012502200.b3lyp_6-31g(d).gjf (generated)

012502200.b3lyp_6-31g(d).firefly.inp (generated)

012502200.b3lyp_6-31g(d).smash.inp (generated)

012502200.b3lyp_6-31g(d).nwchem.inp (generated) 012502200.b3lyp_6-31g(d).log.xz 012502200.td-b3lyp_6-31g+(d).inp 012502200.td-b3lyp_6-31g+(d).log.xz

012502200.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502200.td-b3lyp_6-31+g(d).gjf (generated)

012502200.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502200.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502200.mol 012502200.PUBCHEM 012502200.mol (via Jmol)
012502235.b3lyp_6-31g(d).inp

012502235.b3lyp_6-31g(d).qchem.inp (generated)

012502235.b3lyp_6-31g(d).gjf (generated)

012502235.b3lyp_6-31g(d).firefly.inp (generated)

012502235.b3lyp_6-31g(d).smash.inp (generated)

012502235.b3lyp_6-31g(d).nwchem.inp (generated) 012502235.b3lyp_6-31g(d).log.xz 012502235.td-b3lyp_6-31g+(d).inp 012502235.td-b3lyp_6-31g+(d).log.xz

012502235.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502235.td-b3lyp_6-31+g(d).gjf (generated)

012502235.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502235.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502235.mol 012502235.PUBCHEM 012502235.mol (via Jmol)
012502236.b3lyp_6-31g(d).inp

012502236.b3lyp_6-31g(d).qchem.inp (generated)

012502236.b3lyp_6-31g(d).gjf (generated)

012502236.b3lyp_6-31g(d).firefly.inp (generated)

012502236.b3lyp_6-31g(d).smash.inp (generated)

012502236.b3lyp_6-31g(d).nwchem.inp (generated) 012502236.b3lyp_6-31g(d).log.xz 012502236.td-b3lyp_6-31g+(d).inp 012502236.td-b3lyp_6-31g+(d).log.xz

012502236.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502236.td-b3lyp_6-31+g(d).gjf (generated)

012502236.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502236.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502236.mol 012502236.PUBCHEM 012502236.mol (via Jmol)
012502237.b3lyp_6-31g(d).inp

012502237.b3lyp_6-31g(d).qchem.inp (generated)

012502237.b3lyp_6-31g(d).gjf (generated)

012502237.b3lyp_6-31g(d).firefly.inp (generated)

012502237.b3lyp_6-31g(d).smash.inp (generated)

012502237.b3lyp_6-31g(d).nwchem.inp (generated) 012502237.b3lyp_6-31g(d).log.xz 012502237.td-b3lyp_6-31g+(d).inp 012502237.td-b3lyp_6-31g+(d).log.xz

012502237.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502237.td-b3lyp_6-31+g(d).gjf (generated)

012502237.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502237.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502237.mol 012502237.PUBCHEM 012502237.mol (via Jmol)
012502238.b3lyp_6-31g(d).inp

012502238.b3lyp_6-31g(d).qchem.inp (generated)

012502238.b3lyp_6-31g(d).gjf (generated)

012502238.b3lyp_6-31g(d).firefly.inp (generated)

012502238.b3lyp_6-31g(d).smash.inp (generated)

012502238.b3lyp_6-31g(d).nwchem.inp (generated) 012502238.b3lyp_6-31g(d).log.xz 012502238.td-b3lyp_6-31g+(d).inp 012502238.td-b3lyp_6-31g+(d).log.xz

012502238.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502238.td-b3lyp_6-31+g(d).gjf (generated)

012502238.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502238.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502238.mol 012502238.PUBCHEM 012502238.mol (via Jmol)
012502239.b3lyp_6-31g(d).inp

012502239.b3lyp_6-31g(d).qchem.inp (generated)

012502239.b3lyp_6-31g(d).gjf (generated)

012502239.b3lyp_6-31g(d).firefly.inp (generated)

012502239.b3lyp_6-31g(d).smash.inp (generated)

012502239.b3lyp_6-31g(d).nwchem.inp (generated) 012502239.b3lyp_6-31g(d).log.xz 012502239.td-b3lyp_6-31g+(d).inp 012502239.td-b3lyp_6-31g+(d).log.xz

012502239.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502239.td-b3lyp_6-31+g(d).gjf (generated)

012502239.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502239.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502239.mol 012502239.PUBCHEM 012502239.mol (via Jmol)
012502302.b3lyp_6-31g(d).inp

012502302.b3lyp_6-31g(d).qchem.inp (generated)

012502302.b3lyp_6-31g(d).gjf (generated)

012502302.b3lyp_6-31g(d).firefly.inp (generated)

012502302.b3lyp_6-31g(d).smash.inp (generated)

012502302.b3lyp_6-31g(d).nwchem.inp (generated) 012502302.b3lyp_6-31g(d).log.xz 012502302.td-b3lyp_6-31g+(d).inp 012502302.td-b3lyp_6-31g+(d).log.xz

012502302.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502302.td-b3lyp_6-31+g(d).gjf (generated)

012502302.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502302.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502302.mol 012502302.PUBCHEM 012502302.mol (via Jmol)
012502349.b3lyp_6-31g(d).inp

012502349.b3lyp_6-31g(d).qchem.inp (generated)

012502349.b3lyp_6-31g(d).gjf (generated)

012502349.b3lyp_6-31g(d).firefly.inp (generated)

012502349.b3lyp_6-31g(d).smash.inp (generated)

012502349.b3lyp_6-31g(d).nwchem.inp (generated) 012502349.b3lyp_6-31g(d).log.xz 012502349.td-b3lyp_6-31g+(d).inp 012502349.td-b3lyp_6-31g+(d).log.xz

012502349.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502349.td-b3lyp_6-31+g(d).gjf (generated)

012502349.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502349.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502349.mol 012502349.PUBCHEM 012502349.mol (via Jmol)
012502375.b3lyp_6-31g(d).inp

012502375.b3lyp_6-31g(d).qchem.inp (generated)

012502375.b3lyp_6-31g(d).gjf (generated)

012502375.b3lyp_6-31g(d).firefly.inp (generated)

012502375.b3lyp_6-31g(d).smash.inp (generated)

012502375.b3lyp_6-31g(d).nwchem.inp (generated) 012502375.b3lyp_6-31g(d).log.xz 012502375.td-b3lyp_6-31g+(d).inp 012502375.td-b3lyp_6-31g+(d).log.xz

012502375.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502375.td-b3lyp_6-31+g(d).gjf (generated)

012502375.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502375.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502375.mol 012502375.PUBCHEM 012502375.mol (via Jmol)
012502455.b3lyp_6-31g(d).inp

012502455.b3lyp_6-31g(d).qchem.inp (generated)

012502455.b3lyp_6-31g(d).gjf (generated)

012502455.b3lyp_6-31g(d).firefly.inp (generated)

012502455.b3lyp_6-31g(d).smash.inp (generated)

012502455.b3lyp_6-31g(d).nwchem.inp (generated) 012502455.b3lyp_6-31g(d).log.xz 012502455.td-b3lyp_6-31g+(d).inp 012502455.td-b3lyp_6-31g+(d).log.xz

012502455.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502455.td-b3lyp_6-31+g(d).gjf (generated)

012502455.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502455.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502455.mol 012502455.PUBCHEM 012502455.mol (via Jmol)
012502465.b3lyp_6-31g(d).inp

012502465.b3lyp_6-31g(d).qchem.inp (generated)

012502465.b3lyp_6-31g(d).gjf (generated)

012502465.b3lyp_6-31g(d).firefly.inp (generated)

012502465.b3lyp_6-31g(d).smash.inp (generated)

012502465.b3lyp_6-31g(d).nwchem.inp (generated) 012502465.b3lyp_6-31g(d).log.xz 012502465.td-b3lyp_6-31g+(d).inp 012502465.td-b3lyp_6-31g+(d).log.xz

012502465.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502465.td-b3lyp_6-31+g(d).gjf (generated)

012502465.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502465.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502465.mol 012502465.PUBCHEM 012502465.mol (via Jmol)
012502466.b3lyp_6-31g(d).inp

012502466.b3lyp_6-31g(d).qchem.inp (generated)

012502466.b3lyp_6-31g(d).gjf (generated)

012502466.b3lyp_6-31g(d).firefly.inp (generated)

012502466.b3lyp_6-31g(d).smash.inp (generated)

012502466.b3lyp_6-31g(d).nwchem.inp (generated) 012502466.b3lyp_6-31g(d).log.xz 012502466.td-b3lyp_6-31g+(d).inp 012502466.td-b3lyp_6-31g+(d).log.xz

012502466.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502466.td-b3lyp_6-31+g(d).gjf (generated)

012502466.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502466.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502466.mol 012502466.PUBCHEM 012502466.mol (via Jmol)
012502474.b3lyp_6-31g(d).inp

012502474.b3lyp_6-31g(d).qchem.inp (generated)

012502474.b3lyp_6-31g(d).gjf (generated)

012502474.b3lyp_6-31g(d).firefly.inp (generated)

012502474.b3lyp_6-31g(d).smash.inp (generated)

012502474.b3lyp_6-31g(d).nwchem.inp (generated) 012502474.b3lyp_6-31g(d).log.xz 012502474.td-b3lyp_6-31g+(d).inp 012502474.td-b3lyp_6-31g+(d).log.xz

012502474.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502474.td-b3lyp_6-31+g(d).gjf (generated)

012502474.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502474.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502474.mol 012502474.PUBCHEM 012502474.mol (via Jmol)
012502481.b3lyp_6-31g(d).inp

012502481.b3lyp_6-31g(d).qchem.inp (generated)

012502481.b3lyp_6-31g(d).gjf (generated)

012502481.b3lyp_6-31g(d).firefly.inp (generated)

012502481.b3lyp_6-31g(d).smash.inp (generated)

012502481.b3lyp_6-31g(d).nwchem.inp (generated) 012502481.b3lyp_6-31g(d).log.xz 012502481.td-b3lyp_6-31g+(d).inp 012502481.td-b3lyp_6-31g+(d).log.xz

012502481.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502481.td-b3lyp_6-31+g(d).gjf (generated)

012502481.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502481.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502481.mol 012502481.PUBCHEM 012502481.mol (via Jmol)
012502502.b3lyp_6-31g(d).inp

012502502.b3lyp_6-31g(d).qchem.inp (generated)

012502502.b3lyp_6-31g(d).gjf (generated)

012502502.b3lyp_6-31g(d).firefly.inp (generated)

012502502.b3lyp_6-31g(d).smash.inp (generated)

012502502.b3lyp_6-31g(d).nwchem.inp (generated) 012502502.b3lyp_6-31g(d).log.xz 012502502.td-b3lyp_6-31g+(d).inp 012502502.td-b3lyp_6-31g+(d).log.xz

012502502.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502502.td-b3lyp_6-31+g(d).gjf (generated)

012502502.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502502.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502502.mol 012502502.PUBCHEM 012502502.mol (via Jmol)
012502503.b3lyp_6-31g(d).inp

012502503.b3lyp_6-31g(d).qchem.inp (generated)

012502503.b3lyp_6-31g(d).gjf (generated)

012502503.b3lyp_6-31g(d).firefly.inp (generated)

012502503.b3lyp_6-31g(d).smash.inp (generated)

012502503.b3lyp_6-31g(d).nwchem.inp (generated) 012502503.b3lyp_6-31g(d).log.xz 012502503.td-b3lyp_6-31g+(d).inp 012502503.td-b3lyp_6-31g+(d).log.xz

012502503.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502503.td-b3lyp_6-31+g(d).gjf (generated)

012502503.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502503.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502503.mol 012502503.PUBCHEM 012502503.mol (via Jmol)
012502507.b3lyp_6-31g(d).inp

012502507.b3lyp_6-31g(d).qchem.inp (generated)

012502507.b3lyp_6-31g(d).gjf (generated)

012502507.b3lyp_6-31g(d).firefly.inp (generated)

012502507.b3lyp_6-31g(d).smash.inp (generated)

012502507.b3lyp_6-31g(d).nwchem.inp (generated) 012502507.b3lyp_6-31g(d).log.xz 012502507.td-b3lyp_6-31g+(d).inp 012502507.td-b3lyp_6-31g+(d).log.xz

012502507.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502507.td-b3lyp_6-31+g(d).gjf (generated)

012502507.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502507.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502507.mol 012502507.PUBCHEM 012502507.mol (via Jmol)
012502512.b3lyp_6-31g(d).inp

012502512.b3lyp_6-31g(d).qchem.inp (generated)

012502512.b3lyp_6-31g(d).gjf (generated)

012502512.b3lyp_6-31g(d).firefly.inp (generated)

012502512.b3lyp_6-31g(d).smash.inp (generated)

012502512.b3lyp_6-31g(d).nwchem.inp (generated) 012502512.b3lyp_6-31g(d).log.xz 012502512.td-b3lyp_6-31g+(d).inp 012502512.td-b3lyp_6-31g+(d).log.xz

012502512.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502512.td-b3lyp_6-31+g(d).gjf (generated)

012502512.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502512.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502512.mol 012502512.PUBCHEM 012502512.mol (via Jmol)
012502525.b3lyp_6-31g(d).inp

012502525.b3lyp_6-31g(d).qchem.inp (generated)

012502525.b3lyp_6-31g(d).gjf (generated)

012502525.b3lyp_6-31g(d).firefly.inp (generated)

012502525.b3lyp_6-31g(d).smash.inp (generated)

012502525.b3lyp_6-31g(d).nwchem.inp (generated) 012502525.b3lyp_6-31g(d).log.xz 012502525.td-b3lyp_6-31g+(d).inp 012502525.td-b3lyp_6-31g+(d).log.xz

012502525.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502525.td-b3lyp_6-31+g(d).gjf (generated)

012502525.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502525.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502525.mol 012502525.PUBCHEM 012502525.mol (via Jmol)
012502570.b3lyp_6-31g(d).inp

012502570.b3lyp_6-31g(d).qchem.inp (generated)

012502570.b3lyp_6-31g(d).gjf (generated)

012502570.b3lyp_6-31g(d).firefly.inp (generated)

012502570.b3lyp_6-31g(d).smash.inp (generated)

012502570.b3lyp_6-31g(d).nwchem.inp (generated) 012502570.b3lyp_6-31g(d).log.xz 012502570.td-b3lyp_6-31g+(d).inp 012502570.td-b3lyp_6-31g+(d).log.xz

012502570.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502570.td-b3lyp_6-31+g(d).gjf (generated)

012502570.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502570.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502570.mol 012502570.PUBCHEM 012502570.mol (via Jmol)
012502572.b3lyp_6-31g(d).inp

012502572.b3lyp_6-31g(d).qchem.inp (generated)

012502572.b3lyp_6-31g(d).gjf (generated)

012502572.b3lyp_6-31g(d).firefly.inp (generated)

012502572.b3lyp_6-31g(d).smash.inp (generated)

012502572.b3lyp_6-31g(d).nwchem.inp (generated) 012502572.b3lyp_6-31g(d).log.xz 012502572.td-b3lyp_6-31g+(d).inp 012502572.td-b3lyp_6-31g+(d).log.xz

012502572.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502572.td-b3lyp_6-31+g(d).gjf (generated)

012502572.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502572.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502572.mol 012502572.PUBCHEM 012502572.mol (via Jmol)
012502605.b3lyp_6-31g(d).inp

012502605.b3lyp_6-31g(d).qchem.inp (generated)

012502605.b3lyp_6-31g(d).gjf (generated)

012502605.b3lyp_6-31g(d).firefly.inp (generated)

012502605.b3lyp_6-31g(d).smash.inp (generated)

012502605.b3lyp_6-31g(d).nwchem.inp (generated) 012502605.b3lyp_6-31g(d).log.xz 012502605.mol 012502605.PUBCHEM 012502605.mol (via Jmol)
012502612.b3lyp_6-31g(d).inp

012502612.b3lyp_6-31g(d).qchem.inp (generated)

012502612.b3lyp_6-31g(d).gjf (generated)

012502612.b3lyp_6-31g(d).firefly.inp (generated)

012502612.b3lyp_6-31g(d).smash.inp (generated)

012502612.b3lyp_6-31g(d).nwchem.inp (generated) 012502612.b3lyp_6-31g(d).log.xz 012502612.td-b3lyp_6-31g+(d).inp 012502612.td-b3lyp_6-31g+(d).log.xz

012502612.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502612.td-b3lyp_6-31+g(d).gjf (generated)

012502612.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502612.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502612.mol 012502612.PUBCHEM 012502612.mol (via Jmol)
012502613.b3lyp_6-31g(d).inp

012502613.b3lyp_6-31g(d).qchem.inp (generated)

012502613.b3lyp_6-31g(d).gjf (generated)

012502613.b3lyp_6-31g(d).firefly.inp (generated)

012502613.b3lyp_6-31g(d).smash.inp (generated)

012502613.b3lyp_6-31g(d).nwchem.inp (generated) 012502613.b3lyp_6-31g(d).log.xz 012502613.td-b3lyp_6-31g+(d).inp 012502613.td-b3lyp_6-31g+(d).log.xz

012502613.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502613.td-b3lyp_6-31+g(d).gjf (generated)

012502613.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502613.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502613.mol 012502613.PUBCHEM 012502613.mol (via Jmol)
012502614.b3lyp_6-31g(d).inp

012502614.b3lyp_6-31g(d).qchem.inp (generated)

012502614.b3lyp_6-31g(d).gjf (generated)

012502614.b3lyp_6-31g(d).firefly.inp (generated)

012502614.b3lyp_6-31g(d).smash.inp (generated)

012502614.b3lyp_6-31g(d).nwchem.inp (generated) 012502614.b3lyp_6-31g(d).log.xz 012502614.td-b3lyp_6-31g+(d).inp 012502614.td-b3lyp_6-31g+(d).log.xz

012502614.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502614.td-b3lyp_6-31+g(d).gjf (generated)

012502614.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502614.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502614.mol 012502614.PUBCHEM 012502614.mol (via Jmol)
012502644.b3lyp_6-31g(d).inp

012502644.b3lyp_6-31g(d).qchem.inp (generated)

012502644.b3lyp_6-31g(d).gjf (generated)

012502644.b3lyp_6-31g(d).firefly.inp (generated)

012502644.b3lyp_6-31g(d).smash.inp (generated)

012502644.b3lyp_6-31g(d).nwchem.inp (generated) 012502644.b3lyp_6-31g(d).log.xz 012502644.td-b3lyp_6-31g+(d).inp 012502644.td-b3lyp_6-31g+(d).log.xz

012502644.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502644.td-b3lyp_6-31+g(d).gjf (generated)

012502644.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502644.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502644.mol 012502644.PUBCHEM 012502644.mol (via Jmol)
012502665.b3lyp_6-31g(d).inp

012502665.b3lyp_6-31g(d).qchem.inp (generated)

012502665.b3lyp_6-31g(d).gjf (generated)

012502665.b3lyp_6-31g(d).firefly.inp (generated)

012502665.b3lyp_6-31g(d).smash.inp (generated)

012502665.b3lyp_6-31g(d).nwchem.inp (generated) 012502665.b3lyp_6-31g(d).log.xz 012502665.td-b3lyp_6-31g+(d).inp 012502665.td-b3lyp_6-31g+(d).log.xz

012502665.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502665.td-b3lyp_6-31+g(d).gjf (generated)

012502665.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502665.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502665.mol 012502665.PUBCHEM 012502665.mol (via Jmol)
012502672.b3lyp_6-31g(d).inp

012502672.b3lyp_6-31g(d).qchem.inp (generated)

012502672.b3lyp_6-31g(d).gjf (generated)

012502672.b3lyp_6-31g(d).firefly.inp (generated)

012502672.b3lyp_6-31g(d).smash.inp (generated)

012502672.b3lyp_6-31g(d).nwchem.inp (generated) 012502672.b3lyp_6-31g(d).log.xz 012502672.td-b3lyp_6-31g+(d).inp 012502672.td-b3lyp_6-31g+(d).log.xz

012502672.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502672.td-b3lyp_6-31+g(d).gjf (generated)

012502672.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502672.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502672.mol 012502672.PUBCHEM 012502672.mol (via Jmol)
012502681.b3lyp_6-31g(d).inp

012502681.b3lyp_6-31g(d).qchem.inp (generated)

012502681.b3lyp_6-31g(d).gjf (generated)

012502681.b3lyp_6-31g(d).firefly.inp (generated)

012502681.b3lyp_6-31g(d).smash.inp (generated)

012502681.b3lyp_6-31g(d).nwchem.inp (generated) 012502681.b3lyp_6-31g(d).log.xz 012502681.td-b3lyp_6-31g+(d).inp 012502681.td-b3lyp_6-31g+(d).log.xz

012502681.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502681.td-b3lyp_6-31+g(d).gjf (generated)

012502681.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502681.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502681.mol 012502681.PUBCHEM 012502681.mol (via Jmol)
012502682.b3lyp_6-31g(d).inp

012502682.b3lyp_6-31g(d).qchem.inp (generated)

012502682.b3lyp_6-31g(d).gjf (generated)

012502682.b3lyp_6-31g(d).firefly.inp (generated)

012502682.b3lyp_6-31g(d).smash.inp (generated)

012502682.b3lyp_6-31g(d).nwchem.inp (generated) 012502682.b3lyp_6-31g(d).log.xz 012502682.td-b3lyp_6-31g+(d).inp 012502682.td-b3lyp_6-31g+(d).log.xz

012502682.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502682.td-b3lyp_6-31+g(d).gjf (generated)

012502682.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502682.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502682.mol 012502682.PUBCHEM 012502682.mol (via Jmol)
012502687.b3lyp_6-31g(d).inp

012502687.b3lyp_6-31g(d).qchem.inp (generated)

012502687.b3lyp_6-31g(d).gjf (generated)

012502687.b3lyp_6-31g(d).firefly.inp (generated)

012502687.b3lyp_6-31g(d).smash.inp (generated)

012502687.b3lyp_6-31g(d).nwchem.inp (generated) 012502687.b3lyp_6-31g(d).log.xz 012502687.td-b3lyp_6-31g+(d).inp 012502687.td-b3lyp_6-31g+(d).log.xz

012502687.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502687.td-b3lyp_6-31+g(d).gjf (generated)

012502687.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502687.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502687.mol 012502687.PUBCHEM 012502687.mol (via Jmol)
012502702.b3lyp_6-31g(d).inp

012502702.b3lyp_6-31g(d).qchem.inp (generated)

012502702.b3lyp_6-31g(d).gjf (generated)

012502702.b3lyp_6-31g(d).firefly.inp (generated)

012502702.b3lyp_6-31g(d).smash.inp (generated)

012502702.b3lyp_6-31g(d).nwchem.inp (generated) 012502702.b3lyp_6-31g(d).log.xz 012502702.td-b3lyp_6-31g+(d).inp 012502702.td-b3lyp_6-31g+(d).log.xz

012502702.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502702.td-b3lyp_6-31+g(d).gjf (generated)

012502702.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502702.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502702.mol 012502702.PUBCHEM 012502702.mol (via Jmol)
012502704.b3lyp_6-31g(d).inp

012502704.b3lyp_6-31g(d).qchem.inp (generated)

012502704.b3lyp_6-31g(d).gjf (generated)

012502704.b3lyp_6-31g(d).firefly.inp (generated)

012502704.b3lyp_6-31g(d).smash.inp (generated)

012502704.b3lyp_6-31g(d).nwchem.inp (generated) 012502704.b3lyp_6-31g(d).log.xz 012502704.td-b3lyp_6-31g+(d).inp 012502704.td-b3lyp_6-31g+(d).log.xz

012502704.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502704.td-b3lyp_6-31+g(d).gjf (generated)

012502704.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502704.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502704.mol 012502704.PUBCHEM 012502704.mol (via Jmol)
012502734.b3lyp_6-31g(d).inp

012502734.b3lyp_6-31g(d).qchem.inp (generated)

012502734.b3lyp_6-31g(d).gjf (generated)

012502734.b3lyp_6-31g(d).firefly.inp (generated)

012502734.b3lyp_6-31g(d).smash.inp (generated)

012502734.b3lyp_6-31g(d).nwchem.inp (generated) 012502734.b3lyp_6-31g(d).log.xz 012502734.td-b3lyp_6-31g+(d).inp 012502734.td-b3lyp_6-31g+(d).log.xz

012502734.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502734.td-b3lyp_6-31+g(d).gjf (generated)

012502734.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502734.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502734.mol 012502734.PUBCHEM 012502734.mol (via Jmol)
012502741.b3lyp_6-31g(d).inp

012502741.b3lyp_6-31g(d).qchem.inp (generated)

012502741.b3lyp_6-31g(d).gjf (generated)

012502741.b3lyp_6-31g(d).firefly.inp (generated)

012502741.b3lyp_6-31g(d).smash.inp (generated)

012502741.b3lyp_6-31g(d).nwchem.inp (generated) 012502741.b3lyp_6-31g(d).log.xz 012502741.td-b3lyp_6-31g+(d).inp 012502741.td-b3lyp_6-31g+(d).log.xz

012502741.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502741.td-b3lyp_6-31+g(d).gjf (generated)

012502741.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502741.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502741.mol 012502741.PUBCHEM 012502741.mol (via Jmol)
012502742.b3lyp_6-31g(d).inp

012502742.b3lyp_6-31g(d).qchem.inp (generated)

012502742.b3lyp_6-31g(d).gjf (generated)

012502742.b3lyp_6-31g(d).firefly.inp (generated)

012502742.b3lyp_6-31g(d).smash.inp (generated)

012502742.b3lyp_6-31g(d).nwchem.inp (generated) 012502742.b3lyp_6-31g(d).log.xz 012502742.mol 012502742.PUBCHEM 012502742.mol (via Jmol)
012502746.b3lyp_6-31g(d).inp

012502746.b3lyp_6-31g(d).qchem.inp (generated)

012502746.b3lyp_6-31g(d).gjf (generated)

012502746.b3lyp_6-31g(d).firefly.inp (generated)

012502746.b3lyp_6-31g(d).smash.inp (generated)

012502746.b3lyp_6-31g(d).nwchem.inp (generated) 012502746.b3lyp_6-31g(d).log.xz 012502746.td-b3lyp_6-31g+(d).inp 012502746.td-b3lyp_6-31g+(d).log.xz

012502746.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502746.td-b3lyp_6-31+g(d).gjf (generated)

012502746.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502746.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502746.mol 012502746.PUBCHEM 012502746.mol (via Jmol)
012502747.b3lyp_6-31g(d).inp

012502747.b3lyp_6-31g(d).qchem.inp (generated)

012502747.b3lyp_6-31g(d).gjf (generated)

012502747.b3lyp_6-31g(d).firefly.inp (generated)

012502747.b3lyp_6-31g(d).smash.inp (generated)

012502747.b3lyp_6-31g(d).nwchem.inp (generated) 012502747.b3lyp_6-31g(d).log.xz 012502747.td-b3lyp_6-31g+(d).inp 012502747.td-b3lyp_6-31g+(d).log.xz

012502747.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502747.td-b3lyp_6-31+g(d).gjf (generated)

012502747.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502747.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502747.mol 012502747.PUBCHEM 012502747.mol (via Jmol)
012502749.b3lyp_6-31g(d).inp

012502749.b3lyp_6-31g(d).qchem.inp (generated)

012502749.b3lyp_6-31g(d).gjf (generated)

012502749.b3lyp_6-31g(d).firefly.inp (generated)

012502749.b3lyp_6-31g(d).smash.inp (generated)

012502749.b3lyp_6-31g(d).nwchem.inp (generated) 012502749.b3lyp_6-31g(d).log.xz 012502749.td-b3lyp_6-31g+(d).inp 012502749.td-b3lyp_6-31g+(d).log.xz

012502749.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502749.td-b3lyp_6-31+g(d).gjf (generated)

012502749.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502749.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502749.mol 012502749.PUBCHEM 012502749.mol (via Jmol)
012502751.b3lyp_6-31g(d).inp

012502751.b3lyp_6-31g(d).qchem.inp (generated)

012502751.b3lyp_6-31g(d).gjf (generated)

012502751.b3lyp_6-31g(d).firefly.inp (generated)

012502751.b3lyp_6-31g(d).smash.inp (generated)

012502751.b3lyp_6-31g(d).nwchem.inp (generated) 012502751.b3lyp_6-31g(d).log.xz 012502751.td-b3lyp_6-31g+(d).inp 012502751.td-b3lyp_6-31g+(d).log.xz

012502751.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502751.td-b3lyp_6-31+g(d).gjf (generated)

012502751.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502751.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502751.mol 012502751.PUBCHEM 012502751.mol (via Jmol)
012502752.b3lyp_6-31g(d).inp

012502752.b3lyp_6-31g(d).qchem.inp (generated)

012502752.b3lyp_6-31g(d).gjf (generated)

012502752.b3lyp_6-31g(d).firefly.inp (generated)

012502752.b3lyp_6-31g(d).smash.inp (generated)

012502752.b3lyp_6-31g(d).nwchem.inp (generated) 012502752.b3lyp_6-31g(d).log.xz 012502752.td-b3lyp_6-31g+(d).inp 012502752.td-b3lyp_6-31g+(d).log.xz

012502752.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502752.td-b3lyp_6-31+g(d).gjf (generated)

012502752.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502752.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502752.mol 012502752.PUBCHEM 012502752.mol (via Jmol)
012502754.b3lyp_6-31g(d).inp

012502754.b3lyp_6-31g(d).qchem.inp (generated)

012502754.b3lyp_6-31g(d).gjf (generated)

012502754.b3lyp_6-31g(d).firefly.inp (generated)

012502754.b3lyp_6-31g(d).smash.inp (generated)

012502754.b3lyp_6-31g(d).nwchem.inp (generated) 012502754.b3lyp_6-31g(d).log.xz 012502754.td-b3lyp_6-31g+(d).inp 012502754.td-b3lyp_6-31g+(d).log.xz

012502754.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502754.td-b3lyp_6-31+g(d).gjf (generated)

012502754.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502754.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502754.mol 012502754.PUBCHEM 012502754.mol (via Jmol)
012502755.b3lyp_6-31g(d).inp

012502755.b3lyp_6-31g(d).qchem.inp (generated)

012502755.b3lyp_6-31g(d).gjf (generated)

012502755.b3lyp_6-31g(d).firefly.inp (generated)

012502755.b3lyp_6-31g(d).smash.inp (generated)

012502755.b3lyp_6-31g(d).nwchem.inp (generated) 012502755.b3lyp_6-31g(d).log.xz 012502755.td-b3lyp_6-31g+(d).inp 012502755.td-b3lyp_6-31g+(d).log.xz

012502755.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502755.td-b3lyp_6-31+g(d).gjf (generated)

012502755.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502755.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502755.mol 012502755.PUBCHEM 012502755.mol (via Jmol)
012502786.b3lyp_6-31g(d).inp

012502786.b3lyp_6-31g(d).qchem.inp (generated)

012502786.b3lyp_6-31g(d).gjf (generated)

012502786.b3lyp_6-31g(d).firefly.inp (generated)

012502786.b3lyp_6-31g(d).smash.inp (generated)

012502786.b3lyp_6-31g(d).nwchem.inp (generated) 012502786.b3lyp_6-31g(d).log.xz 012502786.td-b3lyp_6-31g+(d).inp 012502786.td-b3lyp_6-31g+(d).log.xz

012502786.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502786.td-b3lyp_6-31+g(d).gjf (generated)

012502786.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502786.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502786.mol 012502786.PUBCHEM 012502786.mol (via Jmol)
012502788.b3lyp_6-31g(d).inp

012502788.b3lyp_6-31g(d).qchem.inp (generated)

012502788.b3lyp_6-31g(d).gjf (generated)

012502788.b3lyp_6-31g(d).firefly.inp (generated)

012502788.b3lyp_6-31g(d).smash.inp (generated)

012502788.b3lyp_6-31g(d).nwchem.inp (generated) 012502788.b3lyp_6-31g(d).log.xz 012502788.td-b3lyp_6-31g+(d).inp 012502788.td-b3lyp_6-31g+(d).log.xz

012502788.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502788.td-b3lyp_6-31+g(d).gjf (generated)

012502788.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502788.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502788.mol 012502788.PUBCHEM 012502788.mol (via Jmol)
012502800.b3lyp_6-31g(d).inp

012502800.b3lyp_6-31g(d).qchem.inp (generated)

012502800.b3lyp_6-31g(d).gjf (generated)

012502800.b3lyp_6-31g(d).firefly.inp (generated)

012502800.b3lyp_6-31g(d).smash.inp (generated)

012502800.b3lyp_6-31g(d).nwchem.inp (generated) 012502800.b3lyp_6-31g(d).log.xz 012502800.td-b3lyp_6-31g+(d).inp 012502800.td-b3lyp_6-31g+(d).log.xz

012502800.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502800.td-b3lyp_6-31+g(d).gjf (generated)

012502800.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502800.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502800.mol 012502800.PUBCHEM 012502800.mol (via Jmol)
012502801.b3lyp_6-31g(d).inp

012502801.b3lyp_6-31g(d).qchem.inp (generated)

012502801.b3lyp_6-31g(d).gjf (generated)

012502801.b3lyp_6-31g(d).firefly.inp (generated)

012502801.b3lyp_6-31g(d).smash.inp (generated)

012502801.b3lyp_6-31g(d).nwchem.inp (generated) 012502801.b3lyp_6-31g(d).log.xz 012502801.td-b3lyp_6-31g+(d).inp 012502801.td-b3lyp_6-31g+(d).log.xz

012502801.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502801.td-b3lyp_6-31+g(d).gjf (generated)

012502801.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502801.mol 012502801.PUBCHEM 012502801.mol (via Jmol)
012502802.b3lyp_6-31g(d).inp

012502802.b3lyp_6-31g(d).qchem.inp (generated)

012502802.b3lyp_6-31g(d).gjf (generated)

012502802.b3lyp_6-31g(d).firefly.inp (generated)

012502802.b3lyp_6-31g(d).smash.inp (generated)

012502802.b3lyp_6-31g(d).nwchem.inp (generated) 012502802.b3lyp_6-31g(d).log.xz 012502802.td-b3lyp_6-31g+(d).inp 012502802.td-b3lyp_6-31g+(d).log.xz

012502802.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502802.td-b3lyp_6-31+g(d).gjf (generated)

012502802.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502802.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502802.mol 012502802.PUBCHEM 012502802.mol (via Jmol)
012502803.b3lyp_6-31g(d).inp

012502803.b3lyp_6-31g(d).qchem.inp (generated)

012502803.b3lyp_6-31g(d).gjf (generated)

012502803.b3lyp_6-31g(d).firefly.inp (generated)

012502803.b3lyp_6-31g(d).smash.inp (generated)

012502803.b3lyp_6-31g(d).nwchem.inp (generated) 012502803.b3lyp_6-31g(d).log.xz 012502803.td-b3lyp_6-31g+(d).inp 012502803.td-b3lyp_6-31g+(d).log.xz

012502803.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502803.td-b3lyp_6-31+g(d).gjf (generated)

012502803.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502803.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502803.mol 012502803.PUBCHEM 012502803.mol (via Jmol)
012502810.b3lyp_6-31g(d).inp

012502810.b3lyp_6-31g(d).qchem.inp (generated)

012502810.b3lyp_6-31g(d).gjf (generated)

012502810.b3lyp_6-31g(d).firefly.inp (generated)

012502810.b3lyp_6-31g(d).smash.inp (generated)

012502810.b3lyp_6-31g(d).nwchem.inp (generated) 012502810.b3lyp_6-31g(d).log.xz 012502810.td-b3lyp_6-31g+(d).inp 012502810.td-b3lyp_6-31g+(d).log.xz

012502810.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502810.td-b3lyp_6-31+g(d).gjf (generated)

012502810.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502810.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502810.mol 012502810.PUBCHEM 012502810.mol (via Jmol)
012502811.b3lyp_6-31g(d).inp

012502811.b3lyp_6-31g(d).qchem.inp (generated)

012502811.b3lyp_6-31g(d).gjf (generated)

012502811.b3lyp_6-31g(d).firefly.inp (generated)

012502811.b3lyp_6-31g(d).smash.inp (generated)

012502811.b3lyp_6-31g(d).nwchem.inp (generated) 012502811.b3lyp_6-31g(d).log.xz 012502811.td-b3lyp_6-31g+(d).inp 012502811.td-b3lyp_6-31g+(d).log.xz

012502811.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502811.td-b3lyp_6-31+g(d).gjf (generated)

012502811.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502811.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502811.mol 012502811.PUBCHEM 012502811.mol (via Jmol)
012502812.b3lyp_6-31g(d).inp

012502812.b3lyp_6-31g(d).qchem.inp (generated)

012502812.b3lyp_6-31g(d).gjf (generated)

012502812.b3lyp_6-31g(d).firefly.inp (generated)

012502812.b3lyp_6-31g(d).smash.inp (generated)

012502812.b3lyp_6-31g(d).nwchem.inp (generated) 012502812.b3lyp_6-31g(d).log.xz 012502812.td-b3lyp_6-31g+(d).inp 012502812.td-b3lyp_6-31g+(d).log.xz

012502812.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502812.td-b3lyp_6-31+g(d).gjf (generated)

012502812.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502812.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502812.mol 012502812.PUBCHEM 012502812.mol (via Jmol)
012502813.b3lyp_6-31g(d).inp

012502813.b3lyp_6-31g(d).qchem.inp (generated)

012502813.b3lyp_6-31g(d).gjf (generated)

012502813.b3lyp_6-31g(d).firefly.inp (generated)

012502813.b3lyp_6-31g(d).smash.inp (generated)

012502813.b3lyp_6-31g(d).nwchem.inp (generated) 012502813.b3lyp_6-31g(d).log.xz 012502813.td-b3lyp_6-31g+(d).inp 012502813.td-b3lyp_6-31g+(d).log.xz

012502813.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502813.td-b3lyp_6-31+g(d).gjf (generated)

012502813.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502813.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502813.mol 012502813.PUBCHEM 012502813.mol (via Jmol)
012502819.b3lyp_6-31g(d).inp

012502819.b3lyp_6-31g(d).qchem.inp (generated)

012502819.b3lyp_6-31g(d).gjf (generated)

012502819.b3lyp_6-31g(d).firefly.inp (generated)

012502819.b3lyp_6-31g(d).smash.inp (generated)

012502819.b3lyp_6-31g(d).nwchem.inp (generated) 012502819.b3lyp_6-31g(d).log.xz 012502819.td-b3lyp_6-31g+(d).inp 012502819.td-b3lyp_6-31g+(d).log.xz

012502819.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502819.td-b3lyp_6-31+g(d).gjf (generated)

012502819.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502819.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502819.mol 012502819.PUBCHEM 012502819.mol (via Jmol)
012502821.b3lyp_6-31g(d).inp

012502821.b3lyp_6-31g(d).qchem.inp (generated)

012502821.b3lyp_6-31g(d).gjf (generated)

012502821.b3lyp_6-31g(d).firefly.inp (generated)

012502821.b3lyp_6-31g(d).smash.inp (generated)

012502821.b3lyp_6-31g(d).nwchem.inp (generated) 012502821.b3lyp_6-31g(d).log.xz 012502821.td-b3lyp_6-31g+(d).inp 012502821.td-b3lyp_6-31g+(d).log.xz

012502821.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502821.td-b3lyp_6-31+g(d).gjf (generated)

012502821.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502821.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502821.mol 012502821.PUBCHEM 012502821.mol (via Jmol)
012502822.b3lyp_6-31g(d).inp

012502822.b3lyp_6-31g(d).qchem.inp (generated)

012502822.b3lyp_6-31g(d).gjf (generated)

012502822.b3lyp_6-31g(d).firefly.inp (generated)

012502822.b3lyp_6-31g(d).smash.inp (generated)

012502822.b3lyp_6-31g(d).nwchem.inp (generated) 012502822.b3lyp_6-31g(d).log.xz 012502822.td-b3lyp_6-31g+(d).inp 012502822.td-b3lyp_6-31g+(d).log.xz

012502822.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502822.td-b3lyp_6-31+g(d).gjf (generated)

012502822.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502822.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502822.mol 012502822.PUBCHEM 012502822.mol (via Jmol)
012502823.b3lyp_6-31g(d).inp

012502823.b3lyp_6-31g(d).qchem.inp (generated)

012502823.b3lyp_6-31g(d).gjf (generated)

012502823.b3lyp_6-31g(d).firefly.inp (generated)

012502823.b3lyp_6-31g(d).smash.inp (generated)

012502823.b3lyp_6-31g(d).nwchem.inp (generated) 012502823.b3lyp_6-31g(d).log.xz 012502823.td-b3lyp_6-31g+(d).inp 012502823.td-b3lyp_6-31g+(d).log.xz

012502823.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502823.td-b3lyp_6-31+g(d).gjf (generated)

012502823.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502823.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502823.mol 012502823.PUBCHEM 012502823.mol (via Jmol)
012502851.b3lyp_6-31g(d).inp

012502851.b3lyp_6-31g(d).qchem.inp (generated)

012502851.b3lyp_6-31g(d).gjf (generated)

012502851.b3lyp_6-31g(d).firefly.inp (generated)

012502851.b3lyp_6-31g(d).smash.inp (generated)

012502851.b3lyp_6-31g(d).nwchem.inp (generated) 012502851.b3lyp_6-31g(d).log.xz 012502851.td-b3lyp_6-31g+(d).inp 012502851.td-b3lyp_6-31g+(d).log.xz

012502851.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502851.td-b3lyp_6-31+g(d).gjf (generated)

012502851.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502851.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502851.mol 012502851.PUBCHEM 012502851.mol (via Jmol)
012502852.b3lyp_6-31g(d).inp

012502852.b3lyp_6-31g(d).qchem.inp (generated)

012502852.b3lyp_6-31g(d).gjf (generated)

012502852.b3lyp_6-31g(d).firefly.inp (generated)

012502852.b3lyp_6-31g(d).smash.inp (generated)

012502852.b3lyp_6-31g(d).nwchem.inp (generated) 012502852.b3lyp_6-31g(d).log.xz 012502852.td-b3lyp_6-31g+(d).inp 012502852.td-b3lyp_6-31g+(d).log.xz

012502852.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502852.td-b3lyp_6-31+g(d).gjf (generated)

012502852.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502852.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502852.mol 012502852.PUBCHEM 012502852.mol (via Jmol)
012502855.b3lyp_6-31g(d).inp

012502855.b3lyp_6-31g(d).qchem.inp (generated)

012502855.b3lyp_6-31g(d).gjf (generated)

012502855.b3lyp_6-31g(d).firefly.inp (generated)

012502855.b3lyp_6-31g(d).smash.inp (generated)

012502855.b3lyp_6-31g(d).nwchem.inp (generated) 012502855.b3lyp_6-31g(d).log.xz 012502855.td-b3lyp_6-31g+(d).inp 012502855.td-b3lyp_6-31g+(d).log.xz

012502855.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502855.td-b3lyp_6-31+g(d).gjf (generated)

012502855.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502855.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502855.mol 012502855.PUBCHEM 012502855.mol (via Jmol)
012502856.b3lyp_6-31g(d).inp

012502856.b3lyp_6-31g(d).qchem.inp (generated)

012502856.b3lyp_6-31g(d).gjf (generated)

012502856.b3lyp_6-31g(d).firefly.inp (generated)

012502856.b3lyp_6-31g(d).smash.inp (generated)

012502856.b3lyp_6-31g(d).nwchem.inp (generated) 012502856.b3lyp_6-31g(d).log.xz 012502856.td-b3lyp_6-31g+(d).inp 012502856.td-b3lyp_6-31g+(d).log.xz

012502856.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502856.td-b3lyp_6-31+g(d).gjf (generated)

012502856.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502856.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502856.mol 012502856.PUBCHEM 012502856.mol (via Jmol)
012502858.b3lyp_6-31g(d).inp

012502858.b3lyp_6-31g(d).qchem.inp (generated)

012502858.b3lyp_6-31g(d).gjf (generated)

012502858.b3lyp_6-31g(d).firefly.inp (generated)

012502858.b3lyp_6-31g(d).smash.inp (generated)

012502858.b3lyp_6-31g(d).nwchem.inp (generated) 012502858.b3lyp_6-31g(d).log.xz 012502858.td-b3lyp_6-31g+(d).inp 012502858.td-b3lyp_6-31g+(d).log.xz

012502858.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502858.td-b3lyp_6-31+g(d).gjf (generated)

012502858.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502858.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502858.mol 012502858.PUBCHEM 012502858.mol (via Jmol)
012502860.b3lyp_6-31g(d).inp

012502860.b3lyp_6-31g(d).qchem.inp (generated)

012502860.b3lyp_6-31g(d).gjf (generated)

012502860.b3lyp_6-31g(d).firefly.inp (generated)

012502860.b3lyp_6-31g(d).smash.inp (generated)

012502860.b3lyp_6-31g(d).nwchem.inp (generated) 012502860.b3lyp_6-31g(d).log.xz 012502860.td-b3lyp_6-31g+(d).inp 012502860.td-b3lyp_6-31g+(d).log.xz

012502860.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502860.td-b3lyp_6-31+g(d).gjf (generated)

012502860.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502860.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502860.mol 012502860.PUBCHEM 012502860.mol (via Jmol)
012502862.b3lyp_6-31g(d).inp

012502862.b3lyp_6-31g(d).qchem.inp (generated)

012502862.b3lyp_6-31g(d).gjf (generated)

012502862.b3lyp_6-31g(d).firefly.inp (generated)

012502862.b3lyp_6-31g(d).smash.inp (generated)

012502862.b3lyp_6-31g(d).nwchem.inp (generated) 012502862.b3lyp_6-31g(d).log.xz 012502862.td-b3lyp_6-31g+(d).inp 012502862.td-b3lyp_6-31g+(d).log.xz

012502862.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502862.td-b3lyp_6-31+g(d).gjf (generated)

012502862.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502862.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502862.mol 012502862.PUBCHEM 012502862.mol (via Jmol)
012502899.b3lyp_6-31g(d).inp

012502899.b3lyp_6-31g(d).qchem.inp (generated)

012502899.b3lyp_6-31g(d).gjf (generated)

012502899.b3lyp_6-31g(d).firefly.inp (generated)

012502899.b3lyp_6-31g(d).smash.inp (generated)

012502899.b3lyp_6-31g(d).nwchem.inp (generated) 012502899.b3lyp_6-31g(d).log.xz 012502899.td-b3lyp_6-31g+(d).inp 012502899.td-b3lyp_6-31g+(d).log.xz

012502899.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502899.td-b3lyp_6-31+g(d).gjf (generated)

012502899.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502899.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502899.mol 012502899.PUBCHEM 012502899.mol (via Jmol)
012502931.b3lyp_6-31g(d).inp

012502931.b3lyp_6-31g(d).qchem.inp (generated)

012502931.b3lyp_6-31g(d).gjf (generated)

012502931.b3lyp_6-31g(d).firefly.inp (generated)

012502931.b3lyp_6-31g(d).smash.inp (generated)

012502931.b3lyp_6-31g(d).nwchem.inp (generated) 012502931.b3lyp_6-31g(d).log.xz 012502931.td-b3lyp_6-31g+(d).inp 012502931.td-b3lyp_6-31g+(d).log.xz

012502931.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502931.td-b3lyp_6-31+g(d).gjf (generated)

012502931.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502931.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502931.mol 012502931.PUBCHEM 012502931.mol (via Jmol)
012502936.b3lyp_6-31g(d).inp

012502936.b3lyp_6-31g(d).qchem.inp (generated)

012502936.b3lyp_6-31g(d).gjf (generated)

012502936.b3lyp_6-31g(d).firefly.inp (generated)

012502936.b3lyp_6-31g(d).smash.inp (generated)

012502936.b3lyp_6-31g(d).nwchem.inp (generated) 012502936.b3lyp_6-31g(d).log.xz 012502936.td-b3lyp_6-31g+(d).inp 012502936.td-b3lyp_6-31g+(d).log.xz

012502936.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502936.td-b3lyp_6-31+g(d).gjf (generated)

012502936.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502936.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502936.mol 012502936.PUBCHEM 012502936.mol (via Jmol)
012502948.b3lyp_6-31g(d).inp

012502948.b3lyp_6-31g(d).qchem.inp (generated)

012502948.b3lyp_6-31g(d).gjf (generated)

012502948.b3lyp_6-31g(d).firefly.inp (generated)

012502948.b3lyp_6-31g(d).smash.inp (generated)

012502948.b3lyp_6-31g(d).nwchem.inp (generated) 012502948.b3lyp_6-31g(d).log.xz 012502948.td-b3lyp_6-31g+(d).inp 012502948.td-b3lyp_6-31g+(d).log.xz

012502948.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502948.td-b3lyp_6-31+g(d).gjf (generated)

012502948.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502948.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502948.mol 012502948.PUBCHEM 012502948.mol (via Jmol)
012502981.b3lyp_6-31g(d).inp

012502981.b3lyp_6-31g(d).qchem.inp (generated)

012502981.b3lyp_6-31g(d).gjf (generated)

012502981.b3lyp_6-31g(d).firefly.inp (generated)

012502981.b3lyp_6-31g(d).smash.inp (generated)

012502981.b3lyp_6-31g(d).nwchem.inp (generated) 012502981.b3lyp_6-31g(d).log.xz 012502981.td-b3lyp_6-31g+(d).inp 012502981.td-b3lyp_6-31g+(d).log.xz

012502981.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502981.td-b3lyp_6-31+g(d).gjf (generated)

012502981.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502981.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502981.mol 012502981.PUBCHEM 012502981.mol (via Jmol)
012502982.b3lyp_6-31g(d).inp

012502982.b3lyp_6-31g(d).qchem.inp (generated)

012502982.b3lyp_6-31g(d).gjf (generated)

012502982.b3lyp_6-31g(d).firefly.inp (generated)

012502982.b3lyp_6-31g(d).smash.inp (generated)

012502982.b3lyp_6-31g(d).nwchem.inp (generated) 012502982.b3lyp_6-31g(d).log.xz 012502982.td-b3lyp_6-31g+(d).inp 012502982.td-b3lyp_6-31g+(d).log.xz

012502982.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502982.td-b3lyp_6-31+g(d).gjf (generated)

012502982.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502982.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502982.mol 012502982.PUBCHEM 012502982.mol (via Jmol)
012502988.b3lyp_6-31g(d).inp

012502988.b3lyp_6-31g(d).qchem.inp (generated)

012502988.b3lyp_6-31g(d).gjf (generated)

012502988.b3lyp_6-31g(d).firefly.inp (generated)

012502988.b3lyp_6-31g(d).smash.inp (generated)

012502988.b3lyp_6-31g(d).nwchem.inp (generated) 012502988.b3lyp_6-31g(d).log.xz 012502988.td-b3lyp_6-31g+(d).inp 012502988.td-b3lyp_6-31g+(d).log.xz

012502988.td-b3lyp_6-31+g(d).qchem.inp (generated)

012502988.td-b3lyp_6-31+g(d).gjf (generated)

012502988.td-b3lyp_6-31+g(d).firefly.inp (generated)

012502988.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012502988.mol 012502988.PUBCHEM 012502988.mol (via Jmol)
012503012.b3lyp_6-31g(d).inp

012503012.b3lyp_6-31g(d).qchem.inp (generated)

012503012.b3lyp_6-31g(d).gjf (generated)

012503012.b3lyp_6-31g(d).firefly.inp (generated)

012503012.b3lyp_6-31g(d).smash.inp (generated)

012503012.b3lyp_6-31g(d).nwchem.inp (generated) 012503012.b3lyp_6-31g(d).log.xz 012503012.td-b3lyp_6-31g+(d).inp 012503012.td-b3lyp_6-31g+(d).log.xz

012503012.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503012.td-b3lyp_6-31+g(d).gjf (generated)

012503012.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503012.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503012.mol 012503012.PUBCHEM 012503012.mol (via Jmol)
012503032.b3lyp_6-31g(d).inp

012503032.b3lyp_6-31g(d).qchem.inp (generated)

012503032.b3lyp_6-31g(d).gjf (generated)

012503032.b3lyp_6-31g(d).firefly.inp (generated)

012503032.b3lyp_6-31g(d).smash.inp (generated)

012503032.b3lyp_6-31g(d).nwchem.inp (generated) 012503032.b3lyp_6-31g(d).log.xz 012503032.td-b3lyp_6-31g+(d).inp 012503032.td-b3lyp_6-31g+(d).log.xz

012503032.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503032.td-b3lyp_6-31+g(d).gjf (generated)

012503032.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503032.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503032.mol 012503032.PUBCHEM 012503032.mol (via Jmol)
012503036.b3lyp_6-31g(d).inp

012503036.b3lyp_6-31g(d).qchem.inp (generated)

012503036.b3lyp_6-31g(d).gjf (generated)

012503036.b3lyp_6-31g(d).firefly.inp (generated)

012503036.b3lyp_6-31g(d).smash.inp (generated)

012503036.b3lyp_6-31g(d).nwchem.inp (generated) 012503036.b3lyp_6-31g(d).log.xz 012503036.td-b3lyp_6-31g+(d).inp 012503036.td-b3lyp_6-31g+(d).log.xz

012503036.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503036.td-b3lyp_6-31+g(d).gjf (generated)

012503036.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503036.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503036.mol 012503036.PUBCHEM 012503036.mol (via Jmol)
012503047.b3lyp_6-31g(d).inp

012503047.b3lyp_6-31g(d).qchem.inp (generated)

012503047.b3lyp_6-31g(d).gjf (generated)

012503047.b3lyp_6-31g(d).firefly.inp (generated)

012503047.b3lyp_6-31g(d).smash.inp (generated)

012503047.b3lyp_6-31g(d).nwchem.inp (generated) 012503047.b3lyp_6-31g(d).log.xz 012503047.td-b3lyp_6-31g+(d).inp 012503047.td-b3lyp_6-31g+(d).log.xz

012503047.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503047.td-b3lyp_6-31+g(d).gjf (generated)

012503047.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503047.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503047.mol 012503047.PUBCHEM 012503047.mol (via Jmol)
012503058.b3lyp_6-31g(d).inp

012503058.b3lyp_6-31g(d).qchem.inp (generated)

012503058.b3lyp_6-31g(d).gjf (generated)

012503058.b3lyp_6-31g(d).firefly.inp (generated)

012503058.b3lyp_6-31g(d).smash.inp (generated)

012503058.b3lyp_6-31g(d).nwchem.inp (generated) 012503058.b3lyp_6-31g(d).log.xz 012503058.td-b3lyp_6-31g+(d).inp 012503058.td-b3lyp_6-31g+(d).log.xz

012503058.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503058.td-b3lyp_6-31+g(d).gjf (generated)

012503058.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503058.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503058.mol 012503058.PUBCHEM 012503058.mol (via Jmol)
012503075.b3lyp_6-31g(d).inp

012503075.b3lyp_6-31g(d).qchem.inp (generated)

012503075.b3lyp_6-31g(d).gjf (generated)

012503075.b3lyp_6-31g(d).firefly.inp (generated)

012503075.b3lyp_6-31g(d).smash.inp (generated)

012503075.b3lyp_6-31g(d).nwchem.inp (generated) 012503075.b3lyp_6-31g(d).log.xz 012503075.td-b3lyp_6-31g+(d).inp 012503075.td-b3lyp_6-31g+(d).log.xz

012503075.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503075.td-b3lyp_6-31+g(d).gjf (generated)

012503075.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503075.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503075.mol 012503075.PUBCHEM 012503075.mol (via Jmol)
012503077.b3lyp_6-31g(d).inp

012503077.b3lyp_6-31g(d).qchem.inp (generated)

012503077.b3lyp_6-31g(d).gjf (generated)

012503077.b3lyp_6-31g(d).firefly.inp (generated)

012503077.b3lyp_6-31g(d).smash.inp (generated)

012503077.b3lyp_6-31g(d).nwchem.inp (generated) 012503077.b3lyp_6-31g(d).log.xz 012503077.td-b3lyp_6-31g+(d).inp 012503077.td-b3lyp_6-31g+(d).log.xz

012503077.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503077.td-b3lyp_6-31+g(d).gjf (generated)

012503077.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503077.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503077.mol 012503077.PUBCHEM 012503077.mol (via Jmol)
012503081.b3lyp_6-31g(d).inp

012503081.b3lyp_6-31g(d).qchem.inp (generated)

012503081.b3lyp_6-31g(d).gjf (generated)

012503081.b3lyp_6-31g(d).firefly.inp (generated)

012503081.b3lyp_6-31g(d).smash.inp (generated)

012503081.b3lyp_6-31g(d).nwchem.inp (generated) 012503081.b3lyp_6-31g(d).log.xz 012503081.td-b3lyp_6-31g+(d).inp 012503081.td-b3lyp_6-31g+(d).log.xz

012503081.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503081.td-b3lyp_6-31+g(d).gjf (generated)

012503081.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503081.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503081.mol 012503081.PUBCHEM 012503081.mol (via Jmol)
012503093.b3lyp_6-31g(d).inp

012503093.b3lyp_6-31g(d).qchem.inp (generated)

012503093.b3lyp_6-31g(d).gjf (generated)

012503093.b3lyp_6-31g(d).firefly.inp (generated)

012503093.b3lyp_6-31g(d).smash.inp (generated)

012503093.b3lyp_6-31g(d).nwchem.inp (generated) 012503093.b3lyp_6-31g(d).log.xz 012503093.td-b3lyp_6-31g+(d).inp 012503093.td-b3lyp_6-31g+(d).log.xz

012503093.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503093.td-b3lyp_6-31+g(d).gjf (generated)

012503093.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503093.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503093.mol 012503093.PUBCHEM 012503093.mol (via Jmol)
012503096.b3lyp_6-31g(d).inp

012503096.b3lyp_6-31g(d).qchem.inp (generated)

012503096.b3lyp_6-31g(d).gjf (generated)

012503096.b3lyp_6-31g(d).firefly.inp (generated)

012503096.b3lyp_6-31g(d).smash.inp (generated)

012503096.b3lyp_6-31g(d).nwchem.inp (generated) 012503096.b3lyp_6-31g(d).log.xz 012503096.td-b3lyp_6-31g+(d).inp 012503096.td-b3lyp_6-31g+(d).log.xz

012503096.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503096.td-b3lyp_6-31+g(d).gjf (generated)

012503096.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503096.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503096.mol 012503096.PUBCHEM 012503096.mol (via Jmol)
012503113.b3lyp_6-31g(d).inp

012503113.b3lyp_6-31g(d).qchem.inp (generated)

012503113.b3lyp_6-31g(d).gjf (generated)

012503113.b3lyp_6-31g(d).firefly.inp (generated)

012503113.b3lyp_6-31g(d).smash.inp (generated)

012503113.b3lyp_6-31g(d).nwchem.inp (generated) 012503113.b3lyp_6-31g(d).log.xz 012503113.td-b3lyp_6-31g+(d).inp 012503113.td-b3lyp_6-31g+(d).log.xz

012503113.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503113.td-b3lyp_6-31+g(d).gjf (generated)

012503113.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503113.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503113.mol 012503113.PUBCHEM 012503113.mol (via Jmol)
012503114.b3lyp_6-31g(d).inp

012503114.b3lyp_6-31g(d).qchem.inp (generated)

012503114.b3lyp_6-31g(d).gjf (generated)

012503114.b3lyp_6-31g(d).firefly.inp (generated)

012503114.b3lyp_6-31g(d).smash.inp (generated)

012503114.b3lyp_6-31g(d).nwchem.inp (generated) 012503114.b3lyp_6-31g(d).log.xz 012503114.td-b3lyp_6-31g+(d).inp 012503114.td-b3lyp_6-31g+(d).log.xz

012503114.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503114.td-b3lyp_6-31+g(d).gjf (generated)

012503114.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503114.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503114.mol 012503114.PUBCHEM 012503114.mol (via Jmol)
012503115.b3lyp_6-31g(d).inp

012503115.b3lyp_6-31g(d).qchem.inp (generated)

012503115.b3lyp_6-31g(d).gjf (generated)

012503115.b3lyp_6-31g(d).firefly.inp (generated)

012503115.b3lyp_6-31g(d).smash.inp (generated)

012503115.b3lyp_6-31g(d).nwchem.inp (generated) 012503115.b3lyp_6-31g(d).log.xz 012503115.td-b3lyp_6-31g+(d).inp 012503115.td-b3lyp_6-31g+(d).log.xz

012503115.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503115.td-b3lyp_6-31+g(d).gjf (generated)

012503115.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503115.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503115.mol 012503115.PUBCHEM 012503115.mol (via Jmol)
012503116.b3lyp_6-31g(d).inp

012503116.b3lyp_6-31g(d).qchem.inp (generated)

012503116.b3lyp_6-31g(d).gjf (generated)

012503116.b3lyp_6-31g(d).firefly.inp (generated)

012503116.b3lyp_6-31g(d).smash.inp (generated)

012503116.b3lyp_6-31g(d).nwchem.inp (generated) 012503116.b3lyp_6-31g(d).log.xz 012503116.td-b3lyp_6-31g+(d).inp 012503116.td-b3lyp_6-31g+(d).log.xz

012503116.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503116.td-b3lyp_6-31+g(d).gjf (generated)

012503116.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503116.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503116.mol 012503116.PUBCHEM 012503116.mol (via Jmol)
012503192.b3lyp_6-31g(d).inp

012503192.b3lyp_6-31g(d).qchem.inp (generated)

012503192.b3lyp_6-31g(d).gjf (generated)

012503192.b3lyp_6-31g(d).firefly.inp (generated)

012503192.b3lyp_6-31g(d).smash.inp (generated)

012503192.b3lyp_6-31g(d).nwchem.inp (generated) 012503192.b3lyp_6-31g(d).log.xz 012503192.td-b3lyp_6-31g+(d).inp 012503192.td-b3lyp_6-31g+(d).log.xz

012503192.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503192.td-b3lyp_6-31+g(d).gjf (generated)

012503192.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503192.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503192.mol 012503192.PUBCHEM 012503192.mol (via Jmol)
012503194.b3lyp_6-31g(d).inp

012503194.b3lyp_6-31g(d).qchem.inp (generated)

012503194.b3lyp_6-31g(d).gjf (generated)

012503194.b3lyp_6-31g(d).firefly.inp (generated)

012503194.b3lyp_6-31g(d).smash.inp (generated)

012503194.b3lyp_6-31g(d).nwchem.inp (generated) 012503194.b3lyp_6-31g(d).log.xz 012503194.td-b3lyp_6-31g+(d).inp 012503194.td-b3lyp_6-31g+(d).log.xz

012503194.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503194.td-b3lyp_6-31+g(d).gjf (generated)

012503194.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503194.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503194.mol 012503194.PUBCHEM 012503194.mol (via Jmol)
012503203.b3lyp_6-31g(d).inp

012503203.b3lyp_6-31g(d).qchem.inp (generated)

012503203.b3lyp_6-31g(d).gjf (generated)

012503203.b3lyp_6-31g(d).firefly.inp (generated)

012503203.b3lyp_6-31g(d).smash.inp (generated)

012503203.b3lyp_6-31g(d).nwchem.inp (generated) 012503203.b3lyp_6-31g(d).log.xz 012503203.mol 012503203.PUBCHEM 012503203.mol (via Jmol)
012503205.b3lyp_6-31g(d).inp

012503205.b3lyp_6-31g(d).qchem.inp (generated)

012503205.b3lyp_6-31g(d).gjf (generated)

012503205.b3lyp_6-31g(d).firefly.inp (generated)

012503205.b3lyp_6-31g(d).smash.inp (generated)

012503205.b3lyp_6-31g(d).nwchem.inp (generated) 012503205.b3lyp_6-31g(d).log.xz 012503205.td-b3lyp_6-31g+(d).inp 012503205.td-b3lyp_6-31g+(d).log.xz

012503205.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503205.td-b3lyp_6-31+g(d).gjf (generated)

012503205.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503205.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503205.mol 012503205.PUBCHEM 012503205.mol (via Jmol)
012503223.b3lyp_6-31g(d).inp

012503223.b3lyp_6-31g(d).qchem.inp (generated)

012503223.b3lyp_6-31g(d).gjf (generated)

012503223.b3lyp_6-31g(d).firefly.inp (generated)

012503223.b3lyp_6-31g(d).smash.inp (generated)

012503223.b3lyp_6-31g(d).nwchem.inp (generated) 012503223.b3lyp_6-31g(d).log.xz 012503223.td-b3lyp_6-31g+(d).inp 012503223.td-b3lyp_6-31g+(d).log.xz

012503223.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503223.td-b3lyp_6-31+g(d).gjf (generated)

012503223.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503223.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503223.mol 012503223.PUBCHEM 012503223.mol (via Jmol)
012503226.b3lyp_6-31g(d).inp

012503226.b3lyp_6-31g(d).qchem.inp (generated)

012503226.b3lyp_6-31g(d).gjf (generated)

012503226.b3lyp_6-31g(d).firefly.inp (generated)

012503226.b3lyp_6-31g(d).smash.inp (generated)

012503226.b3lyp_6-31g(d).nwchem.inp (generated) 012503226.b3lyp_6-31g(d).log.xz 012503226.td-b3lyp_6-31g+(d).inp 012503226.td-b3lyp_6-31g+(d).log.xz

012503226.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503226.td-b3lyp_6-31+g(d).gjf (generated)

012503226.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503226.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503226.mol 012503226.PUBCHEM 012503226.mol (via Jmol)
012503251.b3lyp_6-31g(d).inp

012503251.b3lyp_6-31g(d).qchem.inp (generated)

012503251.b3lyp_6-31g(d).gjf (generated)

012503251.b3lyp_6-31g(d).firefly.inp (generated)

012503251.b3lyp_6-31g(d).smash.inp (generated)

012503251.b3lyp_6-31g(d).nwchem.inp (generated) 012503251.b3lyp_6-31g(d).log.xz 012503251.td-b3lyp_6-31g+(d).inp 012503251.td-b3lyp_6-31g+(d).log.xz

012503251.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503251.td-b3lyp_6-31+g(d).gjf (generated)

012503251.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503251.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503251.mol 012503251.PUBCHEM 012503251.mol (via Jmol)
012503258.b3lyp_6-31g(d).inp

012503258.b3lyp_6-31g(d).qchem.inp (generated)

012503258.b3lyp_6-31g(d).gjf (generated)

012503258.b3lyp_6-31g(d).firefly.inp (generated)

012503258.b3lyp_6-31g(d).smash.inp (generated)

012503258.b3lyp_6-31g(d).nwchem.inp (generated) 012503258.b3lyp_6-31g(d).log.xz 012503258.td-b3lyp_6-31g+(d).inp 012503258.td-b3lyp_6-31g+(d).log.xz

012503258.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503258.td-b3lyp_6-31+g(d).gjf (generated)

012503258.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503258.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503258.mol 012503258.PUBCHEM 012503258.mol (via Jmol)
012503261.b3lyp_6-31g(d).inp

012503261.b3lyp_6-31g(d).qchem.inp (generated)

012503261.b3lyp_6-31g(d).gjf (generated)

012503261.b3lyp_6-31g(d).firefly.inp (generated)

012503261.b3lyp_6-31g(d).smash.inp (generated)

012503261.b3lyp_6-31g(d).nwchem.inp (generated) 012503261.b3lyp_6-31g(d).log.xz 012503261.td-b3lyp_6-31g+(d).inp 012503261.td-b3lyp_6-31g+(d).log.xz

012503261.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503261.td-b3lyp_6-31+g(d).gjf (generated)

012503261.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503261.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503261.mol 012503261.PUBCHEM 012503261.mol (via Jmol)
012503262.b3lyp_6-31g(d).inp

012503262.b3lyp_6-31g(d).qchem.inp (generated)

012503262.b3lyp_6-31g(d).gjf (generated)

012503262.b3lyp_6-31g(d).firefly.inp (generated)

012503262.b3lyp_6-31g(d).smash.inp (generated)

012503262.b3lyp_6-31g(d).nwchem.inp (generated) 012503262.b3lyp_6-31g(d).log.xz 012503262.td-b3lyp_6-31g+(d).inp 012503262.td-b3lyp_6-31g+(d).log.xz

012503262.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503262.td-b3lyp_6-31+g(d).gjf (generated)

012503262.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503262.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503262.mol 012503262.PUBCHEM 012503262.mol (via Jmol)
012503264.b3lyp_6-31g(d).inp

012503264.b3lyp_6-31g(d).qchem.inp (generated)

012503264.b3lyp_6-31g(d).gjf (generated)

012503264.b3lyp_6-31g(d).firefly.inp (generated)

012503264.b3lyp_6-31g(d).smash.inp (generated)

012503264.b3lyp_6-31g(d).nwchem.inp (generated) 012503264.b3lyp_6-31g(d).log.xz 012503264.td-b3lyp_6-31g+(d).inp 012503264.td-b3lyp_6-31g+(d).log.xz

012503264.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503264.td-b3lyp_6-31+g(d).gjf (generated)

012503264.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503264.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503264.mol 012503264.PUBCHEM 012503264.mol (via Jmol)
012503265.b3lyp_6-31g(d).inp

012503265.b3lyp_6-31g(d).qchem.inp (generated)

012503265.b3lyp_6-31g(d).gjf (generated)

012503265.b3lyp_6-31g(d).firefly.inp (generated)

012503265.b3lyp_6-31g(d).smash.inp (generated)

012503265.b3lyp_6-31g(d).nwchem.inp (generated) 012503265.b3lyp_6-31g(d).log.xz 012503265.td-b3lyp_6-31g+(d).inp 012503265.td-b3lyp_6-31g+(d).log.xz

012503265.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503265.td-b3lyp_6-31+g(d).gjf (generated)

012503265.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503265.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503265.mol 012503265.PUBCHEM 012503265.mol (via Jmol)
012503269.b3lyp_6-31g(d).inp

012503269.b3lyp_6-31g(d).qchem.inp (generated)

012503269.b3lyp_6-31g(d).gjf (generated)

012503269.b3lyp_6-31g(d).firefly.inp (generated)

012503269.b3lyp_6-31g(d).smash.inp (generated)

012503269.b3lyp_6-31g(d).nwchem.inp (generated) 012503269.b3lyp_6-31g(d).log.xz 012503269.td-b3lyp_6-31g+(d).inp 012503269.td-b3lyp_6-31g+(d).log.xz

012503269.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503269.td-b3lyp_6-31+g(d).gjf (generated)

012503269.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503269.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503269.mol 012503269.PUBCHEM 012503269.mol (via Jmol)
012503274.b3lyp_6-31g(d).inp

012503274.b3lyp_6-31g(d).qchem.inp (generated)

012503274.b3lyp_6-31g(d).gjf (generated)

012503274.b3lyp_6-31g(d).firefly.inp (generated)

012503274.b3lyp_6-31g(d).smash.inp (generated)

012503274.b3lyp_6-31g(d).nwchem.inp (generated) 012503274.b3lyp_6-31g(d).log.xz 012503274.td-b3lyp_6-31g+(d).inp 012503274.td-b3lyp_6-31g+(d).log.xz

012503274.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503274.td-b3lyp_6-31+g(d).gjf (generated)

012503274.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503274.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503274.mol 012503274.PUBCHEM 012503274.mol (via Jmol)
012503275.b3lyp_6-31g(d).inp

012503275.b3lyp_6-31g(d).qchem.inp (generated)

012503275.b3lyp_6-31g(d).gjf (generated)

012503275.b3lyp_6-31g(d).firefly.inp (generated)

012503275.b3lyp_6-31g(d).smash.inp (generated)

012503275.b3lyp_6-31g(d).nwchem.inp (generated) 012503275.b3lyp_6-31g(d).log.xz 012503275.td-b3lyp_6-31g+(d).inp 012503275.td-b3lyp_6-31g+(d).log.xz

012503275.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503275.td-b3lyp_6-31+g(d).gjf (generated)

012503275.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503275.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503275.mol 012503275.PUBCHEM 012503275.mol (via Jmol)
012503276.b3lyp_6-31g(d).inp

012503276.b3lyp_6-31g(d).qchem.inp (generated)

012503276.b3lyp_6-31g(d).gjf (generated)

012503276.b3lyp_6-31g(d).firefly.inp (generated)

012503276.b3lyp_6-31g(d).smash.inp (generated)

012503276.b3lyp_6-31g(d).nwchem.inp (generated) 012503276.b3lyp_6-31g(d).log.xz 012503276.td-b3lyp_6-31g+(d).inp 012503276.td-b3lyp_6-31g+(d).log.xz

012503276.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503276.td-b3lyp_6-31+g(d).gjf (generated)

012503276.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503276.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503276.mol 012503276.PUBCHEM 012503276.mol (via Jmol)
012503277.b3lyp_6-31g(d).inp

012503277.b3lyp_6-31g(d).qchem.inp (generated)

012503277.b3lyp_6-31g(d).gjf (generated)

012503277.b3lyp_6-31g(d).firefly.inp (generated)

012503277.b3lyp_6-31g(d).smash.inp (generated)

012503277.b3lyp_6-31g(d).nwchem.inp (generated) 012503277.b3lyp_6-31g(d).log.xz 012503277.td-b3lyp_6-31g+(d).inp 012503277.td-b3lyp_6-31g+(d).log.xz

012503277.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503277.td-b3lyp_6-31+g(d).gjf (generated)

012503277.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503277.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503277.mol 012503277.PUBCHEM 012503277.mol (via Jmol)
012503287.b3lyp_6-31g(d).inp

012503287.b3lyp_6-31g(d).qchem.inp (generated)

012503287.b3lyp_6-31g(d).gjf (generated)

012503287.b3lyp_6-31g(d).firefly.inp (generated)

012503287.b3lyp_6-31g(d).smash.inp (generated)

012503287.b3lyp_6-31g(d).nwchem.inp (generated) 012503287.b3lyp_6-31g(d).log.xz 012503287.td-b3lyp_6-31g+(d).inp 012503287.td-b3lyp_6-31g+(d).log.xz

012503287.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503287.td-b3lyp_6-31+g(d).gjf (generated)

012503287.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503287.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503287.mol 012503287.PUBCHEM 012503287.mol (via Jmol)
012503288.b3lyp_6-31g(d).inp

012503288.b3lyp_6-31g(d).qchem.inp (generated)

012503288.b3lyp_6-31g(d).gjf (generated)

012503288.b3lyp_6-31g(d).firefly.inp (generated)

012503288.b3lyp_6-31g(d).smash.inp (generated)

012503288.b3lyp_6-31g(d).nwchem.inp (generated) 012503288.b3lyp_6-31g(d).log.xz 012503288.td-b3lyp_6-31g+(d).inp 012503288.td-b3lyp_6-31g+(d).log.xz

012503288.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503288.td-b3lyp_6-31+g(d).gjf (generated)

012503288.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503288.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503288.mol 012503288.PUBCHEM 012503288.mol (via Jmol)
012503289.b3lyp_6-31g(d).inp

012503289.b3lyp_6-31g(d).qchem.inp (generated)

012503289.b3lyp_6-31g(d).gjf (generated)

012503289.b3lyp_6-31g(d).firefly.inp (generated)

012503289.b3lyp_6-31g(d).smash.inp (generated)

012503289.b3lyp_6-31g(d).nwchem.inp (generated) 012503289.b3lyp_6-31g(d).log.xz 012503289.td-b3lyp_6-31g+(d).inp 012503289.td-b3lyp_6-31g+(d).log.xz

012503289.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503289.td-b3lyp_6-31+g(d).gjf (generated)

012503289.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503289.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503289.mol 012503289.PUBCHEM 012503289.mol (via Jmol)
012503309.b3lyp_6-31g(d).inp

012503309.b3lyp_6-31g(d).qchem.inp (generated)

012503309.b3lyp_6-31g(d).gjf (generated)

012503309.b3lyp_6-31g(d).firefly.inp (generated)

012503309.b3lyp_6-31g(d).smash.inp (generated)

012503309.b3lyp_6-31g(d).nwchem.inp (generated) 012503309.b3lyp_6-31g(d).log.xz 012503309.td-b3lyp_6-31g+(d).inp 012503309.td-b3lyp_6-31g+(d).log.xz

012503309.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503309.td-b3lyp_6-31+g(d).gjf (generated)

012503309.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503309.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503309.mol 012503309.PUBCHEM 012503309.mol (via Jmol)
012503355.b3lyp_6-31g(d).inp

012503355.b3lyp_6-31g(d).qchem.inp (generated)

012503355.b3lyp_6-31g(d).gjf (generated)

012503355.b3lyp_6-31g(d).firefly.inp (generated)

012503355.b3lyp_6-31g(d).smash.inp (generated)

012503355.b3lyp_6-31g(d).nwchem.inp (generated) 012503355.b3lyp_6-31g(d).log.xz 012503355.td-b3lyp_6-31g+(d).inp 012503355.td-b3lyp_6-31g+(d).log.xz

012503355.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503355.td-b3lyp_6-31+g(d).gjf (generated)

012503355.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503355.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503355.mol 012503355.PUBCHEM 012503355.mol (via Jmol)
012503371.b3lyp_6-31g(d).inp

012503371.b3lyp_6-31g(d).qchem.inp (generated)

012503371.b3lyp_6-31g(d).gjf (generated)

012503371.b3lyp_6-31g(d).firefly.inp (generated)

012503371.b3lyp_6-31g(d).smash.inp (generated)

012503371.b3lyp_6-31g(d).nwchem.inp (generated) 012503371.b3lyp_6-31g(d).log.xz 012503371.td-b3lyp_6-31g+(d).inp 012503371.td-b3lyp_6-31g+(d).log.xz

012503371.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503371.td-b3lyp_6-31+g(d).gjf (generated)

012503371.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503371.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503371.mol 012503371.PUBCHEM 012503371.mol (via Jmol)
012503437.b3lyp_6-31g(d).inp

012503437.b3lyp_6-31g(d).qchem.inp (generated)

012503437.b3lyp_6-31g(d).gjf (generated)

012503437.b3lyp_6-31g(d).firefly.inp (generated)

012503437.b3lyp_6-31g(d).smash.inp (generated)

012503437.b3lyp_6-31g(d).nwchem.inp (generated) 012503437.b3lyp_6-31g(d).log.xz 012503437.td-b3lyp_6-31g+(d).inp 012503437.td-b3lyp_6-31g+(d).log.xz

012503437.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503437.td-b3lyp_6-31+g(d).gjf (generated)

012503437.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503437.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503437.mol 012503437.PUBCHEM 012503437.mol (via Jmol)
012503438.b3lyp_6-31g(d).inp

012503438.b3lyp_6-31g(d).qchem.inp (generated)

012503438.b3lyp_6-31g(d).gjf (generated)

012503438.b3lyp_6-31g(d).firefly.inp (generated)

012503438.b3lyp_6-31g(d).smash.inp (generated)

012503438.b3lyp_6-31g(d).nwchem.inp (generated) 012503438.b3lyp_6-31g(d).log.xz 012503438.td-b3lyp_6-31g+(d).inp 012503438.td-b3lyp_6-31g+(d).log.xz

012503438.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503438.td-b3lyp_6-31+g(d).gjf (generated)

012503438.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503438.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503438.mol 012503438.PUBCHEM 012503438.mol (via Jmol)
012503439.b3lyp_6-31g(d).inp

012503439.b3lyp_6-31g(d).qchem.inp (generated)

012503439.b3lyp_6-31g(d).gjf (generated)

012503439.b3lyp_6-31g(d).firefly.inp (generated)

012503439.b3lyp_6-31g(d).smash.inp (generated)

012503439.b3lyp_6-31g(d).nwchem.inp (generated) 012503439.b3lyp_6-31g(d).log.xz 012503439.td-b3lyp_6-31g+(d).inp 012503439.td-b3lyp_6-31g+(d).log.xz

012503439.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503439.td-b3lyp_6-31+g(d).gjf (generated)

012503439.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503439.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503439.mol 012503439.PUBCHEM 012503439.mol (via Jmol)
012503440.b3lyp_6-31g(d).inp

012503440.b3lyp_6-31g(d).qchem.inp (generated)

012503440.b3lyp_6-31g(d).gjf (generated)

012503440.b3lyp_6-31g(d).firefly.inp (generated)

012503440.b3lyp_6-31g(d).smash.inp (generated)

012503440.b3lyp_6-31g(d).nwchem.inp (generated) 012503440.b3lyp_6-31g(d).log.xz 012503440.td-b3lyp_6-31g+(d).inp 012503440.td-b3lyp_6-31g+(d).log.xz

012503440.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503440.td-b3lyp_6-31+g(d).gjf (generated)

012503440.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503440.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503440.mol 012503440.PUBCHEM 012503440.mol (via Jmol)
012503441.b3lyp_6-31g(d).inp

012503441.b3lyp_6-31g(d).qchem.inp (generated)

012503441.b3lyp_6-31g(d).gjf (generated)

012503441.b3lyp_6-31g(d).firefly.inp (generated)

012503441.b3lyp_6-31g(d).smash.inp (generated)

012503441.b3lyp_6-31g(d).nwchem.inp (generated) 012503441.b3lyp_6-31g(d).log.xz 012503441.td-b3lyp_6-31g+(d).inp 012503441.td-b3lyp_6-31g+(d).log.xz

012503441.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503441.td-b3lyp_6-31+g(d).gjf (generated)

012503441.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503441.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503441.mol 012503441.PUBCHEM 012503441.mol (via Jmol)
012503442.b3lyp_6-31g(d).inp

012503442.b3lyp_6-31g(d).qchem.inp (generated)

012503442.b3lyp_6-31g(d).gjf (generated)

012503442.b3lyp_6-31g(d).firefly.inp (generated)

012503442.b3lyp_6-31g(d).smash.inp (generated)

012503442.b3lyp_6-31g(d).nwchem.inp (generated) 012503442.b3lyp_6-31g(d).log.xz 012503442.td-b3lyp_6-31g+(d).inp 012503442.td-b3lyp_6-31g+(d).log.xz

012503442.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503442.td-b3lyp_6-31+g(d).gjf (generated)

012503442.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503442.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503442.mol 012503442.PUBCHEM 012503442.mol (via Jmol)
012503443.b3lyp_6-31g(d).inp

012503443.b3lyp_6-31g(d).qchem.inp (generated)

012503443.b3lyp_6-31g(d).gjf (generated)

012503443.b3lyp_6-31g(d).firefly.inp (generated)

012503443.b3lyp_6-31g(d).smash.inp (generated)

012503443.b3lyp_6-31g(d).nwchem.inp (generated) 012503443.b3lyp_6-31g(d).log.xz 012503443.td-b3lyp_6-31g+(d).inp 012503443.td-b3lyp_6-31g+(d).log.xz

012503443.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503443.td-b3lyp_6-31+g(d).gjf (generated)

012503443.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503443.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503443.mol 012503443.PUBCHEM 012503443.mol (via Jmol)
012503444.b3lyp_6-31g(d).inp

012503444.b3lyp_6-31g(d).qchem.inp (generated)

012503444.b3lyp_6-31g(d).gjf (generated)

012503444.b3lyp_6-31g(d).firefly.inp (generated)

012503444.b3lyp_6-31g(d).smash.inp (generated)

012503444.b3lyp_6-31g(d).nwchem.inp (generated) 012503444.b3lyp_6-31g(d).log.xz 012503444.td-b3lyp_6-31g+(d).inp 012503444.td-b3lyp_6-31g+(d).log.xz

012503444.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503444.td-b3lyp_6-31+g(d).gjf (generated)

012503444.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503444.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503444.mol 012503444.PUBCHEM 012503444.mol (via Jmol)
012503445.b3lyp_6-31g(d).inp

012503445.b3lyp_6-31g(d).qchem.inp (generated)

012503445.b3lyp_6-31g(d).gjf (generated)

012503445.b3lyp_6-31g(d).firefly.inp (generated)

012503445.b3lyp_6-31g(d).smash.inp (generated)

012503445.b3lyp_6-31g(d).nwchem.inp (generated) 012503445.b3lyp_6-31g(d).log.xz 012503445.td-b3lyp_6-31g+(d).inp 012503445.td-b3lyp_6-31g+(d).log.xz

012503445.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503445.td-b3lyp_6-31+g(d).gjf (generated)

012503445.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503445.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503445.mol 012503445.PUBCHEM 012503445.mol (via Jmol)
012503446.b3lyp_6-31g(d).inp

012503446.b3lyp_6-31g(d).qchem.inp (generated)

012503446.b3lyp_6-31g(d).gjf (generated)

012503446.b3lyp_6-31g(d).firefly.inp (generated)

012503446.b3lyp_6-31g(d).smash.inp (generated)

012503446.b3lyp_6-31g(d).nwchem.inp (generated) 012503446.b3lyp_6-31g(d).log.xz 012503446.td-b3lyp_6-31g+(d).inp 012503446.td-b3lyp_6-31g+(d).log.xz

012503446.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503446.td-b3lyp_6-31+g(d).gjf (generated)

012503446.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503446.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503446.mol 012503446.PUBCHEM 012503446.mol (via Jmol)
012503447.b3lyp_6-31g(d).inp

012503447.b3lyp_6-31g(d).qchem.inp (generated)

012503447.b3lyp_6-31g(d).gjf (generated)

012503447.b3lyp_6-31g(d).firefly.inp (generated)

012503447.b3lyp_6-31g(d).smash.inp (generated)

012503447.b3lyp_6-31g(d).nwchem.inp (generated) 012503447.b3lyp_6-31g(d).log.xz 012503447.td-b3lyp_6-31g+(d).inp 012503447.td-b3lyp_6-31g+(d).log.xz

012503447.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503447.td-b3lyp_6-31+g(d).gjf (generated)

012503447.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503447.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503447.mol 012503447.PUBCHEM 012503447.mol (via Jmol)
012503448.b3lyp_6-31g(d).inp

012503448.b3lyp_6-31g(d).qchem.inp (generated)

012503448.b3lyp_6-31g(d).gjf (generated)

012503448.b3lyp_6-31g(d).firefly.inp (generated)

012503448.b3lyp_6-31g(d).smash.inp (generated)

012503448.b3lyp_6-31g(d).nwchem.inp (generated) 012503448.b3lyp_6-31g(d).log.xz 012503448.td-b3lyp_6-31g+(d).inp 012503448.td-b3lyp_6-31g+(d).log.xz

012503448.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503448.td-b3lyp_6-31+g(d).gjf (generated)

012503448.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503448.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503448.mol 012503448.PUBCHEM 012503448.mol (via Jmol)
012503449.b3lyp_6-31g(d).inp

012503449.b3lyp_6-31g(d).qchem.inp (generated)

012503449.b3lyp_6-31g(d).gjf (generated)

012503449.b3lyp_6-31g(d).firefly.inp (generated)

012503449.b3lyp_6-31g(d).smash.inp (generated)

012503449.b3lyp_6-31g(d).nwchem.inp (generated) 012503449.b3lyp_6-31g(d).log.xz 012503449.td-b3lyp_6-31g+(d).inp 012503449.td-b3lyp_6-31g+(d).log.xz

012503449.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503449.td-b3lyp_6-31+g(d).gjf (generated)

012503449.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503449.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503449.mol 012503449.PUBCHEM 012503449.mol (via Jmol)
012503450.b3lyp_6-31g(d).inp

012503450.b3lyp_6-31g(d).qchem.inp (generated)

012503450.b3lyp_6-31g(d).gjf (generated)

012503450.b3lyp_6-31g(d).firefly.inp (generated)

012503450.b3lyp_6-31g(d).smash.inp (generated)

012503450.b3lyp_6-31g(d).nwchem.inp (generated) 012503450.b3lyp_6-31g(d).log.xz 012503450.td-b3lyp_6-31g+(d).inp 012503450.td-b3lyp_6-31g+(d).log.xz

012503450.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503450.td-b3lyp_6-31+g(d).gjf (generated)

012503450.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503450.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503450.mol 012503450.PUBCHEM 012503450.mol (via Jmol)
012503452.b3lyp_6-31g(d).inp

012503452.b3lyp_6-31g(d).qchem.inp (generated)

012503452.b3lyp_6-31g(d).gjf (generated)

012503452.b3lyp_6-31g(d).firefly.inp (generated)

012503452.b3lyp_6-31g(d).smash.inp (generated)

012503452.b3lyp_6-31g(d).nwchem.inp (generated) 012503452.b3lyp_6-31g(d).log.xz 012503452.td-b3lyp_6-31g+(d).inp 012503452.td-b3lyp_6-31g+(d).log.xz

012503452.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503452.td-b3lyp_6-31+g(d).gjf (generated)

012503452.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503452.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503452.mol 012503452.PUBCHEM 012503452.mol (via Jmol)
012503453.b3lyp_6-31g(d).inp

012503453.b3lyp_6-31g(d).qchem.inp (generated)

012503453.b3lyp_6-31g(d).gjf (generated)

012503453.b3lyp_6-31g(d).firefly.inp (generated)

012503453.b3lyp_6-31g(d).smash.inp (generated)

012503453.b3lyp_6-31g(d).nwchem.inp (generated) 012503453.b3lyp_6-31g(d).log.xz 012503453.td-b3lyp_6-31g+(d).inp 012503453.td-b3lyp_6-31g+(d).log.xz

012503453.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503453.td-b3lyp_6-31+g(d).gjf (generated)

012503453.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503453.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503453.mol 012503453.PUBCHEM 012503453.mol (via Jmol)
012503454.b3lyp_6-31g(d).inp

012503454.b3lyp_6-31g(d).qchem.inp (generated)

012503454.b3lyp_6-31g(d).gjf (generated)

012503454.b3lyp_6-31g(d).firefly.inp (generated)

012503454.b3lyp_6-31g(d).smash.inp (generated)

012503454.b3lyp_6-31g(d).nwchem.inp (generated) 012503454.b3lyp_6-31g(d).log.xz 012503454.td-b3lyp_6-31g+(d).inp 012503454.td-b3lyp_6-31g+(d).log.xz

012503454.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503454.td-b3lyp_6-31+g(d).gjf (generated)

012503454.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503454.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503454.mol 012503454.PUBCHEM 012503454.mol (via Jmol)
012503455.b3lyp_6-31g(d).inp

012503455.b3lyp_6-31g(d).qchem.inp (generated)

012503455.b3lyp_6-31g(d).gjf (generated)

012503455.b3lyp_6-31g(d).firefly.inp (generated)

012503455.b3lyp_6-31g(d).smash.inp (generated)

012503455.b3lyp_6-31g(d).nwchem.inp (generated) 012503455.b3lyp_6-31g(d).log.xz 012503455.td-b3lyp_6-31g+(d).inp 012503455.td-b3lyp_6-31g+(d).log.xz

012503455.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503455.td-b3lyp_6-31+g(d).gjf (generated)

012503455.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503455.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503455.mol 012503455.PUBCHEM 012503455.mol (via Jmol)
012503456.b3lyp_6-31g(d).inp

012503456.b3lyp_6-31g(d).qchem.inp (generated)

012503456.b3lyp_6-31g(d).gjf (generated)

012503456.b3lyp_6-31g(d).firefly.inp (generated)

012503456.b3lyp_6-31g(d).smash.inp (generated)

012503456.b3lyp_6-31g(d).nwchem.inp (generated) 012503456.b3lyp_6-31g(d).log.xz 012503456.td-b3lyp_6-31g+(d).inp 012503456.td-b3lyp_6-31g+(d).log.xz

012503456.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503456.td-b3lyp_6-31+g(d).gjf (generated)

012503456.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503456.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503456.mol 012503456.PUBCHEM 012503456.mol (via Jmol)
012503457.b3lyp_6-31g(d).inp

012503457.b3lyp_6-31g(d).qchem.inp (generated)

012503457.b3lyp_6-31g(d).gjf (generated)

012503457.b3lyp_6-31g(d).firefly.inp (generated)

012503457.b3lyp_6-31g(d).smash.inp (generated)

012503457.b3lyp_6-31g(d).nwchem.inp (generated) 012503457.b3lyp_6-31g(d).log.xz 012503457.td-b3lyp_6-31g+(d).inp 012503457.td-b3lyp_6-31g+(d).log.xz

012503457.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503457.td-b3lyp_6-31+g(d).gjf (generated)

012503457.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503457.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503457.mol 012503457.PUBCHEM 012503457.mol (via Jmol)
012503461.b3lyp_6-31g(d).inp

012503461.b3lyp_6-31g(d).qchem.inp (generated)

012503461.b3lyp_6-31g(d).gjf (generated)

012503461.b3lyp_6-31g(d).firefly.inp (generated)

012503461.b3lyp_6-31g(d).smash.inp (generated)

012503461.b3lyp_6-31g(d).nwchem.inp (generated) 012503461.b3lyp_6-31g(d).log.xz 012503461.td-b3lyp_6-31g+(d).inp 012503461.td-b3lyp_6-31g+(d).log.xz

012503461.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503461.td-b3lyp_6-31+g(d).gjf (generated)

012503461.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503461.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503461.mol 012503461.PUBCHEM 012503461.mol (via Jmol)
012503475.b3lyp_6-31g(d).inp

012503475.b3lyp_6-31g(d).qchem.inp (generated)

012503475.b3lyp_6-31g(d).gjf (generated)

012503475.b3lyp_6-31g(d).firefly.inp (generated)

012503475.b3lyp_6-31g(d).smash.inp (generated)

012503475.b3lyp_6-31g(d).nwchem.inp (generated) 012503475.b3lyp_6-31g(d).log.xz 012503475.td-b3lyp_6-31g+(d).inp 012503475.td-b3lyp_6-31g+(d).log.xz

012503475.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503475.td-b3lyp_6-31+g(d).gjf (generated)

012503475.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503475.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503475.mol 012503475.PUBCHEM 012503475.mol (via Jmol)
012503486.b3lyp_6-31g(d).inp

012503486.b3lyp_6-31g(d).qchem.inp (generated)

012503486.b3lyp_6-31g(d).gjf (generated)

012503486.b3lyp_6-31g(d).firefly.inp (generated)

012503486.b3lyp_6-31g(d).smash.inp (generated)

012503486.b3lyp_6-31g(d).nwchem.inp (generated) 012503486.b3lyp_6-31g(d).log.xz 012503486.td-b3lyp_6-31g+(d).inp 012503486.td-b3lyp_6-31g+(d).log.xz

012503486.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503486.td-b3lyp_6-31+g(d).gjf (generated)

012503486.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503486.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503486.mol 012503486.PUBCHEM 012503486.mol (via Jmol)
012503511.b3lyp_6-31g(d).inp

012503511.b3lyp_6-31g(d).qchem.inp (generated)

012503511.b3lyp_6-31g(d).gjf (generated)

012503511.b3lyp_6-31g(d).firefly.inp (generated)

012503511.b3lyp_6-31g(d).smash.inp (generated)

012503511.b3lyp_6-31g(d).nwchem.inp (generated) 012503511.b3lyp_6-31g(d).log.xz 012503511.td-b3lyp_6-31g+(d).inp 012503511.td-b3lyp_6-31g+(d).log.xz

012503511.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503511.td-b3lyp_6-31+g(d).gjf (generated)

012503511.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503511.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503511.mol 012503511.PUBCHEM 012503511.mol (via Jmol)
012503527.b3lyp_6-31g(d).inp

012503527.b3lyp_6-31g(d).qchem.inp (generated)

012503527.b3lyp_6-31g(d).gjf (generated)

012503527.b3lyp_6-31g(d).firefly.inp (generated)

012503527.b3lyp_6-31g(d).smash.inp (generated)

012503527.b3lyp_6-31g(d).nwchem.inp (generated) 012503527.b3lyp_6-31g(d).log.xz 012503527.td-b3lyp_6-31g+(d).inp 012503527.td-b3lyp_6-31g+(d).log.xz

012503527.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503527.td-b3lyp_6-31+g(d).gjf (generated)

012503527.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503527.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503527.mol 012503527.PUBCHEM 012503527.mol (via Jmol)
012503535.b3lyp_6-31g(d).inp

012503535.b3lyp_6-31g(d).qchem.inp (generated)

012503535.b3lyp_6-31g(d).gjf (generated)

012503535.b3lyp_6-31g(d).firefly.inp (generated)

012503535.b3lyp_6-31g(d).smash.inp (generated)

012503535.b3lyp_6-31g(d).nwchem.inp (generated) 012503535.b3lyp_6-31g(d).log.xz 012503535.td-b3lyp_6-31g+(d).inp 012503535.td-b3lyp_6-31g+(d).log.xz

012503535.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503535.td-b3lyp_6-31+g(d).gjf (generated)

012503535.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503535.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503535.mol 012503535.PUBCHEM 012503535.mol (via Jmol)
012503537.b3lyp_6-31g(d).inp

012503537.b3lyp_6-31g(d).qchem.inp (generated)

012503537.b3lyp_6-31g(d).gjf (generated)

012503537.b3lyp_6-31g(d).firefly.inp (generated)

012503537.b3lyp_6-31g(d).smash.inp (generated)

012503537.b3lyp_6-31g(d).nwchem.inp (generated) 012503537.b3lyp_6-31g(d).log.xz 012503537.td-b3lyp_6-31g+(d).inp 012503537.td-b3lyp_6-31g+(d).log.xz

012503537.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503537.td-b3lyp_6-31+g(d).gjf (generated)

012503537.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503537.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503537.mol 012503537.PUBCHEM 012503537.mol (via Jmol)
012503539.b3lyp_6-31g(d).inp

012503539.b3lyp_6-31g(d).qchem.inp (generated)

012503539.b3lyp_6-31g(d).gjf (generated)

012503539.b3lyp_6-31g(d).firefly.inp (generated)

012503539.b3lyp_6-31g(d).smash.inp (generated)

012503539.b3lyp_6-31g(d).nwchem.inp (generated) 012503539.b3lyp_6-31g(d).log.xz 012503539.td-b3lyp_6-31g+(d).inp 012503539.td-b3lyp_6-31g+(d).log.xz

012503539.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503539.td-b3lyp_6-31+g(d).gjf (generated)

012503539.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503539.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503539.mol 012503539.PUBCHEM 012503539.mol (via Jmol)
012503542.b3lyp_6-31g(d).inp

012503542.b3lyp_6-31g(d).qchem.inp (generated)

012503542.b3lyp_6-31g(d).gjf (generated)

012503542.b3lyp_6-31g(d).firefly.inp (generated)

012503542.b3lyp_6-31g(d).smash.inp (generated)

012503542.b3lyp_6-31g(d).nwchem.inp (generated) 012503542.b3lyp_6-31g(d).log.xz 012503542.td-b3lyp_6-31g+(d).inp 012503542.td-b3lyp_6-31g+(d).log.xz

012503542.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503542.td-b3lyp_6-31+g(d).gjf (generated)

012503542.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503542.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503542.mol 012503542.PUBCHEM 012503542.mol (via Jmol)
012503543.b3lyp_6-31g(d).inp

012503543.b3lyp_6-31g(d).qchem.inp (generated)

012503543.b3lyp_6-31g(d).gjf (generated)

012503543.b3lyp_6-31g(d).firefly.inp (generated)

012503543.b3lyp_6-31g(d).smash.inp (generated)

012503543.b3lyp_6-31g(d).nwchem.inp (generated) 012503543.b3lyp_6-31g(d).log.xz 012503543.td-b3lyp_6-31g+(d).inp 012503543.td-b3lyp_6-31g+(d).log.xz

012503543.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503543.td-b3lyp_6-31+g(d).gjf (generated)

012503543.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503543.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503543.mol 012503543.PUBCHEM 012503543.mol (via Jmol)
012503544.b3lyp_6-31g(d).inp

012503544.b3lyp_6-31g(d).qchem.inp (generated)

012503544.b3lyp_6-31g(d).gjf (generated)

012503544.b3lyp_6-31g(d).firefly.inp (generated)

012503544.b3lyp_6-31g(d).smash.inp (generated)

012503544.b3lyp_6-31g(d).nwchem.inp (generated) 012503544.b3lyp_6-31g(d).log.xz 012503544.td-b3lyp_6-31g+(d).inp 012503544.td-b3lyp_6-31g+(d).log.xz

012503544.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503544.td-b3lyp_6-31+g(d).gjf (generated)

012503544.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503544.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503544.mol 012503544.PUBCHEM 012503544.mol (via Jmol)
012503545.b3lyp_6-31g(d).inp

012503545.b3lyp_6-31g(d).qchem.inp (generated)

012503545.b3lyp_6-31g(d).gjf (generated)

012503545.b3lyp_6-31g(d).firefly.inp (generated)

012503545.b3lyp_6-31g(d).smash.inp (generated)

012503545.b3lyp_6-31g(d).nwchem.inp (generated) 012503545.b3lyp_6-31g(d).log.xz 012503545.td-b3lyp_6-31g+(d).inp 012503545.td-b3lyp_6-31g+(d).log.xz

012503545.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503545.td-b3lyp_6-31+g(d).gjf (generated)

012503545.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503545.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503545.mol 012503545.PUBCHEM 012503545.mol (via Jmol)
012503552.b3lyp_6-31g(d).inp

012503552.b3lyp_6-31g(d).qchem.inp (generated)

012503552.b3lyp_6-31g(d).gjf (generated)

012503552.b3lyp_6-31g(d).firefly.inp (generated)

012503552.b3lyp_6-31g(d).smash.inp (generated)

012503552.b3lyp_6-31g(d).nwchem.inp (generated) 012503552.b3lyp_6-31g(d).log.xz 012503552.td-b3lyp_6-31g+(d).inp 012503552.td-b3lyp_6-31g+(d).log.xz

012503552.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503552.td-b3lyp_6-31+g(d).gjf (generated)

012503552.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503552.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503552.mol 012503552.PUBCHEM 012503552.mol (via Jmol)
012503570.b3lyp_6-31g(d).inp

012503570.b3lyp_6-31g(d).qchem.inp (generated)

012503570.b3lyp_6-31g(d).gjf (generated)

012503570.b3lyp_6-31g(d).firefly.inp (generated)

012503570.b3lyp_6-31g(d).smash.inp (generated)

012503570.b3lyp_6-31g(d).nwchem.inp (generated) 012503570.b3lyp_6-31g(d).log.xz 012503570.td-b3lyp_6-31g+(d).inp 012503570.td-b3lyp_6-31g+(d).log.xz

012503570.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503570.td-b3lyp_6-31+g(d).gjf (generated)

012503570.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503570.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503570.mol 012503570.PUBCHEM 012503570.mol (via Jmol)
012503572.b3lyp_6-31g(d).inp

012503572.b3lyp_6-31g(d).qchem.inp (generated)

012503572.b3lyp_6-31g(d).gjf (generated)

012503572.b3lyp_6-31g(d).firefly.inp (generated)

012503572.b3lyp_6-31g(d).smash.inp (generated)

012503572.b3lyp_6-31g(d).nwchem.inp (generated) 012503572.b3lyp_6-31g(d).log.xz 012503572.td-b3lyp_6-31g+(d).inp 012503572.td-b3lyp_6-31g+(d).log.xz

012503572.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503572.td-b3lyp_6-31+g(d).gjf (generated)

012503572.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503572.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503572.mol 012503572.PUBCHEM 012503572.mol (via Jmol)
012503583.b3lyp_6-31g(d).inp

012503583.b3lyp_6-31g(d).qchem.inp (generated)

012503583.b3lyp_6-31g(d).gjf (generated)

012503583.b3lyp_6-31g(d).firefly.inp (generated)

012503583.b3lyp_6-31g(d).smash.inp (generated)

012503583.b3lyp_6-31g(d).nwchem.inp (generated) 012503583.b3lyp_6-31g(d).log.xz 012503583.td-b3lyp_6-31g+(d).inp 012503583.td-b3lyp_6-31g+(d).log.xz

012503583.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503583.td-b3lyp_6-31+g(d).gjf (generated)

012503583.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503583.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503583.mol 012503583.PUBCHEM 012503583.mol (via Jmol)
012503611.b3lyp_6-31g(d).inp

012503611.b3lyp_6-31g(d).qchem.inp (generated)

012503611.b3lyp_6-31g(d).gjf (generated)

012503611.b3lyp_6-31g(d).firefly.inp (generated)

012503611.b3lyp_6-31g(d).smash.inp (generated)

012503611.b3lyp_6-31g(d).nwchem.inp (generated) 012503611.b3lyp_6-31g(d).log.xz 012503611.td-b3lyp_6-31g+(d).inp 012503611.td-b3lyp_6-31g+(d).log.xz

012503611.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503611.td-b3lyp_6-31+g(d).gjf (generated)

012503611.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503611.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503611.mol 012503611.PUBCHEM 012503611.mol (via Jmol)
012503613.b3lyp_6-31g(d).inp

012503613.b3lyp_6-31g(d).qchem.inp (generated)

012503613.b3lyp_6-31g(d).gjf (generated)

012503613.b3lyp_6-31g(d).firefly.inp (generated)

012503613.b3lyp_6-31g(d).smash.inp (generated)

012503613.b3lyp_6-31g(d).nwchem.inp (generated) 012503613.b3lyp_6-31g(d).log.xz 012503613.td-b3lyp_6-31g+(d).inp 012503613.td-b3lyp_6-31g+(d).log.xz

012503613.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503613.td-b3lyp_6-31+g(d).gjf (generated)

012503613.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503613.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503613.mol 012503613.PUBCHEM 012503613.mol (via Jmol)
012503641.b3lyp_6-31g(d).inp

012503641.b3lyp_6-31g(d).qchem.inp (generated)

012503641.b3lyp_6-31g(d).gjf (generated)

012503641.b3lyp_6-31g(d).firefly.inp (generated)

012503641.b3lyp_6-31g(d).smash.inp (generated)

012503641.b3lyp_6-31g(d).nwchem.inp (generated) 012503641.b3lyp_6-31g(d).log.xz 012503641.td-b3lyp_6-31g+(d).inp 012503641.td-b3lyp_6-31g+(d).log.xz

012503641.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503641.td-b3lyp_6-31+g(d).gjf (generated)

012503641.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503641.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503641.mol 012503641.PUBCHEM 012503641.mol (via Jmol)
012503642.b3lyp_6-31g(d).inp

012503642.b3lyp_6-31g(d).qchem.inp (generated)

012503642.b3lyp_6-31g(d).gjf (generated)

012503642.b3lyp_6-31g(d).firefly.inp (generated)

012503642.b3lyp_6-31g(d).smash.inp (generated)

012503642.b3lyp_6-31g(d).nwchem.inp (generated) 012503642.b3lyp_6-31g(d).log.xz 012503642.td-b3lyp_6-31g+(d).inp 012503642.td-b3lyp_6-31g+(d).log.xz

012503642.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503642.td-b3lyp_6-31+g(d).gjf (generated)

012503642.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503642.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503642.mol 012503642.PUBCHEM 012503642.mol (via Jmol)
012503643.b3lyp_6-31g(d).inp

012503643.b3lyp_6-31g(d).qchem.inp (generated)

012503643.b3lyp_6-31g(d).gjf (generated)

012503643.b3lyp_6-31g(d).firefly.inp (generated)

012503643.b3lyp_6-31g(d).smash.inp (generated)

012503643.b3lyp_6-31g(d).nwchem.inp (generated) 012503643.b3lyp_6-31g(d).log.xz 012503643.td-b3lyp_6-31g+(d).inp 012503643.td-b3lyp_6-31g+(d).log.xz

012503643.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503643.td-b3lyp_6-31+g(d).gjf (generated)

012503643.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503643.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503643.mol 012503643.PUBCHEM 012503643.mol (via Jmol)
012503644.b3lyp_6-31g(d).inp

012503644.b3lyp_6-31g(d).qchem.inp (generated)

012503644.b3lyp_6-31g(d).gjf (generated)

012503644.b3lyp_6-31g(d).firefly.inp (generated)

012503644.b3lyp_6-31g(d).smash.inp (generated)

012503644.b3lyp_6-31g(d).nwchem.inp (generated) 012503644.b3lyp_6-31g(d).log.xz 012503644.td-b3lyp_6-31g+(d).inp 012503644.td-b3lyp_6-31g+(d).log.xz

012503644.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503644.td-b3lyp_6-31+g(d).gjf (generated)

012503644.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503644.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503644.mol 012503644.PUBCHEM 012503644.mol (via Jmol)
012503645.b3lyp_6-31g(d).inp

012503645.b3lyp_6-31g(d).qchem.inp (generated)

012503645.b3lyp_6-31g(d).gjf (generated)

012503645.b3lyp_6-31g(d).firefly.inp (generated)

012503645.b3lyp_6-31g(d).smash.inp (generated)

012503645.b3lyp_6-31g(d).nwchem.inp (generated) 012503645.b3lyp_6-31g(d).log.xz 012503645.td-b3lyp_6-31g+(d).inp 012503645.td-b3lyp_6-31g+(d).log.xz

012503645.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503645.td-b3lyp_6-31+g(d).gjf (generated)

012503645.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503645.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503645.mol 012503645.PUBCHEM 012503645.mol (via Jmol)
012503652.b3lyp_6-31g(d).inp

012503652.b3lyp_6-31g(d).qchem.inp (generated)

012503652.b3lyp_6-31g(d).gjf (generated)

012503652.b3lyp_6-31g(d).firefly.inp (generated)

012503652.b3lyp_6-31g(d).smash.inp (generated)

012503652.b3lyp_6-31g(d).nwchem.inp (generated) 012503652.b3lyp_6-31g(d).log.xz 012503652.td-b3lyp_6-31g+(d).inp 012503652.td-b3lyp_6-31g+(d).log.xz

012503652.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503652.td-b3lyp_6-31+g(d).gjf (generated)

012503652.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503652.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503652.mol 012503652.PUBCHEM 012503652.mol (via Jmol)
012503667.b3lyp_6-31g(d).inp

012503667.b3lyp_6-31g(d).qchem.inp (generated)

012503667.b3lyp_6-31g(d).gjf (generated)

012503667.b3lyp_6-31g(d).firefly.inp (generated)

012503667.b3lyp_6-31g(d).smash.inp (generated)

012503667.b3lyp_6-31g(d).nwchem.inp (generated) 012503667.b3lyp_6-31g(d).log.xz 012503667.td-b3lyp_6-31g+(d).inp 012503667.td-b3lyp_6-31g+(d).log.xz

012503667.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503667.td-b3lyp_6-31+g(d).gjf (generated)

012503667.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503667.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503667.mol 012503667.PUBCHEM 012503667.mol (via Jmol)
012503668.b3lyp_6-31g(d).inp

012503668.b3lyp_6-31g(d).qchem.inp (generated)

012503668.b3lyp_6-31g(d).gjf (generated)

012503668.b3lyp_6-31g(d).firefly.inp (generated)

012503668.b3lyp_6-31g(d).smash.inp (generated)

012503668.b3lyp_6-31g(d).nwchem.inp (generated) 012503668.b3lyp_6-31g(d).log.xz 012503668.td-b3lyp_6-31g+(d).inp 012503668.td-b3lyp_6-31g+(d).log.xz

012503668.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503668.td-b3lyp_6-31+g(d).gjf (generated)

012503668.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503668.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503668.mol 012503668.PUBCHEM 012503668.mol (via Jmol)
012503673.b3lyp_6-31g(d).inp

012503673.b3lyp_6-31g(d).qchem.inp (generated)

012503673.b3lyp_6-31g(d).gjf (generated)

012503673.b3lyp_6-31g(d).firefly.inp (generated)

012503673.b3lyp_6-31g(d).smash.inp (generated)

012503673.b3lyp_6-31g(d).nwchem.inp (generated) 012503673.b3lyp_6-31g(d).log.xz 012503673.td-b3lyp_6-31g+(d).inp 012503673.td-b3lyp_6-31g+(d).log.xz

012503673.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503673.td-b3lyp_6-31+g(d).gjf (generated)

012503673.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503673.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503673.mol 012503673.PUBCHEM 012503673.mol (via Jmol)
012503674.b3lyp_6-31g(d).inp

012503674.b3lyp_6-31g(d).qchem.inp (generated)

012503674.b3lyp_6-31g(d).gjf (generated)

012503674.b3lyp_6-31g(d).firefly.inp (generated)

012503674.b3lyp_6-31g(d).smash.inp (generated)

012503674.b3lyp_6-31g(d).nwchem.inp (generated) 012503674.b3lyp_6-31g(d).log.xz 012503674.td-b3lyp_6-31g+(d).inp 012503674.td-b3lyp_6-31g+(d).log.xz

012503674.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503674.td-b3lyp_6-31+g(d).gjf (generated)

012503674.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503674.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503674.mol 012503674.PUBCHEM 012503674.mol (via Jmol)
012503675.b3lyp_6-31g(d).inp

012503675.b3lyp_6-31g(d).qchem.inp (generated)

012503675.b3lyp_6-31g(d).gjf (generated)

012503675.b3lyp_6-31g(d).firefly.inp (generated)

012503675.b3lyp_6-31g(d).smash.inp (generated)

012503675.b3lyp_6-31g(d).nwchem.inp (generated) 012503675.b3lyp_6-31g(d).log.xz 012503675.mol 012503675.PUBCHEM 012503675.mol (via Jmol)
012503701.b3lyp_6-31g(d).inp

012503701.b3lyp_6-31g(d).qchem.inp (generated)

012503701.b3lyp_6-31g(d).gjf (generated)

012503701.b3lyp_6-31g(d).firefly.inp (generated)

012503701.b3lyp_6-31g(d).smash.inp (generated)

012503701.b3lyp_6-31g(d).nwchem.inp (generated) 012503701.b3lyp_6-31g(d).log.xz 012503701.td-b3lyp_6-31g+(d).inp 012503701.td-b3lyp_6-31g+(d).log.xz

012503701.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503701.td-b3lyp_6-31+g(d).gjf (generated)

012503701.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503701.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503701.mol 012503701.PUBCHEM 012503701.mol (via Jmol)
012503703.b3lyp_6-31g(d).inp

012503703.b3lyp_6-31g(d).qchem.inp (generated)

012503703.b3lyp_6-31g(d).gjf (generated)

012503703.b3lyp_6-31g(d).firefly.inp (generated)

012503703.b3lyp_6-31g(d).smash.inp (generated)

012503703.b3lyp_6-31g(d).nwchem.inp (generated) 012503703.b3lyp_6-31g(d).log.xz 012503703.td-b3lyp_6-31g+(d).inp 012503703.td-b3lyp_6-31g+(d).log.xz

012503703.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503703.td-b3lyp_6-31+g(d).gjf (generated)

012503703.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503703.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503703.mol 012503703.PUBCHEM 012503703.mol (via Jmol)
012503714.b3lyp_6-31g(d).inp

012503714.b3lyp_6-31g(d).qchem.inp (generated)

012503714.b3lyp_6-31g(d).gjf (generated)

012503714.b3lyp_6-31g(d).firefly.inp (generated)

012503714.b3lyp_6-31g(d).smash.inp (generated)

012503714.b3lyp_6-31g(d).nwchem.inp (generated) 012503714.b3lyp_6-31g(d).log.xz 012503714.td-b3lyp_6-31g+(d).inp 012503714.td-b3lyp_6-31g+(d).log.xz

012503714.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503714.td-b3lyp_6-31+g(d).gjf (generated)

012503714.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503714.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503714.mol 012503714.PUBCHEM 012503714.mol (via Jmol)
012503715.b3lyp_6-31g(d).inp

012503715.b3lyp_6-31g(d).qchem.inp (generated)

012503715.b3lyp_6-31g(d).gjf (generated)

012503715.b3lyp_6-31g(d).firefly.inp (generated)

012503715.b3lyp_6-31g(d).smash.inp (generated)

012503715.b3lyp_6-31g(d).nwchem.inp (generated) 012503715.b3lyp_6-31g(d).log.xz 012503715.td-b3lyp_6-31g+(d).inp 012503715.td-b3lyp_6-31g+(d).log.xz

012503715.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503715.td-b3lyp_6-31+g(d).gjf (generated)

012503715.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503715.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503715.mol 012503715.PUBCHEM 012503715.mol (via Jmol)
012503717.b3lyp_6-31g(d).inp

012503717.b3lyp_6-31g(d).qchem.inp (generated)

012503717.b3lyp_6-31g(d).gjf (generated)

012503717.b3lyp_6-31g(d).firefly.inp (generated)

012503717.b3lyp_6-31g(d).smash.inp (generated)

012503717.b3lyp_6-31g(d).nwchem.inp (generated) 012503717.b3lyp_6-31g(d).log.xz 012503717.td-b3lyp_6-31g+(d).inp 012503717.td-b3lyp_6-31g+(d).log.xz

012503717.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503717.td-b3lyp_6-31+g(d).gjf (generated)

012503717.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503717.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503717.mol 012503717.PUBCHEM 012503717.mol (via Jmol)
012503730.b3lyp_6-31g(d).inp

012503730.b3lyp_6-31g(d).qchem.inp (generated)

012503730.b3lyp_6-31g(d).gjf (generated)

012503730.b3lyp_6-31g(d).firefly.inp (generated)

012503730.b3lyp_6-31g(d).smash.inp (generated)

012503730.b3lyp_6-31g(d).nwchem.inp (generated) 012503730.b3lyp_6-31g(d).log.xz 012503730.td-b3lyp_6-31g+(d).inp 012503730.td-b3lyp_6-31g+(d).log.xz

012503730.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503730.td-b3lyp_6-31+g(d).gjf (generated)

012503730.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503730.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503730.mol 012503730.PUBCHEM 012503730.mol (via Jmol)
012503736.b3lyp_6-31g(d).inp

012503736.b3lyp_6-31g(d).qchem.inp (generated)

012503736.b3lyp_6-31g(d).gjf (generated)

012503736.b3lyp_6-31g(d).firefly.inp (generated)

012503736.b3lyp_6-31g(d).smash.inp (generated)

012503736.b3lyp_6-31g(d).nwchem.inp (generated) 012503736.b3lyp_6-31g(d).log.xz 012503736.td-b3lyp_6-31g+(d).inp 012503736.td-b3lyp_6-31g+(d).log.xz

012503736.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503736.td-b3lyp_6-31+g(d).gjf (generated)

012503736.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503736.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503736.mol 012503736.PUBCHEM 012503736.mol (via Jmol)
012503758.b3lyp_6-31g(d).inp

012503758.b3lyp_6-31g(d).qchem.inp (generated)

012503758.b3lyp_6-31g(d).gjf (generated)

012503758.b3lyp_6-31g(d).firefly.inp (generated)

012503758.b3lyp_6-31g(d).smash.inp (generated)

012503758.b3lyp_6-31g(d).nwchem.inp (generated) 012503758.b3lyp_6-31g(d).log.xz 012503758.td-b3lyp_6-31g+(d).inp 012503758.td-b3lyp_6-31g+(d).log.xz

012503758.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503758.td-b3lyp_6-31+g(d).gjf (generated)

012503758.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503758.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503758.mol 012503758.PUBCHEM 012503758.mol (via Jmol)
012503787.b3lyp_6-31g(d).inp

012503787.b3lyp_6-31g(d).qchem.inp (generated)

012503787.b3lyp_6-31g(d).gjf (generated)

012503787.b3lyp_6-31g(d).firefly.inp (generated)

012503787.b3lyp_6-31g(d).smash.inp (generated)

012503787.b3lyp_6-31g(d).nwchem.inp (generated) 012503787.b3lyp_6-31g(d).log.xz 012503787.td-b3lyp_6-31g+(d).inp 012503787.td-b3lyp_6-31g+(d).log.xz

012503787.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503787.td-b3lyp_6-31+g(d).gjf (generated)

012503787.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503787.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503787.mol 012503787.PUBCHEM 012503787.mol (via Jmol)
012503793.b3lyp_6-31g(d).inp

012503793.b3lyp_6-31g(d).qchem.inp (generated)

012503793.b3lyp_6-31g(d).gjf (generated)

012503793.b3lyp_6-31g(d).firefly.inp (generated)

012503793.b3lyp_6-31g(d).smash.inp (generated)

012503793.b3lyp_6-31g(d).nwchem.inp (generated) 012503793.b3lyp_6-31g(d).log.xz 012503793.td-b3lyp_6-31g+(d).inp 012503793.td-b3lyp_6-31g+(d).log.xz

012503793.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503793.td-b3lyp_6-31+g(d).gjf (generated)

012503793.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503793.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503793.mol 012503793.PUBCHEM 012503793.mol (via Jmol)
012503794.b3lyp_6-31g(d).inp

012503794.b3lyp_6-31g(d).qchem.inp (generated)

012503794.b3lyp_6-31g(d).gjf (generated)

012503794.b3lyp_6-31g(d).firefly.inp (generated)

012503794.b3lyp_6-31g(d).smash.inp (generated)

012503794.b3lyp_6-31g(d).nwchem.inp (generated) 012503794.b3lyp_6-31g(d).log.xz 012503794.td-b3lyp_6-31g+(d).inp 012503794.td-b3lyp_6-31g+(d).log.xz

012503794.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503794.td-b3lyp_6-31+g(d).gjf (generated)

012503794.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503794.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503794.mol 012503794.PUBCHEM 012503794.mol (via Jmol)
012503795.b3lyp_6-31g(d).inp

012503795.b3lyp_6-31g(d).qchem.inp (generated)

012503795.b3lyp_6-31g(d).gjf (generated)

012503795.b3lyp_6-31g(d).firefly.inp (generated)

012503795.b3lyp_6-31g(d).smash.inp (generated)

012503795.b3lyp_6-31g(d).nwchem.inp (generated) 012503795.b3lyp_6-31g(d).log.xz 012503795.td-b3lyp_6-31g+(d).inp 012503795.td-b3lyp_6-31g+(d).log.xz

012503795.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503795.td-b3lyp_6-31+g(d).gjf (generated)

012503795.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503795.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503795.mol 012503795.PUBCHEM 012503795.mol (via Jmol)
012503801.b3lyp_6-31g(d).inp

012503801.b3lyp_6-31g(d).qchem.inp (generated)

012503801.b3lyp_6-31g(d).gjf (generated)

012503801.b3lyp_6-31g(d).firefly.inp (generated)

012503801.b3lyp_6-31g(d).smash.inp (generated)

012503801.b3lyp_6-31g(d).nwchem.inp (generated) 012503801.b3lyp_6-31g(d).log.xz 012503801.td-b3lyp_6-31g+(d).inp 012503801.td-b3lyp_6-31g+(d).log.xz

012503801.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503801.td-b3lyp_6-31+g(d).gjf (generated)

012503801.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503801.mol 012503801.PUBCHEM 012503801.mol (via Jmol)
012503802.b3lyp_6-31g(d).inp

012503802.b3lyp_6-31g(d).qchem.inp (generated)

012503802.b3lyp_6-31g(d).gjf (generated)

012503802.b3lyp_6-31g(d).firefly.inp (generated)

012503802.b3lyp_6-31g(d).smash.inp (generated)

012503802.b3lyp_6-31g(d).nwchem.inp (generated) 012503802.b3lyp_6-31g(d).log.xz 012503802.td-b3lyp_6-31g+(d).inp 012503802.td-b3lyp_6-31g+(d).log.xz

012503802.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503802.td-b3lyp_6-31+g(d).gjf (generated)

012503802.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503802.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503802.mol 012503802.PUBCHEM 012503802.mol (via Jmol)
012503804.b3lyp_6-31g(d).inp

012503804.b3lyp_6-31g(d).qchem.inp (generated)

012503804.b3lyp_6-31g(d).gjf (generated)

012503804.b3lyp_6-31g(d).firefly.inp (generated)

012503804.b3lyp_6-31g(d).smash.inp (generated)

012503804.b3lyp_6-31g(d).nwchem.inp (generated) 012503804.b3lyp_6-31g(d).log.xz 012503804.td-b3lyp_6-31g+(d).inp 012503804.td-b3lyp_6-31g+(d).log.xz

012503804.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503804.td-b3lyp_6-31+g(d).gjf (generated)

012503804.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503804.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503804.mol 012503804.PUBCHEM 012503804.mol (via Jmol)
012503814.b3lyp_6-31g(d).inp

012503814.b3lyp_6-31g(d).qchem.inp (generated)

012503814.b3lyp_6-31g(d).gjf (generated)

012503814.b3lyp_6-31g(d).firefly.inp (generated)

012503814.b3lyp_6-31g(d).smash.inp (generated)

012503814.b3lyp_6-31g(d).nwchem.inp (generated) 012503814.b3lyp_6-31g(d).log.xz 012503814.td-b3lyp_6-31g+(d).inp 012503814.td-b3lyp_6-31g+(d).log.xz

012503814.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503814.td-b3lyp_6-31+g(d).gjf (generated)

012503814.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503814.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503814.mol 012503814.PUBCHEM 012503814.mol (via Jmol)
012503823.b3lyp_6-31g(d).inp

012503823.b3lyp_6-31g(d).qchem.inp (generated)

012503823.b3lyp_6-31g(d).gjf (generated)

012503823.b3lyp_6-31g(d).firefly.inp (generated)

012503823.b3lyp_6-31g(d).smash.inp (generated)

012503823.b3lyp_6-31g(d).nwchem.inp (generated) 012503823.b3lyp_6-31g(d).log.xz 012503823.td-b3lyp_6-31g+(d).inp 012503823.td-b3lyp_6-31g+(d).log.xz

012503823.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503823.td-b3lyp_6-31+g(d).gjf (generated)

012503823.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503823.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503823.mol 012503823.PUBCHEM 012503823.mol (via Jmol)
012503824.b3lyp_6-31g(d).inp

012503824.b3lyp_6-31g(d).qchem.inp (generated)

012503824.b3lyp_6-31g(d).gjf (generated)

012503824.b3lyp_6-31g(d).firefly.inp (generated)

012503824.b3lyp_6-31g(d).smash.inp (generated)

012503824.b3lyp_6-31g(d).nwchem.inp (generated) 012503824.b3lyp_6-31g(d).log.xz 012503824.td-b3lyp_6-31g+(d).inp 012503824.td-b3lyp_6-31g+(d).log.xz

012503824.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503824.td-b3lyp_6-31+g(d).gjf (generated)

012503824.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503824.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503824.mol 012503824.PUBCHEM 012503824.mol (via Jmol)
012503827.b3lyp_6-31g(d).inp

012503827.b3lyp_6-31g(d).qchem.inp (generated)

012503827.b3lyp_6-31g(d).gjf (generated)

012503827.b3lyp_6-31g(d).firefly.inp (generated)

012503827.b3lyp_6-31g(d).smash.inp (generated)

012503827.b3lyp_6-31g(d).nwchem.inp (generated) 012503827.b3lyp_6-31g(d).log.xz 012503827.td-b3lyp_6-31g+(d).inp 012503827.td-b3lyp_6-31g+(d).log.xz

012503827.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503827.td-b3lyp_6-31+g(d).gjf (generated)

012503827.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503827.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503827.mol 012503827.PUBCHEM 012503827.mol (via Jmol)
012503828.b3lyp_6-31g(d).inp

012503828.b3lyp_6-31g(d).qchem.inp (generated)

012503828.b3lyp_6-31g(d).gjf (generated)

012503828.b3lyp_6-31g(d).firefly.inp (generated)

012503828.b3lyp_6-31g(d).smash.inp (generated)

012503828.b3lyp_6-31g(d).nwchem.inp (generated) 012503828.b3lyp_6-31g(d).log.xz 012503828.td-b3lyp_6-31g+(d).inp 012503828.td-b3lyp_6-31g+(d).log.xz

012503828.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503828.td-b3lyp_6-31+g(d).gjf (generated)

012503828.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503828.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503828.mol 012503828.PUBCHEM 012503828.mol (via Jmol)
012503829.b3lyp_6-31g(d).inp

012503829.b3lyp_6-31g(d).qchem.inp (generated)

012503829.b3lyp_6-31g(d).gjf (generated)

012503829.b3lyp_6-31g(d).firefly.inp (generated)

012503829.b3lyp_6-31g(d).smash.inp (generated)

012503829.b3lyp_6-31g(d).nwchem.inp (generated) 012503829.b3lyp_6-31g(d).log.xz 012503829.td-b3lyp_6-31g+(d).inp 012503829.td-b3lyp_6-31g+(d).log.xz

012503829.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503829.td-b3lyp_6-31+g(d).gjf (generated)

012503829.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503829.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503829.mol 012503829.PUBCHEM 012503829.mol (via Jmol)
012503843.b3lyp_6-31g(d).inp

012503843.b3lyp_6-31g(d).qchem.inp (generated)

012503843.b3lyp_6-31g(d).gjf (generated)

012503843.b3lyp_6-31g(d).firefly.inp (generated)

012503843.b3lyp_6-31g(d).smash.inp (generated)

012503843.b3lyp_6-31g(d).nwchem.inp (generated) 012503843.b3lyp_6-31g(d).log.xz 012503843.td-b3lyp_6-31g+(d).inp 012503843.td-b3lyp_6-31g+(d).log.xz

012503843.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503843.td-b3lyp_6-31+g(d).gjf (generated)

012503843.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503843.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503843.mol 012503843.PUBCHEM 012503843.mol (via Jmol)
012503845.b3lyp_6-31g(d).inp

012503845.b3lyp_6-31g(d).qchem.inp (generated)

012503845.b3lyp_6-31g(d).gjf (generated)

012503845.b3lyp_6-31g(d).firefly.inp (generated)

012503845.b3lyp_6-31g(d).smash.inp (generated)

012503845.b3lyp_6-31g(d).nwchem.inp (generated) 012503845.b3lyp_6-31g(d).log.xz 012503845.td-b3lyp_6-31g+(d).inp 012503845.td-b3lyp_6-31g+(d).log.xz

012503845.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503845.td-b3lyp_6-31+g(d).gjf (generated)

012503845.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503845.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503845.mol 012503845.PUBCHEM 012503845.mol (via Jmol)
012503846.b3lyp_6-31g(d).inp

012503846.b3lyp_6-31g(d).qchem.inp (generated)

012503846.b3lyp_6-31g(d).gjf (generated)

012503846.b3lyp_6-31g(d).firefly.inp (generated)

012503846.b3lyp_6-31g(d).smash.inp (generated)

012503846.b3lyp_6-31g(d).nwchem.inp (generated) 012503846.b3lyp_6-31g(d).log.xz 012503846.td-b3lyp_6-31g+(d).inp 012503846.td-b3lyp_6-31g+(d).log.xz

012503846.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503846.td-b3lyp_6-31+g(d).gjf (generated)

012503846.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503846.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503846.mol 012503846.PUBCHEM 012503846.mol (via Jmol)
012503848.b3lyp_6-31g(d).inp

012503848.b3lyp_6-31g(d).qchem.inp (generated)

012503848.b3lyp_6-31g(d).gjf (generated)

012503848.b3lyp_6-31g(d).firefly.inp (generated)

012503848.b3lyp_6-31g(d).smash.inp (generated)

012503848.b3lyp_6-31g(d).nwchem.inp (generated) 012503848.b3lyp_6-31g(d).log.xz 012503848.td-b3lyp_6-31g+(d).inp 012503848.td-b3lyp_6-31g+(d).log.xz

012503848.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503848.td-b3lyp_6-31+g(d).gjf (generated)

012503848.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503848.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503848.mol 012503848.PUBCHEM 012503848.mol (via Jmol)
012503849.b3lyp_6-31g(d).inp

012503849.b3lyp_6-31g(d).qchem.inp (generated)

012503849.b3lyp_6-31g(d).gjf (generated)

012503849.b3lyp_6-31g(d).firefly.inp (generated)

012503849.b3lyp_6-31g(d).smash.inp (generated)

012503849.b3lyp_6-31g(d).nwchem.inp (generated) 012503849.b3lyp_6-31g(d).log.xz 012503849.td-b3lyp_6-31g+(d).inp 012503849.td-b3lyp_6-31g+(d).log.xz

012503849.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503849.td-b3lyp_6-31+g(d).gjf (generated)

012503849.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503849.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503849.mol 012503849.PUBCHEM 012503849.mol (via Jmol)
012503850.b3lyp_6-31g(d).inp

012503850.b3lyp_6-31g(d).qchem.inp (generated)

012503850.b3lyp_6-31g(d).gjf (generated)

012503850.b3lyp_6-31g(d).firefly.inp (generated)

012503850.b3lyp_6-31g(d).smash.inp (generated)

012503850.b3lyp_6-31g(d).nwchem.inp (generated) 012503850.b3lyp_6-31g(d).log.xz 012503850.td-b3lyp_6-31g+(d).inp 012503850.td-b3lyp_6-31g+(d).log.xz

012503850.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503850.td-b3lyp_6-31+g(d).gjf (generated)

012503850.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503850.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503850.mol 012503850.PUBCHEM 012503850.mol (via Jmol)
012503858.b3lyp_6-31g(d).inp

012503858.b3lyp_6-31g(d).qchem.inp (generated)

012503858.b3lyp_6-31g(d).gjf (generated)

012503858.b3lyp_6-31g(d).firefly.inp (generated)

012503858.b3lyp_6-31g(d).smash.inp (generated)

012503858.b3lyp_6-31g(d).nwchem.inp (generated) 012503858.b3lyp_6-31g(d).log.xz 012503858.td-b3lyp_6-31g+(d).inp 012503858.td-b3lyp_6-31g+(d).log.xz

012503858.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503858.td-b3lyp_6-31+g(d).gjf (generated)

012503858.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503858.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503858.mol 012503858.PUBCHEM 012503858.mol (via Jmol)
012503862.b3lyp_6-31g(d).inp

012503862.b3lyp_6-31g(d).qchem.inp (generated)

012503862.b3lyp_6-31g(d).gjf (generated)

012503862.b3lyp_6-31g(d).firefly.inp (generated)

012503862.b3lyp_6-31g(d).smash.inp (generated)

012503862.b3lyp_6-31g(d).nwchem.inp (generated) 012503862.b3lyp_6-31g(d).log.xz 012503862.td-b3lyp_6-31g+(d).inp 012503862.td-b3lyp_6-31g+(d).log.xz

012503862.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503862.td-b3lyp_6-31+g(d).gjf (generated)

012503862.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503862.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503862.mol 012503862.PUBCHEM 012503862.mol (via Jmol)
012503864.b3lyp_6-31g(d).inp

012503864.b3lyp_6-31g(d).qchem.inp (generated)

012503864.b3lyp_6-31g(d).gjf (generated)

012503864.b3lyp_6-31g(d).firefly.inp (generated)

012503864.b3lyp_6-31g(d).smash.inp (generated)

012503864.b3lyp_6-31g(d).nwchem.inp (generated) 012503864.b3lyp_6-31g(d).log.xz 012503864.td-b3lyp_6-31g+(d).inp 012503864.td-b3lyp_6-31g+(d).log.xz

012503864.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503864.td-b3lyp_6-31+g(d).gjf (generated)

012503864.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503864.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503864.mol 012503864.PUBCHEM 012503864.mol (via Jmol)
012503871.b3lyp_6-31g(d).inp

012503871.b3lyp_6-31g(d).qchem.inp (generated)

012503871.b3lyp_6-31g(d).gjf (generated)

012503871.b3lyp_6-31g(d).firefly.inp (generated)

012503871.b3lyp_6-31g(d).smash.inp (generated)

012503871.b3lyp_6-31g(d).nwchem.inp (generated) 012503871.b3lyp_6-31g(d).log.xz 012503871.td-b3lyp_6-31g+(d).inp 012503871.td-b3lyp_6-31g+(d).log.xz

012503871.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503871.td-b3lyp_6-31+g(d).gjf (generated)

012503871.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503871.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503871.mol 012503871.PUBCHEM 012503871.mol (via Jmol)
012503872.b3lyp_6-31g(d).inp

012503872.b3lyp_6-31g(d).qchem.inp (generated)

012503872.b3lyp_6-31g(d).gjf (generated)

012503872.b3lyp_6-31g(d).firefly.inp (generated)

012503872.b3lyp_6-31g(d).smash.inp (generated)

012503872.b3lyp_6-31g(d).nwchem.inp (generated) 012503872.b3lyp_6-31g(d).log.xz 012503872.td-b3lyp_6-31g+(d).inp 012503872.td-b3lyp_6-31g+(d).log.xz

012503872.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503872.td-b3lyp_6-31+g(d).gjf (generated)

012503872.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503872.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503872.mol 012503872.PUBCHEM 012503872.mol (via Jmol)
012503873.b3lyp_6-31g(d).inp

012503873.b3lyp_6-31g(d).qchem.inp (generated)

012503873.b3lyp_6-31g(d).gjf (generated)

012503873.b3lyp_6-31g(d).firefly.inp (generated)

012503873.b3lyp_6-31g(d).smash.inp (generated)

012503873.b3lyp_6-31g(d).nwchem.inp (generated) 012503873.b3lyp_6-31g(d).log.xz 012503873.td-b3lyp_6-31g+(d).inp 012503873.td-b3lyp_6-31g+(d).log.xz

012503873.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503873.td-b3lyp_6-31+g(d).gjf (generated)

012503873.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503873.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503873.mol 012503873.PUBCHEM 012503873.mol (via Jmol)
012503876.b3lyp_6-31g(d).inp

012503876.b3lyp_6-31g(d).qchem.inp (generated)

012503876.b3lyp_6-31g(d).gjf (generated)

012503876.b3lyp_6-31g(d).firefly.inp (generated)

012503876.b3lyp_6-31g(d).smash.inp (generated)

012503876.b3lyp_6-31g(d).nwchem.inp (generated) 012503876.b3lyp_6-31g(d).log.xz 012503876.td-b3lyp_6-31g+(d).inp 012503876.td-b3lyp_6-31g+(d).log.xz

012503876.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503876.td-b3lyp_6-31+g(d).gjf (generated)

012503876.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503876.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503876.mol 012503876.PUBCHEM 012503876.mol (via Jmol)
012503900.b3lyp_6-31g(d).inp

012503900.b3lyp_6-31g(d).qchem.inp (generated)

012503900.b3lyp_6-31g(d).gjf (generated)

012503900.b3lyp_6-31g(d).firefly.inp (generated)

012503900.b3lyp_6-31g(d).smash.inp (generated)

012503900.b3lyp_6-31g(d).nwchem.inp (generated) 012503900.b3lyp_6-31g(d).log.xz 012503900.mol 012503900.PUBCHEM 012503900.mol (via Jmol)
012503948.b3lyp_6-31g(d).inp

012503948.b3lyp_6-31g(d).qchem.inp (generated)

012503948.b3lyp_6-31g(d).gjf (generated)

012503948.b3lyp_6-31g(d).firefly.inp (generated)

012503948.b3lyp_6-31g(d).smash.inp (generated)

012503948.b3lyp_6-31g(d).nwchem.inp (generated) 012503948.b3lyp_6-31g(d).log.xz 012503948.td-b3lyp_6-31g+(d).inp 012503948.td-b3lyp_6-31g+(d).log.xz

012503948.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503948.td-b3lyp_6-31+g(d).gjf (generated)

012503948.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503948.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503948.mol 012503948.PUBCHEM 012503948.mol (via Jmol)
012503949.b3lyp_6-31g(d).inp

012503949.b3lyp_6-31g(d).qchem.inp (generated)

012503949.b3lyp_6-31g(d).gjf (generated)

012503949.b3lyp_6-31g(d).firefly.inp (generated)

012503949.b3lyp_6-31g(d).smash.inp (generated)

012503949.b3lyp_6-31g(d).nwchem.inp (generated) 012503949.b3lyp_6-31g(d).log.xz 012503949.td-b3lyp_6-31g+(d).inp 012503949.td-b3lyp_6-31g+(d).log.xz

012503949.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503949.td-b3lyp_6-31+g(d).gjf (generated)

012503949.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503949.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503949.mol 012503949.PUBCHEM 012503949.mol (via Jmol)
012503950.b3lyp_6-31g(d).inp

012503950.b3lyp_6-31g(d).qchem.inp (generated)

012503950.b3lyp_6-31g(d).gjf (generated)

012503950.b3lyp_6-31g(d).firefly.inp (generated)

012503950.b3lyp_6-31g(d).smash.inp (generated)

012503950.b3lyp_6-31g(d).nwchem.inp (generated) 012503950.b3lyp_6-31g(d).log.xz 012503950.td-b3lyp_6-31g+(d).inp 012503950.td-b3lyp_6-31g+(d).log.xz

012503950.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503950.td-b3lyp_6-31+g(d).gjf (generated)

012503950.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503950.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503950.mol 012503950.PUBCHEM 012503950.mol (via Jmol)
012503951.b3lyp_6-31g(d).inp

012503951.b3lyp_6-31g(d).qchem.inp (generated)

012503951.b3lyp_6-31g(d).gjf (generated)

012503951.b3lyp_6-31g(d).firefly.inp (generated)

012503951.b3lyp_6-31g(d).smash.inp (generated)

012503951.b3lyp_6-31g(d).nwchem.inp (generated) 012503951.b3lyp_6-31g(d).log.xz 012503951.td-b3lyp_6-31g+(d).inp 012503951.td-b3lyp_6-31g+(d).log.xz

012503951.td-b3lyp_6-31+g(d).qchem.inp (generated)

012503951.td-b3lyp_6-31+g(d).gjf (generated)

012503951.td-b3lyp_6-31+g(d).firefly.inp (generated)

012503951.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012503951.mol 012503951.PUBCHEM 012503951.mol (via Jmol)
012503954.b3lyp_6-31g(d).inp

012503954.b3lyp_6-31g(d).qchem.inp (generated)

012503954.b3lyp_6-31g(d).gjf (generated)

012503954.b3lyp_6-31g(d).firefly.inp (generated)

012503954.b3lyp_6-31g(d).smash.inp (generated)

012503954.b3lyp_6-31g(d).nwchem.inp (generated) 012503954.b3lyp_6-31g(d).log.xz 012503954.mol 012503954.PUBCHEM 012503954.mol (via Jmol)
012504008.b3lyp_6-31g(d).inp

012504008.b3lyp_6-31g(d).qchem.inp (generated)

012504008.b3lyp_6-31g(d).gjf (generated)

012504008.b3lyp_6-31g(d).firefly.inp (generated)

012504008.b3lyp_6-31g(d).smash.inp (generated)

012504008.b3lyp_6-31g(d).nwchem.inp (generated) 012504008.b3lyp_6-31g(d).log.xz 012504008.td-b3lyp_6-31g+(d).inp 012504008.td-b3lyp_6-31g+(d).log.xz

012504008.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504008.td-b3lyp_6-31+g(d).gjf (generated)

012504008.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504008.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504008.mol 012504008.PUBCHEM 012504008.mol (via Jmol)
012504025.b3lyp_6-31g(d).inp

012504025.b3lyp_6-31g(d).qchem.inp (generated)

012504025.b3lyp_6-31g(d).gjf (generated)

012504025.b3lyp_6-31g(d).firefly.inp (generated)

012504025.b3lyp_6-31g(d).smash.inp (generated)

012504025.b3lyp_6-31g(d).nwchem.inp (generated) 012504025.b3lyp_6-31g(d).log.xz 012504025.td-b3lyp_6-31g+(d).inp 012504025.td-b3lyp_6-31g+(d).log.xz

012504025.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504025.td-b3lyp_6-31+g(d).gjf (generated)

012504025.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504025.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504025.mol 012504025.PUBCHEM 012504025.mol (via Jmol)
012504027.b3lyp_6-31g(d).inp

012504027.b3lyp_6-31g(d).qchem.inp (generated)

012504027.b3lyp_6-31g(d).gjf (generated)

012504027.b3lyp_6-31g(d).firefly.inp (generated)

012504027.b3lyp_6-31g(d).smash.inp (generated)

012504027.b3lyp_6-31g(d).nwchem.inp (generated) 012504027.b3lyp_6-31g(d).log.xz 012504027.td-b3lyp_6-31g+(d).inp 012504027.td-b3lyp_6-31g+(d).log.xz

012504027.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504027.td-b3lyp_6-31+g(d).gjf (generated)

012504027.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504027.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504027.mol 012504027.PUBCHEM 012504027.mol (via Jmol)
012504039.b3lyp_6-31g(d).inp

012504039.b3lyp_6-31g(d).qchem.inp (generated)

012504039.b3lyp_6-31g(d).gjf (generated)

012504039.b3lyp_6-31g(d).firefly.inp (generated)

012504039.b3lyp_6-31g(d).smash.inp (generated)

012504039.b3lyp_6-31g(d).nwchem.inp (generated) 012504039.b3lyp_6-31g(d).log.xz 012504039.td-b3lyp_6-31g+(d).inp 012504039.td-b3lyp_6-31g+(d).log.xz

012504039.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504039.td-b3lyp_6-31+g(d).gjf (generated)

012504039.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504039.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504039.mol 012504039.PUBCHEM 012504039.mol (via Jmol)
012504040.b3lyp_6-31g(d).inp

012504040.b3lyp_6-31g(d).qchem.inp (generated)

012504040.b3lyp_6-31g(d).gjf (generated)

012504040.b3lyp_6-31g(d).firefly.inp (generated)

012504040.b3lyp_6-31g(d).smash.inp (generated)

012504040.b3lyp_6-31g(d).nwchem.inp (generated) 012504040.b3lyp_6-31g(d).log.xz 012504040.td-b3lyp_6-31g+(d).inp 012504040.td-b3lyp_6-31g+(d).log.xz

012504040.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504040.td-b3lyp_6-31+g(d).gjf (generated)

012504040.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504040.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504040.mol 012504040.PUBCHEM 012504040.mol (via Jmol)
012504045.b3lyp_6-31g(d).inp

012504045.b3lyp_6-31g(d).qchem.inp (generated)

012504045.b3lyp_6-31g(d).gjf (generated)

012504045.b3lyp_6-31g(d).firefly.inp (generated)

012504045.b3lyp_6-31g(d).smash.inp (generated)

012504045.b3lyp_6-31g(d).nwchem.inp (generated) 012504045.b3lyp_6-31g(d).log.xz 012504045.td-b3lyp_6-31g+(d).inp 012504045.td-b3lyp_6-31g+(d).log.xz

012504045.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504045.td-b3lyp_6-31+g(d).gjf (generated)

012504045.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504045.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504045.mol 012504045.PUBCHEM 012504045.mol (via Jmol)
012504054.b3lyp_6-31g(d).inp

012504054.b3lyp_6-31g(d).qchem.inp (generated)

012504054.b3lyp_6-31g(d).gjf (generated)

012504054.b3lyp_6-31g(d).firefly.inp (generated)

012504054.b3lyp_6-31g(d).smash.inp (generated)

012504054.b3lyp_6-31g(d).nwchem.inp (generated) 012504054.b3lyp_6-31g(d).log.xz 012504054.td-b3lyp_6-31g+(d).inp 012504054.td-b3lyp_6-31g+(d).log.xz

012504054.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504054.td-b3lyp_6-31+g(d).gjf (generated)

012504054.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504054.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504054.mol 012504054.PUBCHEM 012504054.mol (via Jmol)
012504056.b3lyp_6-31g(d).inp

012504056.b3lyp_6-31g(d).qchem.inp (generated)

012504056.b3lyp_6-31g(d).gjf (generated)

012504056.b3lyp_6-31g(d).firefly.inp (generated)

012504056.b3lyp_6-31g(d).smash.inp (generated)

012504056.b3lyp_6-31g(d).nwchem.inp (generated) 012504056.b3lyp_6-31g(d).log.xz 012504056.td-b3lyp_6-31g+(d).inp 012504056.td-b3lyp_6-31g+(d).log.xz

012504056.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504056.td-b3lyp_6-31+g(d).gjf (generated)

012504056.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504056.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504056.mol 012504056.PUBCHEM 012504056.mol (via Jmol)
012504065.b3lyp_6-31g(d).inp

012504065.b3lyp_6-31g(d).qchem.inp (generated)

012504065.b3lyp_6-31g(d).gjf (generated)

012504065.b3lyp_6-31g(d).firefly.inp (generated)

012504065.b3lyp_6-31g(d).smash.inp (generated)

012504065.b3lyp_6-31g(d).nwchem.inp (generated) 012504065.b3lyp_6-31g(d).log.xz 012504065.td-b3lyp_6-31g+(d).inp 012504065.td-b3lyp_6-31g+(d).log.xz

012504065.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504065.td-b3lyp_6-31+g(d).gjf (generated)

012504065.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504065.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504065.mol 012504065.PUBCHEM 012504065.mol (via Jmol)
012504067.b3lyp_6-31g(d).inp

012504067.b3lyp_6-31g(d).qchem.inp (generated)

012504067.b3lyp_6-31g(d).gjf (generated)

012504067.b3lyp_6-31g(d).firefly.inp (generated)

012504067.b3lyp_6-31g(d).smash.inp (generated)

012504067.b3lyp_6-31g(d).nwchem.inp (generated) 012504067.b3lyp_6-31g(d).log.xz 012504067.td-b3lyp_6-31g+(d).inp 012504067.td-b3lyp_6-31g+(d).log.xz

012504067.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504067.td-b3lyp_6-31+g(d).gjf (generated)

012504067.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504067.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504067.mol 012504067.PUBCHEM 012504067.mol (via Jmol)
012504075.b3lyp_6-31g(d).inp

012504075.b3lyp_6-31g(d).qchem.inp (generated)

012504075.b3lyp_6-31g(d).gjf (generated)

012504075.b3lyp_6-31g(d).firefly.inp (generated)

012504075.b3lyp_6-31g(d).smash.inp (generated)

012504075.b3lyp_6-31g(d).nwchem.inp (generated) 012504075.b3lyp_6-31g(d).log.xz 012504075.td-b3lyp_6-31g+(d).inp 012504075.td-b3lyp_6-31g+(d).log.xz

012504075.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504075.td-b3lyp_6-31+g(d).gjf (generated)

012504075.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504075.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504075.mol 012504075.PUBCHEM 012504075.mol (via Jmol)
012504076.b3lyp_6-31g(d).inp

012504076.b3lyp_6-31g(d).qchem.inp (generated)

012504076.b3lyp_6-31g(d).gjf (generated)

012504076.b3lyp_6-31g(d).firefly.inp (generated)

012504076.b3lyp_6-31g(d).smash.inp (generated)

012504076.b3lyp_6-31g(d).nwchem.inp (generated) 012504076.b3lyp_6-31g(d).log.xz 012504076.td-b3lyp_6-31g+(d).inp 012504076.td-b3lyp_6-31g+(d).log.xz

012504076.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504076.td-b3lyp_6-31+g(d).gjf (generated)

012504076.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504076.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504076.mol 012504076.PUBCHEM 012504076.mol (via Jmol)
012504092.b3lyp_6-31g(d).inp

012504092.b3lyp_6-31g(d).qchem.inp (generated)

012504092.b3lyp_6-31g(d).gjf (generated)

012504092.b3lyp_6-31g(d).firefly.inp (generated)

012504092.b3lyp_6-31g(d).smash.inp (generated)

012504092.b3lyp_6-31g(d).nwchem.inp (generated) 012504092.b3lyp_6-31g(d).log.xz 012504092.td-b3lyp_6-31g+(d).inp 012504092.td-b3lyp_6-31g+(d).log.xz

012504092.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504092.td-b3lyp_6-31+g(d).gjf (generated)

012504092.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504092.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504092.mol 012504092.PUBCHEM 012504092.mol (via Jmol)
012504093.b3lyp_6-31g(d).inp

012504093.b3lyp_6-31g(d).qchem.inp (generated)

012504093.b3lyp_6-31g(d).gjf (generated)

012504093.b3lyp_6-31g(d).firefly.inp (generated)

012504093.b3lyp_6-31g(d).smash.inp (generated)

012504093.b3lyp_6-31g(d).nwchem.inp (generated) 012504093.b3lyp_6-31g(d).log.xz 012504093.td-b3lyp_6-31g+(d).inp 012504093.td-b3lyp_6-31g+(d).log.xz

012504093.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504093.td-b3lyp_6-31+g(d).gjf (generated)

012504093.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504093.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504093.mol 012504093.PUBCHEM 012504093.mol (via Jmol)
012504094.b3lyp_6-31g(d).inp

012504094.b3lyp_6-31g(d).qchem.inp (generated)

012504094.b3lyp_6-31g(d).gjf (generated)

012504094.b3lyp_6-31g(d).firefly.inp (generated)

012504094.b3lyp_6-31g(d).smash.inp (generated)

012504094.b3lyp_6-31g(d).nwchem.inp (generated) 012504094.b3lyp_6-31g(d).log.xz 012504094.td-b3lyp_6-31g+(d).inp 012504094.td-b3lyp_6-31g+(d).log.xz

012504094.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504094.td-b3lyp_6-31+g(d).gjf (generated)

012504094.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504094.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504094.mol 012504094.PUBCHEM 012504094.mol (via Jmol)
012504133.b3lyp_6-31g(d).inp

012504133.b3lyp_6-31g(d).qchem.inp (generated)

012504133.b3lyp_6-31g(d).gjf (generated)

012504133.b3lyp_6-31g(d).firefly.inp (generated)

012504133.b3lyp_6-31g(d).smash.inp (generated)

012504133.b3lyp_6-31g(d).nwchem.inp (generated) 012504133.b3lyp_6-31g(d).log.xz 012504133.td-b3lyp_6-31g+(d).inp 012504133.td-b3lyp_6-31g+(d).log.xz

012504133.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504133.td-b3lyp_6-31+g(d).gjf (generated)

012504133.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504133.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504133.mol 012504133.PUBCHEM 012504133.mol (via Jmol)
012504167.b3lyp_6-31g(d).inp

012504167.b3lyp_6-31g(d).qchem.inp (generated)

012504167.b3lyp_6-31g(d).gjf (generated)

012504167.b3lyp_6-31g(d).firefly.inp (generated)

012504167.b3lyp_6-31g(d).smash.inp (generated)

012504167.b3lyp_6-31g(d).nwchem.inp (generated) 012504167.b3lyp_6-31g(d).log.xz 012504167.mol 012504167.PUBCHEM 012504167.mol (via Jmol)
012504180.b3lyp_6-31g(d).inp

012504180.b3lyp_6-31g(d).qchem.inp (generated)

012504180.b3lyp_6-31g(d).gjf (generated)

012504180.b3lyp_6-31g(d).firefly.inp (generated)

012504180.b3lyp_6-31g(d).smash.inp (generated)

012504180.b3lyp_6-31g(d).nwchem.inp (generated) 012504180.b3lyp_6-31g(d).log.xz 012504180.td-b3lyp_6-31g+(d).inp 012504180.td-b3lyp_6-31g+(d).log.xz

012504180.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504180.td-b3lyp_6-31+g(d).gjf (generated)

012504180.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504180.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504180.mol 012504180.PUBCHEM 012504180.mol (via Jmol)
012504184.b3lyp_6-31g(d).inp

012504184.b3lyp_6-31g(d).qchem.inp (generated)

012504184.b3lyp_6-31g(d).gjf (generated)

012504184.b3lyp_6-31g(d).firefly.inp (generated)

012504184.b3lyp_6-31g(d).smash.inp (generated)

012504184.b3lyp_6-31g(d).nwchem.inp (generated) 012504184.b3lyp_6-31g(d).log.xz 012504184.td-b3lyp_6-31g+(d).inp 012504184.td-b3lyp_6-31g+(d).log.xz

012504184.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504184.td-b3lyp_6-31+g(d).gjf (generated)

012504184.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504184.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504184.mol 012504184.PUBCHEM 012504184.mol (via Jmol)
012504192.b3lyp_6-31g(d).inp

012504192.b3lyp_6-31g(d).qchem.inp (generated)

012504192.b3lyp_6-31g(d).gjf (generated)

012504192.b3lyp_6-31g(d).firefly.inp (generated)

012504192.b3lyp_6-31g(d).smash.inp (generated)

012504192.b3lyp_6-31g(d).nwchem.inp (generated) 012504192.b3lyp_6-31g(d).log.xz 012504192.td-b3lyp_6-31g+(d).inp 012504192.td-b3lyp_6-31g+(d).log.xz

012504192.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504192.td-b3lyp_6-31+g(d).gjf (generated)

012504192.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504192.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504192.mol 012504192.PUBCHEM 012504192.mol (via Jmol)
012504194.b3lyp_6-31g(d).inp

012504194.b3lyp_6-31g(d).qchem.inp (generated)

012504194.b3lyp_6-31g(d).gjf (generated)

012504194.b3lyp_6-31g(d).firefly.inp (generated)

012504194.b3lyp_6-31g(d).smash.inp (generated)

012504194.b3lyp_6-31g(d).nwchem.inp (generated) 012504194.b3lyp_6-31g(d).log.xz 012504194.td-b3lyp_6-31g+(d).inp 012504194.td-b3lyp_6-31g+(d).log.xz

012504194.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504194.td-b3lyp_6-31+g(d).gjf (generated)

012504194.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504194.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504194.mol 012504194.PUBCHEM 012504194.mol (via Jmol)
012504195.b3lyp_6-31g(d).inp

012504195.b3lyp_6-31g(d).qchem.inp (generated)

012504195.b3lyp_6-31g(d).gjf (generated)

012504195.b3lyp_6-31g(d).firefly.inp (generated)

012504195.b3lyp_6-31g(d).smash.inp (generated)

012504195.b3lyp_6-31g(d).nwchem.inp (generated) 012504195.b3lyp_6-31g(d).log.xz 012504195.td-b3lyp_6-31g+(d).inp 012504195.td-b3lyp_6-31g+(d).log.xz

012504195.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504195.td-b3lyp_6-31+g(d).gjf (generated)

012504195.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504195.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504195.mol 012504195.PUBCHEM 012504195.mol (via Jmol)
012504203.b3lyp_6-31g(d).inp

012504203.b3lyp_6-31g(d).qchem.inp (generated)

012504203.b3lyp_6-31g(d).gjf (generated)

012504203.b3lyp_6-31g(d).firefly.inp (generated)

012504203.b3lyp_6-31g(d).smash.inp (generated)

012504203.b3lyp_6-31g(d).nwchem.inp (generated) 012504203.b3lyp_6-31g(d).log.xz 012504203.td-b3lyp_6-31g+(d).inp 012504203.td-b3lyp_6-31g+(d).log.xz

012504203.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504203.td-b3lyp_6-31+g(d).gjf (generated)

012504203.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504203.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504203.mol 012504203.PUBCHEM 012504203.mol (via Jmol)
012504207.b3lyp_6-31g(d).inp

012504207.b3lyp_6-31g(d).qchem.inp (generated)

012504207.b3lyp_6-31g(d).gjf (generated)

012504207.b3lyp_6-31g(d).firefly.inp (generated)

012504207.b3lyp_6-31g(d).smash.inp (generated)

012504207.b3lyp_6-31g(d).nwchem.inp (generated) 012504207.b3lyp_6-31g(d).log.xz 012504207.td-b3lyp_6-31g+(d).inp 012504207.td-b3lyp_6-31g+(d).log.xz

012504207.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504207.td-b3lyp_6-31+g(d).gjf (generated)

012504207.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504207.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504207.mol 012504207.PUBCHEM 012504207.mol (via Jmol)
012504215.b3lyp_6-31g(d).inp

012504215.b3lyp_6-31g(d).qchem.inp (generated)

012504215.b3lyp_6-31g(d).gjf (generated)

012504215.b3lyp_6-31g(d).firefly.inp (generated)

012504215.b3lyp_6-31g(d).smash.inp (generated)

012504215.b3lyp_6-31g(d).nwchem.inp (generated) 012504215.b3lyp_6-31g(d).log.xz 012504215.td-b3lyp_6-31g+(d).inp 012504215.td-b3lyp_6-31g+(d).log.xz

012504215.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504215.td-b3lyp_6-31+g(d).gjf (generated)

012504215.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504215.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504215.mol 012504215.PUBCHEM 012504215.mol (via Jmol)
012504218.b3lyp_6-31g(d).inp

012504218.b3lyp_6-31g(d).qchem.inp (generated)

012504218.b3lyp_6-31g(d).gjf (generated)

012504218.b3lyp_6-31g(d).firefly.inp (generated)

012504218.b3lyp_6-31g(d).smash.inp (generated)

012504218.b3lyp_6-31g(d).nwchem.inp (generated) 012504218.b3lyp_6-31g(d).log.xz 012504218.td-b3lyp_6-31g+(d).inp 012504218.td-b3lyp_6-31g+(d).log.xz

012504218.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504218.td-b3lyp_6-31+g(d).gjf (generated)

012504218.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504218.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504218.mol 012504218.PUBCHEM 012504218.mol (via Jmol)
012504230.b3lyp_6-31g(d).inp

012504230.b3lyp_6-31g(d).qchem.inp (generated)

012504230.b3lyp_6-31g(d).gjf (generated)

012504230.b3lyp_6-31g(d).firefly.inp (generated)

012504230.b3lyp_6-31g(d).smash.inp (generated)

012504230.b3lyp_6-31g(d).nwchem.inp (generated) 012504230.b3lyp_6-31g(d).log.xz 012504230.td-b3lyp_6-31g+(d).inp 012504230.td-b3lyp_6-31g+(d).log.xz

012504230.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504230.td-b3lyp_6-31+g(d).gjf (generated)

012504230.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504230.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504230.mol 012504230.PUBCHEM 012504230.mol (via Jmol)
012504237.b3lyp_6-31g(d).inp

012504237.b3lyp_6-31g(d).qchem.inp (generated)

012504237.b3lyp_6-31g(d).gjf (generated)

012504237.b3lyp_6-31g(d).firefly.inp (generated)

012504237.b3lyp_6-31g(d).smash.inp (generated)

012504237.b3lyp_6-31g(d).nwchem.inp (generated) 012504237.b3lyp_6-31g(d).log.xz 012504237.td-b3lyp_6-31g+(d).inp 012504237.td-b3lyp_6-31g+(d).log.xz

012504237.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504237.td-b3lyp_6-31+g(d).gjf (generated)

012504237.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504237.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504237.mol 012504237.PUBCHEM 012504237.mol (via Jmol)
012504241.b3lyp_6-31g(d).inp

012504241.b3lyp_6-31g(d).qchem.inp (generated)

012504241.b3lyp_6-31g(d).gjf (generated)

012504241.b3lyp_6-31g(d).firefly.inp (generated)

012504241.b3lyp_6-31g(d).smash.inp (generated)

012504241.b3lyp_6-31g(d).nwchem.inp (generated) 012504241.b3lyp_6-31g(d).log.xz 012504241.td-b3lyp_6-31g+(d).inp 012504241.td-b3lyp_6-31g+(d).log.xz

012504241.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504241.td-b3lyp_6-31+g(d).gjf (generated)

012504241.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504241.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504241.mol 012504241.PUBCHEM 012504241.mol (via Jmol)
012504256.b3lyp_6-31g(d).inp

012504256.b3lyp_6-31g(d).qchem.inp (generated)

012504256.b3lyp_6-31g(d).gjf (generated)

012504256.b3lyp_6-31g(d).firefly.inp (generated)

012504256.b3lyp_6-31g(d).smash.inp (generated)

012504256.b3lyp_6-31g(d).nwchem.inp (generated) 012504256.b3lyp_6-31g(d).log.xz 012504256.td-b3lyp_6-31g+(d).inp 012504256.td-b3lyp_6-31g+(d).log.xz

012504256.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504256.td-b3lyp_6-31+g(d).gjf (generated)

012504256.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504256.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504256.mol 012504256.PUBCHEM 012504256.mol (via Jmol)
012504265.b3lyp_6-31g(d).inp

012504265.b3lyp_6-31g(d).qchem.inp (generated)

012504265.b3lyp_6-31g(d).gjf (generated)

012504265.b3lyp_6-31g(d).firefly.inp (generated)

012504265.b3lyp_6-31g(d).smash.inp (generated)

012504265.b3lyp_6-31g(d).nwchem.inp (generated) 012504265.b3lyp_6-31g(d).log.xz 012504265.td-b3lyp_6-31g+(d).inp 012504265.td-b3lyp_6-31g+(d).log.xz

012504265.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504265.td-b3lyp_6-31+g(d).gjf (generated)

012504265.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504265.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504265.mol 012504265.PUBCHEM 012504265.mol (via Jmol)
012504266.b3lyp_6-31g(d).inp

012504266.b3lyp_6-31g(d).qchem.inp (generated)

012504266.b3lyp_6-31g(d).gjf (generated)

012504266.b3lyp_6-31g(d).firefly.inp (generated)

012504266.b3lyp_6-31g(d).smash.inp (generated)

012504266.b3lyp_6-31g(d).nwchem.inp (generated) 012504266.b3lyp_6-31g(d).log.xz 012504266.td-b3lyp_6-31g+(d).inp 012504266.td-b3lyp_6-31g+(d).log.xz

012504266.td-b3lyp_6-31+g(d).qchem.inp (generated)

012504266.td-b3lyp_6-31+g(d).gjf (generated)

012504266.td-b3lyp_6-31+g(d).firefly.inp (generated)

012504266.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012504266.mol 012504266.PUBCHEM 012504266.mol (via Jmol)
012504268.b3lyp_6-31g(d).inp

012504268.b3lyp_6-31g(d).qchem.inp (generated)