Index of

Last updated : Thu Aug 17 01:52:36 JST 2017
Total : 1118 (977) in this page
012000008.b3lyp_6-31g(d).inp

012000008.b3lyp_6-31g(d).qchem.inp (generated)

012000008.b3lyp_6-31g(d).gjf (generated)

012000008.b3lyp_6-31g(d).firefly.inp (generated)

012000008.b3lyp_6-31g(d).smash.inp (generated)

012000008.b3lyp_6-31g(d).nwchem.inp (generated) 012000008.b3lyp_6-31g(d).log.xz 012000008.td-b3lyp_6-31g+(d).inp 012000008.td-b3lyp_6-31g+(d).log.xz

012000008.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000008.td-b3lyp_6-31+g(d).gjf (generated)

012000008.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000008.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000008.mol 012000008.PUBCHEM 012000008.mol (via Jmol)
012000012.b3lyp_6-31g(d).inp

012000012.b3lyp_6-31g(d).qchem.inp (generated)

012000012.b3lyp_6-31g(d).gjf (generated)

012000012.b3lyp_6-31g(d).firefly.inp (generated)

012000012.b3lyp_6-31g(d).smash.inp (generated)

012000012.b3lyp_6-31g(d).nwchem.inp (generated) 012000012.b3lyp_6-31g(d).log.xz 012000012.td-b3lyp_6-31g+(d).inp 012000012.td-b3lyp_6-31g+(d).log.xz

012000012.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000012.td-b3lyp_6-31+g(d).gjf (generated)

012000012.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000012.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000012.mol 012000012.PUBCHEM 012000012.mol (via Jmol)
012000013.b3lyp_6-31g(d).inp

012000013.b3lyp_6-31g(d).qchem.inp (generated)

012000013.b3lyp_6-31g(d).gjf (generated)

012000013.b3lyp_6-31g(d).firefly.inp (generated)

012000013.b3lyp_6-31g(d).smash.inp (generated)

012000013.b3lyp_6-31g(d).nwchem.inp (generated) 012000013.b3lyp_6-31g(d).log.xz 012000013.td-b3lyp_6-31g+(d).inp 012000013.td-b3lyp_6-31g+(d).log.xz

012000013.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000013.td-b3lyp_6-31+g(d).gjf (generated)

012000013.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000013.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000013.mol 012000013.PUBCHEM 012000013.mol (via Jmol)
012000031.b3lyp_6-31g(d).inp

012000031.b3lyp_6-31g(d).qchem.inp (generated)

012000031.b3lyp_6-31g(d).gjf (generated)

012000031.b3lyp_6-31g(d).firefly.inp (generated)

012000031.b3lyp_6-31g(d).smash.inp (generated)

012000031.b3lyp_6-31g(d).nwchem.inp (generated) 012000031.b3lyp_6-31g(d).log.xz 012000031.td-b3lyp_6-31g+(d).inp 012000031.td-b3lyp_6-31g+(d).log.xz

012000031.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000031.td-b3lyp_6-31+g(d).gjf (generated)

012000031.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000031.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000031.mol 012000031.PUBCHEM 012000031.mol (via Jmol)
012000032.b3lyp_6-31g(d).inp

012000032.b3lyp_6-31g(d).qchem.inp (generated)

012000032.b3lyp_6-31g(d).gjf (generated)

012000032.b3lyp_6-31g(d).firefly.inp (generated)

012000032.b3lyp_6-31g(d).smash.inp (generated)

012000032.b3lyp_6-31g(d).nwchem.inp (generated) 012000032.b3lyp_6-31g(d).log.xz 012000032.td-b3lyp_6-31g+(d).inp 012000032.td-b3lyp_6-31g+(d).log.xz

012000032.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000032.td-b3lyp_6-31+g(d).gjf (generated)

012000032.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000032.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000032.mol 012000032.PUBCHEM 012000032.mol (via Jmol)
012000034.b3lyp_6-31g(d).inp

012000034.b3lyp_6-31g(d).qchem.inp (generated)

012000034.b3lyp_6-31g(d).gjf (generated)

012000034.b3lyp_6-31g(d).firefly.inp (generated)

012000034.b3lyp_6-31g(d).smash.inp (generated)

012000034.b3lyp_6-31g(d).nwchem.inp (generated) 012000034.b3lyp_6-31g(d).log.xz 012000034.td-b3lyp_6-31g+(d).inp 012000034.td-b3lyp_6-31g+(d).log.xz

012000034.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000034.td-b3lyp_6-31+g(d).gjf (generated)

012000034.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000034.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000034.mol 012000034.PUBCHEM 012000034.mol (via Jmol)
012000044.b3lyp_6-31g(d).inp

012000044.b3lyp_6-31g(d).qchem.inp (generated)

012000044.b3lyp_6-31g(d).gjf (generated)

012000044.b3lyp_6-31g(d).firefly.inp (generated)

012000044.b3lyp_6-31g(d).smash.inp (generated)

012000044.b3lyp_6-31g(d).nwchem.inp (generated) 012000044.b3lyp_6-31g(d).log.xz 012000044.td-b3lyp_6-31g+(d).inp 012000044.td-b3lyp_6-31g+(d).log.xz

012000044.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000044.td-b3lyp_6-31+g(d).gjf (generated)

012000044.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000044.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000044.mol 012000044.PUBCHEM 012000044.mol (via Jmol)
012000086.b3lyp_6-31g(d).inp

012000086.b3lyp_6-31g(d).qchem.inp (generated)

012000086.b3lyp_6-31g(d).gjf (generated)

012000086.b3lyp_6-31g(d).firefly.inp (generated)

012000086.b3lyp_6-31g(d).smash.inp (generated)

012000086.b3lyp_6-31g(d).nwchem.inp (generated) 012000086.b3lyp_6-31g(d).log.xz 012000086.td-b3lyp_6-31g+(d).inp 012000086.td-b3lyp_6-31g+(d).log.xz

012000086.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000086.td-b3lyp_6-31+g(d).gjf (generated)

012000086.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000086.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000086.mol 012000086.PUBCHEM 012000086.mol (via Jmol)
012000094.b3lyp_6-31g(d).inp

012000094.b3lyp_6-31g(d).qchem.inp (generated)

012000094.b3lyp_6-31g(d).gjf (generated)

012000094.b3lyp_6-31g(d).firefly.inp (generated)

012000094.b3lyp_6-31g(d).smash.inp (generated)

012000094.b3lyp_6-31g(d).nwchem.inp (generated) 012000094.b3lyp_6-31g(d).log.xz 012000094.td-b3lyp_6-31g+(d).inp 012000094.td-b3lyp_6-31g+(d).log.xz

012000094.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000094.td-b3lyp_6-31+g(d).gjf (generated)

012000094.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000094.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000094.mol 012000094.PUBCHEM 012000094.mol (via Jmol)
012000122.b3lyp_6-31g(d).inp

012000122.b3lyp_6-31g(d).qchem.inp (generated)

012000122.b3lyp_6-31g(d).gjf (generated)

012000122.b3lyp_6-31g(d).firefly.inp (generated)

012000122.b3lyp_6-31g(d).smash.inp (generated)

012000122.b3lyp_6-31g(d).nwchem.inp (generated) 012000122.b3lyp_6-31g(d).log.xz 012000122.mol 012000122.PUBCHEM 012000122.mol (via Jmol)
012000132.b3lyp_6-31g(d).inp

012000132.b3lyp_6-31g(d).qchem.inp (generated)

012000132.b3lyp_6-31g(d).gjf (generated)

012000132.b3lyp_6-31g(d).firefly.inp (generated)

012000132.b3lyp_6-31g(d).smash.inp (generated)

012000132.b3lyp_6-31g(d).nwchem.inp (generated) 012000132.b3lyp_6-31g(d).log.xz 012000132.td-b3lyp_6-31g+(d).inp 012000132.td-b3lyp_6-31g+(d).log.xz

012000132.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000132.td-b3lyp_6-31+g(d).gjf (generated)

012000132.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000132.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000132.mol 012000132.PUBCHEM 012000132.mol (via Jmol)
012000135.b3lyp_6-31g(d).inp

012000135.b3lyp_6-31g(d).qchem.inp (generated)

012000135.b3lyp_6-31g(d).gjf (generated)

012000135.b3lyp_6-31g(d).firefly.inp (generated)

012000135.b3lyp_6-31g(d).smash.inp (generated)

012000135.b3lyp_6-31g(d).nwchem.inp (generated) 012000135.b3lyp_6-31g(d).log.xz 012000135.td-b3lyp_6-31g+(d).inp 012000135.td-b3lyp_6-31g+(d).log.xz

012000135.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000135.td-b3lyp_6-31+g(d).gjf (generated)

012000135.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000135.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000135.mol 012000135.PUBCHEM 012000135.mol (via Jmol)
012000145.b3lyp_6-31g(d).inp

012000145.b3lyp_6-31g(d).qchem.inp (generated)

012000145.b3lyp_6-31g(d).gjf (generated)

012000145.b3lyp_6-31g(d).firefly.inp (generated)

012000145.b3lyp_6-31g(d).smash.inp (generated)

012000145.b3lyp_6-31g(d).nwchem.inp (generated) 012000145.b3lyp_6-31g(d).log.xz 012000145.td-b3lyp_6-31g+(d).inp 012000145.td-b3lyp_6-31g+(d).log.xz

012000145.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000145.td-b3lyp_6-31+g(d).gjf (generated)

012000145.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000145.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000145.mol 012000145.PUBCHEM 012000145.mol (via Jmol)
012000169.b3lyp_6-31g(d).inp

012000169.b3lyp_6-31g(d).qchem.inp (generated)

012000169.b3lyp_6-31g(d).gjf (generated)

012000169.b3lyp_6-31g(d).firefly.inp (generated)

012000169.b3lyp_6-31g(d).smash.inp (generated)

012000169.b3lyp_6-31g(d).nwchem.inp (generated) 012000169.b3lyp_6-31g(d).log.xz 012000169.td-b3lyp_6-31g+(d).inp 012000169.td-b3lyp_6-31g+(d).log.xz

012000169.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000169.td-b3lyp_6-31+g(d).gjf (generated)

012000169.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000169.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000169.mol 012000169.PUBCHEM 012000169.mol (via Jmol)
012000188.b3lyp_6-31g(d).inp

012000188.b3lyp_6-31g(d).qchem.inp (generated)

012000188.b3lyp_6-31g(d).gjf (generated)

012000188.b3lyp_6-31g(d).firefly.inp (generated)

012000188.b3lyp_6-31g(d).smash.inp (generated)

012000188.b3lyp_6-31g(d).nwchem.inp (generated) 012000188.b3lyp_6-31g(d).log.xz 012000188.mol 012000188.PUBCHEM 012000188.mol (via Jmol)
012000192.b3lyp_6-31g(d).inp

012000192.b3lyp_6-31g(d).qchem.inp (generated)

012000192.b3lyp_6-31g(d).gjf (generated)

012000192.b3lyp_6-31g(d).firefly.inp (generated)

012000192.b3lyp_6-31g(d).smash.inp (generated)

012000192.b3lyp_6-31g(d).nwchem.inp (generated) 012000192.b3lyp_6-31g(d).log.xz 012000192.td-b3lyp_6-31g+(d).inp 012000192.td-b3lyp_6-31g+(d).log.xz

012000192.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000192.td-b3lyp_6-31+g(d).gjf (generated)

012000192.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000192.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000192.mol 012000192.PUBCHEM 012000192.mol (via Jmol)
012000203.b3lyp_6-31g(d).inp

012000203.b3lyp_6-31g(d).qchem.inp (generated)

012000203.b3lyp_6-31g(d).gjf (generated)

012000203.b3lyp_6-31g(d).firefly.inp (generated)

012000203.b3lyp_6-31g(d).smash.inp (generated)

012000203.b3lyp_6-31g(d).nwchem.inp (generated) 012000203.b3lyp_6-31g(d).log.xz 012000203.td-b3lyp_6-31g+(d).inp 012000203.td-b3lyp_6-31g+(d).log.xz

012000203.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000203.td-b3lyp_6-31+g(d).gjf (generated)

012000203.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000203.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000203.mol 012000203.PUBCHEM 012000203.mol (via Jmol)
012000213.b3lyp_6-31g(d).inp

012000213.b3lyp_6-31g(d).qchem.inp (generated)

012000213.b3lyp_6-31g(d).gjf (generated)

012000213.b3lyp_6-31g(d).firefly.inp (generated)

012000213.b3lyp_6-31g(d).smash.inp (generated)

012000213.b3lyp_6-31g(d).nwchem.inp (generated) 012000213.b3lyp_6-31g(d).log.xz 012000213.td-b3lyp_6-31g+(d).inp 012000213.td-b3lyp_6-31g+(d).log.xz

012000213.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000213.td-b3lyp_6-31+g(d).gjf (generated)

012000213.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000213.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000213.mol 012000213.PUBCHEM 012000213.mol (via Jmol)
012000214.b3lyp_6-31g(d).inp

012000214.b3lyp_6-31g(d).qchem.inp (generated)

012000214.b3lyp_6-31g(d).gjf (generated)

012000214.b3lyp_6-31g(d).firefly.inp (generated)

012000214.b3lyp_6-31g(d).smash.inp (generated)

012000214.b3lyp_6-31g(d).nwchem.inp (generated) 012000214.b3lyp_6-31g(d).log.xz 012000214.td-b3lyp_6-31g+(d).inp 012000214.td-b3lyp_6-31g+(d).log.xz

012000214.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000214.td-b3lyp_6-31+g(d).gjf (generated)

012000214.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000214.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000214.mol 012000214.PUBCHEM 012000214.mol (via Jmol)
012000215.b3lyp_6-31g(d).inp

012000215.b3lyp_6-31g(d).qchem.inp (generated)

012000215.b3lyp_6-31g(d).gjf (generated)

012000215.b3lyp_6-31g(d).firefly.inp (generated)

012000215.b3lyp_6-31g(d).smash.inp (generated)

012000215.b3lyp_6-31g(d).nwchem.inp (generated) 012000215.b3lyp_6-31g(d).log.xz 012000215.mol 012000215.PUBCHEM 012000215.mol (via Jmol)
012000216.b3lyp_6-31g(d).inp

012000216.b3lyp_6-31g(d).qchem.inp (generated)

012000216.b3lyp_6-31g(d).gjf (generated)

012000216.b3lyp_6-31g(d).firefly.inp (generated)

012000216.b3lyp_6-31g(d).smash.inp (generated)

012000216.b3lyp_6-31g(d).nwchem.inp (generated) 012000216.b3lyp_6-31g(d).log.xz 012000216.td-b3lyp_6-31g+(d).inp 012000216.td-b3lyp_6-31g+(d).log.xz

012000216.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000216.td-b3lyp_6-31+g(d).gjf (generated)

012000216.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000216.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000216.mol 012000216.PUBCHEM 012000216.mol (via Jmol)
012000219.b3lyp_6-31g(d).inp

012000219.b3lyp_6-31g(d).qchem.inp (generated)

012000219.b3lyp_6-31g(d).gjf (generated)

012000219.b3lyp_6-31g(d).firefly.inp (generated)

012000219.b3lyp_6-31g(d).smash.inp (generated)

012000219.b3lyp_6-31g(d).nwchem.inp (generated) 012000219.b3lyp_6-31g(d).log.xz 012000219.td-b3lyp_6-31g+(d).inp 012000219.td-b3lyp_6-31g+(d).log.xz

012000219.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000219.td-b3lyp_6-31+g(d).gjf (generated)

012000219.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000219.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000219.mol 012000219.PUBCHEM 012000219.mol (via Jmol)
012000252.b3lyp_6-31g(d).inp

012000252.b3lyp_6-31g(d).qchem.inp (generated)

012000252.b3lyp_6-31g(d).gjf (generated)

012000252.b3lyp_6-31g(d).firefly.inp (generated)

012000252.b3lyp_6-31g(d).smash.inp (generated)

012000252.b3lyp_6-31g(d).nwchem.inp (generated) 012000252.b3lyp_6-31g(d).log.xz 012000252.td-b3lyp_6-31g+(d).inp 012000252.td-b3lyp_6-31g+(d).log.xz

012000252.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000252.td-b3lyp_6-31+g(d).gjf (generated)

012000252.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000252.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000252.mol 012000252.PUBCHEM 012000252.mol (via Jmol)
012000258.b3lyp_6-31g(d).inp

012000258.b3lyp_6-31g(d).qchem.inp (generated)

012000258.b3lyp_6-31g(d).gjf (generated)

012000258.b3lyp_6-31g(d).firefly.inp (generated)

012000258.b3lyp_6-31g(d).smash.inp (generated)

012000258.b3lyp_6-31g(d).nwchem.inp (generated) 012000258.b3lyp_6-31g(d).log.xz 012000258.td-b3lyp_6-31g+(d).inp 012000258.td-b3lyp_6-31g+(d).log.xz

012000258.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000258.td-b3lyp_6-31+g(d).gjf (generated)

012000258.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000258.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000258.mol 012000258.PUBCHEM 012000258.mol (via Jmol)
012000261.b3lyp_6-31g(d).inp

012000261.b3lyp_6-31g(d).qchem.inp (generated)

012000261.b3lyp_6-31g(d).gjf (generated)

012000261.b3lyp_6-31g(d).firefly.inp (generated)

012000261.b3lyp_6-31g(d).smash.inp (generated)

012000261.b3lyp_6-31g(d).nwchem.inp (generated) 012000261.b3lyp_6-31g(d).log.xz 012000261.td-b3lyp_6-31g+(d).inp 012000261.td-b3lyp_6-31g+(d).log.xz

012000261.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000261.td-b3lyp_6-31+g(d).gjf (generated)

012000261.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000261.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000261.mol 012000261.PUBCHEM 012000261.mol (via Jmol)
012000270.b3lyp_6-31g(d).inp

012000270.b3lyp_6-31g(d).qchem.inp (generated)

012000270.b3lyp_6-31g(d).gjf (generated)

012000270.b3lyp_6-31g(d).firefly.inp (generated)

012000270.b3lyp_6-31g(d).smash.inp (generated)

012000270.b3lyp_6-31g(d).nwchem.inp (generated) 012000270.b3lyp_6-31g(d).log.xz 012000270.td-b3lyp_6-31g+(d).inp 012000270.td-b3lyp_6-31g+(d).log.xz

012000270.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000270.td-b3lyp_6-31+g(d).gjf (generated)

012000270.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000270.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000270.mol 012000270.PUBCHEM 012000270.mol (via Jmol)
012000271.b3lyp_6-31g(d).inp

012000271.b3lyp_6-31g(d).qchem.inp (generated)

012000271.b3lyp_6-31g(d).gjf (generated)

012000271.b3lyp_6-31g(d).firefly.inp (generated)

012000271.b3lyp_6-31g(d).smash.inp (generated)

012000271.b3lyp_6-31g(d).nwchem.inp (generated) 012000271.b3lyp_6-31g(d).log.xz 012000271.td-b3lyp_6-31g+(d).inp 012000271.td-b3lyp_6-31g+(d).log.xz

012000271.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000271.td-b3lyp_6-31+g(d).gjf (generated)

012000271.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000271.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000271.mol 012000271.PUBCHEM 012000271.mol (via Jmol)
012000282.b3lyp_6-31g(d).inp

012000282.b3lyp_6-31g(d).qchem.inp (generated)

012000282.b3lyp_6-31g(d).gjf (generated)

012000282.b3lyp_6-31g(d).firefly.inp (generated)

012000282.b3lyp_6-31g(d).smash.inp (generated)

012000282.b3lyp_6-31g(d).nwchem.inp (generated) 012000282.b3lyp_6-31g(d).log.xz 012000282.td-b3lyp_6-31g+(d).inp 012000282.td-b3lyp_6-31g+(d).log.xz

012000282.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000282.td-b3lyp_6-31+g(d).gjf (generated)

012000282.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000282.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000282.mol 012000282.PUBCHEM 012000282.mol (via Jmol)
012000283.b3lyp_6-31g(d).inp

012000283.b3lyp_6-31g(d).qchem.inp (generated)

012000283.b3lyp_6-31g(d).gjf (generated)

012000283.b3lyp_6-31g(d).firefly.inp (generated)

012000283.b3lyp_6-31g(d).smash.inp (generated)

012000283.b3lyp_6-31g(d).nwchem.inp (generated) 012000283.b3lyp_6-31g(d).log.xz 012000283.td-b3lyp_6-31g+(d).inp 012000283.td-b3lyp_6-31g+(d).log.xz

012000283.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000283.td-b3lyp_6-31+g(d).gjf (generated)

012000283.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000283.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000283.mol 012000283.PUBCHEM 012000283.mol (via Jmol)
012000285.b3lyp_6-31g(d).inp

012000285.b3lyp_6-31g(d).qchem.inp (generated)

012000285.b3lyp_6-31g(d).gjf (generated)

012000285.b3lyp_6-31g(d).firefly.inp (generated)

012000285.b3lyp_6-31g(d).smash.inp (generated)

012000285.b3lyp_6-31g(d).nwchem.inp (generated) 012000285.b3lyp_6-31g(d).log.xz 012000285.td-b3lyp_6-31g+(d).inp 012000285.td-b3lyp_6-31g+(d).log.xz

012000285.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000285.td-b3lyp_6-31+g(d).gjf (generated)

012000285.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000285.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000285.mol 012000285.PUBCHEM 012000285.mol (via Jmol)
012000286.b3lyp_6-31g(d).inp

012000286.b3lyp_6-31g(d).qchem.inp (generated)

012000286.b3lyp_6-31g(d).gjf (generated)

012000286.b3lyp_6-31g(d).firefly.inp (generated)

012000286.b3lyp_6-31g(d).smash.inp (generated)

012000286.b3lyp_6-31g(d).nwchem.inp (generated) 012000286.b3lyp_6-31g(d).log.xz 012000286.td-b3lyp_6-31g+(d).inp 012000286.td-b3lyp_6-31g+(d).log.xz

012000286.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000286.td-b3lyp_6-31+g(d).gjf (generated)

012000286.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000286.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000286.mol 012000286.PUBCHEM 012000286.mol (via Jmol)
012000295.b3lyp_6-31g(d).inp

012000295.b3lyp_6-31g(d).qchem.inp (generated)

012000295.b3lyp_6-31g(d).gjf (generated)

012000295.b3lyp_6-31g(d).firefly.inp (generated)

012000295.b3lyp_6-31g(d).smash.inp (generated)

012000295.b3lyp_6-31g(d).nwchem.inp (generated) 012000295.b3lyp_6-31g(d).log.xz 012000295.td-b3lyp_6-31g+(d).inp 012000295.td-b3lyp_6-31g+(d).log.xz

012000295.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000295.td-b3lyp_6-31+g(d).gjf (generated)

012000295.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000295.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000295.mol 012000295.PUBCHEM 012000295.mol (via Jmol)
012000310.b3lyp_6-31g(d).inp

012000310.b3lyp_6-31g(d).qchem.inp (generated)

012000310.b3lyp_6-31g(d).gjf (generated)

012000310.b3lyp_6-31g(d).firefly.inp (generated)

012000310.b3lyp_6-31g(d).smash.inp (generated)

012000310.b3lyp_6-31g(d).nwchem.inp (generated) 012000310.b3lyp_6-31g(d).log.xz 012000310.mol 012000310.PUBCHEM 012000310.mol (via Jmol)
012000321.b3lyp_6-31g(d).inp

012000321.b3lyp_6-31g(d).qchem.inp (generated)

012000321.b3lyp_6-31g(d).gjf (generated)

012000321.b3lyp_6-31g(d).firefly.inp (generated)

012000321.b3lyp_6-31g(d).smash.inp (generated)

012000321.b3lyp_6-31g(d).nwchem.inp (generated) 012000321.b3lyp_6-31g(d).log.xz 012000321.td-b3lyp_6-31g+(d).inp 012000321.td-b3lyp_6-31g+(d).log.xz

012000321.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000321.td-b3lyp_6-31+g(d).gjf (generated)

012000321.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000321.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000321.mol 012000321.PUBCHEM 012000321.mol (via Jmol)
012000322.b3lyp_6-31g(d).inp

012000322.b3lyp_6-31g(d).qchem.inp (generated)

012000322.b3lyp_6-31g(d).gjf (generated)

012000322.b3lyp_6-31g(d).firefly.inp (generated)

012000322.b3lyp_6-31g(d).smash.inp (generated)

012000322.b3lyp_6-31g(d).nwchem.inp (generated) 012000322.b3lyp_6-31g(d).log.xz 012000322.td-b3lyp_6-31g+(d).inp 012000322.td-b3lyp_6-31g+(d).log.xz

012000322.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000322.td-b3lyp_6-31+g(d).gjf (generated)

012000322.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000322.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000322.mol 012000322.PUBCHEM 012000322.mol (via Jmol)
012000323.b3lyp_6-31g(d).inp

012000323.b3lyp_6-31g(d).qchem.inp (generated)

012000323.b3lyp_6-31g(d).gjf (generated)

012000323.b3lyp_6-31g(d).firefly.inp (generated)

012000323.b3lyp_6-31g(d).smash.inp (generated)

012000323.b3lyp_6-31g(d).nwchem.inp (generated) 012000323.b3lyp_6-31g(d).log.xz 012000323.td-b3lyp_6-31g+(d).inp 012000323.td-b3lyp_6-31g+(d).log.xz

012000323.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000323.td-b3lyp_6-31+g(d).gjf (generated)

012000323.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000323.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000323.mol 012000323.PUBCHEM 012000323.mol (via Jmol)
012000333.b3lyp_6-31g(d).inp

012000333.b3lyp_6-31g(d).qchem.inp (generated)

012000333.b3lyp_6-31g(d).gjf (generated)

012000333.b3lyp_6-31g(d).firefly.inp (generated)

012000333.b3lyp_6-31g(d).smash.inp (generated)

012000333.b3lyp_6-31g(d).nwchem.inp (generated) 012000333.b3lyp_6-31g(d).log.xz 012000333.td-b3lyp_6-31g+(d).inp 012000333.td-b3lyp_6-31g+(d).log.xz

012000333.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000333.td-b3lyp_6-31+g(d).gjf (generated)

012000333.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000333.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000333.mol 012000333.PUBCHEM 012000333.mol (via Jmol)
012000339.b3lyp_6-31g(d).inp

012000339.b3lyp_6-31g(d).qchem.inp (generated)

012000339.b3lyp_6-31g(d).gjf (generated)

012000339.b3lyp_6-31g(d).firefly.inp (generated)

012000339.b3lyp_6-31g(d).smash.inp (generated)

012000339.b3lyp_6-31g(d).nwchem.inp (generated) 012000339.b3lyp_6-31g(d).log.xz 012000339.td-b3lyp_6-31g+(d).inp 012000339.td-b3lyp_6-31g+(d).log.xz

012000339.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000339.td-b3lyp_6-31+g(d).gjf (generated)

012000339.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000339.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000339.mol 012000339.PUBCHEM 012000339.mol (via Jmol)
012000381.b3lyp_6-31g(d).inp

012000381.b3lyp_6-31g(d).qchem.inp (generated)

012000381.b3lyp_6-31g(d).gjf (generated)

012000381.b3lyp_6-31g(d).firefly.inp (generated)

012000381.b3lyp_6-31g(d).smash.inp (generated)

012000381.b3lyp_6-31g(d).nwchem.inp (generated) 012000381.b3lyp_6-31g(d).log.xz 012000381.td-b3lyp_6-31g+(d).inp 012000381.td-b3lyp_6-31g+(d).log.xz

012000381.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000381.td-b3lyp_6-31+g(d).gjf (generated)

012000381.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000381.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000381.mol 012000381.PUBCHEM 012000381.mol (via Jmol)
012000385.b3lyp_6-31g(d).inp

012000385.b3lyp_6-31g(d).qchem.inp (generated)

012000385.b3lyp_6-31g(d).gjf (generated)

012000385.b3lyp_6-31g(d).firefly.inp (generated)

012000385.b3lyp_6-31g(d).smash.inp (generated)

012000385.b3lyp_6-31g(d).nwchem.inp (generated) 012000385.b3lyp_6-31g(d).log.xz 012000385.td-b3lyp_6-31g+(d).inp 012000385.td-b3lyp_6-31g+(d).log.xz

012000385.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000385.td-b3lyp_6-31+g(d).gjf (generated)

012000385.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000385.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000385.mol 012000385.PUBCHEM 012000385.mol (via Jmol)
012000387.b3lyp_6-31g(d).inp

012000387.b3lyp_6-31g(d).qchem.inp (generated)

012000387.b3lyp_6-31g(d).gjf (generated)

012000387.b3lyp_6-31g(d).firefly.inp (generated)

012000387.b3lyp_6-31g(d).smash.inp (generated)

012000387.b3lyp_6-31g(d).nwchem.inp (generated) 012000387.b3lyp_6-31g(d).log.xz 012000387.td-b3lyp_6-31g+(d).inp 012000387.td-b3lyp_6-31g+(d).log.xz

012000387.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000387.td-b3lyp_6-31+g(d).gjf (generated)

012000387.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000387.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000387.mol 012000387.PUBCHEM 012000387.mol (via Jmol)
012000395.b3lyp_6-31g(d).inp

012000395.b3lyp_6-31g(d).qchem.inp (generated)

012000395.b3lyp_6-31g(d).gjf (generated)

012000395.b3lyp_6-31g(d).firefly.inp (generated)

012000395.b3lyp_6-31g(d).smash.inp (generated)

012000395.b3lyp_6-31g(d).nwchem.inp (generated) 012000395.b3lyp_6-31g(d).log.xz 012000395.td-b3lyp_6-31g+(d).inp 012000395.td-b3lyp_6-31g+(d).log.xz

012000395.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000395.td-b3lyp_6-31+g(d).gjf (generated)

012000395.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000395.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000395.mol 012000395.PUBCHEM 012000395.mol (via Jmol)
012000413.b3lyp_6-31g(d).inp

012000413.b3lyp_6-31g(d).qchem.inp (generated)

012000413.b3lyp_6-31g(d).gjf (generated)

012000413.b3lyp_6-31g(d).firefly.inp (generated)

012000413.b3lyp_6-31g(d).smash.inp (generated)

012000413.b3lyp_6-31g(d).nwchem.inp (generated) 012000413.b3lyp_6-31g(d).log.xz 012000413.td-b3lyp_6-31g+(d).inp 012000413.td-b3lyp_6-31g+(d).log.xz

012000413.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000413.td-b3lyp_6-31+g(d).gjf (generated)

012000413.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000413.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000413.mol 012000413.PUBCHEM 012000413.mol (via Jmol)
012000434.b3lyp_6-31g(d).inp

012000434.b3lyp_6-31g(d).qchem.inp (generated)

012000434.b3lyp_6-31g(d).gjf (generated)

012000434.b3lyp_6-31g(d).firefly.inp (generated)

012000434.b3lyp_6-31g(d).smash.inp (generated)

012000434.b3lyp_6-31g(d).nwchem.inp (generated) 012000434.b3lyp_6-31g(d).log.xz 012000434.td-b3lyp_6-31g+(d).inp 012000434.td-b3lyp_6-31g+(d).log.xz

012000434.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000434.td-b3lyp_6-31+g(d).gjf (generated)

012000434.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000434.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000434.mol 012000434.PUBCHEM 012000434.mol (via Jmol)
012000444.b3lyp_6-31g(d).inp

012000444.b3lyp_6-31g(d).qchem.inp (generated)

012000444.b3lyp_6-31g(d).gjf (generated)

012000444.b3lyp_6-31g(d).firefly.inp (generated)

012000444.b3lyp_6-31g(d).smash.inp (generated)

012000444.b3lyp_6-31g(d).nwchem.inp (generated) 012000444.b3lyp_6-31g(d).log.xz 012000444.td-b3lyp_6-31g+(d).inp 012000444.td-b3lyp_6-31g+(d).log.xz

012000444.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000444.td-b3lyp_6-31+g(d).gjf (generated)

012000444.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000444.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000444.mol 012000444.PUBCHEM 012000444.mol (via Jmol)
012000452.b3lyp_6-31g(d).inp

012000452.b3lyp_6-31g(d).qchem.inp (generated)

012000452.b3lyp_6-31g(d).gjf (generated)

012000452.b3lyp_6-31g(d).firefly.inp (generated)

012000452.b3lyp_6-31g(d).smash.inp (generated)

012000452.b3lyp_6-31g(d).nwchem.inp (generated) 012000452.b3lyp_6-31g(d).log.xz 012000452.td-b3lyp_6-31g+(d).inp 012000452.td-b3lyp_6-31g+(d).log.xz

012000452.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000452.td-b3lyp_6-31+g(d).gjf (generated)

012000452.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000452.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000452.mol 012000452.PUBCHEM 012000452.mol (via Jmol)
012000460.b3lyp_6-31g(d).inp

012000460.b3lyp_6-31g(d).qchem.inp (generated)

012000460.b3lyp_6-31g(d).gjf (generated)

012000460.b3lyp_6-31g(d).firefly.inp (generated)

012000460.b3lyp_6-31g(d).smash.inp (generated)

012000460.b3lyp_6-31g(d).nwchem.inp (generated) 012000460.b3lyp_6-31g(d).log.xz 012000460.mol 012000460.PUBCHEM 012000460.mol (via Jmol)
012000468.b3lyp_6-31g(d).inp

012000468.b3lyp_6-31g(d).qchem.inp (generated)

012000468.b3lyp_6-31g(d).gjf (generated)

012000468.b3lyp_6-31g(d).firefly.inp (generated)

012000468.b3lyp_6-31g(d).smash.inp (generated)

012000468.b3lyp_6-31g(d).nwchem.inp (generated) 012000468.b3lyp_6-31g(d).log.xz 012000468.td-b3lyp_6-31g+(d).inp 012000468.td-b3lyp_6-31g+(d).log.xz

012000468.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000468.td-b3lyp_6-31+g(d).gjf (generated)

012000468.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000468.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000468.mol 012000468.PUBCHEM 012000468.mol (via Jmol)
012000469.b3lyp_6-31g(d).inp

012000469.b3lyp_6-31g(d).qchem.inp (generated)

012000469.b3lyp_6-31g(d).gjf (generated)

012000469.b3lyp_6-31g(d).firefly.inp (generated)

012000469.b3lyp_6-31g(d).smash.inp (generated)

012000469.b3lyp_6-31g(d).nwchem.inp (generated) 012000469.b3lyp_6-31g(d).log.xz 012000469.td-b3lyp_6-31g+(d).inp 012000469.td-b3lyp_6-31g+(d).log.xz

012000469.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000469.td-b3lyp_6-31+g(d).gjf (generated)

012000469.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000469.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000469.mol 012000469.PUBCHEM 012000469.mol (via Jmol)
012000479.b3lyp_6-31g(d).inp

012000479.b3lyp_6-31g(d).qchem.inp (generated)

012000479.b3lyp_6-31g(d).gjf (generated)

012000479.b3lyp_6-31g(d).firefly.inp (generated)

012000479.b3lyp_6-31g(d).smash.inp (generated)

012000479.b3lyp_6-31g(d).nwchem.inp (generated) 012000479.b3lyp_6-31g(d).log.xz 012000479.td-b3lyp_6-31g+(d).inp 012000479.td-b3lyp_6-31g+(d).log.xz

012000479.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000479.td-b3lyp_6-31+g(d).gjf (generated)

012000479.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000479.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000479.mol 012000479.PUBCHEM 012000479.mol (via Jmol)
012000511.b3lyp_6-31g(d).inp

012000511.b3lyp_6-31g(d).qchem.inp (generated)

012000511.b3lyp_6-31g(d).gjf (generated)

012000511.b3lyp_6-31g(d).firefly.inp (generated)

012000511.b3lyp_6-31g(d).smash.inp (generated)

012000511.b3lyp_6-31g(d).nwchem.inp (generated) 012000511.b3lyp_6-31g(d).log.xz 012000511.td-b3lyp_6-31g+(d).inp 012000511.td-b3lyp_6-31g+(d).log.xz

012000511.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000511.td-b3lyp_6-31+g(d).gjf (generated)

012000511.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000511.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000511.mol 012000511.PUBCHEM 012000511.mol (via Jmol)
012000512.b3lyp_6-31g(d).inp

012000512.b3lyp_6-31g(d).qchem.inp (generated)

012000512.b3lyp_6-31g(d).gjf (generated)

012000512.b3lyp_6-31g(d).firefly.inp (generated)

012000512.b3lyp_6-31g(d).smash.inp (generated)

012000512.b3lyp_6-31g(d).nwchem.inp (generated) 012000512.b3lyp_6-31g(d).log.xz 012000512.td-b3lyp_6-31g+(d).inp 012000512.td-b3lyp_6-31g+(d).log.xz

012000512.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000512.td-b3lyp_6-31+g(d).gjf (generated)

012000512.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000512.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000512.mol 012000512.PUBCHEM 012000512.mol (via Jmol)
012000513.b3lyp_6-31g(d).inp

012000513.b3lyp_6-31g(d).qchem.inp (generated)

012000513.b3lyp_6-31g(d).gjf (generated)

012000513.b3lyp_6-31g(d).firefly.inp (generated)

012000513.b3lyp_6-31g(d).smash.inp (generated)

012000513.b3lyp_6-31g(d).nwchem.inp (generated) 012000513.b3lyp_6-31g(d).log.xz 012000513.td-b3lyp_6-31g+(d).inp 012000513.td-b3lyp_6-31g+(d).log.xz

012000513.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000513.td-b3lyp_6-31+g(d).gjf (generated)

012000513.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000513.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000513.mol 012000513.PUBCHEM 012000513.mol (via Jmol)
012000514.b3lyp_6-31g(d).inp

012000514.b3lyp_6-31g(d).qchem.inp (generated)

012000514.b3lyp_6-31g(d).gjf (generated)

012000514.b3lyp_6-31g(d).firefly.inp (generated)

012000514.b3lyp_6-31g(d).smash.inp (generated)

012000514.b3lyp_6-31g(d).nwchem.inp (generated) 012000514.b3lyp_6-31g(d).log.xz 012000514.td-b3lyp_6-31g+(d).inp 012000514.td-b3lyp_6-31g+(d).log.xz

012000514.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000514.td-b3lyp_6-31+g(d).gjf (generated)

012000514.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000514.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000514.mol 012000514.PUBCHEM 012000514.mol (via Jmol)
012000516.b3lyp_6-31g(d).inp

012000516.b3lyp_6-31g(d).qchem.inp (generated)

012000516.b3lyp_6-31g(d).gjf (generated)

012000516.b3lyp_6-31g(d).firefly.inp (generated)

012000516.b3lyp_6-31g(d).smash.inp (generated)

012000516.b3lyp_6-31g(d).nwchem.inp (generated) 012000516.b3lyp_6-31g(d).log.xz 012000516.td-b3lyp_6-31g+(d).inp 012000516.td-b3lyp_6-31g+(d).log.xz

012000516.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000516.td-b3lyp_6-31+g(d).gjf (generated)

012000516.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000516.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000516.mol 012000516.PUBCHEM 012000516.mol (via Jmol)
012000547.b3lyp_6-31g(d).inp

012000547.b3lyp_6-31g(d).qchem.inp (generated)

012000547.b3lyp_6-31g(d).gjf (generated)

012000547.b3lyp_6-31g(d).firefly.inp (generated)

012000547.b3lyp_6-31g(d).smash.inp (generated)

012000547.b3lyp_6-31g(d).nwchem.inp (generated) 012000547.b3lyp_6-31g(d).log.xz 012000547.td-b3lyp_6-31g+(d).inp 012000547.td-b3lyp_6-31g+(d).log.xz

012000547.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000547.td-b3lyp_6-31+g(d).gjf (generated)

012000547.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000547.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000547.mol 012000547.PUBCHEM 012000547.mol (via Jmol)
012000570.b3lyp_6-31g(d).inp

012000570.b3lyp_6-31g(d).qchem.inp (generated)

012000570.b3lyp_6-31g(d).gjf (generated)

012000570.b3lyp_6-31g(d).firefly.inp (generated)

012000570.b3lyp_6-31g(d).smash.inp (generated)

012000570.b3lyp_6-31g(d).nwchem.inp (generated) 012000570.b3lyp_6-31g(d).log.xz 012000570.mol 012000570.PUBCHEM 012000570.mol (via Jmol)
012000579.b3lyp_6-31g(d).inp

012000579.b3lyp_6-31g(d).qchem.inp (generated)

012000579.b3lyp_6-31g(d).gjf (generated)

012000579.b3lyp_6-31g(d).firefly.inp (generated)

012000579.b3lyp_6-31g(d).smash.inp (generated)

012000579.b3lyp_6-31g(d).nwchem.inp (generated) 012000579.b3lyp_6-31g(d).log.xz 012000579.td-b3lyp_6-31g+(d).inp 012000579.td-b3lyp_6-31g+(d).log.xz

012000579.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000579.td-b3lyp_6-31+g(d).gjf (generated)

012000579.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000579.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000579.mol 012000579.PUBCHEM 012000579.mol (via Jmol)
012000589.b3lyp_6-31g(d).inp

012000589.b3lyp_6-31g(d).qchem.inp (generated)

012000589.b3lyp_6-31g(d).gjf (generated)

012000589.b3lyp_6-31g(d).firefly.inp (generated)

012000589.b3lyp_6-31g(d).smash.inp (generated)

012000589.b3lyp_6-31g(d).nwchem.inp (generated) 012000589.b3lyp_6-31g(d).log.xz 012000589.td-b3lyp_6-31g+(d).inp 012000589.td-b3lyp_6-31g+(d).log.xz

012000589.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000589.td-b3lyp_6-31+g(d).gjf (generated)

012000589.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000589.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000589.mol 012000589.PUBCHEM 012000589.mol (via Jmol)
012000592.b3lyp_6-31g(d).inp

012000592.b3lyp_6-31g(d).qchem.inp (generated)

012000592.b3lyp_6-31g(d).gjf (generated)

012000592.b3lyp_6-31g(d).firefly.inp (generated)

012000592.b3lyp_6-31g(d).smash.inp (generated)

012000592.b3lyp_6-31g(d).nwchem.inp (generated) 012000592.b3lyp_6-31g(d).log.xz 012000592.mol 012000592.PUBCHEM 012000592.mol (via Jmol)
012000596.b3lyp_6-31g(d).inp

012000596.b3lyp_6-31g(d).qchem.inp (generated)

012000596.b3lyp_6-31g(d).gjf (generated)

012000596.b3lyp_6-31g(d).firefly.inp (generated)

012000596.b3lyp_6-31g(d).smash.inp (generated)

012000596.b3lyp_6-31g(d).nwchem.inp (generated) 012000596.b3lyp_6-31g(d).log.xz 012000596.td-b3lyp_6-31g+(d).inp 012000596.td-b3lyp_6-31g+(d).log.xz

012000596.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000596.td-b3lyp_6-31+g(d).gjf (generated)

012000596.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000596.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000596.mol 012000596.PUBCHEM 012000596.mol (via Jmol)
012000598.b3lyp_6-31g(d).inp

012000598.b3lyp_6-31g(d).qchem.inp (generated)

012000598.b3lyp_6-31g(d).gjf (generated)

012000598.b3lyp_6-31g(d).firefly.inp (generated)

012000598.b3lyp_6-31g(d).smash.inp (generated)

012000598.b3lyp_6-31g(d).nwchem.inp (generated) 012000598.b3lyp_6-31g(d).log.xz 012000598.td-b3lyp_6-31g+(d).inp 012000598.td-b3lyp_6-31g+(d).log.xz

012000598.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000598.td-b3lyp_6-31+g(d).gjf (generated)

012000598.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000598.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000598.mol 012000598.PUBCHEM 012000598.mol (via Jmol)
012000602.b3lyp_6-31g(d).inp

012000602.b3lyp_6-31g(d).qchem.inp (generated)

012000602.b3lyp_6-31g(d).gjf (generated)

012000602.b3lyp_6-31g(d).firefly.inp (generated)

012000602.b3lyp_6-31g(d).smash.inp (generated)

012000602.b3lyp_6-31g(d).nwchem.inp (generated) 012000602.b3lyp_6-31g(d).log.xz 012000602.td-b3lyp_6-31g+(d).inp 012000602.td-b3lyp_6-31g+(d).log.xz

012000602.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000602.td-b3lyp_6-31+g(d).gjf (generated)

012000602.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000602.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000602.mol 012000602.PUBCHEM 012000602.mol (via Jmol)
012000604.b3lyp_6-31g(d).inp

012000604.b3lyp_6-31g(d).qchem.inp (generated)

012000604.b3lyp_6-31g(d).gjf (generated)

012000604.b3lyp_6-31g(d).firefly.inp (generated)

012000604.b3lyp_6-31g(d).smash.inp (generated)

012000604.b3lyp_6-31g(d).nwchem.inp (generated) 012000604.b3lyp_6-31g(d).log.xz 012000604.td-b3lyp_6-31g+(d).inp 012000604.td-b3lyp_6-31g+(d).log.xz

012000604.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000604.td-b3lyp_6-31+g(d).gjf (generated)

012000604.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000604.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000604.mol 012000604.PUBCHEM 012000604.mol (via Jmol)
012000634.b3lyp_6-31g(d).inp

012000634.b3lyp_6-31g(d).qchem.inp (generated)

012000634.b3lyp_6-31g(d).gjf (generated)

012000634.b3lyp_6-31g(d).firefly.inp (generated)

012000634.b3lyp_6-31g(d).smash.inp (generated)

012000634.b3lyp_6-31g(d).nwchem.inp (generated) 012000634.b3lyp_6-31g(d).log.xz 012000634.mol 012000634.PUBCHEM 012000634.mol (via Jmol)
012000686.b3lyp_6-31g(d).inp

012000686.b3lyp_6-31g(d).qchem.inp (generated)

012000686.b3lyp_6-31g(d).gjf (generated)

012000686.b3lyp_6-31g(d).firefly.inp (generated)

012000686.b3lyp_6-31g(d).smash.inp (generated)

012000686.b3lyp_6-31g(d).nwchem.inp (generated) 012000686.b3lyp_6-31g(d).log.xz 012000686.td-b3lyp_6-31g+(d).inp 012000686.td-b3lyp_6-31g+(d).log.xz

012000686.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000686.td-b3lyp_6-31+g(d).gjf (generated)

012000686.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000686.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000686.mol 012000686.PUBCHEM 012000686.mol (via Jmol)
012000687.b3lyp_6-31g(d).inp

012000687.b3lyp_6-31g(d).qchem.inp (generated)

012000687.b3lyp_6-31g(d).gjf (generated)

012000687.b3lyp_6-31g(d).firefly.inp (generated)

012000687.b3lyp_6-31g(d).smash.inp (generated)

012000687.b3lyp_6-31g(d).nwchem.inp (generated) 012000687.b3lyp_6-31g(d).log.xz 012000687.td-b3lyp_6-31g+(d).inp 012000687.td-b3lyp_6-31g+(d).log.xz

012000687.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000687.td-b3lyp_6-31+g(d).gjf (generated)

012000687.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000687.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000687.mol 012000687.PUBCHEM 012000687.mol (via Jmol)
012000743.b3lyp_6-31g(d).inp

012000743.b3lyp_6-31g(d).qchem.inp (generated)

012000743.b3lyp_6-31g(d).gjf (generated)

012000743.b3lyp_6-31g(d).firefly.inp (generated)

012000743.b3lyp_6-31g(d).smash.inp (generated)

012000743.b3lyp_6-31g(d).nwchem.inp (generated) 012000743.b3lyp_6-31g(d).log.xz 012000743.td-b3lyp_6-31g+(d).inp 012000743.td-b3lyp_6-31g+(d).log.xz

012000743.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000743.td-b3lyp_6-31+g(d).gjf (generated)

012000743.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000743.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000743.mol 012000743.PUBCHEM 012000743.mol (via Jmol)
012000744.b3lyp_6-31g(d).inp

012000744.b3lyp_6-31g(d).qchem.inp (generated)

012000744.b3lyp_6-31g(d).gjf (generated)

012000744.b3lyp_6-31g(d).firefly.inp (generated)

012000744.b3lyp_6-31g(d).smash.inp (generated)

012000744.b3lyp_6-31g(d).nwchem.inp (generated) 012000744.b3lyp_6-31g(d).log.xz 012000744.td-b3lyp_6-31g+(d).inp 012000744.td-b3lyp_6-31g+(d).log.xz

012000744.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000744.td-b3lyp_6-31+g(d).gjf (generated)

012000744.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000744.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000744.mol 012000744.PUBCHEM 012000744.mol (via Jmol)
012000745.b3lyp_6-31g(d).inp

012000745.b3lyp_6-31g(d).qchem.inp (generated)

012000745.b3lyp_6-31g(d).gjf (generated)

012000745.b3lyp_6-31g(d).firefly.inp (generated)

012000745.b3lyp_6-31g(d).smash.inp (generated)

012000745.b3lyp_6-31g(d).nwchem.inp (generated) 012000745.b3lyp_6-31g(d).log.xz 012000745.td-b3lyp_6-31g+(d).inp 012000745.td-b3lyp_6-31g+(d).log.xz

012000745.td-b3lyp_6-31+g(d).qchem.inp (generated)

012000745.td-b3lyp_6-31+g(d).gjf (generated)

012000745.td-b3lyp_6-31+g(d).firefly.inp (generated)

012000745.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012000745.mol 012000745.PUBCHEM 012000745.mol (via Jmol)
012000890.b3lyp_6-31g(d).inp

012000890.b3lyp_6-31g(d).qchem.inp (generated)

012000890.b3lyp_6-31g(d).gjf (generated)

012000890.b3lyp_6-31g(d).firefly.inp (generated)

012000890.b3lyp_6-31g(d).smash.inp (generated)

012000890.b3lyp_6-31g(d).nwchem.inp (generated) 012000890.b3lyp_6-31g(d).log.xz 012000890.mol 012000890.PUBCHEM 012000890.mol (via Jmol)
012001042.b3lyp_6-31g(d).inp

012001042.b3lyp_6-31g(d).qchem.inp (generated)

012001042.b3lyp_6-31g(d).gjf (generated)

012001042.b3lyp_6-31g(d).firefly.inp (generated)

012001042.b3lyp_6-31g(d).smash.inp (generated)

012001042.b3lyp_6-31g(d).nwchem.inp (generated) 012001042.b3lyp_6-31g(d).log.xz 012001042.td-b3lyp_6-31g+(d).inp 012001042.td-b3lyp_6-31g+(d).log.xz

012001042.td-b3lyp_6-31+g(d).qchem.inp (generated)

012001042.td-b3lyp_6-31+g(d).gjf (generated)

012001042.td-b3lyp_6-31+g(d).firefly.inp (generated)

012001042.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012001042.mol 012001042.PUBCHEM 012001042.mol (via Jmol)
012001109.b3lyp_6-31g(d).inp

012001109.b3lyp_6-31g(d).qchem.inp (generated)

012001109.b3lyp_6-31g(d).gjf (generated)

012001109.b3lyp_6-31g(d).firefly.inp (generated)

012001109.b3lyp_6-31g(d).smash.inp (generated)

012001109.b3lyp_6-31g(d).nwchem.inp (generated) 012001109.b3lyp_6-31g(d).log.xz 012001109.td-b3lyp_6-31g+(d).inp 012001109.td-b3lyp_6-31g+(d).log.xz

012001109.td-b3lyp_6-31+g(d).qchem.inp (generated)

012001109.td-b3lyp_6-31+g(d).gjf (generated)

012001109.td-b3lyp_6-31+g(d).firefly.inp (generated)

012001109.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012001109.mol 012001109.PUBCHEM 012001109.mol (via Jmol)
012001139.b3lyp_6-31g(d).inp

012001139.b3lyp_6-31g(d).qchem.inp (generated)

012001139.b3lyp_6-31g(d).gjf (generated)

012001139.b3lyp_6-31g(d).firefly.inp (generated)

012001139.b3lyp_6-31g(d).smash.inp (generated)

012001139.b3lyp_6-31g(d).nwchem.inp (generated) 012001139.b3lyp_6-31g(d).log.xz 012001139.td-b3lyp_6-31g+(d).inp 012001139.td-b3lyp_6-31g+(d).log.xz

012001139.td-b3lyp_6-31+g(d).qchem.inp (generated)

012001139.td-b3lyp_6-31+g(d).gjf (generated)

012001139.td-b3lyp_6-31+g(d).firefly.inp (generated)

012001139.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012001139.mol 012001139.PUBCHEM 012001139.mol (via Jmol)
012001196.b3lyp_6-31g(d).inp

012001196.b3lyp_6-31g(d).qchem.inp (generated)

012001196.b3lyp_6-31g(d).gjf (generated)

012001196.b3lyp_6-31g(d).firefly.inp (generated)

012001196.b3lyp_6-31g(d).smash.inp (generated)

012001196.b3lyp_6-31g(d).nwchem.inp (generated) 012001196.b3lyp_6-31g(d).log.xz 012001196.td-b3lyp_6-31g+(d).inp 012001196.td-b3lyp_6-31g+(d).log.xz

012001196.td-b3lyp_6-31+g(d).qchem.inp (generated)

012001196.td-b3lyp_6-31+g(d).gjf (generated)

012001196.td-b3lyp_6-31+g(d).firefly.inp (generated)

012001196.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012001196.mol 012001196.PUBCHEM 012001196.mol (via Jmol)
012001674.b3lyp_6-31g(d).inp

012001674.b3lyp_6-31g(d).qchem.inp (generated)

012001674.b3lyp_6-31g(d).gjf (generated)

012001674.b3lyp_6-31g(d).firefly.inp (generated)

012001674.b3lyp_6-31g(d).smash.inp (generated)

012001674.b3lyp_6-31g(d).nwchem.inp (generated) 012001674.b3lyp_6-31g(d).log.xz 012001674.td-b3lyp_6-31g+(d).inp 012001674.td-b3lyp_6-31g+(d).log.xz

012001674.td-b3lyp_6-31+g(d).qchem.inp (generated)

012001674.td-b3lyp_6-31+g(d).gjf (generated)

012001674.td-b3lyp_6-31+g(d).firefly.inp (generated)

012001674.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012001674.mol 012001674.PUBCHEM 012001674.mol (via Jmol)
012001675.b3lyp_6-31g(d).inp

012001675.b3lyp_6-31g(d).qchem.inp (generated)

012001675.b3lyp_6-31g(d).gjf (generated)

012001675.b3lyp_6-31g(d).firefly.inp (generated)

012001675.b3lyp_6-31g(d).smash.inp (generated)

012001675.b3lyp_6-31g(d).nwchem.inp (generated) 012001675.b3lyp_6-31g(d).log.xz 012001675.td-b3lyp_6-31g+(d).inp 012001675.td-b3lyp_6-31g+(d).log.xz

012001675.td-b3lyp_6-31+g(d).qchem.inp (generated)

012001675.td-b3lyp_6-31+g(d).gjf (generated)

012001675.td-b3lyp_6-31+g(d).firefly.inp (generated)

012001675.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012001675.mol 012001675.PUBCHEM 012001675.mol (via Jmol)
012001676.b3lyp_6-31g(d).inp

012001676.b3lyp_6-31g(d).qchem.inp (generated)

012001676.b3lyp_6-31g(d).gjf (generated)

012001676.b3lyp_6-31g(d).firefly.inp (generated)

012001676.b3lyp_6-31g(d).smash.inp (generated)

012001676.b3lyp_6-31g(d).nwchem.inp (generated) 012001676.b3lyp_6-31g(d).log.xz 012001676.td-b3lyp_6-31g+(d).inp 012001676.td-b3lyp_6-31g+(d).log.xz

012001676.td-b3lyp_6-31+g(d).qchem.inp (generated)

012001676.td-b3lyp_6-31+g(d).gjf (generated)

012001676.td-b3lyp_6-31+g(d).firefly.inp (generated)

012001676.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012001676.mol 012001676.PUBCHEM 012001676.mol (via Jmol)
012001677.b3lyp_6-31g(d).inp

012001677.b3lyp_6-31g(d).qchem.inp (generated)

012001677.b3lyp_6-31g(d).gjf (generated)

012001677.b3lyp_6-31g(d).firefly.inp (generated)

012001677.b3lyp_6-31g(d).smash.inp (generated)

012001677.b3lyp_6-31g(d).nwchem.inp (generated) 012001677.b3lyp_6-31g(d).log.xz 012001677.td-b3lyp_6-31g+(d).inp 012001677.td-b3lyp_6-31g+(d).log.xz

012001677.td-b3lyp_6-31+g(d).qchem.inp (generated)

012001677.td-b3lyp_6-31+g(d).gjf (generated)

012001677.td-b3lyp_6-31+g(d).firefly.inp (generated)

012001677.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012001677.mol 012001677.PUBCHEM 012001677.mol (via Jmol)
012001678.b3lyp_6-31g(d).inp

012001678.b3lyp_6-31g(d).qchem.inp (generated)

012001678.b3lyp_6-31g(d).gjf (generated)

012001678.b3lyp_6-31g(d).firefly.inp (generated)

012001678.b3lyp_6-31g(d).smash.inp (generated)

012001678.b3lyp_6-31g(d).nwchem.inp (generated) 012001678.b3lyp_6-31g(d).log.xz 012001678.td-b3lyp_6-31g+(d).inp 012001678.td-b3lyp_6-31g+(d).log.xz

012001678.td-b3lyp_6-31+g(d).qchem.inp (generated)

012001678.td-b3lyp_6-31+g(d).gjf (generated)

012001678.td-b3lyp_6-31+g(d).firefly.inp (generated)

012001678.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012001678.mol 012001678.PUBCHEM 012001678.mol (via Jmol)
012001679.b3lyp_6-31g(d).inp

012001679.b3lyp_6-31g(d).qchem.inp (generated)

012001679.b3lyp_6-31g(d).gjf (generated)

012001679.b3lyp_6-31g(d).firefly.inp (generated)

012001679.b3lyp_6-31g(d).smash.inp (generated)

012001679.b3lyp_6-31g(d).nwchem.inp (generated) 012001679.b3lyp_6-31g(d).log.xz 012001679.td-b3lyp_6-31g+(d).inp 012001679.td-b3lyp_6-31g+(d).log.xz

012001679.td-b3lyp_6-31+g(d).qchem.inp (generated)

012001679.td-b3lyp_6-31+g(d).gjf (generated)

012001679.td-b3lyp_6-31+g(d).firefly.inp (generated)

012001679.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012001679.mol 012001679.PUBCHEM 012001679.mol (via Jmol)
012001893.b3lyp_6-31g(d).inp

012001893.b3lyp_6-31g(d).qchem.inp (generated)

012001893.b3lyp_6-31g(d).gjf (generated)

012001893.b3lyp_6-31g(d).firefly.inp (generated)

012001893.b3lyp_6-31g(d).smash.inp (generated)

012001893.b3lyp_6-31g(d).nwchem.inp (generated) 012001893.b3lyp_6-31g(d).log.xz 012001893.td-b3lyp_6-31g+(d).inp 012001893.td-b3lyp_6-31g+(d).log.xz

012001893.td-b3lyp_6-31+g(d).qchem.inp (generated)

012001893.td-b3lyp_6-31+g(d).gjf (generated)

012001893.td-b3lyp_6-31+g(d).firefly.inp (generated)

012001893.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012001893.mol 012001893.PUBCHEM 012001893.mol (via Jmol)
012001977.b3lyp_6-31g(d).inp

012001977.b3lyp_6-31g(d).qchem.inp (generated)

012001977.b3lyp_6-31g(d).gjf (generated)

012001977.b3lyp_6-31g(d).firefly.inp (generated)

012001977.b3lyp_6-31g(d).smash.inp (generated)

012001977.b3lyp_6-31g(d).nwchem.inp (generated) 012001977.b3lyp_6-31g(d).log.xz 012001977.td-b3lyp_6-31g+(d).inp 012001977.td-b3lyp_6-31g+(d).log.xz

012001977.td-b3lyp_6-31+g(d).qchem.inp (generated)

012001977.td-b3lyp_6-31+g(d).gjf (generated)

012001977.td-b3lyp_6-31+g(d).firefly.inp (generated)

012001977.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012001977.mol 012001977.PUBCHEM 012001977.mol (via Jmol)
012002083.b3lyp_6-31g(d).inp

012002083.b3lyp_6-31g(d).qchem.inp (generated)

012002083.b3lyp_6-31g(d).gjf (generated)

012002083.b3lyp_6-31g(d).firefly.inp (generated)

012002083.b3lyp_6-31g(d).smash.inp (generated)

012002083.b3lyp_6-31g(d).nwchem.inp (generated) 012002083.b3lyp_6-31g(d).log.xz 012002083.mol 012002083.PUBCHEM 012002083.mol (via Jmol)
012002198.b3lyp_6-31g(d).inp

012002198.b3lyp_6-31g(d).qchem.inp (generated)

012002198.b3lyp_6-31g(d).gjf (generated)

012002198.b3lyp_6-31g(d).firefly.inp (generated)

012002198.b3lyp_6-31g(d).smash.inp (generated)

012002198.b3lyp_6-31g(d).nwchem.inp (generated) 012002198.b3lyp_6-31g(d).log.xz 012002198.mol 012002198.PUBCHEM 012002198.mol (via Jmol)
012002215.b3lyp_6-31g(d).inp

012002215.b3lyp_6-31g(d).qchem.inp (generated)

012002215.b3lyp_6-31g(d).gjf (generated)

012002215.b3lyp_6-31g(d).firefly.inp (generated)

012002215.b3lyp_6-31g(d).smash.inp (generated)

012002215.b3lyp_6-31g(d).nwchem.inp (generated) 012002215.b3lyp_6-31g(d).log.xz 012002215.td-b3lyp_6-31g+(d).inp 012002215.td-b3lyp_6-31g+(d).log.xz

012002215.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002215.td-b3lyp_6-31+g(d).gjf (generated)

012002215.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002215.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002215.mol 012002215.PUBCHEM 012002215.mol (via Jmol)
012002216.b3lyp_6-31g(d).inp

012002216.b3lyp_6-31g(d).qchem.inp (generated)

012002216.b3lyp_6-31g(d).gjf (generated)

012002216.b3lyp_6-31g(d).firefly.inp (generated)

012002216.b3lyp_6-31g(d).smash.inp (generated)

012002216.b3lyp_6-31g(d).nwchem.inp (generated) 012002216.b3lyp_6-31g(d).log.xz 012002216.mol 012002216.PUBCHEM 012002216.mol (via Jmol)
012002242.b3lyp_6-31g(d).inp

012002242.b3lyp_6-31g(d).qchem.inp (generated)

012002242.b3lyp_6-31g(d).gjf (generated)

012002242.b3lyp_6-31g(d).firefly.inp (generated)

012002242.b3lyp_6-31g(d).smash.inp (generated)

012002242.b3lyp_6-31g(d).nwchem.inp (generated) 012002242.b3lyp_6-31g(d).log.xz 012002242.td-b3lyp_6-31g+(d).inp 012002242.td-b3lyp_6-31g+(d).log.xz

012002242.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002242.td-b3lyp_6-31+g(d).gjf (generated)

012002242.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002242.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002242.mol 012002242.PUBCHEM 012002242.mol (via Jmol)
012002309.b3lyp_6-31g(d).inp

012002309.b3lyp_6-31g(d).qchem.inp (generated)

012002309.b3lyp_6-31g(d).gjf (generated)

012002309.b3lyp_6-31g(d).firefly.inp (generated)

012002309.b3lyp_6-31g(d).smash.inp (generated)

012002309.b3lyp_6-31g(d).nwchem.inp (generated) 012002309.b3lyp_6-31g(d).log.xz 012002309.td-b3lyp_6-31g+(d).inp 012002309.td-b3lyp_6-31g+(d).log.xz

012002309.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002309.td-b3lyp_6-31+g(d).gjf (generated)

012002309.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002309.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002309.mol 012002309.PUBCHEM 012002309.mol (via Jmol)
012002310.b3lyp_6-31g(d).inp

012002310.b3lyp_6-31g(d).qchem.inp (generated)

012002310.b3lyp_6-31g(d).gjf (generated)

012002310.b3lyp_6-31g(d).firefly.inp (generated)

012002310.b3lyp_6-31g(d).smash.inp (generated)

012002310.b3lyp_6-31g(d).nwchem.inp (generated) 012002310.b3lyp_6-31g(d).log.xz 012002310.td-b3lyp_6-31g+(d).inp 012002310.td-b3lyp_6-31g+(d).log.xz

012002310.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002310.td-b3lyp_6-31+g(d).gjf (generated)

012002310.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002310.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002310.mol 012002310.PUBCHEM 012002310.mol (via Jmol)
012002528.b3lyp_6-31g(d).inp

012002528.b3lyp_6-31g(d).qchem.inp (generated)

012002528.b3lyp_6-31g(d).gjf (generated)

012002528.b3lyp_6-31g(d).firefly.inp (generated)

012002528.b3lyp_6-31g(d).smash.inp (generated)

012002528.b3lyp_6-31g(d).nwchem.inp (generated) 012002528.b3lyp_6-31g(d).log.xz 012002528.td-b3lyp_6-31g+(d).inp 012002528.td-b3lyp_6-31g+(d).log.xz

012002528.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002528.td-b3lyp_6-31+g(d).gjf (generated)

012002528.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002528.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002528.mol 012002528.PUBCHEM 012002528.mol (via Jmol)
012002558.b3lyp_6-31g(d).inp

012002558.b3lyp_6-31g(d).qchem.inp (generated)

012002558.b3lyp_6-31g(d).gjf (generated)

012002558.b3lyp_6-31g(d).firefly.inp (generated)

012002558.b3lyp_6-31g(d).smash.inp (generated)

012002558.b3lyp_6-31g(d).nwchem.inp (generated) 012002558.b3lyp_6-31g(d).log.xz 012002558.td-b3lyp_6-31g+(d).inp 012002558.td-b3lyp_6-31g+(d).log.xz

012002558.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002558.td-b3lyp_6-31+g(d).gjf (generated)

012002558.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002558.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002558.mol 012002558.PUBCHEM 012002558.mol (via Jmol)
012002560.b3lyp_6-31g(d).inp

012002560.b3lyp_6-31g(d).qchem.inp (generated)

012002560.b3lyp_6-31g(d).gjf (generated)

012002560.b3lyp_6-31g(d).firefly.inp (generated)

012002560.b3lyp_6-31g(d).smash.inp (generated)

012002560.b3lyp_6-31g(d).nwchem.inp (generated) 012002560.b3lyp_6-31g(d).log.xz 012002560.td-b3lyp_6-31g+(d).inp 012002560.td-b3lyp_6-31g+(d).log.xz

012002560.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002560.td-b3lyp_6-31+g(d).gjf (generated)

012002560.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002560.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002560.mol 012002560.PUBCHEM 012002560.mol (via Jmol)
012002568.b3lyp_6-31g(d).inp

012002568.b3lyp_6-31g(d).qchem.inp (generated)

012002568.b3lyp_6-31g(d).gjf (generated)

012002568.b3lyp_6-31g(d).firefly.inp (generated)

012002568.b3lyp_6-31g(d).smash.inp (generated)

012002568.b3lyp_6-31g(d).nwchem.inp (generated) 012002568.b3lyp_6-31g(d).log.xz 012002568.mol 012002568.PUBCHEM 012002568.mol (via Jmol)
012002581.b3lyp_6-31g(d).inp

012002581.b3lyp_6-31g(d).qchem.inp (generated)

012002581.b3lyp_6-31g(d).gjf (generated)

012002581.b3lyp_6-31g(d).firefly.inp (generated)

012002581.b3lyp_6-31g(d).smash.inp (generated)

012002581.b3lyp_6-31g(d).nwchem.inp (generated) 012002581.b3lyp_6-31g(d).log.xz 012002581.td-b3lyp_6-31g+(d).inp 012002581.td-b3lyp_6-31g+(d).log.xz

012002581.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002581.td-b3lyp_6-31+g(d).gjf (generated)

012002581.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002581.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002581.mol 012002581.PUBCHEM 012002581.mol (via Jmol)
012002583.b3lyp_6-31g(d).inp

012002583.b3lyp_6-31g(d).qchem.inp (generated)

012002583.b3lyp_6-31g(d).gjf (generated)

012002583.b3lyp_6-31g(d).firefly.inp (generated)

012002583.b3lyp_6-31g(d).smash.inp (generated)

012002583.b3lyp_6-31g(d).nwchem.inp (generated) 012002583.b3lyp_6-31g(d).log.xz 012002583.td-b3lyp_6-31g+(d).inp 012002583.td-b3lyp_6-31g+(d).log.xz

012002583.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002583.td-b3lyp_6-31+g(d).gjf (generated)

012002583.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002583.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002583.mol 012002583.PUBCHEM 012002583.mol (via Jmol)
012002587.b3lyp_6-31g(d).inp

012002587.b3lyp_6-31g(d).qchem.inp (generated)

012002587.b3lyp_6-31g(d).gjf (generated)

012002587.b3lyp_6-31g(d).firefly.inp (generated)

012002587.b3lyp_6-31g(d).smash.inp (generated)

012002587.b3lyp_6-31g(d).nwchem.inp (generated) 012002587.b3lyp_6-31g(d).log.xz 012002587.td-b3lyp_6-31g+(d).inp 012002587.td-b3lyp_6-31g+(d).log.xz

012002587.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002587.td-b3lyp_6-31+g(d).gjf (generated)

012002587.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002587.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002587.mol 012002587.PUBCHEM 012002587.mol (via Jmol)
012002591.b3lyp_6-31g(d).inp

012002591.b3lyp_6-31g(d).qchem.inp (generated)

012002591.b3lyp_6-31g(d).gjf (generated)

012002591.b3lyp_6-31g(d).firefly.inp (generated)

012002591.b3lyp_6-31g(d).smash.inp (generated)

012002591.b3lyp_6-31g(d).nwchem.inp (generated) 012002591.b3lyp_6-31g(d).log.xz 012002591.td-b3lyp_6-31g+(d).inp 012002591.td-b3lyp_6-31g+(d).log.xz

012002591.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002591.td-b3lyp_6-31+g(d).gjf (generated)

012002591.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002591.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002591.mol 012002591.PUBCHEM 012002591.mol (via Jmol)
012002593.b3lyp_6-31g(d).inp

012002593.b3lyp_6-31g(d).qchem.inp (generated)

012002593.b3lyp_6-31g(d).gjf (generated)

012002593.b3lyp_6-31g(d).firefly.inp (generated)

012002593.b3lyp_6-31g(d).smash.inp (generated)

012002593.b3lyp_6-31g(d).nwchem.inp (generated) 012002593.b3lyp_6-31g(d).log.xz 012002593.td-b3lyp_6-31g+(d).inp 012002593.td-b3lyp_6-31g+(d).log.xz

012002593.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002593.td-b3lyp_6-31+g(d).gjf (generated)

012002593.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002593.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002593.mol 012002593.PUBCHEM 012002593.mol (via Jmol)
012002599.b3lyp_6-31g(d).inp

012002599.b3lyp_6-31g(d).qchem.inp (generated)

012002599.b3lyp_6-31g(d).gjf (generated)

012002599.b3lyp_6-31g(d).firefly.inp (generated)

012002599.b3lyp_6-31g(d).smash.inp (generated)

012002599.b3lyp_6-31g(d).nwchem.inp (generated) 012002599.b3lyp_6-31g(d).log.xz 012002599.td-b3lyp_6-31g+(d).inp 012002599.td-b3lyp_6-31g+(d).log.xz

012002599.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002599.td-b3lyp_6-31+g(d).gjf (generated)

012002599.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002599.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002599.mol 012002599.PUBCHEM 012002599.mol (via Jmol)
012002600.b3lyp_6-31g(d).inp

012002600.b3lyp_6-31g(d).qchem.inp (generated)

012002600.b3lyp_6-31g(d).gjf (generated)

012002600.b3lyp_6-31g(d).firefly.inp (generated)

012002600.b3lyp_6-31g(d).smash.inp (generated)

012002600.b3lyp_6-31g(d).nwchem.inp (generated) 012002600.b3lyp_6-31g(d).log.xz 012002600.td-b3lyp_6-31g+(d).inp 012002600.td-b3lyp_6-31g+(d).log.xz

012002600.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002600.td-b3lyp_6-31+g(d).gjf (generated)

012002600.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002600.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002600.mol 012002600.PUBCHEM 012002600.mol (via Jmol)
012002601.b3lyp_6-31g(d).inp

012002601.b3lyp_6-31g(d).qchem.inp (generated)

012002601.b3lyp_6-31g(d).gjf (generated)

012002601.b3lyp_6-31g(d).firefly.inp (generated)

012002601.b3lyp_6-31g(d).smash.inp (generated)

012002601.b3lyp_6-31g(d).nwchem.inp (generated) 012002601.b3lyp_6-31g(d).log.xz 012002601.td-b3lyp_6-31g+(d).inp 012002601.td-b3lyp_6-31g+(d).log.xz

012002601.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002601.td-b3lyp_6-31+g(d).gjf (generated)

012002601.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002601.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002601.mol 012002601.PUBCHEM 012002601.mol (via Jmol)
012002602.b3lyp_6-31g(d).inp

012002602.b3lyp_6-31g(d).qchem.inp (generated)

012002602.b3lyp_6-31g(d).gjf (generated)

012002602.b3lyp_6-31g(d).firefly.inp (generated)

012002602.b3lyp_6-31g(d).smash.inp (generated)

012002602.b3lyp_6-31g(d).nwchem.inp (generated) 012002602.b3lyp_6-31g(d).log.xz 012002602.td-b3lyp_6-31g+(d).inp 012002602.td-b3lyp_6-31g+(d).log.xz

012002602.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002602.td-b3lyp_6-31+g(d).gjf (generated)

012002602.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002602.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002602.mol 012002602.PUBCHEM 012002602.mol (via Jmol)
012002653.b3lyp_6-31g(d).inp

012002653.b3lyp_6-31g(d).qchem.inp (generated)

012002653.b3lyp_6-31g(d).gjf (generated)

012002653.b3lyp_6-31g(d).firefly.inp (generated)

012002653.b3lyp_6-31g(d).smash.inp (generated)

012002653.b3lyp_6-31g(d).nwchem.inp (generated) 012002653.b3lyp_6-31g(d).log.xz 012002653.td-b3lyp_6-31g+(d).inp 012002653.td-b3lyp_6-31g+(d).log.xz

012002653.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002653.td-b3lyp_6-31+g(d).gjf (generated)

012002653.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002653.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002653.mol 012002653.PUBCHEM 012002653.mol (via Jmol)
012002655.b3lyp_6-31g(d).inp

012002655.b3lyp_6-31g(d).qchem.inp (generated)

012002655.b3lyp_6-31g(d).gjf (generated)

012002655.b3lyp_6-31g(d).firefly.inp (generated)

012002655.b3lyp_6-31g(d).smash.inp (generated)

012002655.b3lyp_6-31g(d).nwchem.inp (generated) 012002655.b3lyp_6-31g(d).log.xz 012002655.mol 012002655.PUBCHEM 012002655.mol (via Jmol)
012002660.b3lyp_6-31g(d).inp

012002660.b3lyp_6-31g(d).qchem.inp (generated)

012002660.b3lyp_6-31g(d).gjf (generated)

012002660.b3lyp_6-31g(d).firefly.inp (generated)

012002660.b3lyp_6-31g(d).smash.inp (generated)

012002660.b3lyp_6-31g(d).nwchem.inp (generated) 012002660.b3lyp_6-31g(d).log.xz 012002660.td-b3lyp_6-31g+(d).inp 012002660.td-b3lyp_6-31g+(d).log.xz

012002660.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002660.td-b3lyp_6-31+g(d).gjf (generated)

012002660.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002660.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002660.mol 012002660.PUBCHEM 012002660.mol (via Jmol)
012002679.b3lyp_6-31g(d).inp

012002679.b3lyp_6-31g(d).qchem.inp (generated)

012002679.b3lyp_6-31g(d).gjf (generated)

012002679.b3lyp_6-31g(d).firefly.inp (generated)

012002679.b3lyp_6-31g(d).smash.inp (generated)

012002679.b3lyp_6-31g(d).nwchem.inp (generated) 012002679.b3lyp_6-31g(d).log.xz 012002679.td-b3lyp_6-31g+(d).inp 012002679.td-b3lyp_6-31g+(d).log.xz

012002679.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002679.td-b3lyp_6-31+g(d).gjf (generated)

012002679.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002679.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002679.mol 012002679.PUBCHEM 012002679.mol (via Jmol)
012002680.b3lyp_6-31g(d).inp

012002680.b3lyp_6-31g(d).qchem.inp (generated)

012002680.b3lyp_6-31g(d).gjf (generated)

012002680.b3lyp_6-31g(d).firefly.inp (generated)

012002680.b3lyp_6-31g(d).smash.inp (generated)

012002680.b3lyp_6-31g(d).nwchem.inp (generated) 012002680.b3lyp_6-31g(d).log.xz 012002680.td-b3lyp_6-31g+(d).inp 012002680.td-b3lyp_6-31g+(d).log.xz

012002680.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002680.td-b3lyp_6-31+g(d).gjf (generated)

012002680.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002680.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002680.mol 012002680.PUBCHEM 012002680.mol (via Jmol)
012002682.b3lyp_6-31g(d).inp

012002682.b3lyp_6-31g(d).qchem.inp (generated)

012002682.b3lyp_6-31g(d).gjf (generated)

012002682.b3lyp_6-31g(d).firefly.inp (generated)

012002682.b3lyp_6-31g(d).smash.inp (generated)

012002682.b3lyp_6-31g(d).nwchem.inp (generated) 012002682.b3lyp_6-31g(d).log.xz 012002682.td-b3lyp_6-31g+(d).inp 012002682.td-b3lyp_6-31g+(d).log.xz

012002682.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002682.td-b3lyp_6-31+g(d).gjf (generated)

012002682.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002682.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002682.mol 012002682.PUBCHEM 012002682.mol (via Jmol)
012002691.b3lyp_6-31g(d).inp

012002691.b3lyp_6-31g(d).qchem.inp (generated)

012002691.b3lyp_6-31g(d).gjf (generated)

012002691.b3lyp_6-31g(d).firefly.inp (generated)

012002691.b3lyp_6-31g(d).smash.inp (generated)

012002691.b3lyp_6-31g(d).nwchem.inp (generated) 012002691.b3lyp_6-31g(d).log.xz 012002691.td-b3lyp_6-31g+(d).inp 012002691.td-b3lyp_6-31g+(d).log.xz

012002691.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002691.td-b3lyp_6-31+g(d).gjf (generated)

012002691.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002691.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002691.mol 012002691.PUBCHEM 012002691.mol (via Jmol)
012002692.b3lyp_6-31g(d).inp

012002692.b3lyp_6-31g(d).qchem.inp (generated)

012002692.b3lyp_6-31g(d).gjf (generated)

012002692.b3lyp_6-31g(d).firefly.inp (generated)

012002692.b3lyp_6-31g(d).smash.inp (generated)

012002692.b3lyp_6-31g(d).nwchem.inp (generated) 012002692.b3lyp_6-31g(d).log.xz 012002692.td-b3lyp_6-31g+(d).inp 012002692.td-b3lyp_6-31g+(d).log.xz

012002692.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002692.td-b3lyp_6-31+g(d).gjf (generated)

012002692.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002692.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002692.mol 012002692.PUBCHEM 012002692.mol (via Jmol)
012002754.b3lyp_6-31g(d).inp

012002754.b3lyp_6-31g(d).qchem.inp (generated)

012002754.b3lyp_6-31g(d).gjf (generated)

012002754.b3lyp_6-31g(d).firefly.inp (generated)

012002754.b3lyp_6-31g(d).smash.inp (generated)

012002754.b3lyp_6-31g(d).nwchem.inp (generated) 012002754.b3lyp_6-31g(d).log.xz 012002754.td-b3lyp_6-31g+(d).inp 012002754.td-b3lyp_6-31g+(d).log.xz

012002754.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002754.td-b3lyp_6-31+g(d).gjf (generated)

012002754.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002754.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002754.mol 012002754.PUBCHEM 012002754.mol (via Jmol)
012002756.b3lyp_6-31g(d).inp

012002756.b3lyp_6-31g(d).qchem.inp (generated)

012002756.b3lyp_6-31g(d).gjf (generated)

012002756.b3lyp_6-31g(d).firefly.inp (generated)

012002756.b3lyp_6-31g(d).smash.inp (generated)

012002756.b3lyp_6-31g(d).nwchem.inp (generated) 012002756.b3lyp_6-31g(d).log.xz 012002756.td-b3lyp_6-31g+(d).inp 012002756.td-b3lyp_6-31g+(d).log.xz

012002756.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002756.td-b3lyp_6-31+g(d).gjf (generated)

012002756.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002756.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002756.mol 012002756.PUBCHEM 012002756.mol (via Jmol)
012002772.b3lyp_6-31g(d).inp

012002772.b3lyp_6-31g(d).qchem.inp (generated)

012002772.b3lyp_6-31g(d).gjf (generated)

012002772.b3lyp_6-31g(d).firefly.inp (generated)

012002772.b3lyp_6-31g(d).smash.inp (generated)

012002772.b3lyp_6-31g(d).nwchem.inp (generated) 012002772.b3lyp_6-31g(d).log.xz 012002772.td-b3lyp_6-31g+(d).inp 012002772.td-b3lyp_6-31g+(d).log.xz

012002772.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002772.td-b3lyp_6-31+g(d).gjf (generated)

012002772.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002772.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002772.mol 012002772.PUBCHEM 012002772.mol (via Jmol)
012002774.b3lyp_6-31g(d).inp

012002774.b3lyp_6-31g(d).qchem.inp (generated)

012002774.b3lyp_6-31g(d).gjf (generated)

012002774.b3lyp_6-31g(d).firefly.inp (generated)

012002774.b3lyp_6-31g(d).smash.inp (generated)

012002774.b3lyp_6-31g(d).nwchem.inp (generated) 012002774.b3lyp_6-31g(d).log.xz 012002774.td-b3lyp_6-31g+(d).inp 012002774.td-b3lyp_6-31g+(d).log.xz

012002774.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002774.td-b3lyp_6-31+g(d).gjf (generated)

012002774.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002774.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002774.mol 012002774.PUBCHEM 012002774.mol (via Jmol)
012002775.b3lyp_6-31g(d).inp

012002775.b3lyp_6-31g(d).qchem.inp (generated)

012002775.b3lyp_6-31g(d).gjf (generated)

012002775.b3lyp_6-31g(d).firefly.inp (generated)

012002775.b3lyp_6-31g(d).smash.inp (generated)

012002775.b3lyp_6-31g(d).nwchem.inp (generated) 012002775.b3lyp_6-31g(d).log.xz 012002775.td-b3lyp_6-31g+(d).inp 012002775.td-b3lyp_6-31g+(d).log.xz

012002775.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002775.td-b3lyp_6-31+g(d).gjf (generated)

012002775.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002775.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002775.mol 012002775.PUBCHEM 012002775.mol (via Jmol)
012002825.b3lyp_6-31g(d).inp

012002825.b3lyp_6-31g(d).qchem.inp (generated)

012002825.b3lyp_6-31g(d).gjf (generated)

012002825.b3lyp_6-31g(d).firefly.inp (generated)

012002825.b3lyp_6-31g(d).smash.inp (generated)

012002825.b3lyp_6-31g(d).nwchem.inp (generated) 012002825.b3lyp_6-31g(d).log.xz 012002825.td-b3lyp_6-31g+(d).inp 012002825.td-b3lyp_6-31g+(d).log.xz

012002825.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002825.td-b3lyp_6-31+g(d).gjf (generated)

012002825.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002825.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002825.mol 012002825.PUBCHEM 012002825.mol (via Jmol)
012002847.b3lyp_6-31g(d).inp

012002847.b3lyp_6-31g(d).qchem.inp (generated)

012002847.b3lyp_6-31g(d).gjf (generated)

012002847.b3lyp_6-31g(d).firefly.inp (generated)

012002847.b3lyp_6-31g(d).smash.inp (generated)

012002847.b3lyp_6-31g(d).nwchem.inp (generated) 012002847.b3lyp_6-31g(d).log.xz 012002847.td-b3lyp_6-31g+(d).inp 012002847.td-b3lyp_6-31g+(d).log.xz

012002847.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002847.td-b3lyp_6-31+g(d).gjf (generated)

012002847.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002847.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002847.mol 012002847.PUBCHEM 012002847.mol (via Jmol)
012002848.b3lyp_6-31g(d).inp

012002848.b3lyp_6-31g(d).qchem.inp (generated)

012002848.b3lyp_6-31g(d).gjf (generated)

012002848.b3lyp_6-31g(d).firefly.inp (generated)

012002848.b3lyp_6-31g(d).smash.inp (generated)

012002848.b3lyp_6-31g(d).nwchem.inp (generated) 012002848.b3lyp_6-31g(d).log.xz 012002848.td-b3lyp_6-31g+(d).inp 012002848.td-b3lyp_6-31g+(d).log.xz

012002848.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002848.td-b3lyp_6-31+g(d).gjf (generated)

012002848.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002848.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002848.mol 012002848.PUBCHEM 012002848.mol (via Jmol)
012002849.b3lyp_6-31g(d).inp

012002849.b3lyp_6-31g(d).qchem.inp (generated)

012002849.b3lyp_6-31g(d).gjf (generated)

012002849.b3lyp_6-31g(d).firefly.inp (generated)

012002849.b3lyp_6-31g(d).smash.inp (generated)

012002849.b3lyp_6-31g(d).nwchem.inp (generated) 012002849.b3lyp_6-31g(d).log.xz 012002849.td-b3lyp_6-31g+(d).inp 012002849.td-b3lyp_6-31g+(d).log.xz

012002849.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002849.td-b3lyp_6-31+g(d).gjf (generated)

012002849.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002849.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002849.mol 012002849.PUBCHEM 012002849.mol (via Jmol)
012002850.b3lyp_6-31g(d).inp

012002850.b3lyp_6-31g(d).qchem.inp (generated)

012002850.b3lyp_6-31g(d).gjf (generated)

012002850.b3lyp_6-31g(d).firefly.inp (generated)

012002850.b3lyp_6-31g(d).smash.inp (generated)

012002850.b3lyp_6-31g(d).nwchem.inp (generated) 012002850.b3lyp_6-31g(d).log.xz 012002850.td-b3lyp_6-31g+(d).inp 012002850.td-b3lyp_6-31g+(d).log.xz

012002850.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002850.td-b3lyp_6-31+g(d).gjf (generated)

012002850.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002850.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002850.mol 012002850.PUBCHEM 012002850.mol (via Jmol)
012002869.b3lyp_6-31g(d).inp

012002869.b3lyp_6-31g(d).qchem.inp (generated)

012002869.b3lyp_6-31g(d).gjf (generated)

012002869.b3lyp_6-31g(d).firefly.inp (generated)

012002869.b3lyp_6-31g(d).smash.inp (generated)

012002869.b3lyp_6-31g(d).nwchem.inp (generated) 012002869.b3lyp_6-31g(d).log.xz 012002869.td-b3lyp_6-31g+(d).inp 012002869.td-b3lyp_6-31g+(d).log.xz

012002869.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002869.td-b3lyp_6-31+g(d).gjf (generated)

012002869.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002869.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002869.mol 012002869.PUBCHEM 012002869.mol (via Jmol)
012002870.b3lyp_6-31g(d).inp

012002870.b3lyp_6-31g(d).qchem.inp (generated)

012002870.b3lyp_6-31g(d).gjf (generated)

012002870.b3lyp_6-31g(d).firefly.inp (generated)

012002870.b3lyp_6-31g(d).smash.inp (generated)

012002870.b3lyp_6-31g(d).nwchem.inp (generated) 012002870.b3lyp_6-31g(d).log.xz 012002870.td-b3lyp_6-31g+(d).inp 012002870.td-b3lyp_6-31g+(d).log.xz

012002870.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002870.td-b3lyp_6-31+g(d).gjf (generated)

012002870.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002870.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002870.mol 012002870.PUBCHEM 012002870.mol (via Jmol)
012002929.b3lyp_6-31g(d).inp

012002929.b3lyp_6-31g(d).qchem.inp (generated)

012002929.b3lyp_6-31g(d).gjf (generated)

012002929.b3lyp_6-31g(d).firefly.inp (generated)

012002929.b3lyp_6-31g(d).smash.inp (generated)

012002929.b3lyp_6-31g(d).nwchem.inp (generated) 012002929.b3lyp_6-31g(d).log.xz 012002929.td-b3lyp_6-31g+(d).inp 012002929.td-b3lyp_6-31g+(d).log.xz

012002929.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002929.td-b3lyp_6-31+g(d).gjf (generated)

012002929.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002929.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002929.mol 012002929.PUBCHEM 012002929.mol (via Jmol)
012002941.b3lyp_6-31g(d).inp

012002941.b3lyp_6-31g(d).qchem.inp (generated)

012002941.b3lyp_6-31g(d).gjf (generated)

012002941.b3lyp_6-31g(d).firefly.inp (generated)

012002941.b3lyp_6-31g(d).smash.inp (generated)

012002941.b3lyp_6-31g(d).nwchem.inp (generated) 012002941.b3lyp_6-31g(d).log.xz 012002941.td-b3lyp_6-31g+(d).inp 012002941.td-b3lyp_6-31g+(d).log.xz

012002941.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002941.td-b3lyp_6-31+g(d).gjf (generated)

012002941.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002941.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002941.mol 012002941.PUBCHEM 012002941.mol (via Jmol)
012002943.b3lyp_6-31g(d).inp

012002943.b3lyp_6-31g(d).qchem.inp (generated)

012002943.b3lyp_6-31g(d).gjf (generated)

012002943.b3lyp_6-31g(d).firefly.inp (generated)

012002943.b3lyp_6-31g(d).smash.inp (generated)

012002943.b3lyp_6-31g(d).nwchem.inp (generated) 012002943.b3lyp_6-31g(d).log.xz 012002943.td-b3lyp_6-31g+(d).inp 012002943.td-b3lyp_6-31g+(d).log.xz

012002943.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002943.td-b3lyp_6-31+g(d).gjf (generated)

012002943.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002943.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002943.mol 012002943.PUBCHEM 012002943.mol (via Jmol)
012002995.b3lyp_6-31g(d).inp

012002995.b3lyp_6-31g(d).qchem.inp (generated)

012002995.b3lyp_6-31g(d).gjf (generated)

012002995.b3lyp_6-31g(d).firefly.inp (generated)

012002995.b3lyp_6-31g(d).smash.inp (generated)

012002995.b3lyp_6-31g(d).nwchem.inp (generated) 012002995.b3lyp_6-31g(d).log.xz 012002995.td-b3lyp_6-31g+(d).inp 012002995.td-b3lyp_6-31g+(d).log.xz

012002995.td-b3lyp_6-31+g(d).qchem.inp (generated)

012002995.td-b3lyp_6-31+g(d).gjf (generated)

012002995.td-b3lyp_6-31+g(d).firefly.inp (generated)

012002995.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012002995.mol 012002995.PUBCHEM 012002995.mol (via Jmol)
012003000.b3lyp_6-31g(d).inp

012003000.b3lyp_6-31g(d).qchem.inp (generated)

012003000.b3lyp_6-31g(d).gjf (generated)

012003000.b3lyp_6-31g(d).firefly.inp (generated)

012003000.b3lyp_6-31g(d).smash.inp (generated)

012003000.b3lyp_6-31g(d).nwchem.inp (generated) 012003000.b3lyp_6-31g(d).log.xz 012003000.td-b3lyp_6-31g+(d).inp 012003000.td-b3lyp_6-31g+(d).log.xz

012003000.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003000.td-b3lyp_6-31+g(d).gjf (generated)

012003000.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003000.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003000.mol 012003000.PUBCHEM 012003000.mol (via Jmol)
012003016.b3lyp_6-31g(d).inp

012003016.b3lyp_6-31g(d).qchem.inp (generated)

012003016.b3lyp_6-31g(d).gjf (generated)

012003016.b3lyp_6-31g(d).firefly.inp (generated)

012003016.b3lyp_6-31g(d).smash.inp (generated)

012003016.b3lyp_6-31g(d).nwchem.inp (generated) 012003016.b3lyp_6-31g(d).log.xz 012003016.mol 012003016.PUBCHEM 012003016.mol (via Jmol)
012003017.b3lyp_6-31g(d).inp

012003017.b3lyp_6-31g(d).qchem.inp (generated)

012003017.b3lyp_6-31g(d).gjf (generated)

012003017.b3lyp_6-31g(d).firefly.inp (generated)

012003017.b3lyp_6-31g(d).smash.inp (generated)

012003017.b3lyp_6-31g(d).nwchem.inp (generated) 012003017.b3lyp_6-31g(d).log.xz 012003017.mol 012003017.PUBCHEM 012003017.mol (via Jmol)
012003018.b3lyp_6-31g(d).inp

012003018.b3lyp_6-31g(d).qchem.inp (generated)

012003018.b3lyp_6-31g(d).gjf (generated)

012003018.b3lyp_6-31g(d).firefly.inp (generated)

012003018.b3lyp_6-31g(d).smash.inp (generated)

012003018.b3lyp_6-31g(d).nwchem.inp (generated) 012003018.b3lyp_6-31g(d).log.xz 012003018.td-b3lyp_6-31g+(d).inp 012003018.td-b3lyp_6-31g+(d).log.xz

012003018.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003018.td-b3lyp_6-31+g(d).gjf (generated)

012003018.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003018.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003018.mol 012003018.PUBCHEM 012003018.mol (via Jmol)
012003020.b3lyp_6-31g(d).inp

012003020.b3lyp_6-31g(d).qchem.inp (generated)

012003020.b3lyp_6-31g(d).gjf (generated)

012003020.b3lyp_6-31g(d).firefly.inp (generated)

012003020.b3lyp_6-31g(d).smash.inp (generated)

012003020.b3lyp_6-31g(d).nwchem.inp (generated) 012003020.b3lyp_6-31g(d).log.xz 012003020.td-b3lyp_6-31g+(d).inp 012003020.td-b3lyp_6-31g+(d).log.xz

012003020.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003020.td-b3lyp_6-31+g(d).gjf (generated)

012003020.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003020.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003020.mol 012003020.PUBCHEM 012003020.mol (via Jmol)
012003025.b3lyp_6-31g(d).inp

012003025.b3lyp_6-31g(d).qchem.inp (generated)

012003025.b3lyp_6-31g(d).gjf (generated)

012003025.b3lyp_6-31g(d).firefly.inp (generated)

012003025.b3lyp_6-31g(d).smash.inp (generated)

012003025.b3lyp_6-31g(d).nwchem.inp (generated) 012003025.b3lyp_6-31g(d).log.xz 012003025.td-b3lyp_6-31g+(d).inp 012003025.td-b3lyp_6-31g+(d).log.xz

012003025.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003025.td-b3lyp_6-31+g(d).gjf (generated)

012003025.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003025.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003025.mol 012003025.PUBCHEM 012003025.mol (via Jmol)
012003028.b3lyp_6-31g(d).inp

012003028.b3lyp_6-31g(d).qchem.inp (generated)

012003028.b3lyp_6-31g(d).gjf (generated)

012003028.b3lyp_6-31g(d).firefly.inp (generated)

012003028.b3lyp_6-31g(d).smash.inp (generated)

012003028.b3lyp_6-31g(d).nwchem.inp (generated) 012003028.b3lyp_6-31g(d).log.xz 012003028.td-b3lyp_6-31g+(d).inp 012003028.td-b3lyp_6-31g+(d).log.xz

012003028.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003028.td-b3lyp_6-31+g(d).gjf (generated)

012003028.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003028.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003028.mol 012003028.PUBCHEM 012003028.mol (via Jmol)
012003029.b3lyp_6-31g(d).inp

012003029.b3lyp_6-31g(d).qchem.inp (generated)

012003029.b3lyp_6-31g(d).gjf (generated)

012003029.b3lyp_6-31g(d).firefly.inp (generated)

012003029.b3lyp_6-31g(d).smash.inp (generated)

012003029.b3lyp_6-31g(d).nwchem.inp (generated) 012003029.b3lyp_6-31g(d).log.xz 012003029.td-b3lyp_6-31g+(d).inp 012003029.td-b3lyp_6-31g+(d).log.xz

012003029.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003029.td-b3lyp_6-31+g(d).gjf (generated)

012003029.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003029.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003029.mol 012003029.PUBCHEM 012003029.mol (via Jmol)
012003030.b3lyp_6-31g(d).inp

012003030.b3lyp_6-31g(d).qchem.inp (generated)

012003030.b3lyp_6-31g(d).gjf (generated)

012003030.b3lyp_6-31g(d).firefly.inp (generated)

012003030.b3lyp_6-31g(d).smash.inp (generated)

012003030.b3lyp_6-31g(d).nwchem.inp (generated) 012003030.b3lyp_6-31g(d).log.xz 012003030.td-b3lyp_6-31g+(d).inp 012003030.td-b3lyp_6-31g+(d).log.xz

012003030.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003030.td-b3lyp_6-31+g(d).gjf (generated)

012003030.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003030.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003030.mol 012003030.PUBCHEM 012003030.mol (via Jmol)
012003031.b3lyp_6-31g(d).inp

012003031.b3lyp_6-31g(d).qchem.inp (generated)

012003031.b3lyp_6-31g(d).gjf (generated)

012003031.b3lyp_6-31g(d).firefly.inp (generated)

012003031.b3lyp_6-31g(d).smash.inp (generated)

012003031.b3lyp_6-31g(d).nwchem.inp (generated) 012003031.b3lyp_6-31g(d).log.xz 012003031.td-b3lyp_6-31g+(d).inp 012003031.td-b3lyp_6-31g+(d).log.xz

012003031.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003031.td-b3lyp_6-31+g(d).gjf (generated)

012003031.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003031.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003031.mol 012003031.PUBCHEM 012003031.mol (via Jmol)
012003066.b3lyp_6-31g(d).inp

012003066.b3lyp_6-31g(d).qchem.inp (generated)

012003066.b3lyp_6-31g(d).gjf (generated)

012003066.b3lyp_6-31g(d).firefly.inp (generated)

012003066.b3lyp_6-31g(d).smash.inp (generated)

012003066.b3lyp_6-31g(d).nwchem.inp (generated) 012003066.b3lyp_6-31g(d).log.xz 012003066.td-b3lyp_6-31g+(d).inp 012003066.td-b3lyp_6-31g+(d).log.xz

012003066.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003066.td-b3lyp_6-31+g(d).gjf (generated)

012003066.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003066.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003066.mol 012003066.PUBCHEM 012003066.mol (via Jmol)
012003067.b3lyp_6-31g(d).inp

012003067.b3lyp_6-31g(d).qchem.inp (generated)

012003067.b3lyp_6-31g(d).gjf (generated)

012003067.b3lyp_6-31g(d).firefly.inp (generated)

012003067.b3lyp_6-31g(d).smash.inp (generated)

012003067.b3lyp_6-31g(d).nwchem.inp (generated) 012003067.b3lyp_6-31g(d).log.xz 012003067.td-b3lyp_6-31g+(d).inp 012003067.td-b3lyp_6-31g+(d).log.xz

012003067.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003067.td-b3lyp_6-31+g(d).gjf (generated)

012003067.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003067.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003067.mol 012003067.PUBCHEM 012003067.mol (via Jmol)
012003068.b3lyp_6-31g(d).inp

012003068.b3lyp_6-31g(d).qchem.inp (generated)

012003068.b3lyp_6-31g(d).gjf (generated)

012003068.b3lyp_6-31g(d).firefly.inp (generated)

012003068.b3lyp_6-31g(d).smash.inp (generated)

012003068.b3lyp_6-31g(d).nwchem.inp (generated) 012003068.b3lyp_6-31g(d).log.xz 012003068.td-b3lyp_6-31g+(d).inp 012003068.td-b3lyp_6-31g+(d).log.xz

012003068.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003068.td-b3lyp_6-31+g(d).gjf (generated)

012003068.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003068.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003068.mol 012003068.PUBCHEM 012003068.mol (via Jmol)
012003069.b3lyp_6-31g(d).inp

012003069.b3lyp_6-31g(d).qchem.inp (generated)

012003069.b3lyp_6-31g(d).gjf (generated)

012003069.b3lyp_6-31g(d).firefly.inp (generated)

012003069.b3lyp_6-31g(d).smash.inp (generated)

012003069.b3lyp_6-31g(d).nwchem.inp (generated) 012003069.b3lyp_6-31g(d).log.xz 012003069.td-b3lyp_6-31g+(d).inp 012003069.td-b3lyp_6-31g+(d).log.xz

012003069.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003069.td-b3lyp_6-31+g(d).gjf (generated)

012003069.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003069.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003069.mol 012003069.PUBCHEM 012003069.mol (via Jmol)
012003083.b3lyp_6-31g(d).inp

012003083.b3lyp_6-31g(d).qchem.inp (generated)

012003083.b3lyp_6-31g(d).gjf (generated)

012003083.b3lyp_6-31g(d).firefly.inp (generated)

012003083.b3lyp_6-31g(d).smash.inp (generated)

012003083.b3lyp_6-31g(d).nwchem.inp (generated) 012003083.b3lyp_6-31g(d).log.xz 012003083.td-b3lyp_6-31g+(d).inp 012003083.td-b3lyp_6-31g+(d).log.xz

012003083.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003083.td-b3lyp_6-31+g(d).gjf (generated)

012003083.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003083.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003083.mol 012003083.PUBCHEM 012003083.mol (via Jmol)
012003095.b3lyp_6-31g(d).inp

012003095.b3lyp_6-31g(d).qchem.inp (generated)

012003095.b3lyp_6-31g(d).gjf (generated)

012003095.b3lyp_6-31g(d).firefly.inp (generated)

012003095.b3lyp_6-31g(d).smash.inp (generated)

012003095.b3lyp_6-31g(d).nwchem.inp (generated) 012003095.b3lyp_6-31g(d).log.xz 012003095.td-b3lyp_6-31g+(d).inp 012003095.td-b3lyp_6-31g+(d).log.xz

012003095.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003095.td-b3lyp_6-31+g(d).gjf (generated)

012003095.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003095.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003095.mol 012003095.PUBCHEM 012003095.mol (via Jmol)
012003104.b3lyp_6-31g(d).inp

012003104.b3lyp_6-31g(d).qchem.inp (generated)

012003104.b3lyp_6-31g(d).gjf (generated)

012003104.b3lyp_6-31g(d).firefly.inp (generated)

012003104.b3lyp_6-31g(d).smash.inp (generated)

012003104.b3lyp_6-31g(d).nwchem.inp (generated) 012003104.b3lyp_6-31g(d).log.xz 012003104.td-b3lyp_6-31g+(d).inp 012003104.td-b3lyp_6-31g+(d).log.xz

012003104.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003104.td-b3lyp_6-31+g(d).gjf (generated)

012003104.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003104.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003104.mol 012003104.PUBCHEM 012003104.mol (via Jmol)
012003105.b3lyp_6-31g(d).inp

012003105.b3lyp_6-31g(d).qchem.inp (generated)

012003105.b3lyp_6-31g(d).gjf (generated)

012003105.b3lyp_6-31g(d).firefly.inp (generated)

012003105.b3lyp_6-31g(d).smash.inp (generated)

012003105.b3lyp_6-31g(d).nwchem.inp (generated) 012003105.b3lyp_6-31g(d).log.xz 012003105.td-b3lyp_6-31g+(d).inp 012003105.td-b3lyp_6-31g+(d).log.xz

012003105.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003105.td-b3lyp_6-31+g(d).gjf (generated)

012003105.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003105.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003105.mol 012003105.PUBCHEM 012003105.mol (via Jmol)
012003146.b3lyp_6-31g(d).inp

012003146.b3lyp_6-31g(d).qchem.inp (generated)

012003146.b3lyp_6-31g(d).gjf (generated)

012003146.b3lyp_6-31g(d).firefly.inp (generated)

012003146.b3lyp_6-31g(d).smash.inp (generated)

012003146.b3lyp_6-31g(d).nwchem.inp (generated) 012003146.b3lyp_6-31g(d).log.xz 012003146.td-b3lyp_6-31g+(d).inp 012003146.td-b3lyp_6-31g+(d).log.xz

012003146.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003146.td-b3lyp_6-31+g(d).gjf (generated)

012003146.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003146.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003146.mol 012003146.PUBCHEM 012003146.mol (via Jmol)
012003147.b3lyp_6-31g(d).inp

012003147.b3lyp_6-31g(d).qchem.inp (generated)

012003147.b3lyp_6-31g(d).gjf (generated)

012003147.b3lyp_6-31g(d).firefly.inp (generated)

012003147.b3lyp_6-31g(d).smash.inp (generated)

012003147.b3lyp_6-31g(d).nwchem.inp (generated) 012003147.b3lyp_6-31g(d).log.xz 012003147.td-b3lyp_6-31g+(d).inp 012003147.td-b3lyp_6-31g+(d).log.xz

012003147.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003147.td-b3lyp_6-31+g(d).gjf (generated)

012003147.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003147.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003147.mol 012003147.PUBCHEM 012003147.mol (via Jmol)
012003148.b3lyp_6-31g(d).inp

012003148.b3lyp_6-31g(d).qchem.inp (generated)

012003148.b3lyp_6-31g(d).gjf (generated)

012003148.b3lyp_6-31g(d).firefly.inp (generated)

012003148.b3lyp_6-31g(d).smash.inp (generated)

012003148.b3lyp_6-31g(d).nwchem.inp (generated) 012003148.b3lyp_6-31g(d).log.xz 012003148.td-b3lyp_6-31g+(d).inp 012003148.td-b3lyp_6-31g+(d).log.xz

012003148.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003148.td-b3lyp_6-31+g(d).gjf (generated)

012003148.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003148.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003148.mol 012003148.PUBCHEM 012003148.mol (via Jmol)
012003149.b3lyp_6-31g(d).inp

012003149.b3lyp_6-31g(d).qchem.inp (generated)

012003149.b3lyp_6-31g(d).gjf (generated)

012003149.b3lyp_6-31g(d).firefly.inp (generated)

012003149.b3lyp_6-31g(d).smash.inp (generated)

012003149.b3lyp_6-31g(d).nwchem.inp (generated) 012003149.b3lyp_6-31g(d).log.xz 012003149.td-b3lyp_6-31g+(d).inp 012003149.td-b3lyp_6-31g+(d).log.xz

012003149.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003149.td-b3lyp_6-31+g(d).gjf (generated)

012003149.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003149.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003149.mol 012003149.PUBCHEM 012003149.mol (via Jmol)
012003150.b3lyp_6-31g(d).inp

012003150.b3lyp_6-31g(d).qchem.inp (generated)

012003150.b3lyp_6-31g(d).gjf (generated)

012003150.b3lyp_6-31g(d).firefly.inp (generated)

012003150.b3lyp_6-31g(d).smash.inp (generated)

012003150.b3lyp_6-31g(d).nwchem.inp (generated) 012003150.b3lyp_6-31g(d).log.xz 012003150.td-b3lyp_6-31g+(d).inp 012003150.td-b3lyp_6-31g+(d).log.xz

012003150.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003150.td-b3lyp_6-31+g(d).gjf (generated)

012003150.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003150.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003150.mol 012003150.PUBCHEM 012003150.mol (via Jmol)
012003151.b3lyp_6-31g(d).inp

012003151.b3lyp_6-31g(d).qchem.inp (generated)

012003151.b3lyp_6-31g(d).gjf (generated)

012003151.b3lyp_6-31g(d).firefly.inp (generated)

012003151.b3lyp_6-31g(d).smash.inp (generated)

012003151.b3lyp_6-31g(d).nwchem.inp (generated) 012003151.b3lyp_6-31g(d).log.xz 012003151.td-b3lyp_6-31g+(d).inp 012003151.td-b3lyp_6-31g+(d).log.xz

012003151.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003151.td-b3lyp_6-31+g(d).gjf (generated)

012003151.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003151.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003151.mol 012003151.PUBCHEM 012003151.mol (via Jmol)
012003152.b3lyp_6-31g(d).inp

012003152.b3lyp_6-31g(d).qchem.inp (generated)

012003152.b3lyp_6-31g(d).gjf (generated)

012003152.b3lyp_6-31g(d).firefly.inp (generated)

012003152.b3lyp_6-31g(d).smash.inp (generated)

012003152.b3lyp_6-31g(d).nwchem.inp (generated) 012003152.b3lyp_6-31g(d).log.xz 012003152.td-b3lyp_6-31g+(d).inp 012003152.td-b3lyp_6-31g+(d).log.xz

012003152.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003152.td-b3lyp_6-31+g(d).gjf (generated)

012003152.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003152.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003152.mol 012003152.PUBCHEM 012003152.mol (via Jmol)
012003155.b3lyp_6-31g(d).inp

012003155.b3lyp_6-31g(d).qchem.inp (generated)

012003155.b3lyp_6-31g(d).gjf (generated)

012003155.b3lyp_6-31g(d).firefly.inp (generated)

012003155.b3lyp_6-31g(d).smash.inp (generated)

012003155.b3lyp_6-31g(d).nwchem.inp (generated) 012003155.b3lyp_6-31g(d).log.xz 012003155.td-b3lyp_6-31g+(d).inp 012003155.td-b3lyp_6-31g+(d).log.xz

012003155.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003155.td-b3lyp_6-31+g(d).gjf (generated)

012003155.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003155.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003155.mol 012003155.PUBCHEM 012003155.mol (via Jmol)
012003156.b3lyp_6-31g(d).inp

012003156.b3lyp_6-31g(d).qchem.inp (generated)

012003156.b3lyp_6-31g(d).gjf (generated)

012003156.b3lyp_6-31g(d).firefly.inp (generated)

012003156.b3lyp_6-31g(d).smash.inp (generated)

012003156.b3lyp_6-31g(d).nwchem.inp (generated) 012003156.b3lyp_6-31g(d).log.xz 012003156.mol 012003156.PUBCHEM 012003156.mol (via Jmol)
012003175.b3lyp_6-31g(d).inp

012003175.b3lyp_6-31g(d).qchem.inp (generated)

012003175.b3lyp_6-31g(d).gjf (generated)

012003175.b3lyp_6-31g(d).firefly.inp (generated)

012003175.b3lyp_6-31g(d).smash.inp (generated)

012003175.b3lyp_6-31g(d).nwchem.inp (generated) 012003175.b3lyp_6-31g(d).log.xz 012003175.td-b3lyp_6-31g+(d).inp 012003175.td-b3lyp_6-31g+(d).log.xz

012003175.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003175.td-b3lyp_6-31+g(d).gjf (generated)

012003175.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003175.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003175.mol 012003175.PUBCHEM 012003175.mol (via Jmol)
012003179.b3lyp_6-31g(d).inp

012003179.b3lyp_6-31g(d).qchem.inp (generated)

012003179.b3lyp_6-31g(d).gjf (generated)

012003179.b3lyp_6-31g(d).firefly.inp (generated)

012003179.b3lyp_6-31g(d).smash.inp (generated)

012003179.b3lyp_6-31g(d).nwchem.inp (generated) 012003179.b3lyp_6-31g(d).log.xz 012003179.td-b3lyp_6-31g+(d).inp 012003179.td-b3lyp_6-31g+(d).log.xz

012003179.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003179.td-b3lyp_6-31+g(d).gjf (generated)

012003179.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003179.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003179.mol 012003179.PUBCHEM 012003179.mol (via Jmol)
012003180.b3lyp_6-31g(d).inp

012003180.b3lyp_6-31g(d).qchem.inp (generated)

012003180.b3lyp_6-31g(d).gjf (generated)

012003180.b3lyp_6-31g(d).firefly.inp (generated)

012003180.b3lyp_6-31g(d).smash.inp (generated)

012003180.b3lyp_6-31g(d).nwchem.inp (generated) 012003180.b3lyp_6-31g(d).log.xz 012003180.td-b3lyp_6-31g+(d).inp 012003180.td-b3lyp_6-31g+(d).log.xz

012003180.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003180.td-b3lyp_6-31+g(d).gjf (generated)

012003180.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003180.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003180.mol 012003180.PUBCHEM 012003180.mol (via Jmol)
012003190.b3lyp_6-31g(d).inp

012003190.b3lyp_6-31g(d).qchem.inp (generated)

012003190.b3lyp_6-31g(d).gjf (generated)

012003190.b3lyp_6-31g(d).firefly.inp (generated)

012003190.b3lyp_6-31g(d).smash.inp (generated)

012003190.b3lyp_6-31g(d).nwchem.inp (generated) 012003190.b3lyp_6-31g(d).log.xz 012003190.td-b3lyp_6-31g+(d).inp 012003190.td-b3lyp_6-31g+(d).log.xz

012003190.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003190.td-b3lyp_6-31+g(d).gjf (generated)

012003190.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003190.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003190.mol 012003190.PUBCHEM 012003190.mol (via Jmol)
012003191.b3lyp_6-31g(d).inp

012003191.b3lyp_6-31g(d).qchem.inp (generated)

012003191.b3lyp_6-31g(d).gjf (generated)

012003191.b3lyp_6-31g(d).firefly.inp (generated)

012003191.b3lyp_6-31g(d).smash.inp (generated)

012003191.b3lyp_6-31g(d).nwchem.inp (generated) 012003191.b3lyp_6-31g(d).log.xz 012003191.td-b3lyp_6-31g+(d).inp 012003191.td-b3lyp_6-31g+(d).log.xz

012003191.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003191.td-b3lyp_6-31+g(d).gjf (generated)

012003191.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003191.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003191.mol 012003191.PUBCHEM 012003191.mol (via Jmol)
012003251.b3lyp_6-31g(d).inp

012003251.b3lyp_6-31g(d).qchem.inp (generated)

012003251.b3lyp_6-31g(d).gjf (generated)

012003251.b3lyp_6-31g(d).firefly.inp (generated)

012003251.b3lyp_6-31g(d).smash.inp (generated)

012003251.b3lyp_6-31g(d).nwchem.inp (generated) 012003251.b3lyp_6-31g(d).log.xz 012003251.td-b3lyp_6-31g+(d).inp 012003251.td-b3lyp_6-31g+(d).log.xz

012003251.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003251.td-b3lyp_6-31+g(d).gjf (generated)

012003251.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003251.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003251.mol 012003251.PUBCHEM 012003251.mol (via Jmol)
012003252.b3lyp_6-31g(d).inp

012003252.b3lyp_6-31g(d).qchem.inp (generated)

012003252.b3lyp_6-31g(d).gjf (generated)

012003252.b3lyp_6-31g(d).firefly.inp (generated)

012003252.b3lyp_6-31g(d).smash.inp (generated)

012003252.b3lyp_6-31g(d).nwchem.inp (generated) 012003252.b3lyp_6-31g(d).log.xz 012003252.td-b3lyp_6-31g+(d).inp 012003252.td-b3lyp_6-31g+(d).log.xz

012003252.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003252.td-b3lyp_6-31+g(d).gjf (generated)

012003252.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003252.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003252.mol 012003252.PUBCHEM 012003252.mol (via Jmol)
012003266.b3lyp_6-31g(d).inp

012003266.b3lyp_6-31g(d).qchem.inp (generated)

012003266.b3lyp_6-31g(d).gjf (generated)

012003266.b3lyp_6-31g(d).firefly.inp (generated)

012003266.b3lyp_6-31g(d).smash.inp (generated)

012003266.b3lyp_6-31g(d).nwchem.inp (generated) 012003266.b3lyp_6-31g(d).log.xz 012003266.td-b3lyp_6-31g+(d).inp 012003266.td-b3lyp_6-31g+(d).log.xz

012003266.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003266.td-b3lyp_6-31+g(d).gjf (generated)

012003266.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003266.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003266.mol 012003266.PUBCHEM 012003266.mol (via Jmol)
012003301.b3lyp_6-31g(d).inp

012003301.b3lyp_6-31g(d).qchem.inp (generated)

012003301.b3lyp_6-31g(d).gjf (generated)

012003301.b3lyp_6-31g(d).firefly.inp (generated)

012003301.b3lyp_6-31g(d).smash.inp (generated)

012003301.b3lyp_6-31g(d).nwchem.inp (generated) 012003301.b3lyp_6-31g(d).log.xz 012003301.td-b3lyp_6-31g+(d).inp 012003301.td-b3lyp_6-31g+(d).log.xz

012003301.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003301.td-b3lyp_6-31+g(d).gjf (generated)

012003301.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003301.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003301.mol 012003301.PUBCHEM 012003301.mol (via Jmol)
012003325.b3lyp_6-31g(d).inp

012003325.b3lyp_6-31g(d).qchem.inp (generated)

012003325.b3lyp_6-31g(d).gjf (generated)

012003325.b3lyp_6-31g(d).firefly.inp (generated)

012003325.b3lyp_6-31g(d).smash.inp (generated)

012003325.b3lyp_6-31g(d).nwchem.inp (generated) 012003325.b3lyp_6-31g(d).log.xz 012003325.td-b3lyp_6-31g+(d).inp 012003325.td-b3lyp_6-31g+(d).log.xz

012003325.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003325.td-b3lyp_6-31+g(d).gjf (generated)

012003325.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003325.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003325.mol 012003325.PUBCHEM 012003325.mol (via Jmol)
012003345.b3lyp_6-31g(d).inp

012003345.b3lyp_6-31g(d).qchem.inp (generated)

012003345.b3lyp_6-31g(d).gjf (generated)

012003345.b3lyp_6-31g(d).firefly.inp (generated)

012003345.b3lyp_6-31g(d).smash.inp (generated)

012003345.b3lyp_6-31g(d).nwchem.inp (generated) 012003345.b3lyp_6-31g(d).log.xz 012003345.td-b3lyp_6-31g+(d).inp 012003345.td-b3lyp_6-31g+(d).log.xz

012003345.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003345.td-b3lyp_6-31+g(d).gjf (generated)

012003345.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003345.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003345.mol 012003345.PUBCHEM 012003345.mol (via Jmol)
012003347.b3lyp_6-31g(d).inp

012003347.b3lyp_6-31g(d).qchem.inp (generated)

012003347.b3lyp_6-31g(d).gjf (generated)

012003347.b3lyp_6-31g(d).firefly.inp (generated)

012003347.b3lyp_6-31g(d).smash.inp (generated)

012003347.b3lyp_6-31g(d).nwchem.inp (generated) 012003347.b3lyp_6-31g(d).log.xz 012003347.td-b3lyp_6-31g+(d).inp 012003347.td-b3lyp_6-31g+(d).log.xz

012003347.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003347.td-b3lyp_6-31+g(d).gjf (generated)

012003347.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003347.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003347.mol 012003347.PUBCHEM 012003347.mol (via Jmol)
012003348.b3lyp_6-31g(d).inp

012003348.b3lyp_6-31g(d).qchem.inp (generated)

012003348.b3lyp_6-31g(d).gjf (generated)

012003348.b3lyp_6-31g(d).firefly.inp (generated)

012003348.b3lyp_6-31g(d).smash.inp (generated)

012003348.b3lyp_6-31g(d).nwchem.inp (generated) 012003348.b3lyp_6-31g(d).log.xz 012003348.mol 012003348.PUBCHEM 012003348.mol (via Jmol)
012003367.b3lyp_6-31g(d).inp

012003367.b3lyp_6-31g(d).qchem.inp (generated)

012003367.b3lyp_6-31g(d).gjf (generated)

012003367.b3lyp_6-31g(d).firefly.inp (generated)

012003367.b3lyp_6-31g(d).smash.inp (generated)

012003367.b3lyp_6-31g(d).nwchem.inp (generated) 012003367.b3lyp_6-31g(d).log.xz 012003367.td-b3lyp_6-31g+(d).inp 012003367.td-b3lyp_6-31g+(d).log.xz

012003367.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003367.td-b3lyp_6-31+g(d).gjf (generated)

012003367.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003367.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003367.mol 012003367.PUBCHEM 012003367.mol (via Jmol)
012003438.b3lyp_6-31g(d).inp

012003438.b3lyp_6-31g(d).qchem.inp (generated)

012003438.b3lyp_6-31g(d).gjf (generated)

012003438.b3lyp_6-31g(d).firefly.inp (generated)

012003438.b3lyp_6-31g(d).smash.inp (generated)

012003438.b3lyp_6-31g(d).nwchem.inp (generated) 012003438.b3lyp_6-31g(d).log.xz 012003438.td-b3lyp_6-31g+(d).inp 012003438.td-b3lyp_6-31g+(d).log.xz

012003438.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003438.td-b3lyp_6-31+g(d).gjf (generated)

012003438.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003438.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003438.mol 012003438.PUBCHEM 012003438.mol (via Jmol)
012003442.b3lyp_6-31g(d).inp

012003442.b3lyp_6-31g(d).qchem.inp (generated)

012003442.b3lyp_6-31g(d).gjf (generated)

012003442.b3lyp_6-31g(d).firefly.inp (generated)

012003442.b3lyp_6-31g(d).smash.inp (generated)

012003442.b3lyp_6-31g(d).nwchem.inp (generated) 012003442.b3lyp_6-31g(d).log.xz 012003442.td-b3lyp_6-31g+(d).inp 012003442.td-b3lyp_6-31g+(d).log.xz

012003442.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003442.td-b3lyp_6-31+g(d).gjf (generated)

012003442.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003442.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003442.mol 012003442.PUBCHEM 012003442.mol (via Jmol)
012003445.b3lyp_6-31g(d).inp

012003445.b3lyp_6-31g(d).qchem.inp (generated)

012003445.b3lyp_6-31g(d).gjf (generated)

012003445.b3lyp_6-31g(d).firefly.inp (generated)

012003445.b3lyp_6-31g(d).smash.inp (generated)

012003445.b3lyp_6-31g(d).nwchem.inp (generated) 012003445.b3lyp_6-31g(d).log.xz 012003445.td-b3lyp_6-31g+(d).inp 012003445.td-b3lyp_6-31g+(d).log.xz

012003445.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003445.td-b3lyp_6-31+g(d).gjf (generated)

012003445.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003445.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003445.mol 012003445.PUBCHEM 012003445.mol (via Jmol)
012003446.b3lyp_6-31g(d).inp

012003446.b3lyp_6-31g(d).qchem.inp (generated)

012003446.b3lyp_6-31g(d).gjf (generated)

012003446.b3lyp_6-31g(d).firefly.inp (generated)

012003446.b3lyp_6-31g(d).smash.inp (generated)

012003446.b3lyp_6-31g(d).nwchem.inp (generated) 012003446.b3lyp_6-31g(d).log.xz 012003446.td-b3lyp_6-31g+(d).inp 012003446.td-b3lyp_6-31g+(d).log.xz

012003446.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003446.td-b3lyp_6-31+g(d).gjf (generated)

012003446.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003446.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003446.mol 012003446.PUBCHEM 012003446.mol (via Jmol)
012003447.b3lyp_6-31g(d).inp

012003447.b3lyp_6-31g(d).qchem.inp (generated)

012003447.b3lyp_6-31g(d).gjf (generated)

012003447.b3lyp_6-31g(d).firefly.inp (generated)

012003447.b3lyp_6-31g(d).smash.inp (generated)

012003447.b3lyp_6-31g(d).nwchem.inp (generated) 012003447.b3lyp_6-31g(d).log.xz 012003447.td-b3lyp_6-31g+(d).inp 012003447.td-b3lyp_6-31g+(d).log.xz

012003447.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003447.td-b3lyp_6-31+g(d).gjf (generated)

012003447.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003447.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003447.mol 012003447.PUBCHEM 012003447.mol (via Jmol)
012003451.b3lyp_6-31g(d).inp

012003451.b3lyp_6-31g(d).qchem.inp (generated)

012003451.b3lyp_6-31g(d).gjf (generated)

012003451.b3lyp_6-31g(d).firefly.inp (generated)

012003451.b3lyp_6-31g(d).smash.inp (generated)

012003451.b3lyp_6-31g(d).nwchem.inp (generated) 012003451.b3lyp_6-31g(d).log.xz 012003451.td-b3lyp_6-31g+(d).inp 012003451.td-b3lyp_6-31g+(d).log.xz

012003451.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003451.td-b3lyp_6-31+g(d).gjf (generated)

012003451.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003451.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003451.mol 012003451.PUBCHEM 012003451.mol (via Jmol)
012003548.b3lyp_6-31g(d).inp

012003548.b3lyp_6-31g(d).qchem.inp (generated)

012003548.b3lyp_6-31g(d).gjf (generated)

012003548.b3lyp_6-31g(d).firefly.inp (generated)

012003548.b3lyp_6-31g(d).smash.inp (generated)

012003548.b3lyp_6-31g(d).nwchem.inp (generated) 012003548.b3lyp_6-31g(d).log.xz 012003548.td-b3lyp_6-31g+(d).inp 012003548.td-b3lyp_6-31g+(d).log.xz

012003548.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003548.td-b3lyp_6-31+g(d).gjf (generated)

012003548.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003548.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003548.mol 012003548.PUBCHEM 012003548.mol (via Jmol)
012003549.b3lyp_6-31g(d).inp

012003549.b3lyp_6-31g(d).qchem.inp (generated)

012003549.b3lyp_6-31g(d).gjf (generated)

012003549.b3lyp_6-31g(d).firefly.inp (generated)

012003549.b3lyp_6-31g(d).smash.inp (generated)

012003549.b3lyp_6-31g(d).nwchem.inp (generated) 012003549.b3lyp_6-31g(d).log.xz 012003549.td-b3lyp_6-31g+(d).inp 012003549.td-b3lyp_6-31g+(d).log.xz

012003549.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003549.td-b3lyp_6-31+g(d).gjf (generated)

012003549.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003549.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003549.mol 012003549.PUBCHEM 012003549.mol (via Jmol)
012003550.b3lyp_6-31g(d).inp

012003550.b3lyp_6-31g(d).qchem.inp (generated)

012003550.b3lyp_6-31g(d).gjf (generated)

012003550.b3lyp_6-31g(d).firefly.inp (generated)

012003550.b3lyp_6-31g(d).smash.inp (generated)

012003550.b3lyp_6-31g(d).nwchem.inp (generated) 012003550.b3lyp_6-31g(d).log.xz 012003550.td-b3lyp_6-31g+(d).inp 012003550.td-b3lyp_6-31g+(d).log.xz

012003550.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003550.td-b3lyp_6-31+g(d).gjf (generated)

012003550.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003550.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003550.mol 012003550.PUBCHEM 012003550.mol (via Jmol)
012003567.b3lyp_6-31g(d).inp

012003567.b3lyp_6-31g(d).qchem.inp (generated)

012003567.b3lyp_6-31g(d).gjf (generated)

012003567.b3lyp_6-31g(d).firefly.inp (generated)

012003567.b3lyp_6-31g(d).smash.inp (generated)

012003567.b3lyp_6-31g(d).nwchem.inp (generated) 012003567.b3lyp_6-31g(d).log.xz 012003567.td-b3lyp_6-31g+(d).inp 012003567.td-b3lyp_6-31g+(d).log.xz

012003567.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003567.td-b3lyp_6-31+g(d).gjf (generated)

012003567.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003567.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003567.mol 012003567.PUBCHEM 012003567.mol (via Jmol)
012003569.b3lyp_6-31g(d).inp

012003569.b3lyp_6-31g(d).qchem.inp (generated)

012003569.b3lyp_6-31g(d).gjf (generated)

012003569.b3lyp_6-31g(d).firefly.inp (generated)

012003569.b3lyp_6-31g(d).smash.inp (generated)

012003569.b3lyp_6-31g(d).nwchem.inp (generated) 012003569.b3lyp_6-31g(d).log.xz 012003569.td-b3lyp_6-31g+(d).inp 012003569.td-b3lyp_6-31g+(d).log.xz

012003569.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003569.td-b3lyp_6-31+g(d).gjf (generated)

012003569.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003569.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003569.mol 012003569.PUBCHEM 012003569.mol (via Jmol)
012003575.b3lyp_6-31g(d).inp

012003575.b3lyp_6-31g(d).qchem.inp (generated)

012003575.b3lyp_6-31g(d).gjf (generated)

012003575.b3lyp_6-31g(d).firefly.inp (generated)

012003575.b3lyp_6-31g(d).smash.inp (generated)

012003575.b3lyp_6-31g(d).nwchem.inp (generated) 012003575.b3lyp_6-31g(d).log.xz 012003575.td-b3lyp_6-31g+(d).inp 012003575.td-b3lyp_6-31g+(d).log.xz

012003575.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003575.td-b3lyp_6-31+g(d).gjf (generated)

012003575.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003575.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003575.mol 012003575.PUBCHEM 012003575.mol (via Jmol)
012003577.b3lyp_6-31g(d).inp

012003577.b3lyp_6-31g(d).qchem.inp (generated)

012003577.b3lyp_6-31g(d).gjf (generated)

012003577.b3lyp_6-31g(d).firefly.inp (generated)

012003577.b3lyp_6-31g(d).smash.inp (generated)

012003577.b3lyp_6-31g(d).nwchem.inp (generated) 012003577.b3lyp_6-31g(d).log.xz 012003577.td-b3lyp_6-31g+(d).inp 012003577.td-b3lyp_6-31g+(d).log.xz

012003577.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003577.td-b3lyp_6-31+g(d).gjf (generated)

012003577.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003577.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003577.mol 012003577.PUBCHEM 012003577.mol (via Jmol)
012003579.b3lyp_6-31g(d).inp

012003579.b3lyp_6-31g(d).qchem.inp (generated)

012003579.b3lyp_6-31g(d).gjf (generated)

012003579.b3lyp_6-31g(d).firefly.inp (generated)

012003579.b3lyp_6-31g(d).smash.inp (generated)

012003579.b3lyp_6-31g(d).nwchem.inp (generated) 012003579.b3lyp_6-31g(d).log.xz 012003579.td-b3lyp_6-31g+(d).inp 012003579.td-b3lyp_6-31g+(d).log.xz

012003579.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003579.td-b3lyp_6-31+g(d).gjf (generated)

012003579.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003579.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003579.mol 012003579.PUBCHEM 012003579.mol (via Jmol)
012003580.b3lyp_6-31g(d).inp

012003580.b3lyp_6-31g(d).qchem.inp (generated)

012003580.b3lyp_6-31g(d).gjf (generated)

012003580.b3lyp_6-31g(d).firefly.inp (generated)

012003580.b3lyp_6-31g(d).smash.inp (generated)

012003580.b3lyp_6-31g(d).nwchem.inp (generated) 012003580.b3lyp_6-31g(d).log.xz 012003580.mol 012003580.PUBCHEM 012003580.mol (via Jmol)
012003596.b3lyp_6-31g(d).inp

012003596.b3lyp_6-31g(d).qchem.inp (generated)

012003596.b3lyp_6-31g(d).gjf (generated)

012003596.b3lyp_6-31g(d).firefly.inp (generated)

012003596.b3lyp_6-31g(d).smash.inp (generated)

012003596.b3lyp_6-31g(d).nwchem.inp (generated) 012003596.b3lyp_6-31g(d).log.xz 012003596.td-b3lyp_6-31g+(d).inp 012003596.td-b3lyp_6-31g+(d).log.xz

012003596.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003596.td-b3lyp_6-31+g(d).gjf (generated)

012003596.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003596.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003596.mol 012003596.PUBCHEM 012003596.mol (via Jmol)
012003597.b3lyp_6-31g(d).inp

012003597.b3lyp_6-31g(d).qchem.inp (generated)

012003597.b3lyp_6-31g(d).gjf (generated)

012003597.b3lyp_6-31g(d).firefly.inp (generated)

012003597.b3lyp_6-31g(d).smash.inp (generated)

012003597.b3lyp_6-31g(d).nwchem.inp (generated) 012003597.b3lyp_6-31g(d).log.xz 012003597.td-b3lyp_6-31g+(d).inp 012003597.td-b3lyp_6-31g+(d).log.xz

012003597.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003597.td-b3lyp_6-31+g(d).gjf (generated)

012003597.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003597.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003597.mol 012003597.PUBCHEM 012003597.mol (via Jmol)
012003599.b3lyp_6-31g(d).inp

012003599.b3lyp_6-31g(d).qchem.inp (generated)

012003599.b3lyp_6-31g(d).gjf (generated)

012003599.b3lyp_6-31g(d).firefly.inp (generated)

012003599.b3lyp_6-31g(d).smash.inp (generated)

012003599.b3lyp_6-31g(d).nwchem.inp (generated) 012003599.b3lyp_6-31g(d).log.xz 012003599.td-b3lyp_6-31g+(d).inp 012003599.td-b3lyp_6-31g+(d).log.xz

012003599.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003599.td-b3lyp_6-31+g(d).gjf (generated)

012003599.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003599.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003599.mol 012003599.PUBCHEM 012003599.mol (via Jmol)
012003600.b3lyp_6-31g(d).inp

012003600.b3lyp_6-31g(d).qchem.inp (generated)

012003600.b3lyp_6-31g(d).gjf (generated)

012003600.b3lyp_6-31g(d).firefly.inp (generated)

012003600.b3lyp_6-31g(d).smash.inp (generated)

012003600.b3lyp_6-31g(d).nwchem.inp (generated) 012003600.b3lyp_6-31g(d).log.xz 012003600.td-b3lyp_6-31g+(d).inp 012003600.td-b3lyp_6-31g+(d).log.xz

012003600.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003600.td-b3lyp_6-31+g(d).gjf (generated)

012003600.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003600.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003600.mol 012003600.PUBCHEM 012003600.mol (via Jmol)
012003601.b3lyp_6-31g(d).inp

012003601.b3lyp_6-31g(d).qchem.inp (generated)

012003601.b3lyp_6-31g(d).gjf (generated)

012003601.b3lyp_6-31g(d).firefly.inp (generated)

012003601.b3lyp_6-31g(d).smash.inp (generated)

012003601.b3lyp_6-31g(d).nwchem.inp (generated) 012003601.b3lyp_6-31g(d).log.xz 012003601.td-b3lyp_6-31g+(d).inp 012003601.td-b3lyp_6-31g+(d).log.xz

012003601.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003601.td-b3lyp_6-31+g(d).gjf (generated)

012003601.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003601.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003601.mol 012003601.PUBCHEM 012003601.mol (via Jmol)
012003630.b3lyp_6-31g(d).inp

012003630.b3lyp_6-31g(d).qchem.inp (generated)

012003630.b3lyp_6-31g(d).gjf (generated)

012003630.b3lyp_6-31g(d).firefly.inp (generated)

012003630.b3lyp_6-31g(d).smash.inp (generated)

012003630.b3lyp_6-31g(d).nwchem.inp (generated) 012003630.b3lyp_6-31g(d).log.xz 012003630.td-b3lyp_6-31g+(d).inp 012003630.td-b3lyp_6-31g+(d).log.xz

012003630.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003630.td-b3lyp_6-31+g(d).gjf (generated)

012003630.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003630.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003630.mol 012003630.PUBCHEM 012003630.mol (via Jmol)
012003639.b3lyp_6-31g(d).inp

012003639.b3lyp_6-31g(d).qchem.inp (generated)

012003639.b3lyp_6-31g(d).gjf (generated)

012003639.b3lyp_6-31g(d).firefly.inp (generated)

012003639.b3lyp_6-31g(d).smash.inp (generated)

012003639.b3lyp_6-31g(d).nwchem.inp (generated) 012003639.b3lyp_6-31g(d).log.xz 012003639.td-b3lyp_6-31g+(d).inp 012003639.td-b3lyp_6-31g+(d).log.xz

012003639.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003639.td-b3lyp_6-31+g(d).gjf (generated)

012003639.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003639.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003639.mol 012003639.PUBCHEM 012003639.mol (via Jmol)
012003640.b3lyp_6-31g(d).inp

012003640.b3lyp_6-31g(d).qchem.inp (generated)

012003640.b3lyp_6-31g(d).gjf (generated)

012003640.b3lyp_6-31g(d).firefly.inp (generated)

012003640.b3lyp_6-31g(d).smash.inp (generated)

012003640.b3lyp_6-31g(d).nwchem.inp (generated) 012003640.b3lyp_6-31g(d).log.xz 012003640.td-b3lyp_6-31g+(d).inp 012003640.td-b3lyp_6-31g+(d).log.xz

012003640.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003640.td-b3lyp_6-31+g(d).gjf (generated)

012003640.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003640.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003640.mol 012003640.PUBCHEM 012003640.mol (via Jmol)
012003643.b3lyp_6-31g(d).inp

012003643.b3lyp_6-31g(d).qchem.inp (generated)

012003643.b3lyp_6-31g(d).gjf (generated)

012003643.b3lyp_6-31g(d).firefly.inp (generated)

012003643.b3lyp_6-31g(d).smash.inp (generated)

012003643.b3lyp_6-31g(d).nwchem.inp (generated) 012003643.b3lyp_6-31g(d).log.xz 012003643.td-b3lyp_6-31g+(d).inp 012003643.td-b3lyp_6-31g+(d).log.xz

012003643.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003643.td-b3lyp_6-31+g(d).gjf (generated)

012003643.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003643.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003643.mol 012003643.PUBCHEM 012003643.mol (via Jmol)
012003649.b3lyp_6-31g(d).inp

012003649.b3lyp_6-31g(d).qchem.inp (generated)

012003649.b3lyp_6-31g(d).gjf (generated)

012003649.b3lyp_6-31g(d).firefly.inp (generated)

012003649.b3lyp_6-31g(d).smash.inp (generated)

012003649.b3lyp_6-31g(d).nwchem.inp (generated) 012003649.b3lyp_6-31g(d).log.xz 012003649.td-b3lyp_6-31g+(d).inp 012003649.td-b3lyp_6-31g+(d).log.xz

012003649.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003649.td-b3lyp_6-31+g(d).gjf (generated)

012003649.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003649.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003649.mol 012003649.PUBCHEM 012003649.mol (via Jmol)
012003650.b3lyp_6-31g(d).inp

012003650.b3lyp_6-31g(d).qchem.inp (generated)

012003650.b3lyp_6-31g(d).gjf (generated)

012003650.b3lyp_6-31g(d).firefly.inp (generated)

012003650.b3lyp_6-31g(d).smash.inp (generated)

012003650.b3lyp_6-31g(d).nwchem.inp (generated) 012003650.b3lyp_6-31g(d).log.xz 012003650.td-b3lyp_6-31g+(d).inp 012003650.td-b3lyp_6-31g+(d).log.xz

012003650.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003650.td-b3lyp_6-31+g(d).gjf (generated)

012003650.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003650.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003650.mol 012003650.PUBCHEM 012003650.mol (via Jmol)
012003651.b3lyp_6-31g(d).inp

012003651.b3lyp_6-31g(d).qchem.inp (generated)

012003651.b3lyp_6-31g(d).gjf (generated)

012003651.b3lyp_6-31g(d).firefly.inp (generated)

012003651.b3lyp_6-31g(d).smash.inp (generated)

012003651.b3lyp_6-31g(d).nwchem.inp (generated) 012003651.b3lyp_6-31g(d).log.xz 012003651.td-b3lyp_6-31g+(d).inp 012003651.td-b3lyp_6-31g+(d).log.xz

012003651.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003651.td-b3lyp_6-31+g(d).gjf (generated)

012003651.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003651.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003651.mol 012003651.PUBCHEM 012003651.mol (via Jmol)
012003652.b3lyp_6-31g(d).inp

012003652.b3lyp_6-31g(d).qchem.inp (generated)

012003652.b3lyp_6-31g(d).gjf (generated)

012003652.b3lyp_6-31g(d).firefly.inp (generated)

012003652.b3lyp_6-31g(d).smash.inp (generated)

012003652.b3lyp_6-31g(d).nwchem.inp (generated) 012003652.b3lyp_6-31g(d).log.xz 012003652.td-b3lyp_6-31g+(d).inp 012003652.td-b3lyp_6-31g+(d).log.xz

012003652.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003652.td-b3lyp_6-31+g(d).gjf (generated)

012003652.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003652.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003652.mol 012003652.PUBCHEM 012003652.mol (via Jmol)
012003656.b3lyp_6-31g(d).inp

012003656.b3lyp_6-31g(d).qchem.inp (generated)

012003656.b3lyp_6-31g(d).gjf (generated)

012003656.b3lyp_6-31g(d).firefly.inp (generated)

012003656.b3lyp_6-31g(d).smash.inp (generated)

012003656.b3lyp_6-31g(d).nwchem.inp (generated) 012003656.b3lyp_6-31g(d).log.xz 012003656.td-b3lyp_6-31g+(d).inp 012003656.td-b3lyp_6-31g+(d).log.xz

012003656.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003656.td-b3lyp_6-31+g(d).gjf (generated)

012003656.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003656.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003656.mol 012003656.PUBCHEM 012003656.mol (via Jmol)
012003677.b3lyp_6-31g(d).inp

012003677.b3lyp_6-31g(d).qchem.inp (generated)

012003677.b3lyp_6-31g(d).gjf (generated)

012003677.b3lyp_6-31g(d).firefly.inp (generated)

012003677.b3lyp_6-31g(d).smash.inp (generated)

012003677.b3lyp_6-31g(d).nwchem.inp (generated) 012003677.b3lyp_6-31g(d).log.xz 012003677.mol 012003677.PUBCHEM 012003677.mol (via Jmol)
012003691.b3lyp_6-31g(d).inp

012003691.b3lyp_6-31g(d).qchem.inp (generated)

012003691.b3lyp_6-31g(d).gjf (generated)

012003691.b3lyp_6-31g(d).firefly.inp (generated)

012003691.b3lyp_6-31g(d).smash.inp (generated)

012003691.b3lyp_6-31g(d).nwchem.inp (generated) 012003691.b3lyp_6-31g(d).log.xz 012003691.td-b3lyp_6-31g+(d).inp 012003691.td-b3lyp_6-31g+(d).log.xz

012003691.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003691.td-b3lyp_6-31+g(d).gjf (generated)

012003691.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003691.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003691.mol 012003691.PUBCHEM 012003691.mol (via Jmol)
012003692.b3lyp_6-31g(d).inp

012003692.b3lyp_6-31g(d).qchem.inp (generated)

012003692.b3lyp_6-31g(d).gjf (generated)

012003692.b3lyp_6-31g(d).firefly.inp (generated)

012003692.b3lyp_6-31g(d).smash.inp (generated)

012003692.b3lyp_6-31g(d).nwchem.inp (generated) 012003692.b3lyp_6-31g(d).log.xz 012003692.mol 012003692.PUBCHEM 012003692.mol (via Jmol)
012003694.b3lyp_6-31g(d).inp

012003694.b3lyp_6-31g(d).qchem.inp (generated)

012003694.b3lyp_6-31g(d).gjf (generated)

012003694.b3lyp_6-31g(d).firefly.inp (generated)

012003694.b3lyp_6-31g(d).smash.inp (generated)

012003694.b3lyp_6-31g(d).nwchem.inp (generated) 012003694.b3lyp_6-31g(d).log.xz 012003694.mol 012003694.PUBCHEM 012003694.mol (via Jmol)
012003695.b3lyp_6-31g(d).inp

012003695.b3lyp_6-31g(d).qchem.inp (generated)

012003695.b3lyp_6-31g(d).gjf (generated)

012003695.b3lyp_6-31g(d).firefly.inp (generated)

012003695.b3lyp_6-31g(d).smash.inp (generated)

012003695.b3lyp_6-31g(d).nwchem.inp (generated) 012003695.b3lyp_6-31g(d).log.xz 012003695.mol 012003695.PUBCHEM 012003695.mol (via Jmol)
012003696.b3lyp_6-31g(d).inp

012003696.b3lyp_6-31g(d).qchem.inp (generated)

012003696.b3lyp_6-31g(d).gjf (generated)

012003696.b3lyp_6-31g(d).firefly.inp (generated)

012003696.b3lyp_6-31g(d).smash.inp (generated)

012003696.b3lyp_6-31g(d).nwchem.inp (generated) 012003696.b3lyp_6-31g(d).log.xz 012003696.td-b3lyp_6-31g+(d).inp 012003696.td-b3lyp_6-31g+(d).log.xz

012003696.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003696.td-b3lyp_6-31+g(d).gjf (generated)

012003696.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003696.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003696.mol 012003696.PUBCHEM 012003696.mol (via Jmol)
012003697.b3lyp_6-31g(d).inp

012003697.b3lyp_6-31g(d).qchem.inp (generated)

012003697.b3lyp_6-31g(d).gjf (generated)

012003697.b3lyp_6-31g(d).firefly.inp (generated)

012003697.b3lyp_6-31g(d).smash.inp (generated)

012003697.b3lyp_6-31g(d).nwchem.inp (generated) 012003697.b3lyp_6-31g(d).log.xz 012003697.td-b3lyp_6-31g+(d).inp 012003697.td-b3lyp_6-31g+(d).log.xz

012003697.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003697.td-b3lyp_6-31+g(d).gjf (generated)

012003697.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003697.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003697.mol 012003697.PUBCHEM 012003697.mol (via Jmol)
012003755.b3lyp_6-31g(d).inp

012003755.b3lyp_6-31g(d).qchem.inp (generated)

012003755.b3lyp_6-31g(d).gjf (generated)

012003755.b3lyp_6-31g(d).firefly.inp (generated)

012003755.b3lyp_6-31g(d).smash.inp (generated)

012003755.b3lyp_6-31g(d).nwchem.inp (generated) 012003755.b3lyp_6-31g(d).log.xz 012003755.td-b3lyp_6-31g+(d).inp 012003755.td-b3lyp_6-31g+(d).log.xz

012003755.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003755.td-b3lyp_6-31+g(d).gjf (generated)

012003755.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003755.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003755.mol 012003755.PUBCHEM 012003755.mol (via Jmol)
012003757.b3lyp_6-31g(d).inp

012003757.b3lyp_6-31g(d).qchem.inp (generated)

012003757.b3lyp_6-31g(d).gjf (generated)

012003757.b3lyp_6-31g(d).firefly.inp (generated)

012003757.b3lyp_6-31g(d).smash.inp (generated)

012003757.b3lyp_6-31g(d).nwchem.inp (generated) 012003757.b3lyp_6-31g(d).log.xz 012003757.td-b3lyp_6-31g+(d).inp 012003757.td-b3lyp_6-31g+(d).log.xz

012003757.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003757.td-b3lyp_6-31+g(d).gjf (generated)

012003757.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003757.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003757.mol 012003757.PUBCHEM 012003757.mol (via Jmol)
012003768.b3lyp_6-31g(d).inp

012003768.b3lyp_6-31g(d).qchem.inp (generated)

012003768.b3lyp_6-31g(d).gjf (generated)

012003768.b3lyp_6-31g(d).firefly.inp (generated)

012003768.b3lyp_6-31g(d).smash.inp (generated)

012003768.b3lyp_6-31g(d).nwchem.inp (generated) 012003768.b3lyp_6-31g(d).log.xz 012003768.td-b3lyp_6-31g+(d).inp 012003768.td-b3lyp_6-31g+(d).log.xz

012003768.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003768.td-b3lyp_6-31+g(d).gjf (generated)

012003768.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003768.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003768.mol 012003768.PUBCHEM 012003768.mol (via Jmol)
012003769.b3lyp_6-31g(d).inp

012003769.b3lyp_6-31g(d).qchem.inp (generated)

012003769.b3lyp_6-31g(d).gjf (generated)

012003769.b3lyp_6-31g(d).firefly.inp (generated)

012003769.b3lyp_6-31g(d).smash.inp (generated)

012003769.b3lyp_6-31g(d).nwchem.inp (generated) 012003769.b3lyp_6-31g(d).log.xz 012003769.td-b3lyp_6-31g+(d).inp 012003769.td-b3lyp_6-31g+(d).log.xz

012003769.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003769.td-b3lyp_6-31+g(d).gjf (generated)

012003769.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003769.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003769.mol 012003769.PUBCHEM 012003769.mol (via Jmol)
012003770.b3lyp_6-31g(d).inp

012003770.b3lyp_6-31g(d).qchem.inp (generated)

012003770.b3lyp_6-31g(d).gjf (generated)

012003770.b3lyp_6-31g(d).firefly.inp (generated)

012003770.b3lyp_6-31g(d).smash.inp (generated)

012003770.b3lyp_6-31g(d).nwchem.inp (generated) 012003770.b3lyp_6-31g(d).log.xz 012003770.td-b3lyp_6-31g+(d).inp 012003770.td-b3lyp_6-31g+(d).log.xz

012003770.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003770.td-b3lyp_6-31+g(d).gjf (generated)

012003770.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003770.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003770.mol 012003770.PUBCHEM 012003770.mol (via Jmol)
012003835.b3lyp_6-31g(d).inp

012003835.b3lyp_6-31g(d).qchem.inp (generated)

012003835.b3lyp_6-31g(d).gjf (generated)

012003835.b3lyp_6-31g(d).firefly.inp (generated)

012003835.b3lyp_6-31g(d).smash.inp (generated)

012003835.b3lyp_6-31g(d).nwchem.inp (generated) 012003835.b3lyp_6-31g(d).log.xz 012003835.mol 012003835.PUBCHEM 012003835.mol (via Jmol)
012003836.b3lyp_6-31g(d).inp

012003836.b3lyp_6-31g(d).qchem.inp (generated)

012003836.b3lyp_6-31g(d).gjf (generated)

012003836.b3lyp_6-31g(d).firefly.inp (generated)

012003836.b3lyp_6-31g(d).smash.inp (generated)

012003836.b3lyp_6-31g(d).nwchem.inp (generated) 012003836.b3lyp_6-31g(d).log.xz 012003836.td-b3lyp_6-31g+(d).inp 012003836.td-b3lyp_6-31g+(d).log.xz

012003836.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003836.td-b3lyp_6-31+g(d).gjf (generated)

012003836.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003836.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003836.mol 012003836.PUBCHEM 012003836.mol (via Jmol)
012003839.b3lyp_6-31g(d).inp

012003839.b3lyp_6-31g(d).qchem.inp (generated)

012003839.b3lyp_6-31g(d).gjf (generated)

012003839.b3lyp_6-31g(d).firefly.inp (generated)

012003839.b3lyp_6-31g(d).smash.inp (generated)

012003839.b3lyp_6-31g(d).nwchem.inp (generated) 012003839.b3lyp_6-31g(d).log.xz 012003839.td-b3lyp_6-31g+(d).inp 012003839.td-b3lyp_6-31g+(d).log.xz

012003839.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003839.td-b3lyp_6-31+g(d).gjf (generated)

012003839.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003839.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003839.mol 012003839.PUBCHEM 012003839.mol (via Jmol)
012003845.b3lyp_6-31g(d).inp

012003845.b3lyp_6-31g(d).qchem.inp (generated)

012003845.b3lyp_6-31g(d).gjf (generated)

012003845.b3lyp_6-31g(d).firefly.inp (generated)

012003845.b3lyp_6-31g(d).smash.inp (generated)

012003845.b3lyp_6-31g(d).nwchem.inp (generated) 012003845.b3lyp_6-31g(d).log.xz 012003845.mol 012003845.PUBCHEM 012003845.mol (via Jmol)
012003858.b3lyp_6-31g(d).inp

012003858.b3lyp_6-31g(d).qchem.inp (generated)

012003858.b3lyp_6-31g(d).gjf (generated)

012003858.b3lyp_6-31g(d).firefly.inp (generated)

012003858.b3lyp_6-31g(d).smash.inp (generated)

012003858.b3lyp_6-31g(d).nwchem.inp (generated) 012003858.b3lyp_6-31g(d).log.xz 012003858.td-b3lyp_6-31g+(d).inp 012003858.td-b3lyp_6-31g+(d).log.xz

012003858.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003858.td-b3lyp_6-31+g(d).gjf (generated)

012003858.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003858.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003858.mol 012003858.PUBCHEM 012003858.mol (via Jmol)
012003863.b3lyp_6-31g(d).inp

012003863.b3lyp_6-31g(d).qchem.inp (generated)

012003863.b3lyp_6-31g(d).gjf (generated)

012003863.b3lyp_6-31g(d).firefly.inp (generated)

012003863.b3lyp_6-31g(d).smash.inp (generated)

012003863.b3lyp_6-31g(d).nwchem.inp (generated) 012003863.b3lyp_6-31g(d).log.xz 012003863.td-b3lyp_6-31g+(d).inp 012003863.td-b3lyp_6-31g+(d).log.xz

012003863.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003863.td-b3lyp_6-31+g(d).gjf (generated)

012003863.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003863.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003863.mol 012003863.PUBCHEM 012003863.mol (via Jmol)
012003885.b3lyp_6-31g(d).inp

012003885.b3lyp_6-31g(d).qchem.inp (generated)

012003885.b3lyp_6-31g(d).gjf (generated)

012003885.b3lyp_6-31g(d).firefly.inp (generated)

012003885.b3lyp_6-31g(d).smash.inp (generated)

012003885.b3lyp_6-31g(d).nwchem.inp (generated) 012003885.b3lyp_6-31g(d).log.xz 012003885.td-b3lyp_6-31g+(d).inp 012003885.td-b3lyp_6-31g+(d).log.xz

012003885.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003885.td-b3lyp_6-31+g(d).gjf (generated)

012003885.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003885.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003885.mol 012003885.PUBCHEM 012003885.mol (via Jmol)
012003932.b3lyp_6-31g(d).inp

012003932.b3lyp_6-31g(d).qchem.inp (generated)

012003932.b3lyp_6-31g(d).gjf (generated)

012003932.b3lyp_6-31g(d).firefly.inp (generated)

012003932.b3lyp_6-31g(d).smash.inp (generated)

012003932.b3lyp_6-31g(d).nwchem.inp (generated) 012003932.b3lyp_6-31g(d).log.xz 012003932.td-b3lyp_6-31g+(d).inp 012003932.td-b3lyp_6-31g+(d).log.xz

012003932.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003932.td-b3lyp_6-31+g(d).gjf (generated)

012003932.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003932.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003932.mol 012003932.PUBCHEM 012003932.mol (via Jmol)
012003997.b3lyp_6-31g(d).inp

012003997.b3lyp_6-31g(d).qchem.inp (generated)

012003997.b3lyp_6-31g(d).gjf (generated)

012003997.b3lyp_6-31g(d).firefly.inp (generated)

012003997.b3lyp_6-31g(d).smash.inp (generated)

012003997.b3lyp_6-31g(d).nwchem.inp (generated) 012003997.b3lyp_6-31g(d).log.xz 012003997.td-b3lyp_6-31g+(d).inp 012003997.td-b3lyp_6-31g+(d).log.xz

012003997.td-b3lyp_6-31+g(d).qchem.inp (generated)

012003997.td-b3lyp_6-31+g(d).gjf (generated)

012003997.td-b3lyp_6-31+g(d).firefly.inp (generated)

012003997.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012003997.mol 012003997.PUBCHEM 012003997.mol (via Jmol)
012004240.b3lyp_6-31g(d).inp

012004240.b3lyp_6-31g(d).qchem.inp (generated)

012004240.b3lyp_6-31g(d).gjf (generated)

012004240.b3lyp_6-31g(d).firefly.inp (generated)

012004240.b3lyp_6-31g(d).smash.inp (generated)

012004240.b3lyp_6-31g(d).nwchem.inp (generated) 012004240.b3lyp_6-31g(d).log.xz 012004240.td-b3lyp_6-31g+(d).inp 012004240.td-b3lyp_6-31g+(d).log.xz

012004240.td-b3lyp_6-31+g(d).qchem.inp (generated)

012004240.td-b3lyp_6-31+g(d).gjf (generated)

012004240.td-b3lyp_6-31+g(d).firefly.inp (generated)

012004240.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012004240.mol 012004240.PUBCHEM 012004240.mol (via Jmol)
012004285.b3lyp_6-31g(d).inp

012004285.b3lyp_6-31g(d).qchem.inp (generated)

012004285.b3lyp_6-31g(d).gjf (generated)

012004285.b3lyp_6-31g(d).firefly.inp (generated)

012004285.b3lyp_6-31g(d).smash.inp (generated)

012004285.b3lyp_6-31g(d).nwchem.inp (generated) 012004285.b3lyp_6-31g(d).log.xz 012004285.td-b3lyp_6-31g+(d).inp 012004285.td-b3lyp_6-31g+(d).log.xz

012004285.td-b3lyp_6-31+g(d).qchem.inp (generated)

012004285.td-b3lyp_6-31+g(d).gjf (generated)

012004285.td-b3lyp_6-31+g(d).firefly.inp (generated)

012004285.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012004285.mol 012004285.PUBCHEM 012004285.mol (via Jmol)
012004383.b3lyp_6-31g(d).inp

012004383.b3lyp_6-31g(d).qchem.inp (generated)

012004383.b3lyp_6-31g(d).gjf (generated)

012004383.b3lyp_6-31g(d).firefly.inp (generated)

012004383.b3lyp_6-31g(d).smash.inp (generated)

012004383.b3lyp_6-31g(d).nwchem.inp (generated) 012004383.b3lyp_6-31g(d).log.xz 012004383.td-b3lyp_6-31g+(d).inp 012004383.td-b3lyp_6-31g+(d).log.xz

012004383.td-b3lyp_6-31+g(d).qchem.inp (generated)

012004383.td-b3lyp_6-31+g(d).gjf (generated)

012004383.td-b3lyp_6-31+g(d).firefly.inp (generated)

012004383.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012004383.mol 012004383.PUBCHEM 012004383.mol (via Jmol)
012004384.b3lyp_6-31g(d).inp

012004384.b3lyp_6-31g(d).qchem.inp (generated)

012004384.b3lyp_6-31g(d).gjf (generated)

012004384.b3lyp_6-31g(d).firefly.inp (generated)

012004384.b3lyp_6-31g(d).smash.inp (generated)

012004384.b3lyp_6-31g(d).nwchem.inp (generated) 012004384.b3lyp_6-31g(d).log.xz 012004384.td-b3lyp_6-31g+(d).inp 012004384.td-b3lyp_6-31g+(d).log.xz

012004384.td-b3lyp_6-31+g(d).qchem.inp (generated)

012004384.td-b3lyp_6-31+g(d).gjf (generated)

012004384.td-b3lyp_6-31+g(d).firefly.inp (generated)

012004384.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012004384.mol 012004384.PUBCHEM 012004384.mol (via Jmol)
012004656.b3lyp_6-31g(d).inp

012004656.b3lyp_6-31g(d).qchem.inp (generated)

012004656.b3lyp_6-31g(d).gjf (generated)

012004656.b3lyp_6-31g(d).firefly.inp (generated)

012004656.b3lyp_6-31g(d).smash.inp (generated)

012004656.b3lyp_6-31g(d).nwchem.inp (generated) 012004656.b3lyp_6-31g(d).log.xz 012004656.td-b3lyp_6-31g+(d).inp 012004656.td-b3lyp_6-31g+(d).log.xz

012004656.td-b3lyp_6-31+g(d).qchem.inp (generated)

012004656.td-b3lyp_6-31+g(d).gjf (generated)

012004656.td-b3lyp_6-31+g(d).firefly.inp (generated)

012004656.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012004656.mol 012004656.PUBCHEM 012004656.mol (via Jmol)
012004657.b3lyp_6-31g(d).inp

012004657.b3lyp_6-31g(d).qchem.inp (generated)

012004657.b3lyp_6-31g(d).gjf (generated)

012004657.b3lyp_6-31g(d).firefly.inp (generated)

012004657.b3lyp_6-31g(d).smash.inp (generated)

012004657.b3lyp_6-31g(d).nwchem.inp (generated) 012004657.b3lyp_6-31g(d).log.xz 012004657.td-b3lyp_6-31g+(d).inp 012004657.td-b3lyp_6-31g+(d).log.xz

012004657.td-b3lyp_6-31+g(d).qchem.inp (generated)

012004657.td-b3lyp_6-31+g(d).gjf (generated)

012004657.td-b3lyp_6-31+g(d).firefly.inp (generated)

012004657.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012004657.mol 012004657.PUBCHEM 012004657.mol (via Jmol)
012004802.b3lyp_6-31g(d).inp

012004802.b3lyp_6-31g(d).qchem.inp (generated)

012004802.b3lyp_6-31g(d).gjf (generated)

012004802.b3lyp_6-31g(d).firefly.inp (generated)

012004802.b3lyp_6-31g(d).smash.inp (generated)

012004802.b3lyp_6-31g(d).nwchem.inp (generated) 012004802.b3lyp_6-31g(d).log.xz 012004802.mol 012004802.PUBCHEM 012004802.mol (via Jmol)
012005104.b3lyp_6-31g(d).inp

012005104.b3lyp_6-31g(d).qchem.inp (generated)

012005104.b3lyp_6-31g(d).gjf (generated)

012005104.b3lyp_6-31g(d).firefly.inp (generated)

012005104.b3lyp_6-31g(d).smash.inp (generated)

012005104.b3lyp_6-31g(d).nwchem.inp (generated) 012005104.b3lyp_6-31g(d).log.xz 012005104.td-b3lyp_6-31g+(d).inp 012005104.td-b3lyp_6-31g+(d).log.xz

012005104.td-b3lyp_6-31+g(d).qchem.inp (generated)

012005104.td-b3lyp_6-31+g(d).gjf (generated)

012005104.td-b3lyp_6-31+g(d).firefly.inp (generated)

012005104.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012005104.mol 012005104.PUBCHEM 012005104.mol (via Jmol)
012005160.b3lyp_6-31g(d).inp

012005160.b3lyp_6-31g(d).qchem.inp (generated)

012005160.b3lyp_6-31g(d).gjf (generated)

012005160.b3lyp_6-31g(d).firefly.inp (generated)

012005160.b3lyp_6-31g(d).smash.inp (generated)

012005160.b3lyp_6-31g(d).nwchem.inp (generated) 012005160.b3lyp_6-31g(d).log.xz 012005160.td-b3lyp_6-31g+(d).inp 012005160.td-b3lyp_6-31g+(d).log.xz

012005160.td-b3lyp_6-31+g(d).qchem.inp (generated)

012005160.td-b3lyp_6-31+g(d).gjf (generated)

012005160.td-b3lyp_6-31+g(d).firefly.inp (generated)

012005160.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012005160.mol 012005160.PUBCHEM 012005160.mol (via Jmol)
012006277.b3lyp_6-31g(d).inp

012006277.b3lyp_6-31g(d).qchem.inp (generated)

012006277.b3lyp_6-31g(d).gjf (generated)

012006277.b3lyp_6-31g(d).firefly.inp (generated)

012006277.b3lyp_6-31g(d).smash.inp (generated)

012006277.b3lyp_6-31g(d).nwchem.inp (generated) 012006277.b3lyp_6-31g(d).log.xz 012006277.mol 012006277.PUBCHEM 012006277.mol (via Jmol)
012006292.b3lyp_6-31g(d).inp

012006292.b3lyp_6-31g(d).qchem.inp (generated)

012006292.b3lyp_6-31g(d).gjf (generated)

012006292.b3lyp_6-31g(d).firefly.inp (generated)

012006292.b3lyp_6-31g(d).smash.inp (generated)

012006292.b3lyp_6-31g(d).nwchem.inp (generated) 012006292.b3lyp_6-31g(d).log.xz 012006292.td-b3lyp_6-31g+(d).inp 012006292.td-b3lyp_6-31g+(d).log.xz

012006292.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006292.td-b3lyp_6-31+g(d).gjf (generated)

012006292.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006292.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006292.mol 012006292.PUBCHEM 012006292.mol (via Jmol)
012006311.b3lyp_6-31g(d).inp

012006311.b3lyp_6-31g(d).qchem.inp (generated)

012006311.b3lyp_6-31g(d).gjf (generated)

012006311.b3lyp_6-31g(d).firefly.inp (generated)

012006311.b3lyp_6-31g(d).smash.inp (generated)

012006311.b3lyp_6-31g(d).nwchem.inp (generated) 012006311.b3lyp_6-31g(d).log.xz 012006311.mol 012006311.PUBCHEM 012006311.mol (via Jmol)
012006312.b3lyp_6-31g(d).inp

012006312.b3lyp_6-31g(d).qchem.inp (generated)

012006312.b3lyp_6-31g(d).gjf (generated)

012006312.b3lyp_6-31g(d).firefly.inp (generated)

012006312.b3lyp_6-31g(d).smash.inp (generated)

012006312.b3lyp_6-31g(d).nwchem.inp (generated) 012006312.b3lyp_6-31g(d).log.xz 012006312.td-b3lyp_6-31g+(d).inp 012006312.td-b3lyp_6-31g+(d).log.xz

012006312.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006312.td-b3lyp_6-31+g(d).gjf (generated)

012006312.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006312.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006312.mol 012006312.PUBCHEM 012006312.mol (via Jmol)
012006323.b3lyp_6-31g(d).inp

012006323.b3lyp_6-31g(d).qchem.inp (generated)

012006323.b3lyp_6-31g(d).gjf (generated)

012006323.b3lyp_6-31g(d).firefly.inp (generated)

012006323.b3lyp_6-31g(d).smash.inp (generated)

012006323.b3lyp_6-31g(d).nwchem.inp (generated) 012006323.b3lyp_6-31g(d).log.xz 012006323.td-b3lyp_6-31g+(d).inp 012006323.td-b3lyp_6-31g+(d).log.xz

012006323.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006323.td-b3lyp_6-31+g(d).gjf (generated)

012006323.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006323.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006323.mol 012006323.PUBCHEM 012006323.mol (via Jmol)
012006384.b3lyp_6-31g(d).inp

012006384.b3lyp_6-31g(d).qchem.inp (generated)

012006384.b3lyp_6-31g(d).gjf (generated)

012006384.b3lyp_6-31g(d).firefly.inp (generated)

012006384.b3lyp_6-31g(d).smash.inp (generated)

012006384.b3lyp_6-31g(d).nwchem.inp (generated) 012006384.b3lyp_6-31g(d).log.xz 012006384.td-b3lyp_6-31g+(d).inp 012006384.td-b3lyp_6-31g+(d).log.xz

012006384.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006384.td-b3lyp_6-31+g(d).gjf (generated)

012006384.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006384.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006384.mol 012006384.PUBCHEM 012006384.mol (via Jmol)
012006431.b3lyp_6-31g(d).inp

012006431.b3lyp_6-31g(d).qchem.inp (generated)

012006431.b3lyp_6-31g(d).gjf (generated)

012006431.b3lyp_6-31g(d).firefly.inp (generated)

012006431.b3lyp_6-31g(d).smash.inp (generated)

012006431.b3lyp_6-31g(d).nwchem.inp (generated) 012006431.b3lyp_6-31g(d).log.xz 012006431.td-b3lyp_6-31g+(d).inp 012006431.td-b3lyp_6-31g+(d).log.xz

012006431.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006431.td-b3lyp_6-31+g(d).gjf (generated)

012006431.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006431.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006431.mol 012006431.PUBCHEM 012006431.mol (via Jmol)
012006454.b3lyp_6-31g(d).inp

012006454.b3lyp_6-31g(d).qchem.inp (generated)

012006454.b3lyp_6-31g(d).gjf (generated)

012006454.b3lyp_6-31g(d).firefly.inp (generated)

012006454.b3lyp_6-31g(d).smash.inp (generated)

012006454.b3lyp_6-31g(d).nwchem.inp (generated) 012006454.b3lyp_6-31g(d).log.xz 012006454.td-b3lyp_6-31g+(d).inp 012006454.td-b3lyp_6-31g+(d).log.xz

012006454.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006454.td-b3lyp_6-31+g(d).gjf (generated)

012006454.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006454.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006454.mol 012006454.PUBCHEM 012006454.mol (via Jmol)
012006455.b3lyp_6-31g(d).inp

012006455.b3lyp_6-31g(d).qchem.inp (generated)

012006455.b3lyp_6-31g(d).gjf (generated)

012006455.b3lyp_6-31g(d).firefly.inp (generated)

012006455.b3lyp_6-31g(d).smash.inp (generated)

012006455.b3lyp_6-31g(d).nwchem.inp (generated) 012006455.b3lyp_6-31g(d).log.xz 012006455.td-b3lyp_6-31g+(d).inp 012006455.td-b3lyp_6-31g+(d).log.xz

012006455.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006455.td-b3lyp_6-31+g(d).gjf (generated)

012006455.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006455.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006455.mol 012006455.PUBCHEM 012006455.mol (via Jmol)
012006481.b3lyp_6-31g(d).inp

012006481.b3lyp_6-31g(d).qchem.inp (generated)

012006481.b3lyp_6-31g(d).gjf (generated)

012006481.b3lyp_6-31g(d).firefly.inp (generated)

012006481.b3lyp_6-31g(d).smash.inp (generated)

012006481.b3lyp_6-31g(d).nwchem.inp (generated) 012006481.b3lyp_6-31g(d).log.xz 012006481.td-b3lyp_6-31g+(d).inp 012006481.td-b3lyp_6-31g+(d).log.xz

012006481.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006481.td-b3lyp_6-31+g(d).gjf (generated)

012006481.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006481.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006481.mol 012006481.PUBCHEM 012006481.mol (via Jmol)
012006501.b3lyp_6-31g(d).inp

012006501.b3lyp_6-31g(d).qchem.inp (generated)

012006501.b3lyp_6-31g(d).gjf (generated)

012006501.b3lyp_6-31g(d).firefly.inp (generated)

012006501.b3lyp_6-31g(d).smash.inp (generated)

012006501.b3lyp_6-31g(d).nwchem.inp (generated) 012006501.b3lyp_6-31g(d).log.xz 012006501.mol 012006501.PUBCHEM 012006501.mol (via Jmol)
012006526.b3lyp_6-31g(d).inp

012006526.b3lyp_6-31g(d).qchem.inp (generated)

012006526.b3lyp_6-31g(d).gjf (generated)

012006526.b3lyp_6-31g(d).firefly.inp (generated)

012006526.b3lyp_6-31g(d).smash.inp (generated)

012006526.b3lyp_6-31g(d).nwchem.inp (generated) 012006526.b3lyp_6-31g(d).log.xz 012006526.td-b3lyp_6-31g+(d).inp 012006526.td-b3lyp_6-31g+(d).log.xz

012006526.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006526.td-b3lyp_6-31+g(d).gjf (generated)

012006526.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006526.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006526.mol 012006526.PUBCHEM 012006526.mol (via Jmol)
012006527.b3lyp_6-31g(d).inp

012006527.b3lyp_6-31g(d).qchem.inp (generated)

012006527.b3lyp_6-31g(d).gjf (generated)

012006527.b3lyp_6-31g(d).firefly.inp (generated)

012006527.b3lyp_6-31g(d).smash.inp (generated)

012006527.b3lyp_6-31g(d).nwchem.inp (generated) 012006527.b3lyp_6-31g(d).log.xz 012006527.td-b3lyp_6-31g+(d).inp 012006527.td-b3lyp_6-31g+(d).log.xz

012006527.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006527.td-b3lyp_6-31+g(d).gjf (generated)

012006527.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006527.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006527.mol 012006527.PUBCHEM 012006527.mol (via Jmol)
012006540.b3lyp_6-31g(d).inp

012006540.b3lyp_6-31g(d).qchem.inp (generated)

012006540.b3lyp_6-31g(d).gjf (generated)

012006540.b3lyp_6-31g(d).firefly.inp (generated)

012006540.b3lyp_6-31g(d).smash.inp (generated)

012006540.b3lyp_6-31g(d).nwchem.inp (generated) 012006540.b3lyp_6-31g(d).log.xz 012006540.td-b3lyp_6-31g+(d).inp 012006540.td-b3lyp_6-31g+(d).log.xz

012006540.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006540.td-b3lyp_6-31+g(d).gjf (generated)

012006540.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006540.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006540.mol 012006540.PUBCHEM 012006540.mol (via Jmol)
012006551.b3lyp_6-31g(d).inp

012006551.b3lyp_6-31g(d).qchem.inp (generated)

012006551.b3lyp_6-31g(d).gjf (generated)

012006551.b3lyp_6-31g(d).firefly.inp (generated)

012006551.b3lyp_6-31g(d).smash.inp (generated)

012006551.b3lyp_6-31g(d).nwchem.inp (generated) 012006551.b3lyp_6-31g(d).log.xz 012006551.mol 012006551.PUBCHEM 012006551.mol (via Jmol)
012006561.b3lyp_6-31g(d).inp

012006561.b3lyp_6-31g(d).qchem.inp (generated)

012006561.b3lyp_6-31g(d).gjf (generated)

012006561.b3lyp_6-31g(d).firefly.inp (generated)

012006561.b3lyp_6-31g(d).smash.inp (generated)

012006561.b3lyp_6-31g(d).nwchem.inp (generated) 012006561.b3lyp_6-31g(d).log.xz 012006561.mol 012006561.PUBCHEM 012006561.mol (via Jmol)
012006600.b3lyp_6-31g(d).inp

012006600.b3lyp_6-31g(d).qchem.inp (generated)

012006600.b3lyp_6-31g(d).gjf (generated)

012006600.b3lyp_6-31g(d).firefly.inp (generated)

012006600.b3lyp_6-31g(d).smash.inp (generated)

012006600.b3lyp_6-31g(d).nwchem.inp (generated) 012006600.b3lyp_6-31g(d).log.xz 012006600.td-b3lyp_6-31g+(d).inp 012006600.td-b3lyp_6-31g+(d).log.xz

012006600.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006600.td-b3lyp_6-31+g(d).gjf (generated)

012006600.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006600.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006600.mol 012006600.PUBCHEM 012006600.mol (via Jmol)
012006623.b3lyp_6-31g(d).inp

012006623.b3lyp_6-31g(d).qchem.inp (generated)

012006623.b3lyp_6-31g(d).gjf (generated)

012006623.b3lyp_6-31g(d).firefly.inp (generated)

012006623.b3lyp_6-31g(d).smash.inp (generated)

012006623.b3lyp_6-31g(d).nwchem.inp (generated) 012006623.b3lyp_6-31g(d).log.xz 012006623.td-b3lyp_6-31g+(d).inp 012006623.td-b3lyp_6-31g+(d).log.xz

012006623.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006623.td-b3lyp_6-31+g(d).gjf (generated)

012006623.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006623.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006623.mol 012006623.PUBCHEM 012006623.mol (via Jmol)
012006629.b3lyp_6-31g(d).inp

012006629.b3lyp_6-31g(d).qchem.inp (generated)

012006629.b3lyp_6-31g(d).gjf (generated)

012006629.b3lyp_6-31g(d).firefly.inp (generated)

012006629.b3lyp_6-31g(d).smash.inp (generated)

012006629.b3lyp_6-31g(d).nwchem.inp (generated) 012006629.b3lyp_6-31g(d).log.xz 012006629.td-b3lyp_6-31g+(d).inp 012006629.td-b3lyp_6-31g+(d).log.xz

012006629.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006629.td-b3lyp_6-31+g(d).gjf (generated)

012006629.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006629.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006629.mol 012006629.PUBCHEM 012006629.mol (via Jmol)
012006630.b3lyp_6-31g(d).inp

012006630.b3lyp_6-31g(d).qchem.inp (generated)

012006630.b3lyp_6-31g(d).gjf (generated)

012006630.b3lyp_6-31g(d).firefly.inp (generated)

012006630.b3lyp_6-31g(d).smash.inp (generated)

012006630.b3lyp_6-31g(d).nwchem.inp (generated) 012006630.b3lyp_6-31g(d).log.xz 012006630.mol 012006630.PUBCHEM 012006630.mol (via Jmol)
012006670.b3lyp_6-31g(d).inp

012006670.b3lyp_6-31g(d).qchem.inp (generated)

012006670.b3lyp_6-31g(d).gjf (generated)

012006670.b3lyp_6-31g(d).firefly.inp (generated)

012006670.b3lyp_6-31g(d).smash.inp (generated)

012006670.b3lyp_6-31g(d).nwchem.inp (generated) 012006670.b3lyp_6-31g(d).log.xz 012006670.td-b3lyp_6-31g+(d).inp 012006670.td-b3lyp_6-31g+(d).log.xz

012006670.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006670.td-b3lyp_6-31+g(d).gjf (generated)

012006670.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006670.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006670.mol 012006670.PUBCHEM 012006670.mol (via Jmol)
012006681.b3lyp_6-31g(d).inp

012006681.b3lyp_6-31g(d).qchem.inp (generated)

012006681.b3lyp_6-31g(d).gjf (generated)

012006681.b3lyp_6-31g(d).firefly.inp (generated)

012006681.b3lyp_6-31g(d).smash.inp (generated)

012006681.b3lyp_6-31g(d).nwchem.inp (generated) 012006681.b3lyp_6-31g(d).log.xz 012006681.mol 012006681.PUBCHEM 012006681.mol (via Jmol)
012006682.b3lyp_6-31g(d).inp

012006682.b3lyp_6-31g(d).qchem.inp (generated)

012006682.b3lyp_6-31g(d).gjf (generated)

012006682.b3lyp_6-31g(d).firefly.inp (generated)

012006682.b3lyp_6-31g(d).smash.inp (generated)

012006682.b3lyp_6-31g(d).nwchem.inp (generated) 012006682.b3lyp_6-31g(d).log.xz 012006682.mol 012006682.PUBCHEM 012006682.mol (via Jmol)
012006728.b3lyp_6-31g(d).inp

012006728.b3lyp_6-31g(d).qchem.inp (generated)

012006728.b3lyp_6-31g(d).gjf (generated)

012006728.b3lyp_6-31g(d).firefly.inp (generated)

012006728.b3lyp_6-31g(d).smash.inp (generated)

012006728.b3lyp_6-31g(d).nwchem.inp (generated) 012006728.b3lyp_6-31g(d).log.xz 012006728.td-b3lyp_6-31g+(d).inp 012006728.td-b3lyp_6-31g+(d).log.xz

012006728.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006728.td-b3lyp_6-31+g(d).gjf (generated)

012006728.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006728.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006728.mol 012006728.PUBCHEM 012006728.mol (via Jmol)
012006729.b3lyp_6-31g(d).inp

012006729.b3lyp_6-31g(d).qchem.inp (generated)

012006729.b3lyp_6-31g(d).gjf (generated)

012006729.b3lyp_6-31g(d).firefly.inp (generated)

012006729.b3lyp_6-31g(d).smash.inp (generated)

012006729.b3lyp_6-31g(d).nwchem.inp (generated) 012006729.b3lyp_6-31g(d).log.xz 012006729.td-b3lyp_6-31g+(d).inp 012006729.td-b3lyp_6-31g+(d).log.xz

012006729.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006729.td-b3lyp_6-31+g(d).gjf (generated)

012006729.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006729.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006729.mol 012006729.PUBCHEM 012006729.mol (via Jmol)
012006730.b3lyp_6-31g(d).inp

012006730.b3lyp_6-31g(d).qchem.inp (generated)

012006730.b3lyp_6-31g(d).gjf (generated)

012006730.b3lyp_6-31g(d).firefly.inp (generated)

012006730.b3lyp_6-31g(d).smash.inp (generated)

012006730.b3lyp_6-31g(d).nwchem.inp (generated) 012006730.b3lyp_6-31g(d).log.xz 012006730.td-b3lyp_6-31g+(d).inp 012006730.td-b3lyp_6-31g+(d).log.xz

012006730.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006730.td-b3lyp_6-31+g(d).gjf (generated)

012006730.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006730.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006730.mol 012006730.PUBCHEM 012006730.mol (via Jmol)
012006733.b3lyp_6-31g(d).inp

012006733.b3lyp_6-31g(d).qchem.inp (generated)

012006733.b3lyp_6-31g(d).gjf (generated)

012006733.b3lyp_6-31g(d).firefly.inp (generated)

012006733.b3lyp_6-31g(d).smash.inp (generated)

012006733.b3lyp_6-31g(d).nwchem.inp (generated) 012006733.b3lyp_6-31g(d).log.xz 012006733.td-b3lyp_6-31g+(d).inp 012006733.td-b3lyp_6-31g+(d).log.xz

012006733.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006733.td-b3lyp_6-31+g(d).gjf (generated)

012006733.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006733.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006733.mol 012006733.PUBCHEM 012006733.mol (via Jmol)
012006734.b3lyp_6-31g(d).inp

012006734.b3lyp_6-31g(d).qchem.inp (generated)

012006734.b3lyp_6-31g(d).gjf (generated)

012006734.b3lyp_6-31g(d).firefly.inp (generated)

012006734.b3lyp_6-31g(d).smash.inp (generated)

012006734.b3lyp_6-31g(d).nwchem.inp (generated) 012006734.b3lyp_6-31g(d).log.xz 012006734.mol 012006734.PUBCHEM 012006734.mol (via Jmol)
012006771.b3lyp_6-31g(d).inp

012006771.b3lyp_6-31g(d).qchem.inp (generated)

012006771.b3lyp_6-31g(d).gjf (generated)

012006771.b3lyp_6-31g(d).firefly.inp (generated)

012006771.b3lyp_6-31g(d).smash.inp (generated)

012006771.b3lyp_6-31g(d).nwchem.inp (generated) 012006771.b3lyp_6-31g(d).log.xz 012006771.td-b3lyp_6-31g+(d).inp 012006771.td-b3lyp_6-31g+(d).log.xz

012006771.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006771.td-b3lyp_6-31+g(d).gjf (generated)

012006771.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006771.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006771.mol 012006771.PUBCHEM 012006771.mol (via Jmol)
012006793.b3lyp_6-31g(d).inp

012006793.b3lyp_6-31g(d).qchem.inp (generated)

012006793.b3lyp_6-31g(d).gjf (generated)

012006793.b3lyp_6-31g(d).firefly.inp (generated)

012006793.b3lyp_6-31g(d).smash.inp (generated)

012006793.b3lyp_6-31g(d).nwchem.inp (generated) 012006793.b3lyp_6-31g(d).log.xz 012006793.td-b3lyp_6-31g+(d).inp 012006793.td-b3lyp_6-31g+(d).log.xz

012006793.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006793.td-b3lyp_6-31+g(d).gjf (generated)

012006793.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006793.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006793.mol 012006793.PUBCHEM 012006793.mol (via Jmol)
012006801.b3lyp_6-31g(d).inp

012006801.b3lyp_6-31g(d).qchem.inp (generated)

012006801.b3lyp_6-31g(d).gjf (generated)

012006801.b3lyp_6-31g(d).firefly.inp (generated)

012006801.b3lyp_6-31g(d).smash.inp (generated)

012006801.b3lyp_6-31g(d).nwchem.inp (generated) 012006801.b3lyp_6-31g(d).log.xz 012006801.td-b3lyp_6-31g+(d).inp 012006801.td-b3lyp_6-31g+(d).log.xz

012006801.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006801.td-b3lyp_6-31+g(d).gjf (generated)

012006801.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006801.mol 012006801.PUBCHEM 012006801.mol (via Jmol)
012006839.b3lyp_6-31g(d).inp

012006839.b3lyp_6-31g(d).qchem.inp (generated)

012006839.b3lyp_6-31g(d).gjf (generated)

012006839.b3lyp_6-31g(d).firefly.inp (generated)

012006839.b3lyp_6-31g(d).smash.inp (generated)

012006839.b3lyp_6-31g(d).nwchem.inp (generated) 012006839.b3lyp_6-31g(d).log.xz 012006839.td-b3lyp_6-31g+(d).inp 012006839.td-b3lyp_6-31g+(d).log.xz

012006839.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006839.td-b3lyp_6-31+g(d).gjf (generated)

012006839.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006839.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006839.mol 012006839.PUBCHEM 012006839.mol (via Jmol)
012006882.b3lyp_6-31g(d).inp

012006882.b3lyp_6-31g(d).qchem.inp (generated)

012006882.b3lyp_6-31g(d).gjf (generated)

012006882.b3lyp_6-31g(d).firefly.inp (generated)

012006882.b3lyp_6-31g(d).smash.inp (generated)

012006882.b3lyp_6-31g(d).nwchem.inp (generated) 012006882.b3lyp_6-31g(d).log.xz 012006882.td-b3lyp_6-31g+(d).inp 012006882.td-b3lyp_6-31g+(d).log.xz

012006882.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006882.td-b3lyp_6-31+g(d).gjf (generated)

012006882.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006882.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006882.mol 012006882.PUBCHEM 012006882.mol (via Jmol)
012006894.b3lyp_6-31g(d).inp

012006894.b3lyp_6-31g(d).qchem.inp (generated)

012006894.b3lyp_6-31g(d).gjf (generated)

012006894.b3lyp_6-31g(d).firefly.inp (generated)

012006894.b3lyp_6-31g(d).smash.inp (generated)

012006894.b3lyp_6-31g(d).nwchem.inp (generated) 012006894.b3lyp_6-31g(d).log.xz 012006894.td-b3lyp_6-31g+(d).inp 012006894.td-b3lyp_6-31g+(d).log.xz

012006894.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006894.td-b3lyp_6-31+g(d).gjf (generated)

012006894.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006894.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006894.mol 012006894.PUBCHEM 012006894.mol (via Jmol)
012006902.b3lyp_6-31g(d).inp

012006902.b3lyp_6-31g(d).qchem.inp (generated)

012006902.b3lyp_6-31g(d).gjf (generated)

012006902.b3lyp_6-31g(d).firefly.inp (generated)

012006902.b3lyp_6-31g(d).smash.inp (generated)

012006902.b3lyp_6-31g(d).nwchem.inp (generated) 012006902.b3lyp_6-31g(d).log.xz 012006902.td-b3lyp_6-31g+(d).inp 012006902.td-b3lyp_6-31g+(d).log.xz

012006902.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006902.td-b3lyp_6-31+g(d).gjf (generated)

012006902.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006902.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006902.mol 012006902.PUBCHEM 012006902.mol (via Jmol)
012006956.b3lyp_6-31g(d).inp

012006956.b3lyp_6-31g(d).qchem.inp (generated)

012006956.b3lyp_6-31g(d).gjf (generated)

012006956.b3lyp_6-31g(d).firefly.inp (generated)

012006956.b3lyp_6-31g(d).smash.inp (generated)

012006956.b3lyp_6-31g(d).nwchem.inp (generated) 012006956.b3lyp_6-31g(d).log.xz 012006956.td-b3lyp_6-31g+(d).inp 012006956.td-b3lyp_6-31g+(d).log.xz

012006956.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006956.td-b3lyp_6-31+g(d).gjf (generated)

012006956.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006956.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006956.mol 012006956.PUBCHEM 012006956.mol (via Jmol)
012006974.b3lyp_6-31g(d).inp

012006974.b3lyp_6-31g(d).qchem.inp (generated)

012006974.b3lyp_6-31g(d).gjf (generated)

012006974.b3lyp_6-31g(d).firefly.inp (generated)

012006974.b3lyp_6-31g(d).smash.inp (generated)

012006974.b3lyp_6-31g(d).nwchem.inp (generated) 012006974.b3lyp_6-31g(d).log.xz 012006974.td-b3lyp_6-31g+(d).inp 012006974.td-b3lyp_6-31g+(d).log.xz

012006974.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006974.td-b3lyp_6-31+g(d).gjf (generated)

012006974.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006974.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006974.mol 012006974.PUBCHEM 012006974.mol (via Jmol)
012006988.b3lyp_6-31g(d).inp

012006988.b3lyp_6-31g(d).qchem.inp (generated)

012006988.b3lyp_6-31g(d).gjf (generated)

012006988.b3lyp_6-31g(d).firefly.inp (generated)

012006988.b3lyp_6-31g(d).smash.inp (generated)

012006988.b3lyp_6-31g(d).nwchem.inp (generated) 012006988.b3lyp_6-31g(d).log.xz 012006988.td-b3lyp_6-31g+(d).inp 012006988.td-b3lyp_6-31g+(d).log.xz

012006988.td-b3lyp_6-31+g(d).qchem.inp (generated)

012006988.td-b3lyp_6-31+g(d).gjf (generated)

012006988.td-b3lyp_6-31+g(d).firefly.inp (generated)

012006988.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012006988.mol 012006988.PUBCHEM 012006988.mol (via Jmol)
012007023.b3lyp_6-31g(d).inp

012007023.b3lyp_6-31g(d).qchem.inp (generated)

012007023.b3lyp_6-31g(d).gjf (generated)

012007023.b3lyp_6-31g(d).firefly.inp (generated)

012007023.b3lyp_6-31g(d).smash.inp (generated)

012007023.b3lyp_6-31g(d).nwchem.inp (generated) 012007023.b3lyp_6-31g(d).log.xz 012007023.td-b3lyp_6-31g+(d).inp 012007023.td-b3lyp_6-31g+(d).log.xz

012007023.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007023.td-b3lyp_6-31+g(d).gjf (generated)

012007023.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007023.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007023.mol 012007023.PUBCHEM 012007023.mol (via Jmol)
012007026.b3lyp_6-31g(d).inp

012007026.b3lyp_6-31g(d).qchem.inp (generated)

012007026.b3lyp_6-31g(d).gjf (generated)

012007026.b3lyp_6-31g(d).firefly.inp (generated)

012007026.b3lyp_6-31g(d).smash.inp (generated)

012007026.b3lyp_6-31g(d).nwchem.inp (generated) 012007026.b3lyp_6-31g(d).log.xz 012007026.td-b3lyp_6-31g+(d).inp 012007026.td-b3lyp_6-31g+(d).log.xz

012007026.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007026.td-b3lyp_6-31+g(d).gjf (generated)

012007026.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007026.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007026.mol 012007026.PUBCHEM 012007026.mol (via Jmol)
012007029.b3lyp_6-31g(d).inp

012007029.b3lyp_6-31g(d).qchem.inp (generated)

012007029.b3lyp_6-31g(d).gjf (generated)

012007029.b3lyp_6-31g(d).firefly.inp (generated)

012007029.b3lyp_6-31g(d).smash.inp (generated)

012007029.b3lyp_6-31g(d).nwchem.inp (generated) 012007029.b3lyp_6-31g(d).log.xz 012007029.td-b3lyp_6-31g+(d).inp 012007029.td-b3lyp_6-31g+(d).log.xz

012007029.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007029.td-b3lyp_6-31+g(d).gjf (generated)

012007029.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007029.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007029.mol 012007029.PUBCHEM 012007029.mol (via Jmol)
012007031.b3lyp_6-31g(d).inp

012007031.b3lyp_6-31g(d).qchem.inp (generated)

012007031.b3lyp_6-31g(d).gjf (generated)

012007031.b3lyp_6-31g(d).firefly.inp (generated)

012007031.b3lyp_6-31g(d).smash.inp (generated)

012007031.b3lyp_6-31g(d).nwchem.inp (generated) 012007031.b3lyp_6-31g(d).log.xz 012007031.td-b3lyp_6-31g+(d).inp 012007031.td-b3lyp_6-31g+(d).log.xz

012007031.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007031.td-b3lyp_6-31+g(d).gjf (generated)

012007031.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007031.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007031.mol 012007031.PUBCHEM 012007031.mol (via Jmol)
012007033.b3lyp_6-31g(d).inp

012007033.b3lyp_6-31g(d).qchem.inp (generated)

012007033.b3lyp_6-31g(d).gjf (generated)

012007033.b3lyp_6-31g(d).firefly.inp (generated)

012007033.b3lyp_6-31g(d).smash.inp (generated)

012007033.b3lyp_6-31g(d).nwchem.inp (generated) 012007033.b3lyp_6-31g(d).log.xz 012007033.td-b3lyp_6-31g+(d).inp 012007033.td-b3lyp_6-31g+(d).log.xz

012007033.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007033.td-b3lyp_6-31+g(d).gjf (generated)

012007033.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007033.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007033.mol 012007033.PUBCHEM 012007033.mol (via Jmol)
012007034.b3lyp_6-31g(d).inp

012007034.b3lyp_6-31g(d).qchem.inp (generated)

012007034.b3lyp_6-31g(d).gjf (generated)

012007034.b3lyp_6-31g(d).firefly.inp (generated)

012007034.b3lyp_6-31g(d).smash.inp (generated)

012007034.b3lyp_6-31g(d).nwchem.inp (generated) 012007034.b3lyp_6-31g(d).log.xz 012007034.td-b3lyp_6-31g+(d).inp 012007034.td-b3lyp_6-31g+(d).log.xz

012007034.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007034.td-b3lyp_6-31+g(d).gjf (generated)

012007034.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007034.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007034.mol 012007034.PUBCHEM 012007034.mol (via Jmol)
012007035.b3lyp_6-31g(d).inp

012007035.b3lyp_6-31g(d).qchem.inp (generated)

012007035.b3lyp_6-31g(d).gjf (generated)

012007035.b3lyp_6-31g(d).firefly.inp (generated)

012007035.b3lyp_6-31g(d).smash.inp (generated)

012007035.b3lyp_6-31g(d).nwchem.inp (generated) 012007035.b3lyp_6-31g(d).log.xz 012007035.td-b3lyp_6-31g+(d).inp 012007035.td-b3lyp_6-31g+(d).log.xz

012007035.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007035.td-b3lyp_6-31+g(d).gjf (generated)

012007035.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007035.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007035.mol 012007035.PUBCHEM 012007035.mol (via Jmol)
012007040.b3lyp_6-31g(d).inp

012007040.b3lyp_6-31g(d).qchem.inp (generated)

012007040.b3lyp_6-31g(d).gjf (generated)

012007040.b3lyp_6-31g(d).firefly.inp (generated)

012007040.b3lyp_6-31g(d).smash.inp (generated)

012007040.b3lyp_6-31g(d).nwchem.inp (generated) 012007040.b3lyp_6-31g(d).log.xz 012007040.td-b3lyp_6-31g+(d).inp 012007040.td-b3lyp_6-31g+(d).log.xz

012007040.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007040.td-b3lyp_6-31+g(d).gjf (generated)

012007040.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007040.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007040.mol 012007040.PUBCHEM 012007040.mol (via Jmol)
012007042.b3lyp_6-31g(d).inp

012007042.b3lyp_6-31g(d).qchem.inp (generated)

012007042.b3lyp_6-31g(d).gjf (generated)

012007042.b3lyp_6-31g(d).firefly.inp (generated)

012007042.b3lyp_6-31g(d).smash.inp (generated)

012007042.b3lyp_6-31g(d).nwchem.inp (generated) 012007042.b3lyp_6-31g(d).log.xz 012007042.td-b3lyp_6-31g+(d).inp 012007042.td-b3lyp_6-31g+(d).log.xz

012007042.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007042.td-b3lyp_6-31+g(d).gjf (generated)

012007042.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007042.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007042.mol 012007042.PUBCHEM 012007042.mol (via Jmol)
012007045.b3lyp_6-31g(d).inp

012007045.b3lyp_6-31g(d).qchem.inp (generated)

012007045.b3lyp_6-31g(d).gjf (generated)

012007045.b3lyp_6-31g(d).firefly.inp (generated)

012007045.b3lyp_6-31g(d).smash.inp (generated)

012007045.b3lyp_6-31g(d).nwchem.inp (generated) 012007045.b3lyp_6-31g(d).log.xz 012007045.td-b3lyp_6-31g+(d).inp 012007045.td-b3lyp_6-31g+(d).log.xz

012007045.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007045.td-b3lyp_6-31+g(d).gjf (generated)

012007045.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007045.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007045.mol 012007045.PUBCHEM 012007045.mol (via Jmol)
012007118.b3lyp_6-31g(d).inp

012007118.b3lyp_6-31g(d).qchem.inp (generated)

012007118.b3lyp_6-31g(d).gjf (generated)

012007118.b3lyp_6-31g(d).firefly.inp (generated)

012007118.b3lyp_6-31g(d).smash.inp (generated)

012007118.b3lyp_6-31g(d).nwchem.inp (generated) 012007118.b3lyp_6-31g(d).log.xz 012007118.td-b3lyp_6-31g+(d).inp 012007118.td-b3lyp_6-31g+(d).log.xz

012007118.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007118.td-b3lyp_6-31+g(d).gjf (generated)

012007118.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007118.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007118.mol 012007118.PUBCHEM 012007118.mol (via Jmol)
012007124.b3lyp_6-31g(d).inp

012007124.b3lyp_6-31g(d).qchem.inp (generated)

012007124.b3lyp_6-31g(d).gjf (generated)

012007124.b3lyp_6-31g(d).firefly.inp (generated)

012007124.b3lyp_6-31g(d).smash.inp (generated)

012007124.b3lyp_6-31g(d).nwchem.inp (generated) 012007124.b3lyp_6-31g(d).log.xz 012007124.mol 012007124.PUBCHEM 012007124.mol (via Jmol)
012007125.b3lyp_6-31g(d).inp

012007125.b3lyp_6-31g(d).qchem.inp (generated)

012007125.b3lyp_6-31g(d).gjf (generated)

012007125.b3lyp_6-31g(d).firefly.inp (generated)

012007125.b3lyp_6-31g(d).smash.inp (generated)

012007125.b3lyp_6-31g(d).nwchem.inp (generated) 012007125.b3lyp_6-31g(d).log.xz 012007125.td-b3lyp_6-31g+(d).inp 012007125.td-b3lyp_6-31g+(d).log.xz

012007125.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007125.td-b3lyp_6-31+g(d).gjf (generated)

012007125.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007125.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007125.mol 012007125.PUBCHEM 012007125.mol (via Jmol)
012007126.b3lyp_6-31g(d).inp

012007126.b3lyp_6-31g(d).qchem.inp (generated)

012007126.b3lyp_6-31g(d).gjf (generated)

012007126.b3lyp_6-31g(d).firefly.inp (generated)

012007126.b3lyp_6-31g(d).smash.inp (generated)

012007126.b3lyp_6-31g(d).nwchem.inp (generated) 012007126.b3lyp_6-31g(d).log.xz 012007126.td-b3lyp_6-31g+(d).inp 012007126.td-b3lyp_6-31g+(d).log.xz

012007126.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007126.td-b3lyp_6-31+g(d).gjf (generated)

012007126.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007126.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007126.mol 012007126.PUBCHEM 012007126.mol (via Jmol)
012007127.b3lyp_6-31g(d).inp

012007127.b3lyp_6-31g(d).qchem.inp (generated)

012007127.b3lyp_6-31g(d).gjf (generated)

012007127.b3lyp_6-31g(d).firefly.inp (generated)

012007127.b3lyp_6-31g(d).smash.inp (generated)

012007127.b3lyp_6-31g(d).nwchem.inp (generated) 012007127.b3lyp_6-31g(d).log.xz 012007127.td-b3lyp_6-31g+(d).inp 012007127.td-b3lyp_6-31g+(d).log.xz

012007127.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007127.td-b3lyp_6-31+g(d).gjf (generated)

012007127.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007127.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007127.mol 012007127.PUBCHEM 012007127.mol (via Jmol)
012007129.b3lyp_6-31g(d).inp

012007129.b3lyp_6-31g(d).qchem.inp (generated)

012007129.b3lyp_6-31g(d).gjf (generated)

012007129.b3lyp_6-31g(d).firefly.inp (generated)

012007129.b3lyp_6-31g(d).smash.inp (generated)

012007129.b3lyp_6-31g(d).nwchem.inp (generated) 012007129.b3lyp_6-31g(d).log.xz 012007129.td-b3lyp_6-31g+(d).inp 012007129.td-b3lyp_6-31g+(d).log.xz

012007129.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007129.td-b3lyp_6-31+g(d).gjf (generated)

012007129.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007129.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007129.mol 012007129.PUBCHEM 012007129.mol (via Jmol)
012007134.b3lyp_6-31g(d).inp

012007134.b3lyp_6-31g(d).qchem.inp (generated)

012007134.b3lyp_6-31g(d).gjf (generated)

012007134.b3lyp_6-31g(d).firefly.inp (generated)

012007134.b3lyp_6-31g(d).smash.inp (generated)

012007134.b3lyp_6-31g(d).nwchem.inp (generated) 012007134.b3lyp_6-31g(d).log.xz 012007134.td-b3lyp_6-31g+(d).inp 012007134.td-b3lyp_6-31g+(d).log.xz

012007134.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007134.td-b3lyp_6-31+g(d).gjf (generated)

012007134.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007134.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007134.mol 012007134.PUBCHEM 012007134.mol (via Jmol)
012007139.b3lyp_6-31g(d).inp

012007139.b3lyp_6-31g(d).qchem.inp (generated)

012007139.b3lyp_6-31g(d).gjf (generated)

012007139.b3lyp_6-31g(d).firefly.inp (generated)

012007139.b3lyp_6-31g(d).smash.inp (generated)

012007139.b3lyp_6-31g(d).nwchem.inp (generated) 012007139.b3lyp_6-31g(d).log.xz 012007139.mol 012007139.PUBCHEM 012007139.mol (via Jmol)
012007171.b3lyp_6-31g(d).inp

012007171.b3lyp_6-31g(d).qchem.inp (generated)

012007171.b3lyp_6-31g(d).gjf (generated)

012007171.b3lyp_6-31g(d).firefly.inp (generated)

012007171.b3lyp_6-31g(d).smash.inp (generated)

012007171.b3lyp_6-31g(d).nwchem.inp (generated) 012007171.b3lyp_6-31g(d).log.xz 012007171.td-b3lyp_6-31g+(d).inp 012007171.td-b3lyp_6-31g+(d).log.xz

012007171.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007171.td-b3lyp_6-31+g(d).gjf (generated)

012007171.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007171.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007171.mol 012007171.PUBCHEM 012007171.mol (via Jmol)
012007172.b3lyp_6-31g(d).inp

012007172.b3lyp_6-31g(d).qchem.inp (generated)

012007172.b3lyp_6-31g(d).gjf (generated)

012007172.b3lyp_6-31g(d).firefly.inp (generated)

012007172.b3lyp_6-31g(d).smash.inp (generated)

012007172.b3lyp_6-31g(d).nwchem.inp (generated) 012007172.b3lyp_6-31g(d).log.xz 012007172.td-b3lyp_6-31g+(d).inp 012007172.td-b3lyp_6-31g+(d).log.xz

012007172.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007172.td-b3lyp_6-31+g(d).gjf (generated)

012007172.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007172.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007172.mol 012007172.PUBCHEM 012007172.mol (via Jmol)
012007182.b3lyp_6-31g(d).inp

012007182.b3lyp_6-31g(d).qchem.inp (generated)

012007182.b3lyp_6-31g(d).gjf (generated)

012007182.b3lyp_6-31g(d).firefly.inp (generated)

012007182.b3lyp_6-31g(d).smash.inp (generated)

012007182.b3lyp_6-31g(d).nwchem.inp (generated) 012007182.b3lyp_6-31g(d).log.xz 012007182.td-b3lyp_6-31g+(d).inp 012007182.td-b3lyp_6-31g+(d).log.xz

012007182.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007182.td-b3lyp_6-31+g(d).gjf (generated)

012007182.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007182.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007182.mol 012007182.PUBCHEM 012007182.mol (via Jmol)
012007183.b3lyp_6-31g(d).inp

012007183.b3lyp_6-31g(d).qchem.inp (generated)

012007183.b3lyp_6-31g(d).gjf (generated)

012007183.b3lyp_6-31g(d).firefly.inp (generated)

012007183.b3lyp_6-31g(d).smash.inp (generated)

012007183.b3lyp_6-31g(d).nwchem.inp (generated) 012007183.b3lyp_6-31g(d).log.xz 012007183.td-b3lyp_6-31g+(d).inp 012007183.td-b3lyp_6-31g+(d).log.xz

012007183.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007183.td-b3lyp_6-31+g(d).gjf (generated)

012007183.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007183.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007183.mol 012007183.PUBCHEM 012007183.mol (via Jmol)
012007184.b3lyp_6-31g(d).inp

012007184.b3lyp_6-31g(d).qchem.inp (generated)

012007184.b3lyp_6-31g(d).gjf (generated)

012007184.b3lyp_6-31g(d).firefly.inp (generated)

012007184.b3lyp_6-31g(d).smash.inp (generated)

012007184.b3lyp_6-31g(d).nwchem.inp (generated) 012007184.b3lyp_6-31g(d).log.xz 012007184.td-b3lyp_6-31g+(d).inp 012007184.td-b3lyp_6-31g+(d).log.xz

012007184.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007184.td-b3lyp_6-31+g(d).gjf (generated)

012007184.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007184.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007184.mol 012007184.PUBCHEM 012007184.mol (via Jmol)
012007203.b3lyp_6-31g(d).inp

012007203.b3lyp_6-31g(d).qchem.inp (generated)

012007203.b3lyp_6-31g(d).gjf (generated)

012007203.b3lyp_6-31g(d).firefly.inp (generated)

012007203.b3lyp_6-31g(d).smash.inp (generated)

012007203.b3lyp_6-31g(d).nwchem.inp (generated) 012007203.b3lyp_6-31g(d).log.xz 012007203.td-b3lyp_6-31g+(d).inp 012007203.td-b3lyp_6-31g+(d).log.xz

012007203.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007203.td-b3lyp_6-31+g(d).gjf (generated)

012007203.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007203.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007203.mol 012007203.PUBCHEM 012007203.mol (via Jmol)
012007204.b3lyp_6-31g(d).inp

012007204.b3lyp_6-31g(d).qchem.inp (generated)

012007204.b3lyp_6-31g(d).gjf (generated)

012007204.b3lyp_6-31g(d).firefly.inp (generated)

012007204.b3lyp_6-31g(d).smash.inp (generated)

012007204.b3lyp_6-31g(d).nwchem.inp (generated) 012007204.b3lyp_6-31g(d).log.xz 012007204.td-b3lyp_6-31g+(d).inp 012007204.td-b3lyp_6-31g+(d).log.xz

012007204.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007204.td-b3lyp_6-31+g(d).gjf (generated)

012007204.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007204.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007204.mol 012007204.PUBCHEM 012007204.mol (via Jmol)
012007210.b3lyp_6-31g(d).inp

012007210.b3lyp_6-31g(d).qchem.inp (generated)

012007210.b3lyp_6-31g(d).gjf (generated)

012007210.b3lyp_6-31g(d).firefly.inp (generated)

012007210.b3lyp_6-31g(d).smash.inp (generated)

012007210.b3lyp_6-31g(d).nwchem.inp (generated) 012007210.b3lyp_6-31g(d).log.xz 012007210.td-b3lyp_6-31g+(d).inp 012007210.td-b3lyp_6-31g+(d).log.xz

012007210.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007210.td-b3lyp_6-31+g(d).gjf (generated)

012007210.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007210.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007210.mol 012007210.PUBCHEM 012007210.mol (via Jmol)
012007212.b3lyp_6-31g(d).inp

012007212.b3lyp_6-31g(d).qchem.inp (generated)

012007212.b3lyp_6-31g(d).gjf (generated)

012007212.b3lyp_6-31g(d).firefly.inp (generated)

012007212.b3lyp_6-31g(d).smash.inp (generated)

012007212.b3lyp_6-31g(d).nwchem.inp (generated) 012007212.b3lyp_6-31g(d).log.xz 012007212.td-b3lyp_6-31g+(d).inp 012007212.td-b3lyp_6-31g+(d).log.xz

012007212.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007212.td-b3lyp_6-31+g(d).gjf (generated)

012007212.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007212.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007212.mol 012007212.PUBCHEM 012007212.mol (via Jmol)
012007219.b3lyp_6-31g(d).inp

012007219.b3lyp_6-31g(d).qchem.inp (generated)

012007219.b3lyp_6-31g(d).gjf (generated)

012007219.b3lyp_6-31g(d).firefly.inp (generated)

012007219.b3lyp_6-31g(d).smash.inp (generated)

012007219.b3lyp_6-31g(d).nwchem.inp (generated) 012007219.b3lyp_6-31g(d).log.xz 012007219.td-b3lyp_6-31g+(d).inp 012007219.td-b3lyp_6-31g+(d).log.xz

012007219.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007219.td-b3lyp_6-31+g(d).gjf (generated)

012007219.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007219.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007219.mol 012007219.PUBCHEM 012007219.mol (via Jmol)
012007234.b3lyp_6-31g(d).inp

012007234.b3lyp_6-31g(d).qchem.inp (generated)

012007234.b3lyp_6-31g(d).gjf (generated)

012007234.b3lyp_6-31g(d).firefly.inp (generated)

012007234.b3lyp_6-31g(d).smash.inp (generated)

012007234.b3lyp_6-31g(d).nwchem.inp (generated) 012007234.b3lyp_6-31g(d).log.xz 012007234.td-b3lyp_6-31g+(d).inp 012007234.td-b3lyp_6-31g+(d).log.xz

012007234.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007234.td-b3lyp_6-31+g(d).gjf (generated)

012007234.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007234.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007234.mol 012007234.PUBCHEM 012007234.mol (via Jmol)
012007250.b3lyp_6-31g(d).inp

012007250.b3lyp_6-31g(d).qchem.inp (generated)

012007250.b3lyp_6-31g(d).gjf (generated)

012007250.b3lyp_6-31g(d).firefly.inp (generated)

012007250.b3lyp_6-31g(d).smash.inp (generated)

012007250.b3lyp_6-31g(d).nwchem.inp (generated) 012007250.b3lyp_6-31g(d).log.xz 012007250.mol 012007250.PUBCHEM 012007250.mol (via Jmol)
012007254.b3lyp_6-31g(d).inp

012007254.b3lyp_6-31g(d).qchem.inp (generated)

012007254.b3lyp_6-31g(d).gjf (generated)

012007254.b3lyp_6-31g(d).firefly.inp (generated)

012007254.b3lyp_6-31g(d).smash.inp (generated)

012007254.b3lyp_6-31g(d).nwchem.inp (generated) 012007254.b3lyp_6-31g(d).log.xz 012007254.td-b3lyp_6-31g+(d).inp 012007254.td-b3lyp_6-31g+(d).log.xz

012007254.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007254.td-b3lyp_6-31+g(d).gjf (generated)

012007254.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007254.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007254.mol 012007254.PUBCHEM 012007254.mol (via Jmol)
012007255.b3lyp_6-31g(d).inp

012007255.b3lyp_6-31g(d).qchem.inp (generated)

012007255.b3lyp_6-31g(d).gjf (generated)

012007255.b3lyp_6-31g(d).firefly.inp (generated)

012007255.b3lyp_6-31g(d).smash.inp (generated)

012007255.b3lyp_6-31g(d).nwchem.inp (generated) 012007255.b3lyp_6-31g(d).log.xz 012007255.td-b3lyp_6-31g+(d).inp 012007255.td-b3lyp_6-31g+(d).log.xz

012007255.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007255.td-b3lyp_6-31+g(d).gjf (generated)

012007255.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007255.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007255.mol 012007255.PUBCHEM 012007255.mol (via Jmol)
012007257.b3lyp_6-31g(d).inp

012007257.b3lyp_6-31g(d).qchem.inp (generated)

012007257.b3lyp_6-31g(d).gjf (generated)

012007257.b3lyp_6-31g(d).firefly.inp (generated)

012007257.b3lyp_6-31g(d).smash.inp (generated)

012007257.b3lyp_6-31g(d).nwchem.inp (generated) 012007257.b3lyp_6-31g(d).log.xz 012007257.td-b3lyp_6-31g+(d).inp 012007257.td-b3lyp_6-31g+(d).log.xz

012007257.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007257.td-b3lyp_6-31+g(d).gjf (generated)

012007257.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007257.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007257.mol 012007257.PUBCHEM 012007257.mol (via Jmol)
012007287.b3lyp_6-31g(d).inp

012007287.b3lyp_6-31g(d).qchem.inp (generated)

012007287.b3lyp_6-31g(d).gjf (generated)

012007287.b3lyp_6-31g(d).firefly.inp (generated)

012007287.b3lyp_6-31g(d).smash.inp (generated)

012007287.b3lyp_6-31g(d).nwchem.inp (generated) 012007287.b3lyp_6-31g(d).log.xz 012007287.td-b3lyp_6-31g+(d).inp 012007287.td-b3lyp_6-31g+(d).log.xz

012007287.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007287.td-b3lyp_6-31+g(d).gjf (generated)

012007287.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007287.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007287.mol 012007287.PUBCHEM 012007287.mol (via Jmol)
012007292.b3lyp_6-31g(d).inp

012007292.b3lyp_6-31g(d).qchem.inp (generated)

012007292.b3lyp_6-31g(d).gjf (generated)

012007292.b3lyp_6-31g(d).firefly.inp (generated)

012007292.b3lyp_6-31g(d).smash.inp (generated)

012007292.b3lyp_6-31g(d).nwchem.inp (generated) 012007292.b3lyp_6-31g(d).log.xz 012007292.td-b3lyp_6-31g+(d).inp 012007292.td-b3lyp_6-31g+(d).log.xz

012007292.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007292.td-b3lyp_6-31+g(d).gjf (generated)

012007292.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007292.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007292.mol 012007292.PUBCHEM 012007292.mol (via Jmol)
012007293.b3lyp_6-31g(d).inp

012007293.b3lyp_6-31g(d).qchem.inp (generated)

012007293.b3lyp_6-31g(d).gjf (generated)

012007293.b3lyp_6-31g(d).firefly.inp (generated)

012007293.b3lyp_6-31g(d).smash.inp (generated)

012007293.b3lyp_6-31g(d).nwchem.inp (generated) 012007293.b3lyp_6-31g(d).log.xz 012007293.td-b3lyp_6-31g+(d).inp 012007293.td-b3lyp_6-31g+(d).log.xz

012007293.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007293.td-b3lyp_6-31+g(d).gjf (generated)

012007293.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007293.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007293.mol 012007293.PUBCHEM 012007293.mol (via Jmol)
012007294.b3lyp_6-31g(d).inp

012007294.b3lyp_6-31g(d).qchem.inp (generated)

012007294.b3lyp_6-31g(d).gjf (generated)

012007294.b3lyp_6-31g(d).firefly.inp (generated)

012007294.b3lyp_6-31g(d).smash.inp (generated)

012007294.b3lyp_6-31g(d).nwchem.inp (generated) 012007294.b3lyp_6-31g(d).log.xz 012007294.td-b3lyp_6-31g+(d).inp 012007294.td-b3lyp_6-31g+(d).log.xz

012007294.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007294.td-b3lyp_6-31+g(d).gjf (generated)

012007294.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007294.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007294.mol 012007294.PUBCHEM 012007294.mol (via Jmol)
012007297.b3lyp_6-31g(d).inp

012007297.b3lyp_6-31g(d).qchem.inp (generated)

012007297.b3lyp_6-31g(d).gjf (generated)

012007297.b3lyp_6-31g(d).firefly.inp (generated)

012007297.b3lyp_6-31g(d).smash.inp (generated)

012007297.b3lyp_6-31g(d).nwchem.inp (generated) 012007297.b3lyp_6-31g(d).log.xz 012007297.td-b3lyp_6-31g+(d).inp 012007297.td-b3lyp_6-31g+(d).log.xz

012007297.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007297.td-b3lyp_6-31+g(d).gjf (generated)

012007297.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007297.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007297.mol 012007297.PUBCHEM 012007297.mol (via Jmol)
012007378.b3lyp_6-31g(d).inp

012007378.b3lyp_6-31g(d).qchem.inp (generated)

012007378.b3lyp_6-31g(d).gjf (generated)

012007378.b3lyp_6-31g(d).firefly.inp (generated)

012007378.b3lyp_6-31g(d).smash.inp (generated)

012007378.b3lyp_6-31g(d).nwchem.inp (generated) 012007378.b3lyp_6-31g(d).log.xz 012007378.td-b3lyp_6-31g+(d).inp 012007378.td-b3lyp_6-31g+(d).log.xz

012007378.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007378.td-b3lyp_6-31+g(d).gjf (generated)

012007378.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007378.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007378.mol 012007378.PUBCHEM 012007378.mol (via Jmol)
012007382.b3lyp_6-31g(d).inp

012007382.b3lyp_6-31g(d).qchem.inp (generated)

012007382.b3lyp_6-31g(d).gjf (generated)

012007382.b3lyp_6-31g(d).firefly.inp (generated)

012007382.b3lyp_6-31g(d).smash.inp (generated)

012007382.b3lyp_6-31g(d).nwchem.inp (generated) 012007382.b3lyp_6-31g(d).log.xz 012007382.td-b3lyp_6-31g+(d).inp 012007382.td-b3lyp_6-31g+(d).log.xz

012007382.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007382.td-b3lyp_6-31+g(d).gjf (generated)

012007382.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007382.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007382.mol 012007382.PUBCHEM 012007382.mol (via Jmol)
012007412.b3lyp_6-31g(d).inp

012007412.b3lyp_6-31g(d).qchem.inp (generated)

012007412.b3lyp_6-31g(d).gjf (generated)

012007412.b3lyp_6-31g(d).firefly.inp (generated)

012007412.b3lyp_6-31g(d).smash.inp (generated)

012007412.b3lyp_6-31g(d).nwchem.inp (generated) 012007412.b3lyp_6-31g(d).log.xz 012007412.td-b3lyp_6-31g+(d).inp 012007412.td-b3lyp_6-31g+(d).log.xz

012007412.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007412.td-b3lyp_6-31+g(d).gjf (generated)

012007412.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007412.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007412.mol 012007412.PUBCHEM 012007412.mol (via Jmol)
012007425.b3lyp_6-31g(d).inp

012007425.b3lyp_6-31g(d).qchem.inp (generated)

012007425.b3lyp_6-31g(d).gjf (generated)

012007425.b3lyp_6-31g(d).firefly.inp (generated)

012007425.b3lyp_6-31g(d).smash.inp (generated)

012007425.b3lyp_6-31g(d).nwchem.inp (generated) 012007425.b3lyp_6-31g(d).log.xz 012007425.mol 012007425.PUBCHEM 012007425.mol (via Jmol)
012007431.b3lyp_6-31g(d).inp

012007431.b3lyp_6-31g(d).qchem.inp (generated)

012007431.b3lyp_6-31g(d).gjf (generated)

012007431.b3lyp_6-31g(d).firefly.inp (generated)

012007431.b3lyp_6-31g(d).smash.inp (generated)

012007431.b3lyp_6-31g(d).nwchem.inp (generated) 012007431.b3lyp_6-31g(d).log.xz 012007431.mol 012007431.PUBCHEM 012007431.mol (via Jmol)
012007475.b3lyp_6-31g(d).inp

012007475.b3lyp_6-31g(d).qchem.inp (generated)

012007475.b3lyp_6-31g(d).gjf (generated)

012007475.b3lyp_6-31g(d).firefly.inp (generated)

012007475.b3lyp_6-31g(d).smash.inp (generated)

012007475.b3lyp_6-31g(d).nwchem.inp (generated) 012007475.b3lyp_6-31g(d).log.xz 012007475.td-b3lyp_6-31g+(d).inp 012007475.td-b3lyp_6-31g+(d).log.xz

012007475.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007475.td-b3lyp_6-31+g(d).gjf (generated)

012007475.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007475.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007475.mol 012007475.PUBCHEM 012007475.mol (via Jmol)
012007488.b3lyp_6-31g(d).inp

012007488.b3lyp_6-31g(d).qchem.inp (generated)

012007488.b3lyp_6-31g(d).gjf (generated)

012007488.b3lyp_6-31g(d).firefly.inp (generated)

012007488.b3lyp_6-31g(d).smash.inp (generated)

012007488.b3lyp_6-31g(d).nwchem.inp (generated) 012007488.b3lyp_6-31g(d).log.xz 012007488.td-b3lyp_6-31g+(d).inp 012007488.td-b3lyp_6-31g+(d).log.xz

012007488.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007488.td-b3lyp_6-31+g(d).gjf (generated)

012007488.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007488.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007488.mol 012007488.PUBCHEM 012007488.mol (via Jmol)
012007489.b3lyp_6-31g(d).inp

012007489.b3lyp_6-31g(d).qchem.inp (generated)

012007489.b3lyp_6-31g(d).gjf (generated)

012007489.b3lyp_6-31g(d).firefly.inp (generated)

012007489.b3lyp_6-31g(d).smash.inp (generated)

012007489.b3lyp_6-31g(d).nwchem.inp (generated) 012007489.b3lyp_6-31g(d).log.xz 012007489.td-b3lyp_6-31g+(d).inp 012007489.td-b3lyp_6-31g+(d).log.xz

012007489.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007489.td-b3lyp_6-31+g(d).gjf (generated)

012007489.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007489.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007489.mol 012007489.PUBCHEM 012007489.mol (via Jmol)
012007490.b3lyp_6-31g(d).inp

012007490.b3lyp_6-31g(d).qchem.inp (generated)

012007490.b3lyp_6-31g(d).gjf (generated)

012007490.b3lyp_6-31g(d).firefly.inp (generated)

012007490.b3lyp_6-31g(d).smash.inp (generated)

012007490.b3lyp_6-31g(d).nwchem.inp (generated) 012007490.b3lyp_6-31g(d).log.xz 012007490.td-b3lyp_6-31g+(d).inp 012007490.td-b3lyp_6-31g+(d).log.xz

012007490.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007490.td-b3lyp_6-31+g(d).gjf (generated)

012007490.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007490.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007490.mol 012007490.PUBCHEM 012007490.mol (via Jmol)
012007494.b3lyp_6-31g(d).inp

012007494.b3lyp_6-31g(d).qchem.inp (generated)

012007494.b3lyp_6-31g(d).gjf (generated)

012007494.b3lyp_6-31g(d).firefly.inp (generated)

012007494.b3lyp_6-31g(d).smash.inp (generated)

012007494.b3lyp_6-31g(d).nwchem.inp (generated) 012007494.b3lyp_6-31g(d).log.xz 012007494.td-b3lyp_6-31g+(d).inp 012007494.td-b3lyp_6-31g+(d).log.xz

012007494.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007494.td-b3lyp_6-31+g(d).gjf (generated)

012007494.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007494.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007494.mol 012007494.PUBCHEM 012007494.mol (via Jmol)
012007529.b3lyp_6-31g(d).inp

012007529.b3lyp_6-31g(d).qchem.inp (generated)

012007529.b3lyp_6-31g(d).gjf (generated)

012007529.b3lyp_6-31g(d).firefly.inp (generated)

012007529.b3lyp_6-31g(d).smash.inp (generated)

012007529.b3lyp_6-31g(d).nwchem.inp (generated) 012007529.b3lyp_6-31g(d).log.xz 012007529.td-b3lyp_6-31g+(d).inp 012007529.td-b3lyp_6-31g+(d).log.xz

012007529.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007529.td-b3lyp_6-31+g(d).gjf (generated)

012007529.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007529.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007529.mol 012007529.PUBCHEM 012007529.mol (via Jmol)
012007535.b3lyp_6-31g(d).inp

012007535.b3lyp_6-31g(d).qchem.inp (generated)

012007535.b3lyp_6-31g(d).gjf (generated)

012007535.b3lyp_6-31g(d).firefly.inp (generated)

012007535.b3lyp_6-31g(d).smash.inp (generated)

012007535.b3lyp_6-31g(d).nwchem.inp (generated) 012007535.b3lyp_6-31g(d).log.xz 012007535.td-b3lyp_6-31g+(d).inp 012007535.td-b3lyp_6-31g+(d).log.xz

012007535.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007535.td-b3lyp_6-31+g(d).gjf (generated)

012007535.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007535.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007535.mol 012007535.PUBCHEM 012007535.mol (via Jmol)
012007552.b3lyp_6-31g(d).inp

012007552.b3lyp_6-31g(d).qchem.inp (generated)

012007552.b3lyp_6-31g(d).gjf (generated)

012007552.b3lyp_6-31g(d).firefly.inp (generated)

012007552.b3lyp_6-31g(d).smash.inp (generated)

012007552.b3lyp_6-31g(d).nwchem.inp (generated) 012007552.b3lyp_6-31g(d).log.xz 012007552.td-b3lyp_6-31g+(d).inp 012007552.td-b3lyp_6-31g+(d).log.xz

012007552.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007552.td-b3lyp_6-31+g(d).gjf (generated)

012007552.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007552.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007552.mol 012007552.PUBCHEM 012007552.mol (via Jmol)
012007554.b3lyp_6-31g(d).inp

012007554.b3lyp_6-31g(d).qchem.inp (generated)

012007554.b3lyp_6-31g(d).gjf (generated)

012007554.b3lyp_6-31g(d).firefly.inp (generated)

012007554.b3lyp_6-31g(d).smash.inp (generated)

012007554.b3lyp_6-31g(d).nwchem.inp (generated) 012007554.b3lyp_6-31g(d).log.xz 012007554.mol 012007554.PUBCHEM 012007554.mol (via Jmol)
012007555.b3lyp_6-31g(d).inp

012007555.b3lyp_6-31g(d).qchem.inp (generated)

012007555.b3lyp_6-31g(d).gjf (generated)

012007555.b3lyp_6-31g(d).firefly.inp (generated)

012007555.b3lyp_6-31g(d).smash.inp (generated)

012007555.b3lyp_6-31g(d).nwchem.inp (generated) 012007555.b3lyp_6-31g(d).log.xz 012007555.td-b3lyp_6-31g+(d).inp 012007555.td-b3lyp_6-31g+(d).log.xz

012007555.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007555.td-b3lyp_6-31+g(d).gjf (generated)

012007555.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007555.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007555.mol 012007555.PUBCHEM 012007555.mol (via Jmol)
012007564.b3lyp_6-31g(d).inp

012007564.b3lyp_6-31g(d).qchem.inp (generated)

012007564.b3lyp_6-31g(d).gjf (generated)

012007564.b3lyp_6-31g(d).firefly.inp (generated)

012007564.b3lyp_6-31g(d).smash.inp (generated)

012007564.b3lyp_6-31g(d).nwchem.inp (generated) 012007564.b3lyp_6-31g(d).log.xz 012007564.td-b3lyp_6-31g+(d).inp 012007564.td-b3lyp_6-31g+(d).log.xz

012007564.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007564.td-b3lyp_6-31+g(d).gjf (generated)

012007564.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007564.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007564.mol 012007564.PUBCHEM 012007564.mol (via Jmol)
012007565.b3lyp_6-31g(d).inp

012007565.b3lyp_6-31g(d).qchem.inp (generated)

012007565.b3lyp_6-31g(d).gjf (generated)

012007565.b3lyp_6-31g(d).firefly.inp (generated)

012007565.b3lyp_6-31g(d).smash.inp (generated)

012007565.b3lyp_6-31g(d).nwchem.inp (generated) 012007565.b3lyp_6-31g(d).log.xz 012007565.td-b3lyp_6-31g+(d).inp 012007565.td-b3lyp_6-31g+(d).log.xz

012007565.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007565.td-b3lyp_6-31+g(d).gjf (generated)

012007565.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007565.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007565.mol 012007565.PUBCHEM 012007565.mol (via Jmol)
012007567.b3lyp_6-31g(d).inp

012007567.b3lyp_6-31g(d).qchem.inp (generated)

012007567.b3lyp_6-31g(d).gjf (generated)

012007567.b3lyp_6-31g(d).firefly.inp (generated)

012007567.b3lyp_6-31g(d).smash.inp (generated)

012007567.b3lyp_6-31g(d).nwchem.inp (generated) 012007567.b3lyp_6-31g(d).log.xz 012007567.td-b3lyp_6-31g+(d).inp 012007567.td-b3lyp_6-31g+(d).log.xz

012007567.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007567.td-b3lyp_6-31+g(d).gjf (generated)

012007567.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007567.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007567.mol 012007567.PUBCHEM 012007567.mol (via Jmol)
012007573.b3lyp_6-31g(d).inp

012007573.b3lyp_6-31g(d).qchem.inp (generated)

012007573.b3lyp_6-31g(d).gjf (generated)

012007573.b3lyp_6-31g(d).firefly.inp (generated)

012007573.b3lyp_6-31g(d).smash.inp (generated)

012007573.b3lyp_6-31g(d).nwchem.inp (generated) 012007573.b3lyp_6-31g(d).log.xz 012007573.td-b3lyp_6-31g+(d).inp 012007573.td-b3lyp_6-31g+(d).log.xz

012007573.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007573.td-b3lyp_6-31+g(d).gjf (generated)

012007573.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007573.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007573.mol 012007573.PUBCHEM 012007573.mol (via Jmol)
012007578.b3lyp_6-31g(d).inp

012007578.b3lyp_6-31g(d).qchem.inp (generated)

012007578.b3lyp_6-31g(d).gjf (generated)

012007578.b3lyp_6-31g(d).firefly.inp (generated)

012007578.b3lyp_6-31g(d).smash.inp (generated)

012007578.b3lyp_6-31g(d).nwchem.inp (generated) 012007578.b3lyp_6-31g(d).log.xz 012007578.td-b3lyp_6-31g+(d).inp 012007578.td-b3lyp_6-31g+(d).log.xz

012007578.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007578.td-b3lyp_6-31+g(d).gjf (generated)

012007578.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007578.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007578.mol 012007578.PUBCHEM 012007578.mol (via Jmol)
012007591.b3lyp_6-31g(d).inp

012007591.b3lyp_6-31g(d).qchem.inp (generated)

012007591.b3lyp_6-31g(d).gjf (generated)

012007591.b3lyp_6-31g(d).firefly.inp (generated)

012007591.b3lyp_6-31g(d).smash.inp (generated)

012007591.b3lyp_6-31g(d).nwchem.inp (generated) 012007591.b3lyp_6-31g(d).log.xz 012007591.td-b3lyp_6-31g+(d).inp 012007591.td-b3lyp_6-31g+(d).log.xz

012007591.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007591.td-b3lyp_6-31+g(d).gjf (generated)

012007591.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007591.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007591.mol 012007591.PUBCHEM 012007591.mol (via Jmol)
012007592.b3lyp_6-31g(d).inp

012007592.b3lyp_6-31g(d).qchem.inp (generated)

012007592.b3lyp_6-31g(d).gjf (generated)

012007592.b3lyp_6-31g(d).firefly.inp (generated)

012007592.b3lyp_6-31g(d).smash.inp (generated)

012007592.b3lyp_6-31g(d).nwchem.inp (generated) 012007592.b3lyp_6-31g(d).log.xz 012007592.td-b3lyp_6-31g+(d).inp 012007592.td-b3lyp_6-31g+(d).log.xz

012007592.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007592.td-b3lyp_6-31+g(d).gjf (generated)

012007592.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007592.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007592.mol 012007592.PUBCHEM 012007592.mol (via Jmol)
012007594.b3lyp_6-31g(d).inp

012007594.b3lyp_6-31g(d).qchem.inp (generated)

012007594.b3lyp_6-31g(d).gjf (generated)

012007594.b3lyp_6-31g(d).firefly.inp (generated)

012007594.b3lyp_6-31g(d).smash.inp (generated)

012007594.b3lyp_6-31g(d).nwchem.inp (generated) 012007594.b3lyp_6-31g(d).log.xz 012007594.td-b3lyp_6-31g+(d).inp 012007594.td-b3lyp_6-31g+(d).log.xz

012007594.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007594.td-b3lyp_6-31+g(d).gjf (generated)

012007594.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007594.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007594.mol 012007594.PUBCHEM 012007594.mol (via Jmol)
012007642.b3lyp_6-31g(d).inp

012007642.b3lyp_6-31g(d).qchem.inp (generated)

012007642.b3lyp_6-31g(d).gjf (generated)

012007642.b3lyp_6-31g(d).firefly.inp (generated)

012007642.b3lyp_6-31g(d).smash.inp (generated)

012007642.b3lyp_6-31g(d).nwchem.inp (generated) 012007642.b3lyp_6-31g(d).log.xz 012007642.mol 012007642.PUBCHEM 012007642.mol (via Jmol)
012007657.b3lyp_6-31g(d).inp

012007657.b3lyp_6-31g(d).qchem.inp (generated)

012007657.b3lyp_6-31g(d).gjf (generated)

012007657.b3lyp_6-31g(d).firefly.inp (generated)

012007657.b3lyp_6-31g(d).smash.inp (generated)

012007657.b3lyp_6-31g(d).nwchem.inp (generated) 012007657.b3lyp_6-31g(d).log.xz 012007657.td-b3lyp_6-31g+(d).inp 012007657.td-b3lyp_6-31g+(d).log.xz

012007657.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007657.td-b3lyp_6-31+g(d).gjf (generated)

012007657.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007657.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007657.mol 012007657.PUBCHEM 012007657.mol (via Jmol)
012007659.b3lyp_6-31g(d).inp

012007659.b3lyp_6-31g(d).qchem.inp (generated)

012007659.b3lyp_6-31g(d).gjf (generated)

012007659.b3lyp_6-31g(d).firefly.inp (generated)

012007659.b3lyp_6-31g(d).smash.inp (generated)

012007659.b3lyp_6-31g(d).nwchem.inp (generated) 012007659.b3lyp_6-31g(d).log.xz 012007659.td-b3lyp_6-31g+(d).inp 012007659.td-b3lyp_6-31g+(d).log.xz

012007659.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007659.td-b3lyp_6-31+g(d).gjf (generated)

012007659.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007659.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007659.mol 012007659.PUBCHEM 012007659.mol (via Jmol)
012007671.b3lyp_6-31g(d).inp

012007671.b3lyp_6-31g(d).qchem.inp (generated)

012007671.b3lyp_6-31g(d).gjf (generated)

012007671.b3lyp_6-31g(d).firefly.inp (generated)

012007671.b3lyp_6-31g(d).smash.inp (generated)

012007671.b3lyp_6-31g(d).nwchem.inp (generated) 012007671.b3lyp_6-31g(d).log.xz 012007671.td-b3lyp_6-31g+(d).inp 012007671.td-b3lyp_6-31g+(d).log.xz

012007671.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007671.td-b3lyp_6-31+g(d).gjf (generated)

012007671.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007671.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007671.mol 012007671.PUBCHEM 012007671.mol (via Jmol)
012007673.b3lyp_6-31g(d).inp

012007673.b3lyp_6-31g(d).qchem.inp (generated)

012007673.b3lyp_6-31g(d).gjf (generated)

012007673.b3lyp_6-31g(d).firefly.inp (generated)

012007673.b3lyp_6-31g(d).smash.inp (generated)

012007673.b3lyp_6-31g(d).nwchem.inp (generated) 012007673.b3lyp_6-31g(d).log.xz 012007673.td-b3lyp_6-31g+(d).inp 012007673.td-b3lyp_6-31g+(d).log.xz

012007673.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007673.td-b3lyp_6-31+g(d).gjf (generated)

012007673.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007673.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007673.mol 012007673.PUBCHEM 012007673.mol (via Jmol)
012007695.b3lyp_6-31g(d).inp

012007695.b3lyp_6-31g(d).qchem.inp (generated)

012007695.b3lyp_6-31g(d).gjf (generated)

012007695.b3lyp_6-31g(d).firefly.inp (generated)

012007695.b3lyp_6-31g(d).smash.inp (generated)

012007695.b3lyp_6-31g(d).nwchem.inp (generated) 012007695.b3lyp_6-31g(d).log.xz 012007695.td-b3lyp_6-31g+(d).inp 012007695.td-b3lyp_6-31g+(d).log.xz

012007695.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007695.td-b3lyp_6-31+g(d).gjf (generated)

012007695.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007695.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007695.mol 012007695.PUBCHEM 012007695.mol (via Jmol)
012007699.b3lyp_6-31g(d).inp

012007699.b3lyp_6-31g(d).qchem.inp (generated)

012007699.b3lyp_6-31g(d).gjf (generated)

012007699.b3lyp_6-31g(d).firefly.inp (generated)

012007699.b3lyp_6-31g(d).smash.inp (generated)

012007699.b3lyp_6-31g(d).nwchem.inp (generated) 012007699.b3lyp_6-31g(d).log.xz 012007699.td-b3lyp_6-31g+(d).inp 012007699.td-b3lyp_6-31g+(d).log.xz

012007699.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007699.td-b3lyp_6-31+g(d).gjf (generated)

012007699.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007699.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007699.mol 012007699.PUBCHEM 012007699.mol (via Jmol)
012007700.b3lyp_6-31g(d).inp

012007700.b3lyp_6-31g(d).qchem.inp (generated)

012007700.b3lyp_6-31g(d).gjf (generated)

012007700.b3lyp_6-31g(d).firefly.inp (generated)

012007700.b3lyp_6-31g(d).smash.inp (generated)

012007700.b3lyp_6-31g(d).nwchem.inp (generated) 012007700.b3lyp_6-31g(d).log.xz 012007700.td-b3lyp_6-31g+(d).inp 012007700.td-b3lyp_6-31g+(d).log.xz

012007700.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007700.td-b3lyp_6-31+g(d).gjf (generated)

012007700.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007700.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007700.mol 012007700.PUBCHEM 012007700.mol (via Jmol)
012007701.b3lyp_6-31g(d).inp

012007701.b3lyp_6-31g(d).qchem.inp (generated)

012007701.b3lyp_6-31g(d).gjf (generated)

012007701.b3lyp_6-31g(d).firefly.inp (generated)

012007701.b3lyp_6-31g(d).smash.inp (generated)

012007701.b3lyp_6-31g(d).nwchem.inp (generated) 012007701.b3lyp_6-31g(d).log.xz 012007701.td-b3lyp_6-31g+(d).inp 012007701.td-b3lyp_6-31g+(d).log.xz

012007701.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007701.td-b3lyp_6-31+g(d).gjf (generated)

012007701.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007701.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007701.mol 012007701.PUBCHEM 012007701.mol (via Jmol)
012007708.b3lyp_6-31g(d).inp

012007708.b3lyp_6-31g(d).qchem.inp (generated)

012007708.b3lyp_6-31g(d).gjf (generated)

012007708.b3lyp_6-31g(d).firefly.inp (generated)

012007708.b3lyp_6-31g(d).smash.inp (generated)

012007708.b3lyp_6-31g(d).nwchem.inp (generated) 012007708.b3lyp_6-31g(d).log.xz 012007708.td-b3lyp_6-31g+(d).inp 012007708.td-b3lyp_6-31g+(d).log.xz

012007708.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007708.td-b3lyp_6-31+g(d).gjf (generated)

012007708.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007708.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007708.mol 012007708.PUBCHEM 012007708.mol (via Jmol)
012007729.b3lyp_6-31g(d).inp

012007729.b3lyp_6-31g(d).qchem.inp (generated)

012007729.b3lyp_6-31g(d).gjf (generated)

012007729.b3lyp_6-31g(d).firefly.inp (generated)

012007729.b3lyp_6-31g(d).smash.inp (generated)

012007729.b3lyp_6-31g(d).nwchem.inp (generated) 012007729.b3lyp_6-31g(d).log.xz 012007729.td-b3lyp_6-31g+(d).inp 012007729.td-b3lyp_6-31g+(d).log.xz

012007729.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007729.td-b3lyp_6-31+g(d).gjf (generated)

012007729.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007729.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007729.mol 012007729.PUBCHEM 012007729.mol (via Jmol)
012007730.b3lyp_6-31g(d).inp

012007730.b3lyp_6-31g(d).qchem.inp (generated)

012007730.b3lyp_6-31g(d).gjf (generated)

012007730.b3lyp_6-31g(d).firefly.inp (generated)

012007730.b3lyp_6-31g(d).smash.inp (generated)

012007730.b3lyp_6-31g(d).nwchem.inp (generated) 012007730.b3lyp_6-31g(d).log.xz 012007730.mol 012007730.PUBCHEM 012007730.mol (via Jmol)
012007733.b3lyp_6-31g(d).inp

012007733.b3lyp_6-31g(d).qchem.inp (generated)

012007733.b3lyp_6-31g(d).gjf (generated)

012007733.b3lyp_6-31g(d).firefly.inp (generated)

012007733.b3lyp_6-31g(d).smash.inp (generated)

012007733.b3lyp_6-31g(d).nwchem.inp (generated) 012007733.b3lyp_6-31g(d).log.xz 012007733.td-b3lyp_6-31g+(d).inp 012007733.td-b3lyp_6-31g+(d).log.xz

012007733.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007733.td-b3lyp_6-31+g(d).gjf (generated)

012007733.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007733.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007733.mol 012007733.PUBCHEM 012007733.mol (via Jmol)
012007734.b3lyp_6-31g(d).inp

012007734.b3lyp_6-31g(d).qchem.inp (generated)

012007734.b3lyp_6-31g(d).gjf (generated)

012007734.b3lyp_6-31g(d).firefly.inp (generated)

012007734.b3lyp_6-31g(d).smash.inp (generated)

012007734.b3lyp_6-31g(d).nwchem.inp (generated) 012007734.b3lyp_6-31g(d).log.xz 012007734.td-b3lyp_6-31g+(d).inp 012007734.td-b3lyp_6-31g+(d).log.xz

012007734.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007734.td-b3lyp_6-31+g(d).gjf (generated)

012007734.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007734.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007734.mol 012007734.PUBCHEM 012007734.mol (via Jmol)
012007759.b3lyp_6-31g(d).inp

012007759.b3lyp_6-31g(d).qchem.inp (generated)

012007759.b3lyp_6-31g(d).gjf (generated)

012007759.b3lyp_6-31g(d).firefly.inp (generated)

012007759.b3lyp_6-31g(d).smash.inp (generated)

012007759.b3lyp_6-31g(d).nwchem.inp (generated) 012007759.b3lyp_6-31g(d).log.xz 012007759.td-b3lyp_6-31g+(d).inp 012007759.td-b3lyp_6-31g+(d).log.xz

012007759.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007759.td-b3lyp_6-31+g(d).gjf (generated)

012007759.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007759.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007759.mol 012007759.PUBCHEM 012007759.mol (via Jmol)
012007766.b3lyp_6-31g(d).inp

012007766.b3lyp_6-31g(d).qchem.inp (generated)

012007766.b3lyp_6-31g(d).gjf (generated)

012007766.b3lyp_6-31g(d).firefly.inp (generated)

012007766.b3lyp_6-31g(d).smash.inp (generated)

012007766.b3lyp_6-31g(d).nwchem.inp (generated) 012007766.b3lyp_6-31g(d).log.xz 012007766.td-b3lyp_6-31g+(d).inp 012007766.td-b3lyp_6-31g+(d).log.xz

012007766.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007766.td-b3lyp_6-31+g(d).gjf (generated)

012007766.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007766.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007766.mol 012007766.PUBCHEM 012007766.mol (via Jmol)
012007769.b3lyp_6-31g(d).inp

012007769.b3lyp_6-31g(d).qchem.inp (generated)

012007769.b3lyp_6-31g(d).gjf (generated)

012007769.b3lyp_6-31g(d).firefly.inp (generated)

012007769.b3lyp_6-31g(d).smash.inp (generated)

012007769.b3lyp_6-31g(d).nwchem.inp (generated) 012007769.b3lyp_6-31g(d).log.xz 012007769.td-b3lyp_6-31g+(d).inp 012007769.td-b3lyp_6-31g+(d).log.xz

012007769.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007769.td-b3lyp_6-31+g(d).gjf (generated)

012007769.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007769.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007769.mol 012007769.PUBCHEM 012007769.mol (via Jmol)
012007773.b3lyp_6-31g(d).inp

012007773.b3lyp_6-31g(d).qchem.inp (generated)

012007773.b3lyp_6-31g(d).gjf (generated)

012007773.b3lyp_6-31g(d).firefly.inp (generated)

012007773.b3lyp_6-31g(d).smash.inp (generated)

012007773.b3lyp_6-31g(d).nwchem.inp (generated) 012007773.b3lyp_6-31g(d).log.xz 012007773.td-b3lyp_6-31g+(d).inp 012007773.td-b3lyp_6-31g+(d).log.xz

012007773.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007773.td-b3lyp_6-31+g(d).gjf (generated)

012007773.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007773.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007773.mol 012007773.PUBCHEM 012007773.mol (via Jmol)
012007774.b3lyp_6-31g(d).inp

012007774.b3lyp_6-31g(d).qchem.inp (generated)

012007774.b3lyp_6-31g(d).gjf (generated)

012007774.b3lyp_6-31g(d).firefly.inp (generated)

012007774.b3lyp_6-31g(d).smash.inp (generated)

012007774.b3lyp_6-31g(d).nwchem.inp (generated) 012007774.b3lyp_6-31g(d).log.xz 012007774.td-b3lyp_6-31g+(d).inp 012007774.td-b3lyp_6-31g+(d).log.xz

012007774.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007774.td-b3lyp_6-31+g(d).gjf (generated)

012007774.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007774.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007774.mol 012007774.PUBCHEM 012007774.mol (via Jmol)
012007779.b3lyp_6-31g(d).inp

012007779.b3lyp_6-31g(d).qchem.inp (generated)

012007779.b3lyp_6-31g(d).gjf (generated)

012007779.b3lyp_6-31g(d).firefly.inp (generated)

012007779.b3lyp_6-31g(d).smash.inp (generated)

012007779.b3lyp_6-31g(d).nwchem.inp (generated) 012007779.b3lyp_6-31g(d).log.xz 012007779.td-b3lyp_6-31g+(d).inp 012007779.td-b3lyp_6-31g+(d).log.xz

012007779.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007779.td-b3lyp_6-31+g(d).gjf (generated)

012007779.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007779.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007779.mol 012007779.PUBCHEM 012007779.mol (via Jmol)
012007789.b3lyp_6-31g(d).inp

012007789.b3lyp_6-31g(d).qchem.inp (generated)

012007789.b3lyp_6-31g(d).gjf (generated)

012007789.b3lyp_6-31g(d).firefly.inp (generated)

012007789.b3lyp_6-31g(d).smash.inp (generated)

012007789.b3lyp_6-31g(d).nwchem.inp (generated) 012007789.b3lyp_6-31g(d).log.xz 012007789.td-b3lyp_6-31g+(d).inp 012007789.td-b3lyp_6-31g+(d).log.xz

012007789.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007789.td-b3lyp_6-31+g(d).gjf (generated)

012007789.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007789.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007789.mol 012007789.PUBCHEM 012007789.mol (via Jmol)
012007817.b3lyp_6-31g(d).inp

012007817.b3lyp_6-31g(d).qchem.inp (generated)

012007817.b3lyp_6-31g(d).gjf (generated)

012007817.b3lyp_6-31g(d).firefly.inp (generated)

012007817.b3lyp_6-31g(d).smash.inp (generated)

012007817.b3lyp_6-31g(d).nwchem.inp (generated) 012007817.b3lyp_6-31g(d).log.xz 012007817.mol 012007817.PUBCHEM 012007817.mol (via Jmol)
012007818.b3lyp_6-31g(d).inp

012007818.b3lyp_6-31g(d).qchem.inp (generated)

012007818.b3lyp_6-31g(d).gjf (generated)

012007818.b3lyp_6-31g(d).firefly.inp (generated)

012007818.b3lyp_6-31g(d).smash.inp (generated)

012007818.b3lyp_6-31g(d).nwchem.inp (generated) 012007818.b3lyp_6-31g(d).log.xz 012007818.td-b3lyp_6-31g+(d).inp 012007818.td-b3lyp_6-31g+(d).log.xz

012007818.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007818.td-b3lyp_6-31+g(d).gjf (generated)

012007818.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007818.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007818.mol 012007818.PUBCHEM 012007818.mol (via Jmol)
012007825.b3lyp_6-31g(d).inp

012007825.b3lyp_6-31g(d).qchem.inp (generated)

012007825.b3lyp_6-31g(d).gjf (generated)

012007825.b3lyp_6-31g(d).firefly.inp (generated)

012007825.b3lyp_6-31g(d).smash.inp (generated)

012007825.b3lyp_6-31g(d).nwchem.inp (generated) 012007825.b3lyp_6-31g(d).log.xz 012007825.td-b3lyp_6-31g+(d).inp 012007825.td-b3lyp_6-31g+(d).log.xz

012007825.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007825.td-b3lyp_6-31+g(d).gjf (generated)

012007825.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007825.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007825.mol 012007825.PUBCHEM 012007825.mol (via Jmol)
012007867.b3lyp_6-31g(d).inp

012007867.b3lyp_6-31g(d).qchem.inp (generated)

012007867.b3lyp_6-31g(d).gjf (generated)

012007867.b3lyp_6-31g(d).firefly.inp (generated)

012007867.b3lyp_6-31g(d).smash.inp (generated)

012007867.b3lyp_6-31g(d).nwchem.inp (generated) 012007867.b3lyp_6-31g(d).log.xz 012007867.td-b3lyp_6-31g+(d).inp 012007867.td-b3lyp_6-31g+(d).log.xz

012007867.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007867.td-b3lyp_6-31+g(d).gjf (generated)

012007867.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007867.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007867.mol 012007867.PUBCHEM 012007867.mol (via Jmol)
012007872.b3lyp_6-31g(d).inp

012007872.b3lyp_6-31g(d).qchem.inp (generated)

012007872.b3lyp_6-31g(d).gjf (generated)

012007872.b3lyp_6-31g(d).firefly.inp (generated)

012007872.b3lyp_6-31g(d).smash.inp (generated)

012007872.b3lyp_6-31g(d).nwchem.inp (generated) 012007872.b3lyp_6-31g(d).log.xz 012007872.td-b3lyp_6-31g+(d).inp 012007872.td-b3lyp_6-31g+(d).log.xz

012007872.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007872.td-b3lyp_6-31+g(d).gjf (generated)

012007872.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007872.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007872.mol 012007872.PUBCHEM 012007872.mol (via Jmol)
012007912.b3lyp_6-31g(d).inp

012007912.b3lyp_6-31g(d).qchem.inp (generated)

012007912.b3lyp_6-31g(d).gjf (generated)

012007912.b3lyp_6-31g(d).firefly.inp (generated)

012007912.b3lyp_6-31g(d).smash.inp (generated)

012007912.b3lyp_6-31g(d).nwchem.inp (generated) 012007912.b3lyp_6-31g(d).log.xz 012007912.td-b3lyp_6-31g+(d).inp 012007912.td-b3lyp_6-31g+(d).log.xz

012007912.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007912.td-b3lyp_6-31+g(d).gjf (generated)

012007912.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007912.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007912.mol 012007912.PUBCHEM 012007912.mol (via Jmol)
012007946.b3lyp_6-31g(d).inp

012007946.b3lyp_6-31g(d).qchem.inp (generated)

012007946.b3lyp_6-31g(d).gjf (generated)

012007946.b3lyp_6-31g(d).firefly.inp (generated)

012007946.b3lyp_6-31g(d).smash.inp (generated)

012007946.b3lyp_6-31g(d).nwchem.inp (generated) 012007946.b3lyp_6-31g(d).log.xz 012007946.mol 012007946.PUBCHEM 012007946.mol (via Jmol)
012007959.b3lyp_6-31g(d).inp

012007959.b3lyp_6-31g(d).qchem.inp (generated)

012007959.b3lyp_6-31g(d).gjf (generated)

012007959.b3lyp_6-31g(d).firefly.inp (generated)

012007959.b3lyp_6-31g(d).smash.inp (generated)

012007959.b3lyp_6-31g(d).nwchem.inp (generated) 012007959.b3lyp_6-31g(d).log.xz 012007959.td-b3lyp_6-31g+(d).inp 012007959.td-b3lyp_6-31g+(d).log.xz

012007959.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007959.td-b3lyp_6-31+g(d).gjf (generated)

012007959.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007959.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007959.mol 012007959.PUBCHEM 012007959.mol (via Jmol)
012007965.b3lyp_6-31g(d).inp

012007965.b3lyp_6-31g(d).qchem.inp (generated)

012007965.b3lyp_6-31g(d).gjf (generated)

012007965.b3lyp_6-31g(d).firefly.inp (generated)

012007965.b3lyp_6-31g(d).smash.inp (generated)

012007965.b3lyp_6-31g(d).nwchem.inp (generated) 012007965.b3lyp_6-31g(d).log.xz 012007965.td-b3lyp_6-31g+(d).inp 012007965.td-b3lyp_6-31g+(d).log.xz

012007965.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007965.td-b3lyp_6-31+g(d).gjf (generated)

012007965.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007965.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007965.mol 012007965.PUBCHEM 012007965.mol (via Jmol)
012007966.b3lyp_6-31g(d).inp

012007966.b3lyp_6-31g(d).qchem.inp (generated)

012007966.b3lyp_6-31g(d).gjf (generated)

012007966.b3lyp_6-31g(d).firefly.inp (generated)

012007966.b3lyp_6-31g(d).smash.inp (generated)

012007966.b3lyp_6-31g(d).nwchem.inp (generated) 012007966.b3lyp_6-31g(d).log.xz 012007966.td-b3lyp_6-31g+(d).inp 012007966.td-b3lyp_6-31g+(d).log.xz

012007966.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007966.td-b3lyp_6-31+g(d).gjf (generated)

012007966.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007966.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007966.mol 012007966.PUBCHEM 012007966.mol (via Jmol)
012007967.b3lyp_6-31g(d).inp

012007967.b3lyp_6-31g(d).qchem.inp (generated)

012007967.b3lyp_6-31g(d).gjf (generated)

012007967.b3lyp_6-31g(d).firefly.inp (generated)

012007967.b3lyp_6-31g(d).smash.inp (generated)

012007967.b3lyp_6-31g(d).nwchem.inp (generated) 012007967.b3lyp_6-31g(d).log.xz 012007967.td-b3lyp_6-31g+(d).inp 012007967.td-b3lyp_6-31g+(d).log.xz

012007967.td-b3lyp_6-31+g(d).qchem.inp (generated)

012007967.td-b3lyp_6-31+g(d).gjf (generated)

012007967.td-b3lyp_6-31+g(d).firefly.inp (generated)

012007967.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012007967.mol 012007967.PUBCHEM 012007967.mol (via Jmol)
012008019.b3lyp_6-31g(d).inp

012008019.b3lyp_6-31g(d).qchem.inp (generated)

012008019.b3lyp_6-31g(d).gjf (generated)

012008019.b3lyp_6-31g(d).firefly.inp (generated)

012008019.b3lyp_6-31g(d).smash.inp (generated)

012008019.b3lyp_6-31g(d).nwchem.inp (generated) 012008019.b3lyp_6-31g(d).log.xz 012008019.td-b3lyp_6-31g+(d).inp 012008019.td-b3lyp_6-31g+(d).log.xz

012008019.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008019.td-b3lyp_6-31+g(d).gjf (generated)

012008019.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008019.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008019.mol 012008019.PUBCHEM 012008019.mol (via Jmol)
012008123.b3lyp_6-31g(d).inp

012008123.b3lyp_6-31g(d).qchem.inp (generated)

012008123.b3lyp_6-31g(d).gjf (generated)

012008123.b3lyp_6-31g(d).firefly.inp (generated)

012008123.b3lyp_6-31g(d).smash.inp (generated)

012008123.b3lyp_6-31g(d).nwchem.inp (generated) 012008123.b3lyp_6-31g(d).log.xz 012008123.td-b3lyp_6-31g+(d).inp 012008123.td-b3lyp_6-31g+(d).log.xz

012008123.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008123.td-b3lyp_6-31+g(d).gjf (generated)

012008123.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008123.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008123.mol 012008123.PUBCHEM 012008123.mol (via Jmol)
012008124.b3lyp_6-31g(d).inp

012008124.b3lyp_6-31g(d).qchem.inp (generated)

012008124.b3lyp_6-31g(d).gjf (generated)

012008124.b3lyp_6-31g(d).firefly.inp (generated)

012008124.b3lyp_6-31g(d).smash.inp (generated)

012008124.b3lyp_6-31g(d).nwchem.inp (generated) 012008124.b3lyp_6-31g(d).log.xz 012008124.td-b3lyp_6-31g+(d).inp 012008124.td-b3lyp_6-31g+(d).log.xz

012008124.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008124.td-b3lyp_6-31+g(d).gjf (generated)

012008124.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008124.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008124.mol 012008124.PUBCHEM 012008124.mol (via Jmol)
012008179.b3lyp_6-31g(d).inp

012008179.b3lyp_6-31g(d).qchem.inp (generated)

012008179.b3lyp_6-31g(d).gjf (generated)

012008179.b3lyp_6-31g(d).firefly.inp (generated)

012008179.b3lyp_6-31g(d).smash.inp (generated)

012008179.b3lyp_6-31g(d).nwchem.inp (generated) 012008179.b3lyp_6-31g(d).log.xz 012008179.td-b3lyp_6-31g+(d).inp 012008179.td-b3lyp_6-31g+(d).log.xz

012008179.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008179.td-b3lyp_6-31+g(d).gjf (generated)

012008179.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008179.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008179.mol 012008179.PUBCHEM 012008179.mol (via Jmol)
012008201.b3lyp_6-31g(d).inp

012008201.b3lyp_6-31g(d).qchem.inp (generated)

012008201.b3lyp_6-31g(d).gjf (generated)

012008201.b3lyp_6-31g(d).firefly.inp (generated)

012008201.b3lyp_6-31g(d).smash.inp (generated)

012008201.b3lyp_6-31g(d).nwchem.inp (generated) 012008201.b3lyp_6-31g(d).log.xz 012008201.td-b3lyp_6-31g+(d).inp 012008201.td-b3lyp_6-31g+(d).log.xz

012008201.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008201.td-b3lyp_6-31+g(d).gjf (generated)

012008201.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008201.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008201.mol 012008201.PUBCHEM 012008201.mol (via Jmol)
012008272.b3lyp_6-31g(d).inp

012008272.b3lyp_6-31g(d).qchem.inp (generated)

012008272.b3lyp_6-31g(d).gjf (generated)

012008272.b3lyp_6-31g(d).firefly.inp (generated)

012008272.b3lyp_6-31g(d).smash.inp (generated)

012008272.b3lyp_6-31g(d).nwchem.inp (generated) 012008272.b3lyp_6-31g(d).log.xz 012008272.td-b3lyp_6-31g+(d).inp 012008272.td-b3lyp_6-31g+(d).log.xz

012008272.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008272.td-b3lyp_6-31+g(d).gjf (generated)

012008272.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008272.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008272.mol 012008272.PUBCHEM 012008272.mol (via Jmol)
012008273.b3lyp_6-31g(d).inp

012008273.b3lyp_6-31g(d).qchem.inp (generated)

012008273.b3lyp_6-31g(d).gjf (generated)

012008273.b3lyp_6-31g(d).firefly.inp (generated)

012008273.b3lyp_6-31g(d).smash.inp (generated)

012008273.b3lyp_6-31g(d).nwchem.inp (generated) 012008273.b3lyp_6-31g(d).log.xz 012008273.td-b3lyp_6-31g+(d).inp 012008273.td-b3lyp_6-31g+(d).log.xz

012008273.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008273.td-b3lyp_6-31+g(d).gjf (generated)

012008273.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008273.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008273.mol 012008273.PUBCHEM 012008273.mol (via Jmol)
012008284.b3lyp_6-31g(d).inp

012008284.b3lyp_6-31g(d).qchem.inp (generated)

012008284.b3lyp_6-31g(d).gjf (generated)

012008284.b3lyp_6-31g(d).firefly.inp (generated)

012008284.b3lyp_6-31g(d).smash.inp (generated)

012008284.b3lyp_6-31g(d).nwchem.inp (generated) 012008284.b3lyp_6-31g(d).log.xz 012008284.td-b3lyp_6-31g+(d).inp 012008284.td-b3lyp_6-31g+(d).log.xz

012008284.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008284.td-b3lyp_6-31+g(d).gjf (generated)

012008284.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008284.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008284.mol 012008284.PUBCHEM 012008284.mol (via Jmol)
012008325.b3lyp_6-31g(d).inp

012008325.b3lyp_6-31g(d).qchem.inp (generated)

012008325.b3lyp_6-31g(d).gjf (generated)

012008325.b3lyp_6-31g(d).firefly.inp (generated)

012008325.b3lyp_6-31g(d).smash.inp (generated)

012008325.b3lyp_6-31g(d).nwchem.inp (generated) 012008325.b3lyp_6-31g(d).log.xz 012008325.td-b3lyp_6-31g+(d).inp 012008325.td-b3lyp_6-31g+(d).log.xz

012008325.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008325.td-b3lyp_6-31+g(d).gjf (generated)

012008325.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008325.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008325.mol 012008325.PUBCHEM 012008325.mol (via Jmol)
012008380.b3lyp_6-31g(d).inp

012008380.b3lyp_6-31g(d).qchem.inp (generated)

012008380.b3lyp_6-31g(d).gjf (generated)

012008380.b3lyp_6-31g(d).firefly.inp (generated)

012008380.b3lyp_6-31g(d).smash.inp (generated)

012008380.b3lyp_6-31g(d).nwchem.inp (generated) 012008380.b3lyp_6-31g(d).log.xz 012008380.td-b3lyp_6-31g+(d).inp 012008380.td-b3lyp_6-31g+(d).log.xz

012008380.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008380.td-b3lyp_6-31+g(d).gjf (generated)

012008380.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008380.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008380.mol 012008380.PUBCHEM 012008380.mol (via Jmol)
012008431.b3lyp_6-31g(d).inp

012008431.b3lyp_6-31g(d).qchem.inp (generated)

012008431.b3lyp_6-31g(d).gjf (generated)

012008431.b3lyp_6-31g(d).firefly.inp (generated)

012008431.b3lyp_6-31g(d).smash.inp (generated)

012008431.b3lyp_6-31g(d).nwchem.inp (generated) 012008431.b3lyp_6-31g(d).log.xz 012008431.td-b3lyp_6-31g+(d).inp 012008431.td-b3lyp_6-31g+(d).log.xz

012008431.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008431.td-b3lyp_6-31+g(d).gjf (generated)

012008431.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008431.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008431.mol 012008431.PUBCHEM 012008431.mol (via Jmol)
012008482.b3lyp_6-31g(d).inp

012008482.b3lyp_6-31g(d).qchem.inp (generated)

012008482.b3lyp_6-31g(d).gjf (generated)

012008482.b3lyp_6-31g(d).firefly.inp (generated)

012008482.b3lyp_6-31g(d).smash.inp (generated)

012008482.b3lyp_6-31g(d).nwchem.inp (generated) 012008482.b3lyp_6-31g(d).log.xz 012008482.mol 012008482.PUBCHEM 012008482.mol (via Jmol)
012008554.b3lyp_6-31g(d).inp

012008554.b3lyp_6-31g(d).qchem.inp (generated)

012008554.b3lyp_6-31g(d).gjf (generated)

012008554.b3lyp_6-31g(d).firefly.inp (generated)

012008554.b3lyp_6-31g(d).smash.inp (generated)

012008554.b3lyp_6-31g(d).nwchem.inp (generated) 012008554.b3lyp_6-31g(d).log.xz 012008554.mol 012008554.PUBCHEM 012008554.mol (via Jmol)
012008585.b3lyp_6-31g(d).inp

012008585.b3lyp_6-31g(d).qchem.inp (generated)

012008585.b3lyp_6-31g(d).gjf (generated)

012008585.b3lyp_6-31g(d).firefly.inp (generated)

012008585.b3lyp_6-31g(d).smash.inp (generated)

012008585.b3lyp_6-31g(d).nwchem.inp (generated) 012008585.b3lyp_6-31g(d).log.xz 012008585.td-b3lyp_6-31g+(d).inp 012008585.td-b3lyp_6-31g+(d).log.xz

012008585.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008585.td-b3lyp_6-31+g(d).gjf (generated)

012008585.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008585.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008585.mol 012008585.PUBCHEM 012008585.mol (via Jmol)
012008628.b3lyp_6-31g(d).inp

012008628.b3lyp_6-31g(d).qchem.inp (generated)

012008628.b3lyp_6-31g(d).gjf (generated)

012008628.b3lyp_6-31g(d).firefly.inp (generated)

012008628.b3lyp_6-31g(d).smash.inp (generated)

012008628.b3lyp_6-31g(d).nwchem.inp (generated) 012008628.b3lyp_6-31g(d).log.xz 012008628.td-b3lyp_6-31g+(d).inp 012008628.td-b3lyp_6-31g+(d).log.xz

012008628.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008628.td-b3lyp_6-31+g(d).gjf (generated)

012008628.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008628.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008628.mol 012008628.PUBCHEM 012008628.mol (via Jmol)
012008672.b3lyp_6-31g(d).inp

012008672.b3lyp_6-31g(d).qchem.inp (generated)

012008672.b3lyp_6-31g(d).gjf (generated)

012008672.b3lyp_6-31g(d).firefly.inp (generated)

012008672.b3lyp_6-31g(d).smash.inp (generated)

012008672.b3lyp_6-31g(d).nwchem.inp (generated) 012008672.b3lyp_6-31g(d).log.xz 012008672.td-b3lyp_6-31g+(d).inp 012008672.td-b3lyp_6-31g+(d).log.xz

012008672.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008672.td-b3lyp_6-31+g(d).gjf (generated)

012008672.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008672.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008672.mol 012008672.PUBCHEM 012008672.mol (via Jmol)
012008673.b3lyp_6-31g(d).inp

012008673.b3lyp_6-31g(d).qchem.inp (generated)

012008673.b3lyp_6-31g(d).gjf (generated)

012008673.b3lyp_6-31g(d).firefly.inp (generated)

012008673.b3lyp_6-31g(d).smash.inp (generated)

012008673.b3lyp_6-31g(d).nwchem.inp (generated) 012008673.b3lyp_6-31g(d).log.xz 012008673.td-b3lyp_6-31g+(d).inp 012008673.td-b3lyp_6-31g+(d).log.xz

012008673.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008673.td-b3lyp_6-31+g(d).gjf (generated)

012008673.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008673.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008673.mol 012008673.PUBCHEM 012008673.mol (via Jmol)
012008674.b3lyp_6-31g(d).inp

012008674.b3lyp_6-31g(d).qchem.inp (generated)

012008674.b3lyp_6-31g(d).gjf (generated)

012008674.b3lyp_6-31g(d).firefly.inp (generated)

012008674.b3lyp_6-31g(d).smash.inp (generated)

012008674.b3lyp_6-31g(d).nwchem.inp (generated) 012008674.b3lyp_6-31g(d).log.xz 012008674.td-b3lyp_6-31g+(d).inp 012008674.td-b3lyp_6-31g+(d).log.xz

012008674.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008674.td-b3lyp_6-31+g(d).gjf (generated)

012008674.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008674.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008674.mol 012008674.PUBCHEM 012008674.mol (via Jmol)
012008675.b3lyp_6-31g(d).inp

012008675.b3lyp_6-31g(d).qchem.inp (generated)

012008675.b3lyp_6-31g(d).gjf (generated)

012008675.b3lyp_6-31g(d).firefly.inp (generated)

012008675.b3lyp_6-31g(d).smash.inp (generated)

012008675.b3lyp_6-31g(d).nwchem.inp (generated) 012008675.b3lyp_6-31g(d).log.xz 012008675.td-b3lyp_6-31g+(d).inp 012008675.td-b3lyp_6-31g+(d).log.xz

012008675.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008675.td-b3lyp_6-31+g(d).gjf (generated)

012008675.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008675.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008675.mol 012008675.PUBCHEM 012008675.mol (via Jmol)
012008676.b3lyp_6-31g(d).inp

012008676.b3lyp_6-31g(d).qchem.inp (generated)

012008676.b3lyp_6-31g(d).gjf (generated)

012008676.b3lyp_6-31g(d).firefly.inp (generated)

012008676.b3lyp_6-31g(d).smash.inp (generated)

012008676.b3lyp_6-31g(d).nwchem.inp (generated) 012008676.b3lyp_6-31g(d).log.xz 012008676.td-b3lyp_6-31g+(d).inp 012008676.td-b3lyp_6-31g+(d).log.xz

012008676.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008676.td-b3lyp_6-31+g(d).gjf (generated)

012008676.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008676.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008676.mol 012008676.PUBCHEM 012008676.mol (via Jmol)
012008677.b3lyp_6-31g(d).inp

012008677.b3lyp_6-31g(d).qchem.inp (generated)

012008677.b3lyp_6-31g(d).gjf (generated)

012008677.b3lyp_6-31g(d).firefly.inp (generated)

012008677.b3lyp_6-31g(d).smash.inp (generated)

012008677.b3lyp_6-31g(d).nwchem.inp (generated) 012008677.b3lyp_6-31g(d).log.xz 012008677.mol 012008677.PUBCHEM 012008677.mol (via Jmol)
012008689.b3lyp_6-31g(d).inp

012008689.b3lyp_6-31g(d).qchem.inp (generated)

012008689.b3lyp_6-31g(d).gjf (generated)

012008689.b3lyp_6-31g(d).firefly.inp (generated)

012008689.b3lyp_6-31g(d).smash.inp (generated)

012008689.b3lyp_6-31g(d).nwchem.inp (generated) 012008689.b3lyp_6-31g(d).log.xz 012008689.td-b3lyp_6-31g+(d).inp 012008689.td-b3lyp_6-31g+(d).log.xz

012008689.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008689.td-b3lyp_6-31+g(d).gjf (generated)

012008689.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008689.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008689.mol 012008689.PUBCHEM 012008689.mol (via Jmol)
012008691.b3lyp_6-31g(d).inp

012008691.b3lyp_6-31g(d).qchem.inp (generated)

012008691.b3lyp_6-31g(d).gjf (generated)

012008691.b3lyp_6-31g(d).firefly.inp (generated)

012008691.b3lyp_6-31g(d).smash.inp (generated)

012008691.b3lyp_6-31g(d).nwchem.inp (generated) 012008691.b3lyp_6-31g(d).log.xz 012008691.td-b3lyp_6-31g+(d).inp 012008691.td-b3lyp_6-31g+(d).log.xz

012008691.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008691.td-b3lyp_6-31+g(d).gjf (generated)

012008691.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008691.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008691.mol 012008691.PUBCHEM 012008691.mol (via Jmol)
012008703.b3lyp_6-31g(d).inp

012008703.b3lyp_6-31g(d).qchem.inp (generated)

012008703.b3lyp_6-31g(d).gjf (generated)

012008703.b3lyp_6-31g(d).firefly.inp (generated)

012008703.b3lyp_6-31g(d).smash.inp (generated)

012008703.b3lyp_6-31g(d).nwchem.inp (generated) 012008703.b3lyp_6-31g(d).log.xz 012008703.td-b3lyp_6-31g+(d).inp 012008703.td-b3lyp_6-31g+(d).log.xz

012008703.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008703.td-b3lyp_6-31+g(d).gjf (generated)

012008703.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008703.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008703.mol 012008703.PUBCHEM 012008703.mol (via Jmol)
012008704.b3lyp_6-31g(d).inp

012008704.b3lyp_6-31g(d).qchem.inp (generated)

012008704.b3lyp_6-31g(d).gjf (generated)

012008704.b3lyp_6-31g(d).firefly.inp (generated)

012008704.b3lyp_6-31g(d).smash.inp (generated)

012008704.b3lyp_6-31g(d).nwchem.inp (generated) 012008704.b3lyp_6-31g(d).log.xz 012008704.td-b3lyp_6-31g+(d).inp 012008704.td-b3lyp_6-31g+(d).log.xz

012008704.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008704.td-b3lyp_6-31+g(d).gjf (generated)

012008704.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008704.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008704.mol 012008704.PUBCHEM 012008704.mol (via Jmol)
012008705.b3lyp_6-31g(d).inp

012008705.b3lyp_6-31g(d).qchem.inp (generated)

012008705.b3lyp_6-31g(d).gjf (generated)

012008705.b3lyp_6-31g(d).firefly.inp (generated)

012008705.b3lyp_6-31g(d).smash.inp (generated)

012008705.b3lyp_6-31g(d).nwchem.inp (generated) 012008705.b3lyp_6-31g(d).log.xz 012008705.td-b3lyp_6-31g+(d).inp 012008705.td-b3lyp_6-31g+(d).log.xz

012008705.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008705.td-b3lyp_6-31+g(d).gjf (generated)

012008705.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008705.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008705.mol 012008705.PUBCHEM 012008705.mol (via Jmol)
012008723.b3lyp_6-31g(d).inp

012008723.b3lyp_6-31g(d).qchem.inp (generated)

012008723.b3lyp_6-31g(d).gjf (generated)

012008723.b3lyp_6-31g(d).firefly.inp (generated)

012008723.b3lyp_6-31g(d).smash.inp (generated)

012008723.b3lyp_6-31g(d).nwchem.inp (generated) 012008723.b3lyp_6-31g(d).log.xz 012008723.td-b3lyp_6-31g+(d).inp 012008723.td-b3lyp_6-31g+(d).log.xz

012008723.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008723.td-b3lyp_6-31+g(d).gjf (generated)

012008723.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008723.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008723.mol 012008723.PUBCHEM 012008723.mol (via Jmol)
012008724.b3lyp_6-31g(d).inp

012008724.b3lyp_6-31g(d).qchem.inp (generated)

012008724.b3lyp_6-31g(d).gjf (generated)

012008724.b3lyp_6-31g(d).firefly.inp (generated)

012008724.b3lyp_6-31g(d).smash.inp (generated)

012008724.b3lyp_6-31g(d).nwchem.inp (generated) 012008724.b3lyp_6-31g(d).log.xz 012008724.mol 012008724.PUBCHEM 012008724.mol (via Jmol)
012008736.b3lyp_6-31g(d).inp

012008736.b3lyp_6-31g(d).qchem.inp (generated)

012008736.b3lyp_6-31g(d).gjf (generated)

012008736.b3lyp_6-31g(d).firefly.inp (generated)

012008736.b3lyp_6-31g(d).smash.inp (generated)

012008736.b3lyp_6-31g(d).nwchem.inp (generated) 012008736.b3lyp_6-31g(d).log.xz 012008736.td-b3lyp_6-31g+(d).inp 012008736.td-b3lyp_6-31g+(d).log.xz

012008736.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008736.td-b3lyp_6-31+g(d).gjf (generated)

012008736.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008736.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008736.mol 012008736.PUBCHEM 012008736.mol (via Jmol)
012008737.b3lyp_6-31g(d).inp

012008737.b3lyp_6-31g(d).qchem.inp (generated)

012008737.b3lyp_6-31g(d).gjf (generated)

012008737.b3lyp_6-31g(d).firefly.inp (generated)

012008737.b3lyp_6-31g(d).smash.inp (generated)

012008737.b3lyp_6-31g(d).nwchem.inp (generated) 012008737.b3lyp_6-31g(d).log.xz 012008737.td-b3lyp_6-31g+(d).inp 012008737.td-b3lyp_6-31g+(d).log.xz

012008737.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008737.td-b3lyp_6-31+g(d).gjf (generated)

012008737.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008737.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008737.mol 012008737.PUBCHEM 012008737.mol (via Jmol)
012008739.b3lyp_6-31g(d).inp

012008739.b3lyp_6-31g(d).qchem.inp (generated)

012008739.b3lyp_6-31g(d).gjf (generated)

012008739.b3lyp_6-31g(d).firefly.inp (generated)

012008739.b3lyp_6-31g(d).smash.inp (generated)

012008739.b3lyp_6-31g(d).nwchem.inp (generated) 012008739.b3lyp_6-31g(d).log.xz 012008739.mol 012008739.PUBCHEM 012008739.mol (via Jmol)
012008779.b3lyp_6-31g(d).inp

012008779.b3lyp_6-31g(d).qchem.inp (generated)

012008779.b3lyp_6-31g(d).gjf (generated)

012008779.b3lyp_6-31g(d).firefly.inp (generated)

012008779.b3lyp_6-31g(d).smash.inp (generated)

012008779.b3lyp_6-31g(d).nwchem.inp (generated) 012008779.b3lyp_6-31g(d).log.xz 012008779.td-b3lyp_6-31g+(d).inp 012008779.td-b3lyp_6-31g+(d).log.xz

012008779.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008779.td-b3lyp_6-31+g(d).gjf (generated)

012008779.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008779.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008779.mol 012008779.PUBCHEM 012008779.mol (via Jmol)
012008781.b3lyp_6-31g(d).inp

012008781.b3lyp_6-31g(d).qchem.inp (generated)

012008781.b3lyp_6-31g(d).gjf (generated)

012008781.b3lyp_6-31g(d).firefly.inp (generated)

012008781.b3lyp_6-31g(d).smash.inp (generated)

012008781.b3lyp_6-31g(d).nwchem.inp (generated) 012008781.b3lyp_6-31g(d).log.xz 012008781.td-b3lyp_6-31g+(d).inp 012008781.td-b3lyp_6-31g+(d).log.xz

012008781.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008781.td-b3lyp_6-31+g(d).gjf (generated)

012008781.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008781.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008781.mol 012008781.PUBCHEM 012008781.mol (via Jmol)
012008793.b3lyp_6-31g(d).inp

012008793.b3lyp_6-31g(d).qchem.inp (generated)

012008793.b3lyp_6-31g(d).gjf (generated)

012008793.b3lyp_6-31g(d).firefly.inp (generated)

012008793.b3lyp_6-31g(d).smash.inp (generated)

012008793.b3lyp_6-31g(d).nwchem.inp (generated) 012008793.b3lyp_6-31g(d).log.xz 012008793.td-b3lyp_6-31g+(d).inp 012008793.td-b3lyp_6-31g+(d).log.xz

012008793.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008793.td-b3lyp_6-31+g(d).gjf (generated)

012008793.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008793.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008793.mol 012008793.PUBCHEM 012008793.mol (via Jmol)
012008794.b3lyp_6-31g(d).inp

012008794.b3lyp_6-31g(d).qchem.inp (generated)

012008794.b3lyp_6-31g(d).gjf (generated)

012008794.b3lyp_6-31g(d).firefly.inp (generated)

012008794.b3lyp_6-31g(d).smash.inp (generated)

012008794.b3lyp_6-31g(d).nwchem.inp (generated) 012008794.b3lyp_6-31g(d).log.xz 012008794.td-b3lyp_6-31g+(d).inp 012008794.td-b3lyp_6-31g+(d).log.xz

012008794.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008794.td-b3lyp_6-31+g(d).gjf (generated)

012008794.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008794.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008794.mol 012008794.PUBCHEM 012008794.mol (via Jmol)
012008803.b3lyp_6-31g(d).inp

012008803.b3lyp_6-31g(d).qchem.inp (generated)

012008803.b3lyp_6-31g(d).gjf (generated)

012008803.b3lyp_6-31g(d).firefly.inp (generated)

012008803.b3lyp_6-31g(d).smash.inp (generated)

012008803.b3lyp_6-31g(d).nwchem.inp (generated) 012008803.b3lyp_6-31g(d).log.xz 012008803.mol 012008803.PUBCHEM 012008803.mol (via Jmol)
012008815.b3lyp_6-31g(d).inp

012008815.b3lyp_6-31g(d).qchem.inp (generated)

012008815.b3lyp_6-31g(d).gjf (generated)

012008815.b3lyp_6-31g(d).firefly.inp (generated)

012008815.b3lyp_6-31g(d).smash.inp (generated)

012008815.b3lyp_6-31g(d).nwchem.inp (generated) 012008815.b3lyp_6-31g(d).log.xz 012008815.td-b3lyp_6-31g+(d).inp 012008815.td-b3lyp_6-31g+(d).log.xz

012008815.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008815.td-b3lyp_6-31+g(d).gjf (generated)

012008815.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008815.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008815.mol 012008815.PUBCHEM 012008815.mol (via Jmol)
012008819.b3lyp_6-31g(d).inp

012008819.b3lyp_6-31g(d).qchem.inp (generated)

012008819.b3lyp_6-31g(d).gjf (generated)

012008819.b3lyp_6-31g(d).firefly.inp (generated)

012008819.b3lyp_6-31g(d).smash.inp (generated)

012008819.b3lyp_6-31g(d).nwchem.inp (generated) 012008819.b3lyp_6-31g(d).log.xz 012008819.td-b3lyp_6-31g+(d).inp 012008819.td-b3lyp_6-31g+(d).log.xz

012008819.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008819.td-b3lyp_6-31+g(d).gjf (generated)

012008819.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008819.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008819.mol 012008819.PUBCHEM 012008819.mol (via Jmol)
012008823.b3lyp_6-31g(d).inp

012008823.b3lyp_6-31g(d).qchem.inp (generated)

012008823.b3lyp_6-31g(d).gjf (generated)

012008823.b3lyp_6-31g(d).firefly.inp (generated)

012008823.b3lyp_6-31g(d).smash.inp (generated)

012008823.b3lyp_6-31g(d).nwchem.inp (generated) 012008823.b3lyp_6-31g(d).log.xz 012008823.td-b3lyp_6-31g+(d).inp 012008823.td-b3lyp_6-31g+(d).log.xz

012008823.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008823.td-b3lyp_6-31+g(d).gjf (generated)

012008823.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008823.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008823.mol 012008823.PUBCHEM 012008823.mol (via Jmol)
012008839.b3lyp_6-31g(d).inp

012008839.b3lyp_6-31g(d).qchem.inp (generated)

012008839.b3lyp_6-31g(d).gjf (generated)

012008839.b3lyp_6-31g(d).firefly.inp (generated)

012008839.b3lyp_6-31g(d).smash.inp (generated)

012008839.b3lyp_6-31g(d).nwchem.inp (generated) 012008839.b3lyp_6-31g(d).log.xz 012008839.mol 012008839.PUBCHEM 012008839.mol (via Jmol)
012008849.b3lyp_6-31g(d).inp

012008849.b3lyp_6-31g(d).qchem.inp (generated)

012008849.b3lyp_6-31g(d).gjf (generated)

012008849.b3lyp_6-31g(d).firefly.inp (generated)

012008849.b3lyp_6-31g(d).smash.inp (generated)

012008849.b3lyp_6-31g(d).nwchem.inp (generated) 012008849.b3lyp_6-31g(d).log.xz 012008849.td-b3lyp_6-31g+(d).inp 012008849.td-b3lyp_6-31g+(d).log.xz

012008849.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008849.td-b3lyp_6-31+g(d).gjf (generated)

012008849.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008849.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008849.mol 012008849.PUBCHEM 012008849.mol (via Jmol)
012008860.b3lyp_6-31g(d).inp

012008860.b3lyp_6-31g(d).qchem.inp (generated)

012008860.b3lyp_6-31g(d).gjf (generated)

012008860.b3lyp_6-31g(d).firefly.inp (generated)

012008860.b3lyp_6-31g(d).smash.inp (generated)

012008860.b3lyp_6-31g(d).nwchem.inp (generated) 012008860.b3lyp_6-31g(d).log.xz 012008860.td-b3lyp_6-31g+(d).inp 012008860.td-b3lyp_6-31g+(d).log.xz

012008860.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008860.td-b3lyp_6-31+g(d).gjf (generated)

012008860.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008860.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008860.mol 012008860.PUBCHEM 012008860.mol (via Jmol)
012008861.b3lyp_6-31g(d).inp

012008861.b3lyp_6-31g(d).qchem.inp (generated)

012008861.b3lyp_6-31g(d).gjf (generated)

012008861.b3lyp_6-31g(d).firefly.inp (generated)

012008861.b3lyp_6-31g(d).smash.inp (generated)

012008861.b3lyp_6-31g(d).nwchem.inp (generated) 012008861.b3lyp_6-31g(d).log.xz 012008861.td-b3lyp_6-31g+(d).inp 012008861.td-b3lyp_6-31g+(d).log.xz

012008861.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008861.td-b3lyp_6-31+g(d).gjf (generated)

012008861.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008861.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008861.mol 012008861.PUBCHEM 012008861.mol (via Jmol)
012008872.b3lyp_6-31g(d).inp

012008872.b3lyp_6-31g(d).qchem.inp (generated)

012008872.b3lyp_6-31g(d).gjf (generated)

012008872.b3lyp_6-31g(d).firefly.inp (generated)

012008872.b3lyp_6-31g(d).smash.inp (generated)

012008872.b3lyp_6-31g(d).nwchem.inp (generated) 012008872.b3lyp_6-31g(d).log.xz 012008872.td-b3lyp_6-31g+(d).inp 012008872.td-b3lyp_6-31g+(d).log.xz

012008872.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008872.td-b3lyp_6-31+g(d).gjf (generated)

012008872.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008872.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008872.mol 012008872.PUBCHEM 012008872.mol (via Jmol)
012008876.b3lyp_6-31g(d).inp

012008876.b3lyp_6-31g(d).qchem.inp (generated)

012008876.b3lyp_6-31g(d).gjf (generated)

012008876.b3lyp_6-31g(d).firefly.inp (generated)

012008876.b3lyp_6-31g(d).smash.inp (generated)

012008876.b3lyp_6-31g(d).nwchem.inp (generated) 012008876.b3lyp_6-31g(d).log.xz 012008876.td-b3lyp_6-31g+(d).inp 012008876.td-b3lyp_6-31g+(d).log.xz

012008876.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008876.td-b3lyp_6-31+g(d).gjf (generated)

012008876.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008876.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008876.mol 012008876.PUBCHEM 012008876.mol (via Jmol)
012008881.b3lyp_6-31g(d).inp

012008881.b3lyp_6-31g(d).qchem.inp (generated)

012008881.b3lyp_6-31g(d).gjf (generated)

012008881.b3lyp_6-31g(d).firefly.inp (generated)

012008881.b3lyp_6-31g(d).smash.inp (generated)

012008881.b3lyp_6-31g(d).nwchem.inp (generated) 012008881.b3lyp_6-31g(d).log.xz 012008881.td-b3lyp_6-31g+(d).inp 012008881.td-b3lyp_6-31g+(d).log.xz

012008881.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008881.td-b3lyp_6-31+g(d).gjf (generated)

012008881.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008881.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008881.mol 012008881.PUBCHEM 012008881.mol (via Jmol)
012008882.b3lyp_6-31g(d).inp

012008882.b3lyp_6-31g(d).qchem.inp (generated)

012008882.b3lyp_6-31g(d).gjf (generated)

012008882.b3lyp_6-31g(d).firefly.inp (generated)

012008882.b3lyp_6-31g(d).smash.inp (generated)

012008882.b3lyp_6-31g(d).nwchem.inp (generated) 012008882.b3lyp_6-31g(d).log.xz 012008882.td-b3lyp_6-31g+(d).inp 012008882.td-b3lyp_6-31g+(d).log.xz

012008882.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008882.td-b3lyp_6-31+g(d).gjf (generated)

012008882.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008882.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008882.mol 012008882.PUBCHEM 012008882.mol (via Jmol)
012008886.b3lyp_6-31g(d).inp

012008886.b3lyp_6-31g(d).qchem.inp (generated)

012008886.b3lyp_6-31g(d).gjf (generated)

012008886.b3lyp_6-31g(d).firefly.inp (generated)

012008886.b3lyp_6-31g(d).smash.inp (generated)

012008886.b3lyp_6-31g(d).nwchem.inp (generated) 012008886.b3lyp_6-31g(d).log.xz 012008886.td-b3lyp_6-31g+(d).inp 012008886.td-b3lyp_6-31g+(d).log.xz

012008886.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008886.td-b3lyp_6-31+g(d).gjf (generated)

012008886.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008886.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008886.mol 012008886.PUBCHEM 012008886.mol (via Jmol)
012008890.b3lyp_6-31g(d).inp

012008890.b3lyp_6-31g(d).qchem.inp (generated)

012008890.b3lyp_6-31g(d).gjf (generated)

012008890.b3lyp_6-31g(d).firefly.inp (generated)

012008890.b3lyp_6-31g(d).smash.inp (generated)

012008890.b3lyp_6-31g(d).nwchem.inp (generated) 012008890.b3lyp_6-31g(d).log.xz 012008890.td-b3lyp_6-31g+(d).inp 012008890.td-b3lyp_6-31g+(d).log.xz

012008890.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008890.td-b3lyp_6-31+g(d).gjf (generated)

012008890.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008890.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008890.mol 012008890.PUBCHEM 012008890.mol (via Jmol)
012008974.b3lyp_6-31g(d).inp

012008974.b3lyp_6-31g(d).qchem.inp (generated)

012008974.b3lyp_6-31g(d).gjf (generated)

012008974.b3lyp_6-31g(d).firefly.inp (generated)

012008974.b3lyp_6-31g(d).smash.inp (generated)

012008974.b3lyp_6-31g(d).nwchem.inp (generated) 012008974.b3lyp_6-31g(d).log.xz 012008974.td-b3lyp_6-31g+(d).inp 012008974.td-b3lyp_6-31g+(d).log.xz

012008974.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008974.td-b3lyp_6-31+g(d).gjf (generated)

012008974.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008974.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008974.mol 012008974.PUBCHEM 012008974.mol (via Jmol)
012008983.b3lyp_6-31g(d).inp

012008983.b3lyp_6-31g(d).qchem.inp (generated)

012008983.b3lyp_6-31g(d).gjf (generated)

012008983.b3lyp_6-31g(d).firefly.inp (generated)

012008983.b3lyp_6-31g(d).smash.inp (generated)

012008983.b3lyp_6-31g(d).nwchem.inp (generated) 012008983.b3lyp_6-31g(d).log.xz 012008983.td-b3lyp_6-31g+(d).inp 012008983.td-b3lyp_6-31g+(d).log.xz

012008983.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008983.td-b3lyp_6-31+g(d).gjf (generated)

012008983.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008983.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008983.mol 012008983.PUBCHEM 012008983.mol (via Jmol)
012008984.b3lyp_6-31g(d).inp

012008984.b3lyp_6-31g(d).qchem.inp (generated)

012008984.b3lyp_6-31g(d).gjf (generated)

012008984.b3lyp_6-31g(d).firefly.inp (generated)

012008984.b3lyp_6-31g(d).smash.inp (generated)

012008984.b3lyp_6-31g(d).nwchem.inp (generated) 012008984.b3lyp_6-31g(d).log.xz 012008984.td-b3lyp_6-31g+(d).inp 012008984.td-b3lyp_6-31g+(d).log.xz

012008984.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008984.td-b3lyp_6-31+g(d).gjf (generated)

012008984.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008984.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008984.mol 012008984.PUBCHEM 012008984.mol (via Jmol)
012008985.b3lyp_6-31g(d).inp

012008985.b3lyp_6-31g(d).qchem.inp (generated)

012008985.b3lyp_6-31g(d).gjf (generated)

012008985.b3lyp_6-31g(d).firefly.inp (generated)

012008985.b3lyp_6-31g(d).smash.inp (generated)

012008985.b3lyp_6-31g(d).nwchem.inp (generated) 012008985.b3lyp_6-31g(d).log.xz 012008985.td-b3lyp_6-31g+(d).inp 012008985.td-b3lyp_6-31g+(d).log.xz

012008985.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008985.td-b3lyp_6-31+g(d).gjf (generated)

012008985.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008985.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008985.mol 012008985.PUBCHEM 012008985.mol (via Jmol)
012008986.b3lyp_6-31g(d).inp

012008986.b3lyp_6-31g(d).qchem.inp (generated)

012008986.b3lyp_6-31g(d).gjf (generated)

012008986.b3lyp_6-31g(d).firefly.inp (generated)

012008986.b3lyp_6-31g(d).smash.inp (generated)

012008986.b3lyp_6-31g(d).nwchem.inp (generated) 012008986.b3lyp_6-31g(d).log.xz 012008986.mol 012008986.PUBCHEM 012008986.mol (via Jmol)
012008987.b3lyp_6-31g(d).inp

012008987.b3lyp_6-31g(d).qchem.inp (generated)

012008987.b3lyp_6-31g(d).gjf (generated)

012008987.b3lyp_6-31g(d).firefly.inp (generated)

012008987.b3lyp_6-31g(d).smash.inp (generated)

012008987.b3lyp_6-31g(d).nwchem.inp (generated) 012008987.b3lyp_6-31g(d).log.xz 012008987.td-b3lyp_6-31g+(d).inp 012008987.td-b3lyp_6-31g+(d).log.xz

012008987.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008987.td-b3lyp_6-31+g(d).gjf (generated)

012008987.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008987.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008987.mol 012008987.PUBCHEM 012008987.mol (via Jmol)
012008989.b3lyp_6-31g(d).inp

012008989.b3lyp_6-31g(d).qchem.inp (generated)

012008989.b3lyp_6-31g(d).gjf (generated)

012008989.b3lyp_6-31g(d).firefly.inp (generated)

012008989.b3lyp_6-31g(d).smash.inp (generated)

012008989.b3lyp_6-31g(d).nwchem.inp (generated) 012008989.b3lyp_6-31g(d).log.xz 012008989.mol 012008989.PUBCHEM 012008989.mol (via Jmol)
012008990.b3lyp_6-31g(d).inp

012008990.b3lyp_6-31g(d).qchem.inp (generated)

012008990.b3lyp_6-31g(d).gjf (generated)

012008990.b3lyp_6-31g(d).firefly.inp (generated)

012008990.b3lyp_6-31g(d).smash.inp (generated)

012008990.b3lyp_6-31g(d).nwchem.inp (generated) 012008990.b3lyp_6-31g(d).log.xz 012008990.td-b3lyp_6-31g+(d).inp 012008990.td-b3lyp_6-31g+(d).log.xz

012008990.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008990.td-b3lyp_6-31+g(d).gjf (generated)

012008990.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008990.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008990.mol 012008990.PUBCHEM 012008990.mol (via Jmol)
012008992.b3lyp_6-31g(d).inp

012008992.b3lyp_6-31g(d).qchem.inp (generated)

012008992.b3lyp_6-31g(d).gjf (generated)

012008992.b3lyp_6-31g(d).firefly.inp (generated)

012008992.b3lyp_6-31g(d).smash.inp (generated)

012008992.b3lyp_6-31g(d).nwchem.inp (generated) 012008992.b3lyp_6-31g(d).log.xz 012008992.td-b3lyp_6-31g+(d).inp 012008992.td-b3lyp_6-31g+(d).log.xz

012008992.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008992.td-b3lyp_6-31+g(d).gjf (generated)

012008992.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008992.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008992.mol 012008992.PUBCHEM 012008992.mol (via Jmol)
012008993.b3lyp_6-31g(d).inp

012008993.b3lyp_6-31g(d).qchem.inp (generated)

012008993.b3lyp_6-31g(d).gjf (generated)

012008993.b3lyp_6-31g(d).firefly.inp (generated)

012008993.b3lyp_6-31g(d).smash.inp (generated)

012008993.b3lyp_6-31g(d).nwchem.inp (generated) 012008993.b3lyp_6-31g(d).log.xz 012008993.td-b3lyp_6-31g+(d).inp 012008993.td-b3lyp_6-31g+(d).log.xz

012008993.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008993.td-b3lyp_6-31+g(d).gjf (generated)

012008993.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008993.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008993.mol 012008993.PUBCHEM 012008993.mol (via Jmol)
012008995.b3lyp_6-31g(d).inp

012008995.b3lyp_6-31g(d).qchem.inp (generated)

012008995.b3lyp_6-31g(d).gjf (generated)

012008995.b3lyp_6-31g(d).firefly.inp (generated)

012008995.b3lyp_6-31g(d).smash.inp (generated)

012008995.b3lyp_6-31g(d).nwchem.inp (generated) 012008995.b3lyp_6-31g(d).log.xz 012008995.td-b3lyp_6-31g+(d).inp 012008995.td-b3lyp_6-31g+(d).log.xz

012008995.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008995.td-b3lyp_6-31+g(d).gjf (generated)

012008995.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008995.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008995.mol 012008995.PUBCHEM 012008995.mol (via Jmol)
012008998.b3lyp_6-31g(d).inp

012008998.b3lyp_6-31g(d).qchem.inp (generated)

012008998.b3lyp_6-31g(d).gjf (generated)

012008998.b3lyp_6-31g(d).firefly.inp (generated)

012008998.b3lyp_6-31g(d).smash.inp (generated)

012008998.b3lyp_6-31g(d).nwchem.inp (generated) 012008998.b3lyp_6-31g(d).log.xz 012008998.td-b3lyp_6-31g+(d).inp 012008998.td-b3lyp_6-31g+(d).log.xz

012008998.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008998.td-b3lyp_6-31+g(d).gjf (generated)

012008998.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008998.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008998.mol 012008998.PUBCHEM 012008998.mol (via Jmol)
012008999.b3lyp_6-31g(d).inp

012008999.b3lyp_6-31g(d).qchem.inp (generated)

012008999.b3lyp_6-31g(d).gjf (generated)

012008999.b3lyp_6-31g(d).firefly.inp (generated)

012008999.b3lyp_6-31g(d).smash.inp (generated)

012008999.b3lyp_6-31g(d).nwchem.inp (generated) 012008999.b3lyp_6-31g(d).log.xz 012008999.td-b3lyp_6-31g+(d).inp 012008999.td-b3lyp_6-31g+(d).log.xz

012008999.td-b3lyp_6-31+g(d).qchem.inp (generated)

012008999.td-b3lyp_6-31+g(d).gjf (generated)

012008999.td-b3lyp_6-31+g(d).firefly.inp (generated)

012008999.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012008999.mol 012008999.PUBCHEM 012008999.mol (via Jmol)
012009019.b3lyp_6-31g(d).inp

012009019.b3lyp_6-31g(d).qchem.inp (generated)

012009019.b3lyp_6-31g(d).gjf (generated)

012009019.b3lyp_6-31g(d).firefly.inp (generated)

012009019.b3lyp_6-31g(d).smash.inp (generated)

012009019.b3lyp_6-31g(d).nwchem.inp (generated) 012009019.b3lyp_6-31g(d).log.xz 012009019.td-b3lyp_6-31g+(d).inp 012009019.td-b3lyp_6-31g+(d).log.xz

012009019.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009019.td-b3lyp_6-31+g(d).gjf (generated)

012009019.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009019.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009019.mol 012009019.PUBCHEM 012009019.mol (via Jmol)
012009021.b3lyp_6-31g(d).inp

012009021.b3lyp_6-31g(d).qchem.inp (generated)

012009021.b3lyp_6-31g(d).gjf (generated)

012009021.b3lyp_6-31g(d).firefly.inp (generated)

012009021.b3lyp_6-31g(d).smash.inp (generated)

012009021.b3lyp_6-31g(d).nwchem.inp (generated) 012009021.b3lyp_6-31g(d).log.xz 012009021.td-b3lyp_6-31g+(d).inp 012009021.td-b3lyp_6-31g+(d).log.xz

012009021.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009021.td-b3lyp_6-31+g(d).gjf (generated)

012009021.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009021.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009021.mol 012009021.PUBCHEM 012009021.mol (via Jmol)
012009022.b3lyp_6-31g(d).inp

012009022.b3lyp_6-31g(d).qchem.inp (generated)

012009022.b3lyp_6-31g(d).gjf (generated)

012009022.b3lyp_6-31g(d).firefly.inp (generated)

012009022.b3lyp_6-31g(d).smash.inp (generated)

012009022.b3lyp_6-31g(d).nwchem.inp (generated) 012009022.b3lyp_6-31g(d).log.xz 012009022.td-b3lyp_6-31g+(d).inp 012009022.td-b3lyp_6-31g+(d).log.xz

012009022.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009022.td-b3lyp_6-31+g(d).gjf (generated)

012009022.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009022.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009022.mol 012009022.PUBCHEM 012009022.mol (via Jmol)
012009030.b3lyp_6-31g(d).inp

012009030.b3lyp_6-31g(d).qchem.inp (generated)

012009030.b3lyp_6-31g(d).gjf (generated)

012009030.b3lyp_6-31g(d).firefly.inp (generated)

012009030.b3lyp_6-31g(d).smash.inp (generated)

012009030.b3lyp_6-31g(d).nwchem.inp (generated) 012009030.b3lyp_6-31g(d).log.xz 012009030.td-b3lyp_6-31g+(d).inp 012009030.td-b3lyp_6-31g+(d).log.xz

012009030.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009030.td-b3lyp_6-31+g(d).gjf (generated)

012009030.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009030.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009030.mol 012009030.PUBCHEM 012009030.mol (via Jmol)
012009044.b3lyp_6-31g(d).inp

012009044.b3lyp_6-31g(d).qchem.inp (generated)

012009044.b3lyp_6-31g(d).gjf (generated)

012009044.b3lyp_6-31g(d).firefly.inp (generated)

012009044.b3lyp_6-31g(d).smash.inp (generated)

012009044.b3lyp_6-31g(d).nwchem.inp (generated) 012009044.b3lyp_6-31g(d).log.xz 012009044.td-b3lyp_6-31g+(d).inp 012009044.td-b3lyp_6-31g+(d).log.xz

012009044.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009044.td-b3lyp_6-31+g(d).gjf (generated)

012009044.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009044.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009044.mol 012009044.PUBCHEM 012009044.mol (via Jmol)
012009046.b3lyp_6-31g(d).inp

012009046.b3lyp_6-31g(d).qchem.inp (generated)

012009046.b3lyp_6-31g(d).gjf (generated)

012009046.b3lyp_6-31g(d).firefly.inp (generated)

012009046.b3lyp_6-31g(d).smash.inp (generated)

012009046.b3lyp_6-31g(d).nwchem.inp (generated) 012009046.b3lyp_6-31g(d).log.xz 012009046.td-b3lyp_6-31g+(d).inp 012009046.td-b3lyp_6-31g+(d).log.xz

012009046.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009046.td-b3lyp_6-31+g(d).gjf (generated)

012009046.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009046.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009046.mol 012009046.PUBCHEM 012009046.mol (via Jmol)
012009048.b3lyp_6-31g(d).inp

012009048.b3lyp_6-31g(d).qchem.inp (generated)

012009048.b3lyp_6-31g(d).gjf (generated)

012009048.b3lyp_6-31g(d).firefly.inp (generated)

012009048.b3lyp_6-31g(d).smash.inp (generated)

012009048.b3lyp_6-31g(d).nwchem.inp (generated) 012009048.b3lyp_6-31g(d).log.xz 012009048.td-b3lyp_6-31g+(d).inp 012009048.td-b3lyp_6-31g+(d).log.xz

012009048.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009048.td-b3lyp_6-31+g(d).gjf (generated)

012009048.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009048.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009048.mol 012009048.PUBCHEM 012009048.mol (via Jmol)
012009049.b3lyp_6-31g(d).inp

012009049.b3lyp_6-31g(d).qchem.inp (generated)

012009049.b3lyp_6-31g(d).gjf (generated)

012009049.b3lyp_6-31g(d).firefly.inp (generated)

012009049.b3lyp_6-31g(d).smash.inp (generated)

012009049.b3lyp_6-31g(d).nwchem.inp (generated) 012009049.b3lyp_6-31g(d).log.xz 012009049.td-b3lyp_6-31g+(d).inp 012009049.td-b3lyp_6-31g+(d).log.xz

012009049.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009049.td-b3lyp_6-31+g(d).gjf (generated)

012009049.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009049.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009049.mol 012009049.PUBCHEM 012009049.mol (via Jmol)
012009051.b3lyp_6-31g(d).inp

012009051.b3lyp_6-31g(d).qchem.inp (generated)

012009051.b3lyp_6-31g(d).gjf (generated)

012009051.b3lyp_6-31g(d).firefly.inp (generated)

012009051.b3lyp_6-31g(d).smash.inp (generated)

012009051.b3lyp_6-31g(d).nwchem.inp (generated) 012009051.b3lyp_6-31g(d).log.xz 012009051.td-b3lyp_6-31g+(d).inp 012009051.td-b3lyp_6-31g+(d).log.xz

012009051.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009051.td-b3lyp_6-31+g(d).gjf (generated)

012009051.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009051.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009051.mol 012009051.PUBCHEM 012009051.mol (via Jmol)
012009072.b3lyp_6-31g(d).inp

012009072.b3lyp_6-31g(d).qchem.inp (generated)

012009072.b3lyp_6-31g(d).gjf (generated)

012009072.b3lyp_6-31g(d).firefly.inp (generated)

012009072.b3lyp_6-31g(d).smash.inp (generated)

012009072.b3lyp_6-31g(d).nwchem.inp (generated) 012009072.b3lyp_6-31g(d).log.xz 012009072.td-b3lyp_6-31g+(d).inp 012009072.td-b3lyp_6-31g+(d).log.xz

012009072.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009072.td-b3lyp_6-31+g(d).gjf (generated)

012009072.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009072.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009072.mol 012009072.PUBCHEM 012009072.mol (via Jmol)
012009087.b3lyp_6-31g(d).inp

012009087.b3lyp_6-31g(d).qchem.inp (generated)

012009087.b3lyp_6-31g(d).gjf (generated)

012009087.b3lyp_6-31g(d).firefly.inp (generated)

012009087.b3lyp_6-31g(d).smash.inp (generated)

012009087.b3lyp_6-31g(d).nwchem.inp (generated) 012009087.b3lyp_6-31g(d).log.xz 012009087.td-b3lyp_6-31g+(d).inp 012009087.td-b3lyp_6-31g+(d).log.xz

012009087.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009087.td-b3lyp_6-31+g(d).gjf (generated)

012009087.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009087.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009087.mol 012009087.PUBCHEM 012009087.mol (via Jmol)
012009089.b3lyp_6-31g(d).inp

012009089.b3lyp_6-31g(d).qchem.inp (generated)

012009089.b3lyp_6-31g(d).gjf (generated)

012009089.b3lyp_6-31g(d).firefly.inp (generated)

012009089.b3lyp_6-31g(d).smash.inp (generated)

012009089.b3lyp_6-31g(d).nwchem.inp (generated) 012009089.b3lyp_6-31g(d).log.xz 012009089.td-b3lyp_6-31g+(d).inp 012009089.td-b3lyp_6-31g+(d).log.xz

012009089.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009089.td-b3lyp_6-31+g(d).gjf (generated)

012009089.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009089.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009089.mol 012009089.PUBCHEM 012009089.mol (via Jmol)
012009090.b3lyp_6-31g(d).inp

012009090.b3lyp_6-31g(d).qchem.inp (generated)

012009090.b3lyp_6-31g(d).gjf (generated)

012009090.b3lyp_6-31g(d).firefly.inp (generated)

012009090.b3lyp_6-31g(d).smash.inp (generated)

012009090.b3lyp_6-31g(d).nwchem.inp (generated) 012009090.b3lyp_6-31g(d).log.xz 012009090.td-b3lyp_6-31g+(d).inp 012009090.td-b3lyp_6-31g+(d).log.xz

012009090.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009090.td-b3lyp_6-31+g(d).gjf (generated)

012009090.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009090.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009090.mol 012009090.PUBCHEM 012009090.mol (via Jmol)
012009091.b3lyp_6-31g(d).inp

012009091.b3lyp_6-31g(d).qchem.inp (generated)

012009091.b3lyp_6-31g(d).gjf (generated)

012009091.b3lyp_6-31g(d).firefly.inp (generated)

012009091.b3lyp_6-31g(d).smash.inp (generated)

012009091.b3lyp_6-31g(d).nwchem.inp (generated) 012009091.b3lyp_6-31g(d).log.xz 012009091.td-b3lyp_6-31g+(d).inp 012009091.td-b3lyp_6-31g+(d).log.xz

012009091.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009091.td-b3lyp_6-31+g(d).gjf (generated)

012009091.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009091.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009091.mol 012009091.PUBCHEM 012009091.mol (via Jmol)
012009093.b3lyp_6-31g(d).inp

012009093.b3lyp_6-31g(d).qchem.inp (generated)

012009093.b3lyp_6-31g(d).gjf (generated)

012009093.b3lyp_6-31g(d).firefly.inp (generated)

012009093.b3lyp_6-31g(d).smash.inp (generated)

012009093.b3lyp_6-31g(d).nwchem.inp (generated) 012009093.b3lyp_6-31g(d).log.xz 012009093.td-b3lyp_6-31g+(d).inp 012009093.td-b3lyp_6-31g+(d).log.xz

012009093.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009093.td-b3lyp_6-31+g(d).gjf (generated)

012009093.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009093.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009093.mol 012009093.PUBCHEM 012009093.mol (via Jmol)
012009094.b3lyp_6-31g(d).inp

012009094.b3lyp_6-31g(d).qchem.inp (generated)

012009094.b3lyp_6-31g(d).gjf (generated)

012009094.b3lyp_6-31g(d).firefly.inp (generated)

012009094.b3lyp_6-31g(d).smash.inp (generated)

012009094.b3lyp_6-31g(d).nwchem.inp (generated) 012009094.b3lyp_6-31g(d).log.xz 012009094.td-b3lyp_6-31g+(d).inp 012009094.td-b3lyp_6-31g+(d).log.xz

012009094.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009094.td-b3lyp_6-31+g(d).gjf (generated)

012009094.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009094.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009094.mol 012009094.PUBCHEM 012009094.mol (via Jmol)
012009120.b3lyp_6-31g(d).inp

012009120.b3lyp_6-31g(d).qchem.inp (generated)

012009120.b3lyp_6-31g(d).gjf (generated)

012009120.b3lyp_6-31g(d).firefly.inp (generated)

012009120.b3lyp_6-31g(d).smash.inp (generated)

012009120.b3lyp_6-31g(d).nwchem.inp (generated) 012009120.b3lyp_6-31g(d).log.xz 012009120.td-b3lyp_6-31g+(d).inp 012009120.td-b3lyp_6-31g+(d).log.xz

012009120.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009120.td-b3lyp_6-31+g(d).gjf (generated)

012009120.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009120.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009120.mol 012009120.PUBCHEM 012009120.mol (via Jmol)
012009136.b3lyp_6-31g(d).inp

012009136.b3lyp_6-31g(d).qchem.inp (generated)

012009136.b3lyp_6-31g(d).gjf (generated)

012009136.b3lyp_6-31g(d).firefly.inp (generated)

012009136.b3lyp_6-31g(d).smash.inp (generated)

012009136.b3lyp_6-31g(d).nwchem.inp (generated) 012009136.b3lyp_6-31g(d).log.xz 012009136.mol 012009136.PUBCHEM 012009136.mol (via Jmol)
012009137.b3lyp_6-31g(d).inp

012009137.b3lyp_6-31g(d).qchem.inp (generated)

012009137.b3lyp_6-31g(d).gjf (generated)

012009137.b3lyp_6-31g(d).firefly.inp (generated)

012009137.b3lyp_6-31g(d).smash.inp (generated)

012009137.b3lyp_6-31g(d).nwchem.inp (generated) 012009137.b3lyp_6-31g(d).log.xz 012009137.td-b3lyp_6-31g+(d).inp 012009137.td-b3lyp_6-31g+(d).log.xz

012009137.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009137.td-b3lyp_6-31+g(d).gjf (generated)

012009137.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009137.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009137.mol 012009137.PUBCHEM 012009137.mol (via Jmol)
012009138.b3lyp_6-31g(d).inp

012009138.b3lyp_6-31g(d).qchem.inp (generated)

012009138.b3lyp_6-31g(d).gjf (generated)

012009138.b3lyp_6-31g(d).firefly.inp (generated)

012009138.b3lyp_6-31g(d).smash.inp (generated)

012009138.b3lyp_6-31g(d).nwchem.inp (generated) 012009138.b3lyp_6-31g(d).log.xz 012009138.td-b3lyp_6-31g+(d).inp 012009138.td-b3lyp_6-31g+(d).log.xz

012009138.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009138.td-b3lyp_6-31+g(d).gjf (generated)

012009138.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009138.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009138.mol 012009138.PUBCHEM 012009138.mol (via Jmol)
012009145.b3lyp_6-31g(d).inp

012009145.b3lyp_6-31g(d).qchem.inp (generated)

012009145.b3lyp_6-31g(d).gjf (generated)

012009145.b3lyp_6-31g(d).firefly.inp (generated)

012009145.b3lyp_6-31g(d).smash.inp (generated)

012009145.b3lyp_6-31g(d).nwchem.inp (generated) 012009145.b3lyp_6-31g(d).log.xz 012009145.td-b3lyp_6-31g+(d).inp 012009145.td-b3lyp_6-31g+(d).log.xz

012009145.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009145.td-b3lyp_6-31+g(d).gjf (generated)

012009145.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009145.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009145.mol 012009145.PUBCHEM 012009145.mol (via Jmol)
012009171.b3lyp_6-31g(d).inp

012009171.b3lyp_6-31g(d).qchem.inp (generated)

012009171.b3lyp_6-31g(d).gjf (generated)

012009171.b3lyp_6-31g(d).firefly.inp (generated)

012009171.b3lyp_6-31g(d).smash.inp (generated)

012009171.b3lyp_6-31g(d).nwchem.inp (generated) 012009171.b3lyp_6-31g(d).log.xz 012009171.td-b3lyp_6-31g+(d).inp 012009171.td-b3lyp_6-31g+(d).log.xz

012009171.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009171.td-b3lyp_6-31+g(d).gjf (generated)

012009171.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009171.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009171.mol 012009171.PUBCHEM 012009171.mol (via Jmol)
012009311.b3lyp_6-31g(d).inp

012009311.b3lyp_6-31g(d).qchem.inp (generated)

012009311.b3lyp_6-31g(d).gjf (generated)

012009311.b3lyp_6-31g(d).firefly.inp (generated)

012009311.b3lyp_6-31g(d).smash.inp (generated)

012009311.b3lyp_6-31g(d).nwchem.inp (generated) 012009311.b3lyp_6-31g(d).log.xz 012009311.mol 012009311.PUBCHEM 012009311.mol (via Jmol)
012009330.b3lyp_6-31g(d).inp

012009330.b3lyp_6-31g(d).qchem.inp (generated)

012009330.b3lyp_6-31g(d).gjf (generated)

012009330.b3lyp_6-31g(d).firefly.inp (generated)

012009330.b3lyp_6-31g(d).smash.inp (generated)

012009330.b3lyp_6-31g(d).nwchem.inp (generated) 012009330.b3lyp_6-31g(d).log.xz 012009330.mol 012009330.PUBCHEM 012009330.mol (via Jmol)
012009338.b3lyp_6-31g(d).inp

012009338.b3lyp_6-31g(d).qchem.inp (generated)

012009338.b3lyp_6-31g(d).gjf (generated)

012009338.b3lyp_6-31g(d).firefly.inp (generated)

012009338.b3lyp_6-31g(d).smash.inp (generated)

012009338.b3lyp_6-31g(d).nwchem.inp (generated) 012009338.b3lyp_6-31g(d).log.xz 012009338.mol 012009338.PUBCHEM 012009338.mol (via Jmol)
012009347.b3lyp_6-31g(d).inp

012009347.b3lyp_6-31g(d).qchem.inp (generated)

012009347.b3lyp_6-31g(d).gjf (generated)

012009347.b3lyp_6-31g(d).firefly.inp (generated)

012009347.b3lyp_6-31g(d).smash.inp (generated)

012009347.b3lyp_6-31g(d).nwchem.inp (generated) 012009347.b3lyp_6-31g(d).log.xz 012009347.td-b3lyp_6-31g+(d).inp 012009347.td-b3lyp_6-31g+(d).log.xz

012009347.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009347.td-b3lyp_6-31+g(d).gjf (generated)

012009347.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009347.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009347.mol 012009347.PUBCHEM 012009347.mol (via Jmol)
012009349.b3lyp_6-31g(d).inp

012009349.b3lyp_6-31g(d).qchem.inp (generated)

012009349.b3lyp_6-31g(d).gjf (generated)

012009349.b3lyp_6-31g(d).firefly.inp (generated)

012009349.b3lyp_6-31g(d).smash.inp (generated)

012009349.b3lyp_6-31g(d).nwchem.inp (generated) 012009349.b3lyp_6-31g(d).log.xz 012009349.td-b3lyp_6-31g+(d).inp 012009349.td-b3lyp_6-31g+(d).log.xz

012009349.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009349.td-b3lyp_6-31+g(d).gjf (generated)

012009349.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009349.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009349.mol 012009349.PUBCHEM 012009349.mol (via Jmol)
012009355.b3lyp_6-31g(d).inp

012009355.b3lyp_6-31g(d).qchem.inp (generated)

012009355.b3lyp_6-31g(d).gjf (generated)

012009355.b3lyp_6-31g(d).firefly.inp (generated)

012009355.b3lyp_6-31g(d).smash.inp (generated)

012009355.b3lyp_6-31g(d).nwchem.inp (generated) 012009355.b3lyp_6-31g(d).log.xz 012009355.td-b3lyp_6-31g+(d).inp 012009355.td-b3lyp_6-31g+(d).log.xz

012009355.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009355.td-b3lyp_6-31+g(d).gjf (generated)

012009355.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009355.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009355.mol 012009355.PUBCHEM 012009355.mol (via Jmol)
012009356.b3lyp_6-31g(d).inp

012009356.b3lyp_6-31g(d).qchem.inp (generated)

012009356.b3lyp_6-31g(d).gjf (generated)

012009356.b3lyp_6-31g(d).firefly.inp (generated)

012009356.b3lyp_6-31g(d).smash.inp (generated)

012009356.b3lyp_6-31g(d).nwchem.inp (generated) 012009356.b3lyp_6-31g(d).log.xz 012009356.td-b3lyp_6-31g+(d).inp 012009356.td-b3lyp_6-31g+(d).log.xz

012009356.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009356.td-b3lyp_6-31+g(d).gjf (generated)

012009356.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009356.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009356.mol 012009356.PUBCHEM 012009356.mol (via Jmol)
012009357.b3lyp_6-31g(d).inp

012009357.b3lyp_6-31g(d).qchem.inp (generated)

012009357.b3lyp_6-31g(d).gjf (generated)

012009357.b3lyp_6-31g(d).firefly.inp (generated)

012009357.b3lyp_6-31g(d).smash.inp (generated)

012009357.b3lyp_6-31g(d).nwchem.inp (generated) 012009357.b3lyp_6-31g(d).log.xz 012009357.td-b3lyp_6-31g+(d).inp 012009357.td-b3lyp_6-31g+(d).log.xz

012009357.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009357.td-b3lyp_6-31+g(d).gjf (generated)

012009357.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009357.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009357.mol 012009357.PUBCHEM 012009357.mol (via Jmol)
012009371.b3lyp_6-31g(d).inp

012009371.b3lyp_6-31g(d).qchem.inp (generated)

012009371.b3lyp_6-31g(d).gjf (generated)

012009371.b3lyp_6-31g(d).firefly.inp (generated)

012009371.b3lyp_6-31g(d).smash.inp (generated)

012009371.b3lyp_6-31g(d).nwchem.inp (generated) 012009371.b3lyp_6-31g(d).log.xz 012009371.td-b3lyp_6-31g+(d).inp 012009371.td-b3lyp_6-31g+(d).log.xz

012009371.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009371.td-b3lyp_6-31+g(d).gjf (generated)

012009371.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009371.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009371.mol 012009371.PUBCHEM 012009371.mol (via Jmol)
012009373.b3lyp_6-31g(d).inp

012009373.b3lyp_6-31g(d).qchem.inp (generated)

012009373.b3lyp_6-31g(d).gjf (generated)

012009373.b3lyp_6-31g(d).firefly.inp (generated)

012009373.b3lyp_6-31g(d).smash.inp (generated)

012009373.b3lyp_6-31g(d).nwchem.inp (generated) 012009373.b3lyp_6-31g(d).log.xz 012009373.td-b3lyp_6-31g+(d).inp 012009373.td-b3lyp_6-31g+(d).log.xz

012009373.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009373.td-b3lyp_6-31+g(d).gjf (generated)

012009373.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009373.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009373.mol 012009373.PUBCHEM 012009373.mol (via Jmol)
012009374.b3lyp_6-31g(d).inp

012009374.b3lyp_6-31g(d).qchem.inp (generated)

012009374.b3lyp_6-31g(d).gjf (generated)

012009374.b3lyp_6-31g(d).firefly.inp (generated)

012009374.b3lyp_6-31g(d).smash.inp (generated)

012009374.b3lyp_6-31g(d).nwchem.inp (generated) 012009374.b3lyp_6-31g(d).log.xz 012009374.td-b3lyp_6-31g+(d).inp 012009374.td-b3lyp_6-31g+(d).log.xz

012009374.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009374.td-b3lyp_6-31+g(d).gjf (generated)

012009374.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009374.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009374.mol 012009374.PUBCHEM 012009374.mol (via Jmol)
012009375.b3lyp_6-31g(d).inp

012009375.b3lyp_6-31g(d).qchem.inp (generated)

012009375.b3lyp_6-31g(d).gjf (generated)

012009375.b3lyp_6-31g(d).firefly.inp (generated)

012009375.b3lyp_6-31g(d).smash.inp (generated)

012009375.b3lyp_6-31g(d).nwchem.inp (generated) 012009375.b3lyp_6-31g(d).log.xz 012009375.td-b3lyp_6-31g+(d).inp 012009375.td-b3lyp_6-31g+(d).log.xz

012009375.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009375.td-b3lyp_6-31+g(d).gjf (generated)

012009375.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009375.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009375.mol 012009375.PUBCHEM 012009375.mol (via Jmol)
012009376.b3lyp_6-31g(d).inp

012009376.b3lyp_6-31g(d).qchem.inp (generated)

012009376.b3lyp_6-31g(d).gjf (generated)

012009376.b3lyp_6-31g(d).firefly.inp (generated)

012009376.b3lyp_6-31g(d).smash.inp (generated)

012009376.b3lyp_6-31g(d).nwchem.inp (generated) 012009376.b3lyp_6-31g(d).log.xz 012009376.mol 012009376.PUBCHEM 012009376.mol (via Jmol)
012009380.b3lyp_6-31g(d).inp

012009380.b3lyp_6-31g(d).qchem.inp (generated)

012009380.b3lyp_6-31g(d).gjf (generated)

012009380.b3lyp_6-31g(d).firefly.inp (generated)

012009380.b3lyp_6-31g(d).smash.inp (generated)

012009380.b3lyp_6-31g(d).nwchem.inp (generated) 012009380.b3lyp_6-31g(d).log.xz 012009380.td-b3lyp_6-31g+(d).inp 012009380.td-b3lyp_6-31g+(d).log.xz

012009380.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009380.td-b3lyp_6-31+g(d).gjf (generated)

012009380.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009380.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009380.mol 012009380.PUBCHEM 012009380.mol (via Jmol)
012009381.b3lyp_6-31g(d).inp

012009381.b3lyp_6-31g(d).qchem.inp (generated)

012009381.b3lyp_6-31g(d).gjf (generated)

012009381.b3lyp_6-31g(d).firefly.inp (generated)

012009381.b3lyp_6-31g(d).smash.inp (generated)

012009381.b3lyp_6-31g(d).nwchem.inp (generated) 012009381.b3lyp_6-31g(d).log.xz 012009381.td-b3lyp_6-31g+(d).inp 012009381.td-b3lyp_6-31g+(d).log.xz

012009381.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009381.td-b3lyp_6-31+g(d).gjf (generated)

012009381.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009381.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009381.mol 012009381.PUBCHEM 012009381.mol (via Jmol)
012009382.b3lyp_6-31g(d).inp

012009382.b3lyp_6-31g(d).qchem.inp (generated)

012009382.b3lyp_6-31g(d).gjf (generated)

012009382.b3lyp_6-31g(d).firefly.inp (generated)

012009382.b3lyp_6-31g(d).smash.inp (generated)

012009382.b3lyp_6-31g(d).nwchem.inp (generated) 012009382.b3lyp_6-31g(d).log.xz 012009382.td-b3lyp_6-31g+(d).inp 012009382.td-b3lyp_6-31g+(d).log.xz

012009382.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009382.td-b3lyp_6-31+g(d).gjf (generated)

012009382.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009382.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009382.mol 012009382.PUBCHEM 012009382.mol (via Jmol)
012009383.b3lyp_6-31g(d).inp

012009383.b3lyp_6-31g(d).qchem.inp (generated)

012009383.b3lyp_6-31g(d).gjf (generated)

012009383.b3lyp_6-31g(d).firefly.inp (generated)

012009383.b3lyp_6-31g(d).smash.inp (generated)

012009383.b3lyp_6-31g(d).nwchem.inp (generated) 012009383.b3lyp_6-31g(d).log.xz 012009383.td-b3lyp_6-31g+(d).inp 012009383.td-b3lyp_6-31g+(d).log.xz

012009383.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009383.td-b3lyp_6-31+g(d).gjf (generated)

012009383.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009383.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009383.mol 012009383.PUBCHEM 012009383.mol (via Jmol)
012009390.b3lyp_6-31g(d).inp

012009390.b3lyp_6-31g(d).qchem.inp (generated)

012009390.b3lyp_6-31g(d).gjf (generated)

012009390.b3lyp_6-31g(d).firefly.inp (generated)

012009390.b3lyp_6-31g(d).smash.inp (generated)

012009390.b3lyp_6-31g(d).nwchem.inp (generated) 012009390.b3lyp_6-31g(d).log.xz 012009390.mol 012009390.PUBCHEM 012009390.mol (via Jmol)
012009426.b3lyp_6-31g(d).inp

012009426.b3lyp_6-31g(d).qchem.inp (generated)

012009426.b3lyp_6-31g(d).gjf (generated)

012009426.b3lyp_6-31g(d).firefly.inp (generated)

012009426.b3lyp_6-31g(d).smash.inp (generated)

012009426.b3lyp_6-31g(d).nwchem.inp (generated) 012009426.b3lyp_6-31g(d).log.xz 012009426.mol 012009426.PUBCHEM 012009426.mol (via Jmol)
012009451.b3lyp_6-31g(d).inp

012009451.b3lyp_6-31g(d).qchem.inp (generated)

012009451.b3lyp_6-31g(d).gjf (generated)

012009451.b3lyp_6-31g(d).firefly.inp (generated)

012009451.b3lyp_6-31g(d).smash.inp (generated)

012009451.b3lyp_6-31g(d).nwchem.inp (generated) 012009451.b3lyp_6-31g(d).log.xz 012009451.td-b3lyp_6-31g+(d).inp 012009451.td-b3lyp_6-31g+(d).log.xz

012009451.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009451.td-b3lyp_6-31+g(d).gjf (generated)

012009451.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009451.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009451.mol 012009451.PUBCHEM 012009451.mol (via Jmol)
012009490.b3lyp_6-31g(d).inp

012009490.b3lyp_6-31g(d).qchem.inp (generated)

012009490.b3lyp_6-31g(d).gjf (generated)

012009490.b3lyp_6-31g(d).firefly.inp (generated)

012009490.b3lyp_6-31g(d).smash.inp (generated)

012009490.b3lyp_6-31g(d).nwchem.inp (generated) 012009490.b3lyp_6-31g(d).log.xz 012009490.td-b3lyp_6-31g+(d).inp 012009490.td-b3lyp_6-31g+(d).log.xz

012009490.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009490.td-b3lyp_6-31+g(d).gjf (generated)

012009490.td-b3lyp_6-31+g(d).firefly.inp (generated)

012009490.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012009490.mol 012009490.PUBCHEM 012009490.mol (via Jmol)
012009498.b3lyp_6-31g(d).inp

012009498.b3lyp_6-31g(d).qchem.inp (generated)

012009498.b3lyp_6-31g(d).gjf (generated)

012009498.b3lyp_6-31g(d).firefly.inp (generated)

012009498.b3lyp_6-31g(d).smash.inp (generated)

012009498.b3lyp_6-31g(d).nwchem.inp (generated) 012009498.b3lyp_6-31g(d).log.xz 012009498.td-b3lyp_6-31g+(d).inp 012009498.td-b3lyp_6-31g+(d).log.xz

012009498.td-b3lyp_6-31+g(d).qchem.inp (generated)

012009498.td-b3lyp_6-31+g(d).gjf (generated)

012009498.td-b3lyp_6-31+g(d).firefly.inp (generated)