Index of

Last updated : Thu Jun 22 02:29:55 JST 2017
Total : 67 (62) in this page
045000016.b3lyp_6-31g(d).inp

045000016.b3lyp_6-31g(d).qchem.inp (generated)

045000016.b3lyp_6-31g(d).gjf (generated)

045000016.b3lyp_6-31g(d).firefly.inp (generated)

045000016.b3lyp_6-31g(d).smash.inp (generated)

045000016.b3lyp_6-31g(d).nwchem.inp (generated) 045000016.b3lyp_6-31g(d).log.xz 045000016.td-b3lyp_6-31g+(d).inp 045000016.td-b3lyp_6-31g+(d).log.xz

045000016.td-b3lyp_6-31+g(d).qchem.inp (generated)

045000016.td-b3lyp_6-31+g(d).gjf (generated)

045000016.td-b3lyp_6-31+g(d).firefly.inp (generated)

045000016.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045000016.mol 045000016.PUBCHEM 045000016.mol (via Jmol)
045000032.b3lyp_6-31g(d).inp

045000032.b3lyp_6-31g(d).qchem.inp (generated)

045000032.b3lyp_6-31g(d).gjf (generated)

045000032.b3lyp_6-31g(d).firefly.inp (generated)

045000032.b3lyp_6-31g(d).smash.inp (generated)

045000032.b3lyp_6-31g(d).nwchem.inp (generated) 045000032.b3lyp_6-31g(d).log.xz 045000032.td-b3lyp_6-31g+(d).inp 045000032.td-b3lyp_6-31g+(d).log.xz

045000032.td-b3lyp_6-31+g(d).qchem.inp (generated)

045000032.td-b3lyp_6-31+g(d).gjf (generated)

045000032.td-b3lyp_6-31+g(d).firefly.inp (generated)

045000032.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045000032.mol 045000032.PUBCHEM 045000032.mol (via Jmol)
045000044.b3lyp_6-31g(d).inp

045000044.b3lyp_6-31g(d).qchem.inp (generated)

045000044.b3lyp_6-31g(d).gjf (generated)

045000044.b3lyp_6-31g(d).firefly.inp (generated)

045000044.b3lyp_6-31g(d).smash.inp (generated)

045000044.b3lyp_6-31g(d).nwchem.inp (generated) 045000044.b3lyp_6-31g(d).log.xz 045000044.td-b3lyp_6-31g+(d).inp 045000044.td-b3lyp_6-31g+(d).log.xz

045000044.td-b3lyp_6-31+g(d).qchem.inp (generated)

045000044.td-b3lyp_6-31+g(d).gjf (generated)

045000044.td-b3lyp_6-31+g(d).firefly.inp (generated)

045000044.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045000044.mol 045000044.PUBCHEM 045000044.mol (via Jmol)
045000064.b3lyp_6-31g(d).inp

045000064.b3lyp_6-31g(d).qchem.inp (generated)

045000064.b3lyp_6-31g(d).gjf (generated)

045000064.b3lyp_6-31g(d).firefly.inp (generated)

045000064.b3lyp_6-31g(d).smash.inp (generated)

045000064.b3lyp_6-31g(d).nwchem.inp (generated) 045000064.b3lyp_6-31g(d).log.xz 045000064.td-b3lyp_6-31g+(d).inp 045000064.td-b3lyp_6-31g+(d).log.xz

045000064.td-b3lyp_6-31+g(d).qchem.inp (generated)

045000064.td-b3lyp_6-31+g(d).gjf (generated)

045000064.td-b3lyp_6-31+g(d).firefly.inp (generated)

045000064.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045000064.mol 045000064.PUBCHEM 045000064.mol (via Jmol)
045000065.b3lyp_6-31g(d).inp

045000065.b3lyp_6-31g(d).qchem.inp (generated)

045000065.b3lyp_6-31g(d).gjf (generated)

045000065.b3lyp_6-31g(d).firefly.inp (generated)

045000065.b3lyp_6-31g(d).smash.inp (generated)

045000065.b3lyp_6-31g(d).nwchem.inp (generated) 045000065.b3lyp_6-31g(d).log.xz 045000065.td-b3lyp_6-31g+(d).inp 045000065.td-b3lyp_6-31g+(d).log.xz

045000065.td-b3lyp_6-31+g(d).qchem.inp (generated)

045000065.td-b3lyp_6-31+g(d).gjf (generated)

045000065.td-b3lyp_6-31+g(d).firefly.inp (generated)

045000065.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045000065.mol 045000065.PUBCHEM 045000065.mol (via Jmol)
045000073.b3lyp_6-31g(d).inp

045000073.b3lyp_6-31g(d).qchem.inp (generated)

045000073.b3lyp_6-31g(d).gjf (generated)

045000073.b3lyp_6-31g(d).firefly.inp (generated)

045000073.b3lyp_6-31g(d).smash.inp (generated)

045000073.b3lyp_6-31g(d).nwchem.inp (generated) 045000073.b3lyp_6-31g(d).log.xz 045000073.td-b3lyp_6-31g+(d).inp 045000073.td-b3lyp_6-31g+(d).log.xz

045000073.td-b3lyp_6-31+g(d).qchem.inp (generated)

045000073.td-b3lyp_6-31+g(d).gjf (generated)

045000073.td-b3lyp_6-31+g(d).firefly.inp (generated)

045000073.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045000073.mol 045000073.PUBCHEM 045000073.mol (via Jmol)
045000078.b3lyp_6-31g(d).inp

045000078.b3lyp_6-31g(d).qchem.inp (generated)

045000078.b3lyp_6-31g(d).gjf (generated)

045000078.b3lyp_6-31g(d).firefly.inp (generated)

045000078.b3lyp_6-31g(d).smash.inp (generated)

045000078.b3lyp_6-31g(d).nwchem.inp (generated) 045000078.b3lyp_6-31g(d).log.xz 045000078.td-b3lyp_6-31g+(d).inp 045000078.td-b3lyp_6-31g+(d).log.xz

045000078.td-b3lyp_6-31+g(d).qchem.inp (generated)

045000078.td-b3lyp_6-31+g(d).gjf (generated)

045000078.td-b3lyp_6-31+g(d).firefly.inp (generated)

045000078.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045000078.mol 045000078.PUBCHEM 045000078.mol (via Jmol)
045000111.b3lyp_6-31g(d).inp

045000111.b3lyp_6-31g(d).qchem.inp (generated)

045000111.b3lyp_6-31g(d).gjf (generated)

045000111.b3lyp_6-31g(d).firefly.inp (generated)

045000111.b3lyp_6-31g(d).smash.inp (generated)

045000111.b3lyp_6-31g(d).nwchem.inp (generated) 045000111.b3lyp_6-31g(d).log.xz 045000111.td-b3lyp_6-31g+(d).inp 045000111.td-b3lyp_6-31g+(d).log.xz

045000111.td-b3lyp_6-31+g(d).qchem.inp (generated)

045000111.td-b3lyp_6-31+g(d).gjf (generated)

045000111.td-b3lyp_6-31+g(d).firefly.inp (generated)

045000111.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045000111.mol 045000111.PUBCHEM 045000111.mol (via Jmol)
045000113.b3lyp_6-31g(d).inp

045000113.b3lyp_6-31g(d).qchem.inp (generated)

045000113.b3lyp_6-31g(d).gjf (generated)

045000113.b3lyp_6-31g(d).firefly.inp (generated)

045000113.b3lyp_6-31g(d).smash.inp (generated)

045000113.b3lyp_6-31g(d).nwchem.inp (generated) 045000113.b3lyp_6-31g(d).log.xz 045000113.td-b3lyp_6-31g+(d).inp 045000113.td-b3lyp_6-31g+(d).log.xz

045000113.td-b3lyp_6-31+g(d).qchem.inp (generated)

045000113.td-b3lyp_6-31+g(d).gjf (generated)

045000113.td-b3lyp_6-31+g(d).firefly.inp (generated)

045000113.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045000113.mol 045000113.PUBCHEM 045000113.mol (via Jmol)
045000124.b3lyp_6-31g(d).inp

045000124.b3lyp_6-31g(d).qchem.inp (generated)

045000124.b3lyp_6-31g(d).gjf (generated)

045000124.b3lyp_6-31g(d).firefly.inp (generated)

045000124.b3lyp_6-31g(d).smash.inp (generated)

045000124.b3lyp_6-31g(d).nwchem.inp (generated) 045000124.b3lyp_6-31g(d).log.xz 045000124.td-b3lyp_6-31g+(d).inp 045000124.td-b3lyp_6-31g+(d).log.xz

045000124.td-b3lyp_6-31+g(d).qchem.inp (generated)

045000124.td-b3lyp_6-31+g(d).gjf (generated)

045000124.td-b3lyp_6-31+g(d).firefly.inp (generated)

045000124.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045000124.mol 045000124.PUBCHEM 045000124.mol (via Jmol)
045000125.b3lyp_6-31g(d).inp

045000125.b3lyp_6-31g(d).qchem.inp (generated)

045000125.b3lyp_6-31g(d).gjf (generated)

045000125.b3lyp_6-31g(d).firefly.inp (generated)

045000125.b3lyp_6-31g(d).smash.inp (generated)

045000125.b3lyp_6-31g(d).nwchem.inp (generated) 045000125.b3lyp_6-31g(d).log.xz 045000125.td-b3lyp_6-31g+(d).inp 045000125.td-b3lyp_6-31g+(d).log.xz

045000125.td-b3lyp_6-31+g(d).qchem.inp (generated)

045000125.td-b3lyp_6-31+g(d).gjf (generated)

045000125.td-b3lyp_6-31+g(d).firefly.inp (generated)

045000125.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045000125.mol 045000125.PUBCHEM 045000125.mol (via Jmol)
045000135.b3lyp_6-31g(d).inp

045000135.b3lyp_6-31g(d).qchem.inp (generated)

045000135.b3lyp_6-31g(d).gjf (generated)

045000135.b3lyp_6-31g(d).firefly.inp (generated)

045000135.b3lyp_6-31g(d).smash.inp (generated)

045000135.b3lyp_6-31g(d).nwchem.inp (generated) 045000135.b3lyp_6-31g(d).log.xz 045000135.td-b3lyp_6-31g+(d).inp 045000135.td-b3lyp_6-31g+(d).log.xz

045000135.td-b3lyp_6-31+g(d).qchem.inp (generated)

045000135.td-b3lyp_6-31+g(d).gjf (generated)

045000135.td-b3lyp_6-31+g(d).firefly.inp (generated)

045000135.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045000135.mol 045000135.PUBCHEM 045000135.mol (via Jmol)
045000136.b3lyp_6-31g(d).inp

045000136.b3lyp_6-31g(d).qchem.inp (generated)

045000136.b3lyp_6-31g(d).gjf (generated)

045000136.b3lyp_6-31g(d).firefly.inp (generated)

045000136.b3lyp_6-31g(d).smash.inp (generated)

045000136.b3lyp_6-31g(d).nwchem.inp (generated) 045000136.b3lyp_6-31g(d).log.xz 045000136.td-b3lyp_6-31g+(d).inp 045000136.td-b3lyp_6-31g+(d).log.xz

045000136.td-b3lyp_6-31+g(d).qchem.inp (generated)

045000136.td-b3lyp_6-31+g(d).gjf (generated)

045000136.td-b3lyp_6-31+g(d).firefly.inp (generated)

045000136.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045000136.mol 045000136.PUBCHEM 045000136.mol (via Jmol)
045000168.b3lyp_6-31g(d).inp

045000168.b3lyp_6-31g(d).qchem.inp (generated)

045000168.b3lyp_6-31g(d).gjf (generated)

045000168.b3lyp_6-31g(d).firefly.inp (generated)

045000168.b3lyp_6-31g(d).smash.inp (generated)

045000168.b3lyp_6-31g(d).nwchem.inp (generated) 045000168.b3lyp_6-31g(d).log.xz 045000168.mol 045000168.PUBCHEM 045000168.mol (via Jmol)
045000170.b3lyp_6-31g(d).inp

045000170.b3lyp_6-31g(d).qchem.inp (generated)

045000170.b3lyp_6-31g(d).gjf (generated)

045000170.b3lyp_6-31g(d).firefly.inp (generated)

045000170.b3lyp_6-31g(d).smash.inp (generated)

045000170.b3lyp_6-31g(d).nwchem.inp (generated) 045000170.b3lyp_6-31g(d).log.xz 045000170.mol 045000170.PUBCHEM 045000170.mol (via Jmol)
045000171.b3lyp_6-31g(d).inp

045000171.b3lyp_6-31g(d).qchem.inp (generated)

045000171.b3lyp_6-31g(d).gjf (generated)

045000171.b3lyp_6-31g(d).firefly.inp (generated)

045000171.b3lyp_6-31g(d).smash.inp (generated)

045000171.b3lyp_6-31g(d).nwchem.inp (generated) 045000171.b3lyp_6-31g(d).log.xz 045000171.td-b3lyp_6-31g+(d).inp 045000171.td-b3lyp_6-31g+(d).log.xz

045000171.td-b3lyp_6-31+g(d).qchem.inp (generated)

045000171.td-b3lyp_6-31+g(d).gjf (generated)

045000171.td-b3lyp_6-31+g(d).firefly.inp (generated)

045000171.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045000171.mol 045000171.PUBCHEM 045000171.mol (via Jmol)
045005569.b3lyp_6-31g(d).inp

045005569.b3lyp_6-31g(d).qchem.inp (generated)

045005569.b3lyp_6-31g(d).gjf (generated)

045005569.b3lyp_6-31g(d).firefly.inp (generated)

045005569.b3lyp_6-31g(d).smash.inp (generated)

045005569.b3lyp_6-31g(d).nwchem.inp (generated) 045005569.b3lyp_6-31g(d).log.xz 045005569.td-b3lyp_6-31g+(d).inp 045005569.td-b3lyp_6-31g+(d).log.xz

045005569.td-b3lyp_6-31+g(d).qchem.inp (generated)

045005569.td-b3lyp_6-31+g(d).gjf (generated)

045005569.td-b3lyp_6-31+g(d).firefly.inp (generated)

045005569.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045005569.mol 045005569.PUBCHEM 045005569.mol (via Jmol)
045006000.b3lyp_6-31g(d).inp

045006000.b3lyp_6-31g(d).qchem.inp (generated)

045006000.b3lyp_6-31g(d).gjf (generated)

045006000.b3lyp_6-31g(d).firefly.inp (generated)

045006000.b3lyp_6-31g(d).smash.inp (generated)

045006000.b3lyp_6-31g(d).nwchem.inp (generated) 045006000.b3lyp_6-31g(d).log.xz 045006000.td-b3lyp_6-31g+(d).inp 045006000.td-b3lyp_6-31g+(d).log.xz

045006000.td-b3lyp_6-31+g(d).qchem.inp (generated)

045006000.td-b3lyp_6-31+g(d).gjf (generated)

045006000.td-b3lyp_6-31+g(d).firefly.inp (generated)

045006000.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045006000.mol 045006000.PUBCHEM 045006000.mol (via Jmol)
045006059.b3lyp_6-31g(d).inp

045006059.b3lyp_6-31g(d).qchem.inp (generated)

045006059.b3lyp_6-31g(d).gjf (generated)

045006059.b3lyp_6-31g(d).firefly.inp (generated)

045006059.b3lyp_6-31g(d).smash.inp (generated)

045006059.b3lyp_6-31g(d).nwchem.inp (generated) 045006059.b3lyp_6-31g(d).log.xz 045006059.td-b3lyp_6-31g+(d).inp 045006059.td-b3lyp_6-31g+(d).log.xz

045006059.td-b3lyp_6-31+g(d).qchem.inp (generated)

045006059.td-b3lyp_6-31+g(d).gjf (generated)

045006059.td-b3lyp_6-31+g(d).firefly.inp (generated)

045006059.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045006059.mol 045006059.PUBCHEM 045006059.mol (via Jmol)
045006085.b3lyp_6-31g(d).inp

045006085.b3lyp_6-31g(d).qchem.inp (generated)

045006085.b3lyp_6-31g(d).gjf (generated)

045006085.b3lyp_6-31g(d).firefly.inp (generated)

045006085.b3lyp_6-31g(d).smash.inp (generated)

045006085.b3lyp_6-31g(d).nwchem.inp (generated) 045006085.b3lyp_6-31g(d).log.xz 045006085.td-b3lyp_6-31g+(d).inp 045006085.td-b3lyp_6-31g+(d).log.xz

045006085.td-b3lyp_6-31+g(d).qchem.inp (generated)

045006085.td-b3lyp_6-31+g(d).gjf (generated)

045006085.td-b3lyp_6-31+g(d).firefly.inp (generated)

045006085.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045006085.mol 045006085.PUBCHEM 045006085.mol (via Jmol)
045007481.b3lyp_6-31g(d).inp

045007481.b3lyp_6-31g(d).qchem.inp (generated)

045007481.b3lyp_6-31g(d).gjf (generated)

045007481.b3lyp_6-31g(d).firefly.inp (generated)

045007481.b3lyp_6-31g(d).smash.inp (generated)

045007481.b3lyp_6-31g(d).nwchem.inp (generated) 045007481.b3lyp_6-31g(d).log.xz 045007481.td-b3lyp_6-31g+(d).inp 045007481.td-b3lyp_6-31g+(d).log.xz

045007481.td-b3lyp_6-31+g(d).qchem.inp (generated)

045007481.td-b3lyp_6-31+g(d).gjf (generated)

045007481.td-b3lyp_6-31+g(d).firefly.inp (generated)

045007481.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045007481.mol 045007481.PUBCHEM 045007481.mol (via Jmol)
045008383.b3lyp_6-31g(d).inp

045008383.b3lyp_6-31g(d).qchem.inp (generated)

045008383.b3lyp_6-31g(d).gjf (generated)

045008383.b3lyp_6-31g(d).firefly.inp (generated)

045008383.b3lyp_6-31g(d).smash.inp (generated)

045008383.b3lyp_6-31g(d).nwchem.inp (generated) 045008383.b3lyp_6-31g(d).log.xz 045008383.td-b3lyp_6-31g+(d).inp 045008383.td-b3lyp_6-31g+(d).log.xz

045008383.td-b3lyp_6-31+g(d).qchem.inp (generated)

045008383.td-b3lyp_6-31+g(d).gjf (generated)

045008383.td-b3lyp_6-31+g(d).firefly.inp (generated)

045008383.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045008383.mol 045008383.PUBCHEM 045008383.mol (via Jmol)
045008552.b3lyp_6-31g(d).inp

045008552.b3lyp_6-31g(d).qchem.inp (generated)

045008552.b3lyp_6-31g(d).gjf (generated)

045008552.b3lyp_6-31g(d).firefly.inp (generated)

045008552.b3lyp_6-31g(d).smash.inp (generated)

045008552.b3lyp_6-31g(d).nwchem.inp (generated) 045008552.b3lyp_6-31g(d).log.xz 045008552.mol 045008552.PUBCHEM 045008552.mol (via Jmol)
045009327.b3lyp_6-31g(d).inp

045009327.b3lyp_6-31g(d).qchem.inp (generated)

045009327.b3lyp_6-31g(d).gjf (generated)

045009327.b3lyp_6-31g(d).firefly.inp (generated)

045009327.b3lyp_6-31g(d).smash.inp (generated)

045009327.b3lyp_6-31g(d).nwchem.inp (generated) 045009327.b3lyp_6-31g(d).log.xz 045009327.td-b3lyp_6-31g+(d).inp 045009327.td-b3lyp_6-31g+(d).log.xz

045009327.td-b3lyp_6-31+g(d).qchem.inp (generated)

045009327.td-b3lyp_6-31+g(d).gjf (generated)

045009327.td-b3lyp_6-31+g(d).firefly.inp (generated)

045009327.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045009327.mol 045009327.PUBCHEM 045009327.mol (via Jmol)
045010067.b3lyp_6-31g(d).inp

045010067.b3lyp_6-31g(d).qchem.inp (generated)

045010067.b3lyp_6-31g(d).gjf (generated)

045010067.b3lyp_6-31g(d).firefly.inp (generated)

045010067.b3lyp_6-31g(d).smash.inp (generated)

045010067.b3lyp_6-31g(d).nwchem.inp (generated) 045010067.b3lyp_6-31g(d).log.xz 045010067.td-b3lyp_6-31g+(d).inp 045010067.td-b3lyp_6-31g+(d).log.xz

045010067.td-b3lyp_6-31+g(d).qchem.inp (generated)

045010067.td-b3lyp_6-31+g(d).gjf (generated)

045010067.td-b3lyp_6-31+g(d).firefly.inp (generated)

045010067.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045010067.mol 045010067.PUBCHEM 045010067.mol (via Jmol)
045012016.b3lyp_6-31g(d).inp

045012016.b3lyp_6-31g(d).qchem.inp (generated)

045012016.b3lyp_6-31g(d).gjf (generated)

045012016.b3lyp_6-31g(d).firefly.inp (generated)

045012016.b3lyp_6-31g(d).smash.inp (generated)

045012016.b3lyp_6-31g(d).nwchem.inp (generated) 045012016.b3lyp_6-31g(d).log.xz 045012016.td-b3lyp_6-31g+(d).inp 045012016.td-b3lyp_6-31g+(d).log.xz

045012016.td-b3lyp_6-31+g(d).qchem.inp (generated)

045012016.td-b3lyp_6-31+g(d).gjf (generated)

045012016.td-b3lyp_6-31+g(d).firefly.inp (generated)

045012016.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045012016.mol 045012016.PUBCHEM 045012016.mol (via Jmol)
045012312.b3lyp_6-31g(d).inp

045012312.b3lyp_6-31g(d).qchem.inp (generated)

045012312.b3lyp_6-31g(d).gjf (generated)

045012312.b3lyp_6-31g(d).firefly.inp (generated)

045012312.b3lyp_6-31g(d).smash.inp (generated)

045012312.b3lyp_6-31g(d).nwchem.inp (generated) 045012312.b3lyp_6-31g(d).log.xz 045012312.td-b3lyp_6-31g+(d).inp 045012312.td-b3lyp_6-31g+(d).log.xz

045012312.td-b3lyp_6-31+g(d).qchem.inp (generated)

045012312.td-b3lyp_6-31+g(d).gjf (generated)

045012312.td-b3lyp_6-31+g(d).firefly.inp (generated)

045012312.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045012312.mol 045012312.PUBCHEM 045012312.mol (via Jmol)
045012696.b3lyp_6-31g(d).inp

045012696.b3lyp_6-31g(d).qchem.inp (generated)

045012696.b3lyp_6-31g(d).gjf (generated)

045012696.b3lyp_6-31g(d).firefly.inp (generated)

045012696.b3lyp_6-31g(d).smash.inp (generated)

045012696.b3lyp_6-31g(d).nwchem.inp (generated) 045012696.b3lyp_6-31g(d).log.xz 045012696.td-b3lyp_6-31g+(d).inp 045012696.td-b3lyp_6-31g+(d).log.xz

045012696.td-b3lyp_6-31+g(d).qchem.inp (generated)

045012696.td-b3lyp_6-31+g(d).gjf (generated)

045012696.td-b3lyp_6-31+g(d).firefly.inp (generated)

045012696.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045012696.mol 045012696.PUBCHEM 045012696.mol (via Jmol)
045014242.b3lyp_6-31g(d).inp

045014242.b3lyp_6-31g(d).qchem.inp (generated)

045014242.b3lyp_6-31g(d).gjf (generated)

045014242.b3lyp_6-31g(d).firefly.inp (generated)

045014242.b3lyp_6-31g(d).smash.inp (generated)

045014242.b3lyp_6-31g(d).nwchem.inp (generated) 045014242.b3lyp_6-31g(d).log.xz 045014242.td-b3lyp_6-31g+(d).inp 045014242.td-b3lyp_6-31g+(d).log.xz

045014242.td-b3lyp_6-31+g(d).qchem.inp (generated)

045014242.td-b3lyp_6-31+g(d).gjf (generated)

045014242.td-b3lyp_6-31+g(d).firefly.inp (generated)

045014242.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045014242.mol 045014242.PUBCHEM 045014242.mol (via Jmol)
045014867.b3lyp_6-31g(d).inp

045014867.b3lyp_6-31g(d).qchem.inp (generated)

045014867.b3lyp_6-31g(d).gjf (generated)

045014867.b3lyp_6-31g(d).firefly.inp (generated)

045014867.b3lyp_6-31g(d).smash.inp (generated)

045014867.b3lyp_6-31g(d).nwchem.inp (generated) 045014867.b3lyp_6-31g(d).log.xz 045014867.td-b3lyp_6-31g+(d).inp 045014867.td-b3lyp_6-31g+(d).log.xz

045014867.td-b3lyp_6-31+g(d).qchem.inp (generated)

045014867.td-b3lyp_6-31+g(d).gjf (generated)

045014867.td-b3lyp_6-31+g(d).firefly.inp (generated)

045014867.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045014867.mol 045014867.PUBCHEM 045014867.mol (via Jmol)
045017751.b3lyp_6-31g(d).inp

045017751.b3lyp_6-31g(d).qchem.inp (generated)

045017751.b3lyp_6-31g(d).gjf (generated)

045017751.b3lyp_6-31g(d).firefly.inp (generated)

045017751.b3lyp_6-31g(d).smash.inp (generated)

045017751.b3lyp_6-31g(d).nwchem.inp (generated) 045017751.b3lyp_6-31g(d).log.xz 045017751.td-b3lyp_6-31g+(d).inp 045017751.td-b3lyp_6-31g+(d).log.xz

045017751.td-b3lyp_6-31+g(d).qchem.inp (generated)

045017751.td-b3lyp_6-31+g(d).gjf (generated)

045017751.td-b3lyp_6-31+g(d).firefly.inp (generated)

045017751.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045017751.mol 045017751.PUBCHEM 045017751.mol (via Jmol)
045017774.b3lyp_6-31g(d).inp

045017774.b3lyp_6-31g(d).qchem.inp (generated)

045017774.b3lyp_6-31g(d).gjf (generated)

045017774.b3lyp_6-31g(d).firefly.inp (generated)

045017774.b3lyp_6-31g(d).smash.inp (generated)

045017774.b3lyp_6-31g(d).nwchem.inp (generated) 045017774.b3lyp_6-31g(d).log.xz 045017774.td-b3lyp_6-31g+(d).inp 045017774.td-b3lyp_6-31g+(d).log.xz

045017774.td-b3lyp_6-31+g(d).qchem.inp (generated)

045017774.td-b3lyp_6-31+g(d).gjf (generated)

045017774.td-b3lyp_6-31+g(d).firefly.inp (generated)

045017774.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045017774.mol 045017774.PUBCHEM 045017774.mol (via Jmol)
045017996.b3lyp_6-31g(d).inp

045017996.b3lyp_6-31g(d).qchem.inp (generated)

045017996.b3lyp_6-31g(d).gjf (generated)

045017996.b3lyp_6-31g(d).firefly.inp (generated)

045017996.b3lyp_6-31g(d).smash.inp (generated)

045017996.b3lyp_6-31g(d).nwchem.inp (generated) 045017996.b3lyp_6-31g(d).log.xz 045017996.td-b3lyp_6-31g+(d).inp 045017996.td-b3lyp_6-31g+(d).log.xz

045017996.td-b3lyp_6-31+g(d).qchem.inp (generated)

045017996.td-b3lyp_6-31+g(d).gjf (generated)

045017996.td-b3lyp_6-31+g(d).firefly.inp (generated)

045017996.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045017996.mol 045017996.PUBCHEM 045017996.mol (via Jmol)
045018332.b3lyp_6-31g(d).inp

045018332.b3lyp_6-31g(d).qchem.inp (generated)

045018332.b3lyp_6-31g(d).gjf (generated)

045018332.b3lyp_6-31g(d).firefly.inp (generated)

045018332.b3lyp_6-31g(d).smash.inp (generated)

045018332.b3lyp_6-31g(d).nwchem.inp (generated) 045018332.b3lyp_6-31g(d).log.xz 045018332.td-b3lyp_6-31g+(d).inp 045018332.td-b3lyp_6-31g+(d).log.xz

045018332.td-b3lyp_6-31+g(d).qchem.inp (generated)

045018332.td-b3lyp_6-31+g(d).gjf (generated)

045018332.td-b3lyp_6-31+g(d).firefly.inp (generated)

045018332.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045018332.mol 045018332.PUBCHEM 045018332.mol (via Jmol)
045020567.b3lyp_6-31g(d).inp

045020567.b3lyp_6-31g(d).qchem.inp (generated)

045020567.b3lyp_6-31g(d).gjf (generated)

045020567.b3lyp_6-31g(d).firefly.inp (generated)

045020567.b3lyp_6-31g(d).smash.inp (generated)

045020567.b3lyp_6-31g(d).nwchem.inp (generated) 045020567.b3lyp_6-31g(d).log.xz 045020567.td-b3lyp_6-31g+(d).inp 045020567.td-b3lyp_6-31g+(d).log.xz

045020567.td-b3lyp_6-31+g(d).qchem.inp (generated)

045020567.td-b3lyp_6-31+g(d).gjf (generated)

045020567.td-b3lyp_6-31+g(d).firefly.inp (generated)

045020567.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045020567.mol 045020567.PUBCHEM 045020567.mol (via Jmol)
045021383.b3lyp_6-31g(d).inp

045021383.b3lyp_6-31g(d).qchem.inp (generated)

045021383.b3lyp_6-31g(d).gjf (generated)

045021383.b3lyp_6-31g(d).firefly.inp (generated)

045021383.b3lyp_6-31g(d).smash.inp (generated)

045021383.b3lyp_6-31g(d).nwchem.inp (generated) 045021383.b3lyp_6-31g(d).log.xz 045021383.td-b3lyp_6-31g+(d).inp 045021383.td-b3lyp_6-31g+(d).log.xz

045021383.td-b3lyp_6-31+g(d).qchem.inp (generated)

045021383.td-b3lyp_6-31+g(d).gjf (generated)

045021383.td-b3lyp_6-31+g(d).firefly.inp (generated)

045021383.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045021383.mol 045021383.PUBCHEM 045021383.mol (via Jmol)
045022448.b3lyp_6-31g(d).inp

045022448.b3lyp_6-31g(d).qchem.inp (generated)

045022448.b3lyp_6-31g(d).gjf (generated)

045022448.b3lyp_6-31g(d).firefly.inp (generated)

045022448.b3lyp_6-31g(d).smash.inp (generated)

045022448.b3lyp_6-31g(d).nwchem.inp (generated) 045022448.b3lyp_6-31g(d).log.xz 045022448.td-b3lyp_6-31g+(d).inp 045022448.td-b3lyp_6-31g+(d).log.xz

045022448.td-b3lyp_6-31+g(d).qchem.inp (generated)

045022448.td-b3lyp_6-31+g(d).gjf (generated)

045022448.td-b3lyp_6-31+g(d).firefly.inp (generated)

045022448.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045022448.mol 045022448.PUBCHEM 045022448.mol (via Jmol)
045022475.b3lyp_6-31g(d).inp

045022475.b3lyp_6-31g(d).qchem.inp (generated)

045022475.b3lyp_6-31g(d).gjf (generated)

045022475.b3lyp_6-31g(d).firefly.inp (generated)

045022475.b3lyp_6-31g(d).smash.inp (generated)

045022475.b3lyp_6-31g(d).nwchem.inp (generated) 045022475.b3lyp_6-31g(d).log.xz 045022475.td-b3lyp_6-31g+(d).inp 045022475.td-b3lyp_6-31g+(d).log.xz

045022475.td-b3lyp_6-31+g(d).qchem.inp (generated)

045022475.td-b3lyp_6-31+g(d).gjf (generated)

045022475.td-b3lyp_6-31+g(d).firefly.inp (generated)

045022475.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045022475.mol 045022475.PUBCHEM 045022475.mol (via Jmol)
045022653.b3lyp_6-31g(d).inp

045022653.b3lyp_6-31g(d).qchem.inp (generated)

045022653.b3lyp_6-31g(d).gjf (generated)

045022653.b3lyp_6-31g(d).firefly.inp (generated)

045022653.b3lyp_6-31g(d).smash.inp (generated)

045022653.b3lyp_6-31g(d).nwchem.inp (generated) 045022653.b3lyp_6-31g(d).log.xz 045022653.td-b3lyp_6-31g+(d).inp 045022653.td-b3lyp_6-31g+(d).log.xz

045022653.td-b3lyp_6-31+g(d).qchem.inp (generated)

045022653.td-b3lyp_6-31+g(d).gjf (generated)

045022653.td-b3lyp_6-31+g(d).firefly.inp (generated)

045022653.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045022653.mol 045022653.PUBCHEM 045022653.mol (via Jmol)
045022737.b3lyp_6-31g(d).inp

045022737.b3lyp_6-31g(d).qchem.inp (generated)

045022737.b3lyp_6-31g(d).gjf (generated)

045022737.b3lyp_6-31g(d).firefly.inp (generated)

045022737.b3lyp_6-31g(d).smash.inp (generated)

045022737.b3lyp_6-31g(d).nwchem.inp (generated) 045022737.b3lyp_6-31g(d).log.xz 045022737.mol 045022737.PUBCHEM 045022737.mol (via Jmol)
045022738.b3lyp_6-31g(d).inp

045022738.b3lyp_6-31g(d).qchem.inp (generated)

045022738.b3lyp_6-31g(d).gjf (generated)

045022738.b3lyp_6-31g(d).firefly.inp (generated)

045022738.b3lyp_6-31g(d).smash.inp (generated)

045022738.b3lyp_6-31g(d).nwchem.inp (generated) 045022738.b3lyp_6-31g(d).log.xz 045022738.td-b3lyp_6-31g+(d).inp 045022738.td-b3lyp_6-31g+(d).log.xz

045022738.td-b3lyp_6-31+g(d).qchem.inp (generated)

045022738.td-b3lyp_6-31+g(d).gjf (generated)

045022738.td-b3lyp_6-31+g(d).firefly.inp (generated)

045022738.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045022738.mol 045022738.PUBCHEM 045022738.mol (via Jmol)
045023551.b3lyp_6-31g(d).inp

045023551.b3lyp_6-31g(d).qchem.inp (generated)

045023551.b3lyp_6-31g(d).gjf (generated)

045023551.b3lyp_6-31g(d).firefly.inp (generated)

045023551.b3lyp_6-31g(d).smash.inp (generated)

045023551.b3lyp_6-31g(d).nwchem.inp (generated) 045023551.b3lyp_6-31g(d).log.xz 045023551.td-b3lyp_6-31g+(d).inp 045023551.td-b3lyp_6-31g+(d).log.xz

045023551.td-b3lyp_6-31+g(d).qchem.inp (generated)

045023551.td-b3lyp_6-31+g(d).gjf (generated)

045023551.td-b3lyp_6-31+g(d).firefly.inp (generated)

045023551.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045023551.mol 045023551.PUBCHEM 045023551.mol (via Jmol)
045023559.b3lyp_6-31g(d).inp

045023559.b3lyp_6-31g(d).qchem.inp (generated)

045023559.b3lyp_6-31g(d).gjf (generated)

045023559.b3lyp_6-31g(d).firefly.inp (generated)

045023559.b3lyp_6-31g(d).smash.inp (generated)

045023559.b3lyp_6-31g(d).nwchem.inp (generated) 045023559.b3lyp_6-31g(d).log.xz 045023559.td-b3lyp_6-31g+(d).inp 045023559.td-b3lyp_6-31g+(d).log.xz

045023559.td-b3lyp_6-31+g(d).qchem.inp (generated)

045023559.td-b3lyp_6-31+g(d).gjf (generated)

045023559.td-b3lyp_6-31+g(d).firefly.inp (generated)

045023559.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045023559.mol 045023559.PUBCHEM 045023559.mol (via Jmol)
045023566.b3lyp_6-31g(d).inp

045023566.b3lyp_6-31g(d).qchem.inp (generated)

045023566.b3lyp_6-31g(d).gjf (generated)

045023566.b3lyp_6-31g(d).firefly.inp (generated)

045023566.b3lyp_6-31g(d).smash.inp (generated)

045023566.b3lyp_6-31g(d).nwchem.inp (generated) 045023566.b3lyp_6-31g(d).log.xz 045023566.td-b3lyp_6-31g+(d).inp 045023566.td-b3lyp_6-31g+(d).log.xz

045023566.td-b3lyp_6-31+g(d).qchem.inp (generated)

045023566.td-b3lyp_6-31+g(d).gjf (generated)

045023566.td-b3lyp_6-31+g(d).firefly.inp (generated)

045023566.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045023566.mol 045023566.PUBCHEM 045023566.mol (via Jmol)
045023567.b3lyp_6-31g(d).inp

045023567.b3lyp_6-31g(d).qchem.inp (generated)

045023567.b3lyp_6-31g(d).gjf (generated)

045023567.b3lyp_6-31g(d).firefly.inp (generated)

045023567.b3lyp_6-31g(d).smash.inp (generated)

045023567.b3lyp_6-31g(d).nwchem.inp (generated) 045023567.b3lyp_6-31g(d).log.xz 045023567.td-b3lyp_6-31g+(d).inp 045023567.td-b3lyp_6-31g+(d).log.xz

045023567.td-b3lyp_6-31+g(d).qchem.inp (generated)

045023567.td-b3lyp_6-31+g(d).gjf (generated)

045023567.td-b3lyp_6-31+g(d).firefly.inp (generated)

045023567.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045023567.mol 045023567.PUBCHEM 045023567.mol (via Jmol)
045023718.b3lyp_6-31g(d).inp

045023718.b3lyp_6-31g(d).qchem.inp (generated)

045023718.b3lyp_6-31g(d).gjf (generated)

045023718.b3lyp_6-31g(d).firefly.inp (generated)

045023718.b3lyp_6-31g(d).smash.inp (generated)

045023718.b3lyp_6-31g(d).nwchem.inp (generated) 045023718.b3lyp_6-31g(d).log.xz 045023718.td-b3lyp_6-31g+(d).inp 045023718.td-b3lyp_6-31g+(d).log.xz

045023718.td-b3lyp_6-31+g(d).qchem.inp (generated)

045023718.td-b3lyp_6-31+g(d).gjf (generated)

045023718.td-b3lyp_6-31+g(d).firefly.inp (generated)

045023718.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045023718.mol 045023718.PUBCHEM 045023718.mol (via Jmol)
045023723.b3lyp_6-31g(d).inp

045023723.b3lyp_6-31g(d).qchem.inp (generated)

045023723.b3lyp_6-31g(d).gjf (generated)

045023723.b3lyp_6-31g(d).firefly.inp (generated)

045023723.b3lyp_6-31g(d).smash.inp (generated)

045023723.b3lyp_6-31g(d).nwchem.inp (generated) 045023723.b3lyp_6-31g(d).log.xz 045023723.td-b3lyp_6-31g+(d).inp 045023723.td-b3lyp_6-31g+(d).log.xz

045023723.td-b3lyp_6-31+g(d).qchem.inp (generated)

045023723.td-b3lyp_6-31+g(d).gjf (generated)

045023723.td-b3lyp_6-31+g(d).firefly.inp (generated)

045023723.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045023723.mol 045023723.PUBCHEM 045023723.mol (via Jmol)
045023867.b3lyp_6-31g(d).inp

045023867.b3lyp_6-31g(d).qchem.inp (generated)

045023867.b3lyp_6-31g(d).gjf (generated)

045023867.b3lyp_6-31g(d).firefly.inp (generated)

045023867.b3lyp_6-31g(d).smash.inp (generated)

045023867.b3lyp_6-31g(d).nwchem.inp (generated) 045023867.b3lyp_6-31g(d).log.xz 045023867.td-b3lyp_6-31g+(d).inp 045023867.td-b3lyp_6-31g+(d).log.xz

045023867.td-b3lyp_6-31+g(d).qchem.inp (generated)

045023867.td-b3lyp_6-31+g(d).gjf (generated)

045023867.td-b3lyp_6-31+g(d).firefly.inp (generated)

045023867.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045023867.mol 045023867.PUBCHEM 045023867.mol (via Jmol)
045023975.b3lyp_6-31g(d).inp

045023975.b3lyp_6-31g(d).qchem.inp (generated)

045023975.b3lyp_6-31g(d).gjf (generated)

045023975.b3lyp_6-31g(d).firefly.inp (generated)

045023975.b3lyp_6-31g(d).smash.inp (generated)

045023975.b3lyp_6-31g(d).nwchem.inp (generated) 045023975.b3lyp_6-31g(d).log.xz 045023975.td-b3lyp_6-31g+(d).inp 045023975.td-b3lyp_6-31g+(d).log.xz

045023975.td-b3lyp_6-31+g(d).qchem.inp (generated)

045023975.td-b3lyp_6-31+g(d).gjf (generated)

045023975.td-b3lyp_6-31+g(d).firefly.inp (generated)

045023975.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045023975.mol 045023975.PUBCHEM 045023975.mol (via Jmol)
045024104.b3lyp_6-31g(d).inp

045024104.b3lyp_6-31g(d).qchem.inp (generated)

045024104.b3lyp_6-31g(d).gjf (generated)

045024104.b3lyp_6-31g(d).firefly.inp (generated)

045024104.b3lyp_6-31g(d).smash.inp (generated)

045024104.b3lyp_6-31g(d).nwchem.inp (generated) 045024104.b3lyp_6-31g(d).log.xz 045024104.td-b3lyp_6-31g+(d).inp 045024104.td-b3lyp_6-31g+(d).log.xz

045024104.td-b3lyp_6-31+g(d).qchem.inp (generated)

045024104.td-b3lyp_6-31+g(d).gjf (generated)

045024104.td-b3lyp_6-31+g(d).firefly.inp (generated)

045024104.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045024104.mol 045024104.PUBCHEM 045024104.mol (via Jmol)
045024209.b3lyp_6-31g(d).inp

045024209.b3lyp_6-31g(d).qchem.inp (generated)

045024209.b3lyp_6-31g(d).gjf (generated)

045024209.b3lyp_6-31g(d).firefly.inp (generated)

045024209.b3lyp_6-31g(d).smash.inp (generated)

045024209.b3lyp_6-31g(d).nwchem.inp (generated) 045024209.b3lyp_6-31g(d).log.xz 045024209.td-b3lyp_6-31g+(d).inp 045024209.td-b3lyp_6-31g+(d).log.xz

045024209.td-b3lyp_6-31+g(d).qchem.inp (generated)

045024209.td-b3lyp_6-31+g(d).gjf (generated)

045024209.td-b3lyp_6-31+g(d).firefly.inp (generated)

045024209.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045024209.mol 045024209.PUBCHEM 045024209.mol (via Jmol)
045024331.b3lyp_6-31g(d).inp

045024331.b3lyp_6-31g(d).qchem.inp (generated)

045024331.b3lyp_6-31g(d).gjf (generated)

045024331.b3lyp_6-31g(d).firefly.inp (generated)

045024331.b3lyp_6-31g(d).smash.inp (generated)

045024331.b3lyp_6-31g(d).nwchem.inp (generated) 045024331.b3lyp_6-31g(d).log.xz 045024331.td-b3lyp_6-31g+(d).inp 045024331.td-b3lyp_6-31g+(d).log.xz

045024331.td-b3lyp_6-31+g(d).qchem.inp (generated)

045024331.td-b3lyp_6-31+g(d).gjf (generated)

045024331.td-b3lyp_6-31+g(d).firefly.inp (generated)

045024331.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045024331.mol 045024331.PUBCHEM 045024331.mol (via Jmol)
045024355.b3lyp_6-31g(d).inp

045024355.b3lyp_6-31g(d).qchem.inp (generated)

045024355.b3lyp_6-31g(d).gjf (generated)

045024355.b3lyp_6-31g(d).firefly.inp (generated)

045024355.b3lyp_6-31g(d).smash.inp (generated)

045024355.b3lyp_6-31g(d).nwchem.inp (generated) 045024355.b3lyp_6-31g(d).log.xz 045024355.td-b3lyp_6-31g+(d).inp 045024355.td-b3lyp_6-31g+(d).log.xz

045024355.td-b3lyp_6-31+g(d).qchem.inp (generated)

045024355.td-b3lyp_6-31+g(d).gjf (generated)

045024355.td-b3lyp_6-31+g(d).firefly.inp (generated)

045024355.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045024355.mol 045024355.PUBCHEM 045024355.mol (via Jmol)
045024450.b3lyp_6-31g(d).inp

045024450.b3lyp_6-31g(d).qchem.inp (generated)

045024450.b3lyp_6-31g(d).gjf (generated)

045024450.b3lyp_6-31g(d).firefly.inp (generated)

045024450.b3lyp_6-31g(d).smash.inp (generated)

045024450.b3lyp_6-31g(d).nwchem.inp (generated) 045024450.b3lyp_6-31g(d).log.xz 045024450.td-b3lyp_6-31g+(d).inp 045024450.td-b3lyp_6-31g+(d).log.xz

045024450.td-b3lyp_6-31+g(d).qchem.inp (generated)

045024450.td-b3lyp_6-31+g(d).gjf (generated)

045024450.td-b3lyp_6-31+g(d).firefly.inp (generated)

045024450.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045024450.mol 045024450.PUBCHEM 045024450.mol (via Jmol)
045024452.b3lyp_6-31g(d).inp

045024452.b3lyp_6-31g(d).qchem.inp (generated)

045024452.b3lyp_6-31g(d).gjf (generated)

045024452.b3lyp_6-31g(d).firefly.inp (generated)

045024452.b3lyp_6-31g(d).smash.inp (generated)

045024452.b3lyp_6-31g(d).nwchem.inp (generated) 045024452.b3lyp_6-31g(d).log.xz 045024452.td-b3lyp_6-31g+(d).inp 045024452.td-b3lyp_6-31g+(d).log.xz

045024452.td-b3lyp_6-31+g(d).qchem.inp (generated)

045024452.td-b3lyp_6-31+g(d).gjf (generated)

045024452.td-b3lyp_6-31+g(d).firefly.inp (generated)

045024452.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045024452.mol 045024452.PUBCHEM 045024452.mol (via Jmol)
045024456.b3lyp_6-31g(d).inp

045024456.b3lyp_6-31g(d).qchem.inp (generated)

045024456.b3lyp_6-31g(d).gjf (generated)

045024456.b3lyp_6-31g(d).firefly.inp (generated)

045024456.b3lyp_6-31g(d).smash.inp (generated)

045024456.b3lyp_6-31g(d).nwchem.inp (generated) 045024456.b3lyp_6-31g(d).log.xz 045024456.td-b3lyp_6-31g+(d).inp 045024456.td-b3lyp_6-31g+(d).log.xz

045024456.td-b3lyp_6-31+g(d).qchem.inp (generated)

045024456.td-b3lyp_6-31+g(d).gjf (generated)

045024456.td-b3lyp_6-31+g(d).firefly.inp (generated)

045024456.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045024456.mol 045024456.PUBCHEM 045024456.mol (via Jmol)
045024458.b3lyp_6-31g(d).inp

045024458.b3lyp_6-31g(d).qchem.inp (generated)

045024458.b3lyp_6-31g(d).gjf (generated)

045024458.b3lyp_6-31g(d).firefly.inp (generated)

045024458.b3lyp_6-31g(d).smash.inp (generated)

045024458.b3lyp_6-31g(d).nwchem.inp (generated) 045024458.b3lyp_6-31g(d).log.xz 045024458.td-b3lyp_6-31g+(d).inp 045024458.td-b3lyp_6-31g+(d).log.xz

045024458.td-b3lyp_6-31+g(d).qchem.inp (generated)

045024458.td-b3lyp_6-31+g(d).gjf (generated)

045024458.td-b3lyp_6-31+g(d).firefly.inp (generated)

045024458.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045024458.mol 045024458.PUBCHEM 045024458.mol (via Jmol)
045024461.b3lyp_6-31g(d).inp

045024461.b3lyp_6-31g(d).qchem.inp (generated)

045024461.b3lyp_6-31g(d).gjf (generated)

045024461.b3lyp_6-31g(d).firefly.inp (generated)

045024461.b3lyp_6-31g(d).smash.inp (generated)

045024461.b3lyp_6-31g(d).nwchem.inp (generated) 045024461.b3lyp_6-31g(d).log.xz 045024461.td-b3lyp_6-31g+(d).inp 045024461.td-b3lyp_6-31g+(d).log.xz

045024461.td-b3lyp_6-31+g(d).qchem.inp (generated)

045024461.td-b3lyp_6-31+g(d).gjf (generated)

045024461.td-b3lyp_6-31+g(d).firefly.inp (generated)

045024461.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045024461.mol 045024461.PUBCHEM 045024461.mol (via Jmol)
045024464.b3lyp_6-31g(d).inp

045024464.b3lyp_6-31g(d).qchem.inp (generated)

045024464.b3lyp_6-31g(d).gjf (generated)

045024464.b3lyp_6-31g(d).firefly.inp (generated)

045024464.b3lyp_6-31g(d).smash.inp (generated)

045024464.b3lyp_6-31g(d).nwchem.inp (generated) 045024464.b3lyp_6-31g(d).log.xz 045024464.td-b3lyp_6-31g+(d).inp 045024464.td-b3lyp_6-31g+(d).log.xz

045024464.td-b3lyp_6-31+g(d).qchem.inp (generated)

045024464.td-b3lyp_6-31+g(d).gjf (generated)

045024464.td-b3lyp_6-31+g(d).firefly.inp (generated)

045024464.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045024464.mol 045024464.PUBCHEM 045024464.mol (via Jmol)
045024477.b3lyp_6-31g(d).inp

045024477.b3lyp_6-31g(d).qchem.inp (generated)

045024477.b3lyp_6-31g(d).gjf (generated)

045024477.b3lyp_6-31g(d).firefly.inp (generated)

045024477.b3lyp_6-31g(d).smash.inp (generated)

045024477.b3lyp_6-31g(d).nwchem.inp (generated) 045024477.b3lyp_6-31g(d).log.xz 045024477.mol 045024477.PUBCHEM 045024477.mol (via Jmol)
045024529.b3lyp_6-31g(d).inp

045024529.b3lyp_6-31g(d).qchem.inp (generated)

045024529.b3lyp_6-31g(d).gjf (generated)

045024529.b3lyp_6-31g(d).firefly.inp (generated)

045024529.b3lyp_6-31g(d).smash.inp (generated)

045024529.b3lyp_6-31g(d).nwchem.inp (generated) 045024529.b3lyp_6-31g(d).log.xz 045024529.td-b3lyp_6-31g+(d).inp 045024529.td-b3lyp_6-31g+(d).log.xz

045024529.td-b3lyp_6-31+g(d).qchem.inp (generated)

045024529.td-b3lyp_6-31+g(d).gjf (generated)

045024529.td-b3lyp_6-31+g(d).firefly.inp (generated)

045024529.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045024529.mol 045024529.PUBCHEM 045024529.mol (via Jmol)
045024936.b3lyp_6-31g(d).inp

045024936.b3lyp_6-31g(d).qchem.inp (generated)

045024936.b3lyp_6-31g(d).gjf (generated)

045024936.b3lyp_6-31g(d).firefly.inp (generated)

045024936.b3lyp_6-31g(d).smash.inp (generated)

045024936.b3lyp_6-31g(d).nwchem.inp (generated) 045024936.b3lyp_6-31g(d).log.xz 045024936.td-b3lyp_6-31g+(d).inp 045024936.td-b3lyp_6-31g+(d).log.xz

045024936.td-b3lyp_6-31+g(d).qchem.inp (generated)

045024936.td-b3lyp_6-31+g(d).gjf (generated)

045024936.td-b3lyp_6-31+g(d).firefly.inp (generated)

045024936.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045024936.mol 045024936.PUBCHEM 045024936.mol (via Jmol)
045024968.b3lyp_6-31g(d).inp

045024968.b3lyp_6-31g(d).qchem.inp (generated)

045024968.b3lyp_6-31g(d).gjf (generated)

045024968.b3lyp_6-31g(d).firefly.inp (generated)

045024968.b3lyp_6-31g(d).smash.inp (generated)

045024968.b3lyp_6-31g(d).nwchem.inp (generated) 045024968.b3lyp_6-31g(d).log.xz 045024968.td-b3lyp_6-31g+(d).inp 045024968.td-b3lyp_6-31g+(d).log.xz

045024968.td-b3lyp_6-31+g(d).qchem.inp (generated)

045024968.td-b3lyp_6-31+g(d).gjf (generated)

045024968.td-b3lyp_6-31+g(d).firefly.inp (generated)

045024968.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045024968.mol 045024968.PUBCHEM 045024968.mol (via Jmol)
045024974.b3lyp_6-31g(d).inp

045024974.b3lyp_6-31g(d).qchem.inp (generated)

045024974.b3lyp_6-31g(d).gjf (generated)

045024974.b3lyp_6-31g(d).firefly.inp (generated)

045024974.b3lyp_6-31g(d).smash.inp (generated)

045024974.b3lyp_6-31g(d).nwchem.inp (generated) 045024974.b3lyp_6-31g(d).log.xz 045024974.td-b3lyp_6-31g+(d).inp 045024974.td-b3lyp_6-31g+(d).log.xz

045024974.td-b3lyp_6-31+g(d).qchem.inp (generated)

045024974.td-b3lyp_6-31+g(d).gjf (generated)

045024974.td-b3lyp_6-31+g(d).firefly.inp (generated)

045024974.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045024974.mol 045024974.PUBCHEM 045024974.mol (via Jmol)
045024981.b3lyp_6-31g(d).inp

045024981.b3lyp_6-31g(d).qchem.inp (generated)

045024981.b3lyp_6-31g(d).gjf (generated)

045024981.b3lyp_6-31g(d).firefly.inp (generated)

045024981.b3lyp_6-31g(d).smash.inp (generated)

045024981.b3lyp_6-31g(d).nwchem.inp (generated) 045024981.b3lyp_6-31g(d).log.xz 045024981.td-b3lyp_6-31g+(d).inp 045024981.td-b3lyp_6-31g+(d).log.xz

045024981.td-b3lyp_6-31+g(d).qchem.inp (generated)

045024981.td-b3lyp_6-31+g(d).gjf (generated)

045024981.td-b3lyp_6-31+g(d).firefly.inp (generated)

045024981.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045024981.mol 045024981.PUBCHEM 045024981.mol (via Jmol)
045024998.b3lyp_6-31g(d).inp

045024998.b3lyp_6-31g(d).qchem.inp (generated)

045024998.b3lyp_6-31g(d).gjf (generated)

045024998.b3lyp_6-31g(d).firefly.inp (generated)

045024998.b3lyp_6-31g(d).smash.inp (generated)

045024998.b3lyp_6-31g(d).nwchem.inp (generated) 045024998.b3lyp_6-31g(d).log.xz 045024998.td-b3lyp_6-31g+(d).inp 045024998.td-b3lyp_6-31g+(d).log.xz

045024998.td-b3lyp_6-31+g(d).qchem.inp (generated)

045024998.td-b3lyp_6-31+g(d).gjf (generated)

045024998.td-b3lyp_6-31+g(d).firefly.inp (generated)

045024998.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045024998.mol 045024998.PUBCHEM 045024998.mol (via Jmol)
045024999.b3lyp_6-31g(d).inp

045024999.b3lyp_6-31g(d).qchem.inp (generated)

045024999.b3lyp_6-31g(d).gjf (generated)

045024999.b3lyp_6-31g(d).firefly.inp (generated)

045024999.b3lyp_6-31g(d).smash.inp (generated)

045024999.b3lyp_6-31g(d).nwchem.inp (generated) 045024999.b3lyp_6-31g(d).log.xz 045024999.td-b3lyp_6-31g+(d).inp 045024999.td-b3lyp_6-31g+(d).log.xz

045024999.td-b3lyp_6-31+g(d).qchem.inp (generated)

045024999.td-b3lyp_6-31+g(d).gjf (generated)

045024999.td-b3lyp_6-31+g(d).firefly.inp (generated)

045024999.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045024999.mol 045024999.PUBCHEM 045024999.mol (via Jmol)


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