Index of

Last updated : Thu Aug 17 01:52:36 JST 2017
Total : 2740 (2501) in this page
055100001.b3lyp_6-31g(d).inp

055100001.b3lyp_6-31g(d).qchem.inp (generated)

055100001.b3lyp_6-31g(d).gjf (generated)

055100001.b3lyp_6-31g(d).firefly.inp (generated)

055100001.b3lyp_6-31g(d).smash.inp (generated)

055100001.b3lyp_6-31g(d).nwchem.inp (generated) 055100001.b3lyp_6-31g(d).log.xz 055100001.td-b3lyp_6-31g+(d).inp 055100001.td-b3lyp_6-31g+(d).log.xz

055100001.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100001.td-b3lyp_6-31+g(d).gjf (generated)

055100001.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100001.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100001.mol 055100001.PUBCHEM 055100001.mol (via Jmol)
055100009.b3lyp_6-31g(d).inp

055100009.b3lyp_6-31g(d).qchem.inp (generated)

055100009.b3lyp_6-31g(d).gjf (generated)

055100009.b3lyp_6-31g(d).firefly.inp (generated)

055100009.b3lyp_6-31g(d).smash.inp (generated)

055100009.b3lyp_6-31g(d).nwchem.inp (generated) 055100009.b3lyp_6-31g(d).log.xz 055100009.td-b3lyp_6-31g+(d).inp 055100009.td-b3lyp_6-31g+(d).log.xz

055100009.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100009.td-b3lyp_6-31+g(d).gjf (generated)

055100009.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100009.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100009.mol 055100009.PUBCHEM 055100009.mol (via Jmol)
055100024.b3lyp_6-31g(d).inp

055100024.b3lyp_6-31g(d).qchem.inp (generated)

055100024.b3lyp_6-31g(d).gjf (generated)

055100024.b3lyp_6-31g(d).firefly.inp (generated)

055100024.b3lyp_6-31g(d).smash.inp (generated)

055100024.b3lyp_6-31g(d).nwchem.inp (generated) 055100024.b3lyp_6-31g(d).log.xz 055100024.td-b3lyp_6-31g+(d).inp 055100024.td-b3lyp_6-31g+(d).log.xz

055100024.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100024.td-b3lyp_6-31+g(d).gjf (generated)

055100024.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100024.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100024.mol 055100024.PUBCHEM 055100024.mol (via Jmol)
055100030.b3lyp_6-31g(d).inp

055100030.b3lyp_6-31g(d).qchem.inp (generated)

055100030.b3lyp_6-31g(d).gjf (generated)

055100030.b3lyp_6-31g(d).firefly.inp (generated)

055100030.b3lyp_6-31g(d).smash.inp (generated)

055100030.b3lyp_6-31g(d).nwchem.inp (generated) 055100030.b3lyp_6-31g(d).log.xz 055100030.td-b3lyp_6-31g+(d).inp 055100030.td-b3lyp_6-31g+(d).log.xz

055100030.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100030.td-b3lyp_6-31+g(d).gjf (generated)

055100030.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100030.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100030.mol 055100030.PUBCHEM 055100030.mol (via Jmol)
055100046.b3lyp_6-31g(d).inp

055100046.b3lyp_6-31g(d).qchem.inp (generated)

055100046.b3lyp_6-31g(d).gjf (generated)

055100046.b3lyp_6-31g(d).firefly.inp (generated)

055100046.b3lyp_6-31g(d).smash.inp (generated)

055100046.b3lyp_6-31g(d).nwchem.inp (generated) 055100046.b3lyp_6-31g(d).log.xz 055100046.td-b3lyp_6-31g+(d).inp 055100046.td-b3lyp_6-31g+(d).log.xz

055100046.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100046.td-b3lyp_6-31+g(d).gjf (generated)

055100046.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100046.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100046.mol 055100046.PUBCHEM 055100046.mol (via Jmol)
055100050.b3lyp_6-31g(d).inp

055100050.b3lyp_6-31g(d).qchem.inp (generated)

055100050.b3lyp_6-31g(d).gjf (generated)

055100050.b3lyp_6-31g(d).firefly.inp (generated)

055100050.b3lyp_6-31g(d).smash.inp (generated)

055100050.b3lyp_6-31g(d).nwchem.inp (generated) 055100050.b3lyp_6-31g(d).log.xz 055100050.td-b3lyp_6-31g+(d).inp 055100050.td-b3lyp_6-31g+(d).log.xz

055100050.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100050.td-b3lyp_6-31+g(d).gjf (generated)

055100050.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100050.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100050.mol 055100050.PUBCHEM 055100050.mol (via Jmol)
055100053.b3lyp_6-31g(d).inp

055100053.b3lyp_6-31g(d).qchem.inp (generated)

055100053.b3lyp_6-31g(d).gjf (generated)

055100053.b3lyp_6-31g(d).firefly.inp (generated)

055100053.b3lyp_6-31g(d).smash.inp (generated)

055100053.b3lyp_6-31g(d).nwchem.inp (generated) 055100053.b3lyp_6-31g(d).log.xz 055100053.td-b3lyp_6-31g+(d).inp 055100053.td-b3lyp_6-31g+(d).log.xz

055100053.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100053.td-b3lyp_6-31+g(d).gjf (generated)

055100053.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100053.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100053.mol 055100053.PUBCHEM 055100053.mol (via Jmol)
055100059.b3lyp_6-31g(d).inp

055100059.b3lyp_6-31g(d).qchem.inp (generated)

055100059.b3lyp_6-31g(d).gjf (generated)

055100059.b3lyp_6-31g(d).firefly.inp (generated)

055100059.b3lyp_6-31g(d).smash.inp (generated)

055100059.b3lyp_6-31g(d).nwchem.inp (generated) 055100059.b3lyp_6-31g(d).log.xz 055100059.td-b3lyp_6-31g+(d).inp 055100059.td-b3lyp_6-31g+(d).log.xz

055100059.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100059.td-b3lyp_6-31+g(d).gjf (generated)

055100059.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100059.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100059.mol 055100059.PUBCHEM 055100059.mol (via Jmol)
055100060.b3lyp_6-31g(d).inp

055100060.b3lyp_6-31g(d).qchem.inp (generated)

055100060.b3lyp_6-31g(d).gjf (generated)

055100060.b3lyp_6-31g(d).firefly.inp (generated)

055100060.b3lyp_6-31g(d).smash.inp (generated)

055100060.b3lyp_6-31g(d).nwchem.inp (generated) 055100060.b3lyp_6-31g(d).log.xz 055100060.td-b3lyp_6-31g+(d).inp 055100060.td-b3lyp_6-31g+(d).log.xz

055100060.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100060.td-b3lyp_6-31+g(d).gjf (generated)

055100060.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100060.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100060.mol 055100060.PUBCHEM 055100060.mol (via Jmol)
055100072.b3lyp_6-31g(d).inp

055100072.b3lyp_6-31g(d).qchem.inp (generated)

055100072.b3lyp_6-31g(d).gjf (generated)

055100072.b3lyp_6-31g(d).firefly.inp (generated)

055100072.b3lyp_6-31g(d).smash.inp (generated)

055100072.b3lyp_6-31g(d).nwchem.inp (generated) 055100072.b3lyp_6-31g(d).log.xz 055100072.td-b3lyp_6-31g+(d).inp 055100072.td-b3lyp_6-31g+(d).log.xz

055100072.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100072.td-b3lyp_6-31+g(d).gjf (generated)

055100072.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100072.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100072.mol 055100072.PUBCHEM 055100072.mol (via Jmol)
055100073.b3lyp_6-31g(d).inp

055100073.b3lyp_6-31g(d).qchem.inp (generated)

055100073.b3lyp_6-31g(d).gjf (generated)

055100073.b3lyp_6-31g(d).firefly.inp (generated)

055100073.b3lyp_6-31g(d).smash.inp (generated)

055100073.b3lyp_6-31g(d).nwchem.inp (generated) 055100073.b3lyp_6-31g(d).log.xz 055100073.mol 055100073.PUBCHEM 055100073.mol (via Jmol)
055100091.b3lyp_6-31g(d).inp

055100091.b3lyp_6-31g(d).qchem.inp (generated)

055100091.b3lyp_6-31g(d).gjf (generated)

055100091.b3lyp_6-31g(d).firefly.inp (generated)

055100091.b3lyp_6-31g(d).smash.inp (generated)

055100091.b3lyp_6-31g(d).nwchem.inp (generated) 055100091.b3lyp_6-31g(d).log.xz 055100091.td-b3lyp_6-31g+(d).inp 055100091.td-b3lyp_6-31g+(d).log.xz

055100091.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100091.td-b3lyp_6-31+g(d).gjf (generated)

055100091.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100091.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100091.mol 055100091.PUBCHEM 055100091.mol (via Jmol)
055100093.b3lyp_6-31g(d).inp

055100093.b3lyp_6-31g(d).qchem.inp (generated)

055100093.b3lyp_6-31g(d).gjf (generated)

055100093.b3lyp_6-31g(d).firefly.inp (generated)

055100093.b3lyp_6-31g(d).smash.inp (generated)

055100093.b3lyp_6-31g(d).nwchem.inp (generated) 055100093.b3lyp_6-31g(d).log.xz 055100093.td-b3lyp_6-31g+(d).inp 055100093.td-b3lyp_6-31g+(d).log.xz

055100093.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100093.td-b3lyp_6-31+g(d).gjf (generated)

055100093.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100093.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100093.mol 055100093.PUBCHEM 055100093.mol (via Jmol)
055100095.b3lyp_6-31g(d).inp

055100095.b3lyp_6-31g(d).qchem.inp (generated)

055100095.b3lyp_6-31g(d).gjf (generated)

055100095.b3lyp_6-31g(d).firefly.inp (generated)

055100095.b3lyp_6-31g(d).smash.inp (generated)

055100095.b3lyp_6-31g(d).nwchem.inp (generated) 055100095.b3lyp_6-31g(d).log.xz 055100095.td-b3lyp_6-31g+(d).inp 055100095.td-b3lyp_6-31g+(d).log.xz

055100095.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100095.td-b3lyp_6-31+g(d).gjf (generated)

055100095.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100095.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100095.mol 055100095.PUBCHEM 055100095.mol (via Jmol)
055100103.b3lyp_6-31g(d).inp

055100103.b3lyp_6-31g(d).qchem.inp (generated)

055100103.b3lyp_6-31g(d).gjf (generated)

055100103.b3lyp_6-31g(d).firefly.inp (generated)

055100103.b3lyp_6-31g(d).smash.inp (generated)

055100103.b3lyp_6-31g(d).nwchem.inp (generated) 055100103.b3lyp_6-31g(d).log.xz 055100103.td-b3lyp_6-31g+(d).inp 055100103.td-b3lyp_6-31g+(d).log.xz

055100103.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100103.td-b3lyp_6-31+g(d).gjf (generated)

055100103.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100103.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100103.mol 055100103.PUBCHEM 055100103.mol (via Jmol)
055100112.b3lyp_6-31g(d).inp

055100112.b3lyp_6-31g(d).qchem.inp (generated)

055100112.b3lyp_6-31g(d).gjf (generated)

055100112.b3lyp_6-31g(d).firefly.inp (generated)

055100112.b3lyp_6-31g(d).smash.inp (generated)

055100112.b3lyp_6-31g(d).nwchem.inp (generated) 055100112.b3lyp_6-31g(d).log.xz 055100112.td-b3lyp_6-31g+(d).inp 055100112.td-b3lyp_6-31g+(d).log.xz

055100112.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100112.td-b3lyp_6-31+g(d).gjf (generated)

055100112.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100112.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100112.mol 055100112.PUBCHEM 055100112.mol (via Jmol)
055100116.b3lyp_6-31g(d).inp

055100116.b3lyp_6-31g(d).qchem.inp (generated)

055100116.b3lyp_6-31g(d).gjf (generated)

055100116.b3lyp_6-31g(d).firefly.inp (generated)

055100116.b3lyp_6-31g(d).smash.inp (generated)

055100116.b3lyp_6-31g(d).nwchem.inp (generated) 055100116.b3lyp_6-31g(d).log.xz 055100116.mol 055100116.PUBCHEM 055100116.mol (via Jmol)
055100117.b3lyp_6-31g(d).inp

055100117.b3lyp_6-31g(d).qchem.inp (generated)

055100117.b3lyp_6-31g(d).gjf (generated)

055100117.b3lyp_6-31g(d).firefly.inp (generated)

055100117.b3lyp_6-31g(d).smash.inp (generated)

055100117.b3lyp_6-31g(d).nwchem.inp (generated) 055100117.b3lyp_6-31g(d).log.xz 055100117.mol 055100117.PUBCHEM 055100117.mol (via Jmol)
055100118.b3lyp_6-31g(d).inp

055100118.b3lyp_6-31g(d).qchem.inp (generated)

055100118.b3lyp_6-31g(d).gjf (generated)

055100118.b3lyp_6-31g(d).firefly.inp (generated)

055100118.b3lyp_6-31g(d).smash.inp (generated)

055100118.b3lyp_6-31g(d).nwchem.inp (generated) 055100118.b3lyp_6-31g(d).log.xz 055100118.td-b3lyp_6-31g+(d).inp 055100118.td-b3lyp_6-31g+(d).log.xz

055100118.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100118.td-b3lyp_6-31+g(d).gjf (generated)

055100118.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100118.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100118.mol 055100118.PUBCHEM 055100118.mol (via Jmol)
055100159.b3lyp_6-31g(d).inp

055100159.b3lyp_6-31g(d).qchem.inp (generated)

055100159.b3lyp_6-31g(d).gjf (generated)

055100159.b3lyp_6-31g(d).firefly.inp (generated)

055100159.b3lyp_6-31g(d).smash.inp (generated)

055100159.b3lyp_6-31g(d).nwchem.inp (generated) 055100159.b3lyp_6-31g(d).log.xz 055100159.td-b3lyp_6-31g+(d).inp 055100159.td-b3lyp_6-31g+(d).log.xz

055100159.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100159.td-b3lyp_6-31+g(d).gjf (generated)

055100159.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100159.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100159.mol 055100159.PUBCHEM 055100159.mol (via Jmol)
055100160.b3lyp_6-31g(d).inp

055100160.b3lyp_6-31g(d).qchem.inp (generated)

055100160.b3lyp_6-31g(d).gjf (generated)

055100160.b3lyp_6-31g(d).firefly.inp (generated)

055100160.b3lyp_6-31g(d).smash.inp (generated)

055100160.b3lyp_6-31g(d).nwchem.inp (generated) 055100160.b3lyp_6-31g(d).log.xz 055100160.td-b3lyp_6-31g+(d).inp 055100160.td-b3lyp_6-31g+(d).log.xz

055100160.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100160.td-b3lyp_6-31+g(d).gjf (generated)

055100160.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100160.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100160.mol 055100160.PUBCHEM 055100160.mol (via Jmol)
055100171.b3lyp_6-31g(d).inp

055100171.b3lyp_6-31g(d).qchem.inp (generated)

055100171.b3lyp_6-31g(d).gjf (generated)

055100171.b3lyp_6-31g(d).firefly.inp (generated)

055100171.b3lyp_6-31g(d).smash.inp (generated)

055100171.b3lyp_6-31g(d).nwchem.inp (generated) 055100171.b3lyp_6-31g(d).log.xz 055100171.td-b3lyp_6-31g+(d).inp 055100171.td-b3lyp_6-31g+(d).log.xz

055100171.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100171.td-b3lyp_6-31+g(d).gjf (generated)

055100171.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100171.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100171.mol 055100171.PUBCHEM 055100171.mol (via Jmol)
055100180.b3lyp_6-31g(d).inp

055100180.b3lyp_6-31g(d).qchem.inp (generated)

055100180.b3lyp_6-31g(d).gjf (generated)

055100180.b3lyp_6-31g(d).firefly.inp (generated)

055100180.b3lyp_6-31g(d).smash.inp (generated)

055100180.b3lyp_6-31g(d).nwchem.inp (generated) 055100180.b3lyp_6-31g(d).log.xz 055100180.td-b3lyp_6-31g+(d).inp 055100180.td-b3lyp_6-31g+(d).log.xz

055100180.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100180.td-b3lyp_6-31+g(d).gjf (generated)

055100180.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100180.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100180.mol 055100180.PUBCHEM 055100180.mol (via Jmol)
055100190.b3lyp_6-31g(d).inp

055100190.b3lyp_6-31g(d).qchem.inp (generated)

055100190.b3lyp_6-31g(d).gjf (generated)

055100190.b3lyp_6-31g(d).firefly.inp (generated)

055100190.b3lyp_6-31g(d).smash.inp (generated)

055100190.b3lyp_6-31g(d).nwchem.inp (generated) 055100190.b3lyp_6-31g(d).log.xz 055100190.mol 055100190.PUBCHEM 055100190.mol (via Jmol)
055100205.b3lyp_6-31g(d).inp

055100205.b3lyp_6-31g(d).qchem.inp (generated)

055100205.b3lyp_6-31g(d).gjf (generated)

055100205.b3lyp_6-31g(d).firefly.inp (generated)

055100205.b3lyp_6-31g(d).smash.inp (generated)

055100205.b3lyp_6-31g(d).nwchem.inp (generated) 055100205.b3lyp_6-31g(d).log.xz 055100205.td-b3lyp_6-31g+(d).inp 055100205.td-b3lyp_6-31g+(d).log.xz

055100205.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100205.td-b3lyp_6-31+g(d).gjf (generated)

055100205.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100205.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100205.mol 055100205.PUBCHEM 055100205.mol (via Jmol)
055100237.b3lyp_6-31g(d).inp

055100237.b3lyp_6-31g(d).qchem.inp (generated)

055100237.b3lyp_6-31g(d).gjf (generated)

055100237.b3lyp_6-31g(d).firefly.inp (generated)

055100237.b3lyp_6-31g(d).smash.inp (generated)

055100237.b3lyp_6-31g(d).nwchem.inp (generated) 055100237.b3lyp_6-31g(d).log.xz 055100237.td-b3lyp_6-31g+(d).inp 055100237.td-b3lyp_6-31g+(d).log.xz

055100237.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100237.td-b3lyp_6-31+g(d).gjf (generated)

055100237.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100237.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100237.mol 055100237.PUBCHEM 055100237.mol (via Jmol)
055100241.b3lyp_6-31g(d).inp

055100241.b3lyp_6-31g(d).qchem.inp (generated)

055100241.b3lyp_6-31g(d).gjf (generated)

055100241.b3lyp_6-31g(d).firefly.inp (generated)

055100241.b3lyp_6-31g(d).smash.inp (generated)

055100241.b3lyp_6-31g(d).nwchem.inp (generated) 055100241.b3lyp_6-31g(d).log.xz 055100241.td-b3lyp_6-31g+(d).inp 055100241.td-b3lyp_6-31g+(d).log.xz

055100241.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100241.td-b3lyp_6-31+g(d).gjf (generated)

055100241.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100241.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100241.mol 055100241.PUBCHEM 055100241.mol (via Jmol)
055100244.b3lyp_6-31g(d).inp

055100244.b3lyp_6-31g(d).qchem.inp (generated)

055100244.b3lyp_6-31g(d).gjf (generated)

055100244.b3lyp_6-31g(d).firefly.inp (generated)

055100244.b3lyp_6-31g(d).smash.inp (generated)

055100244.b3lyp_6-31g(d).nwchem.inp (generated) 055100244.b3lyp_6-31g(d).log.xz 055100244.td-b3lyp_6-31g+(d).inp 055100244.td-b3lyp_6-31g+(d).log.xz

055100244.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100244.td-b3lyp_6-31+g(d).gjf (generated)

055100244.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100244.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100244.mol 055100244.PUBCHEM 055100244.mol (via Jmol)
055100272.b3lyp_6-31g(d).inp

055100272.b3lyp_6-31g(d).qchem.inp (generated)

055100272.b3lyp_6-31g(d).gjf (generated)

055100272.b3lyp_6-31g(d).firefly.inp (generated)

055100272.b3lyp_6-31g(d).smash.inp (generated)

055100272.b3lyp_6-31g(d).nwchem.inp (generated) 055100272.b3lyp_6-31g(d).log.xz 055100272.td-b3lyp_6-31g+(d).inp 055100272.td-b3lyp_6-31g+(d).log.xz

055100272.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100272.td-b3lyp_6-31+g(d).gjf (generated)

055100272.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100272.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100272.mol 055100272.PUBCHEM 055100272.mol (via Jmol)
055100285.b3lyp_6-31g(d).inp

055100285.b3lyp_6-31g(d).qchem.inp (generated)

055100285.b3lyp_6-31g(d).gjf (generated)

055100285.b3lyp_6-31g(d).firefly.inp (generated)

055100285.b3lyp_6-31g(d).smash.inp (generated)

055100285.b3lyp_6-31g(d).nwchem.inp (generated) 055100285.b3lyp_6-31g(d).log.xz 055100285.td-b3lyp_6-31g+(d).inp 055100285.td-b3lyp_6-31g+(d).log.xz

055100285.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100285.td-b3lyp_6-31+g(d).gjf (generated)

055100285.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100285.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100285.mol 055100285.PUBCHEM 055100285.mol (via Jmol)
055100290.b3lyp_6-31g(d).inp

055100290.b3lyp_6-31g(d).qchem.inp (generated)

055100290.b3lyp_6-31g(d).gjf (generated)

055100290.b3lyp_6-31g(d).firefly.inp (generated)

055100290.b3lyp_6-31g(d).smash.inp (generated)

055100290.b3lyp_6-31g(d).nwchem.inp (generated) 055100290.b3lyp_6-31g(d).log.xz 055100290.td-b3lyp_6-31g+(d).inp 055100290.td-b3lyp_6-31g+(d).log.xz

055100290.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100290.td-b3lyp_6-31+g(d).gjf (generated)

055100290.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100290.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100290.mol 055100290.PUBCHEM 055100290.mol (via Jmol)
055100292.b3lyp_6-31g(d).inp

055100292.b3lyp_6-31g(d).qchem.inp (generated)

055100292.b3lyp_6-31g(d).gjf (generated)

055100292.b3lyp_6-31g(d).firefly.inp (generated)

055100292.b3lyp_6-31g(d).smash.inp (generated)

055100292.b3lyp_6-31g(d).nwchem.inp (generated) 055100292.b3lyp_6-31g(d).log.xz 055100292.td-b3lyp_6-31g+(d).inp 055100292.td-b3lyp_6-31g+(d).log.xz

055100292.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100292.td-b3lyp_6-31+g(d).gjf (generated)

055100292.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100292.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100292.mol 055100292.PUBCHEM 055100292.mol (via Jmol)
055100295.b3lyp_6-31g(d).inp

055100295.b3lyp_6-31g(d).qchem.inp (generated)

055100295.b3lyp_6-31g(d).gjf (generated)

055100295.b3lyp_6-31g(d).firefly.inp (generated)

055100295.b3lyp_6-31g(d).smash.inp (generated)

055100295.b3lyp_6-31g(d).nwchem.inp (generated) 055100295.b3lyp_6-31g(d).log.xz 055100295.td-b3lyp_6-31g+(d).inp 055100295.td-b3lyp_6-31g+(d).log.xz

055100295.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100295.td-b3lyp_6-31+g(d).gjf (generated)

055100295.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100295.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100295.mol 055100295.PUBCHEM 055100295.mol (via Jmol)
055100301.b3lyp_6-31g(d).inp

055100301.b3lyp_6-31g(d).qchem.inp (generated)

055100301.b3lyp_6-31g(d).gjf (generated)

055100301.b3lyp_6-31g(d).firefly.inp (generated)

055100301.b3lyp_6-31g(d).smash.inp (generated)

055100301.b3lyp_6-31g(d).nwchem.inp (generated) 055100301.b3lyp_6-31g(d).log.xz 055100301.td-b3lyp_6-31g+(d).inp 055100301.td-b3lyp_6-31g+(d).log.xz

055100301.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100301.td-b3lyp_6-31+g(d).gjf (generated)

055100301.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100301.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100301.mol 055100301.PUBCHEM 055100301.mol (via Jmol)
055100302.b3lyp_6-31g(d).inp

055100302.b3lyp_6-31g(d).qchem.inp (generated)

055100302.b3lyp_6-31g(d).gjf (generated)

055100302.b3lyp_6-31g(d).firefly.inp (generated)

055100302.b3lyp_6-31g(d).smash.inp (generated)

055100302.b3lyp_6-31g(d).nwchem.inp (generated) 055100302.b3lyp_6-31g(d).log.xz 055100302.td-b3lyp_6-31g+(d).inp 055100302.td-b3lyp_6-31g+(d).log.xz

055100302.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100302.td-b3lyp_6-31+g(d).gjf (generated)

055100302.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100302.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100302.mol 055100302.PUBCHEM 055100302.mol (via Jmol)
055100317.b3lyp_6-31g(d).inp

055100317.b3lyp_6-31g(d).qchem.inp (generated)

055100317.b3lyp_6-31g(d).gjf (generated)

055100317.b3lyp_6-31g(d).firefly.inp (generated)

055100317.b3lyp_6-31g(d).smash.inp (generated)

055100317.b3lyp_6-31g(d).nwchem.inp (generated) 055100317.b3lyp_6-31g(d).log.xz 055100317.td-b3lyp_6-31g+(d).inp 055100317.td-b3lyp_6-31g+(d).log.xz

055100317.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100317.td-b3lyp_6-31+g(d).gjf (generated)

055100317.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100317.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100317.mol 055100317.PUBCHEM 055100317.mol (via Jmol)
055100324.b3lyp_6-31g(d).inp

055100324.b3lyp_6-31g(d).qchem.inp (generated)

055100324.b3lyp_6-31g(d).gjf (generated)

055100324.b3lyp_6-31g(d).firefly.inp (generated)

055100324.b3lyp_6-31g(d).smash.inp (generated)

055100324.b3lyp_6-31g(d).nwchem.inp (generated) 055100324.b3lyp_6-31g(d).log.xz 055100324.td-b3lyp_6-31g+(d).inp 055100324.td-b3lyp_6-31g+(d).log.xz

055100324.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100324.td-b3lyp_6-31+g(d).gjf (generated)

055100324.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100324.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100324.mol 055100324.PUBCHEM 055100324.mol (via Jmol)
055100334.b3lyp_6-31g(d).inp

055100334.b3lyp_6-31g(d).qchem.inp (generated)

055100334.b3lyp_6-31g(d).gjf (generated)

055100334.b3lyp_6-31g(d).firefly.inp (generated)

055100334.b3lyp_6-31g(d).smash.inp (generated)

055100334.b3lyp_6-31g(d).nwchem.inp (generated) 055100334.b3lyp_6-31g(d).log.xz 055100334.td-b3lyp_6-31g+(d).inp 055100334.td-b3lyp_6-31g+(d).log.xz

055100334.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100334.td-b3lyp_6-31+g(d).gjf (generated)

055100334.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100334.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100334.mol 055100334.PUBCHEM 055100334.mol (via Jmol)
055100340.b3lyp_6-31g(d).inp

055100340.b3lyp_6-31g(d).qchem.inp (generated)

055100340.b3lyp_6-31g(d).gjf (generated)

055100340.b3lyp_6-31g(d).firefly.inp (generated)

055100340.b3lyp_6-31g(d).smash.inp (generated)

055100340.b3lyp_6-31g(d).nwchem.inp (generated) 055100340.b3lyp_6-31g(d).log.xz 055100340.td-b3lyp_6-31g+(d).inp 055100340.td-b3lyp_6-31g+(d).log.xz

055100340.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100340.td-b3lyp_6-31+g(d).gjf (generated)

055100340.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100340.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100340.mol 055100340.PUBCHEM 055100340.mol (via Jmol)
055100343.b3lyp_6-31g(d).inp

055100343.b3lyp_6-31g(d).qchem.inp (generated)

055100343.b3lyp_6-31g(d).gjf (generated)

055100343.b3lyp_6-31g(d).firefly.inp (generated)

055100343.b3lyp_6-31g(d).smash.inp (generated)

055100343.b3lyp_6-31g(d).nwchem.inp (generated) 055100343.b3lyp_6-31g(d).log.xz 055100343.td-b3lyp_6-31g+(d).inp 055100343.td-b3lyp_6-31g+(d).log.xz

055100343.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100343.td-b3lyp_6-31+g(d).gjf (generated)

055100343.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100343.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100343.mol 055100343.PUBCHEM 055100343.mol (via Jmol)
055100345.b3lyp_6-31g(d).inp

055100345.b3lyp_6-31g(d).qchem.inp (generated)

055100345.b3lyp_6-31g(d).gjf (generated)

055100345.b3lyp_6-31g(d).firefly.inp (generated)

055100345.b3lyp_6-31g(d).smash.inp (generated)

055100345.b3lyp_6-31g(d).nwchem.inp (generated) 055100345.b3lyp_6-31g(d).log.xz 055100345.td-b3lyp_6-31g+(d).inp 055100345.td-b3lyp_6-31g+(d).log.xz

055100345.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100345.td-b3lyp_6-31+g(d).gjf (generated)

055100345.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100345.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100345.mol 055100345.PUBCHEM 055100345.mol (via Jmol)
055100347.b3lyp_6-31g(d).inp

055100347.b3lyp_6-31g(d).qchem.inp (generated)

055100347.b3lyp_6-31g(d).gjf (generated)

055100347.b3lyp_6-31g(d).firefly.inp (generated)

055100347.b3lyp_6-31g(d).smash.inp (generated)

055100347.b3lyp_6-31g(d).nwchem.inp (generated) 055100347.b3lyp_6-31g(d).log.xz 055100347.td-b3lyp_6-31g+(d).inp 055100347.td-b3lyp_6-31g+(d).log.xz

055100347.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100347.td-b3lyp_6-31+g(d).gjf (generated)

055100347.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100347.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100347.mol 055100347.PUBCHEM 055100347.mol (via Jmol)
055100357.b3lyp_6-31g(d).inp

055100357.b3lyp_6-31g(d).qchem.inp (generated)

055100357.b3lyp_6-31g(d).gjf (generated)

055100357.b3lyp_6-31g(d).firefly.inp (generated)

055100357.b3lyp_6-31g(d).smash.inp (generated)

055100357.b3lyp_6-31g(d).nwchem.inp (generated) 055100357.b3lyp_6-31g(d).log.xz 055100357.mol 055100357.PUBCHEM 055100357.mol (via Jmol)
055100359.b3lyp_6-31g(d).inp

055100359.b3lyp_6-31g(d).qchem.inp (generated)

055100359.b3lyp_6-31g(d).gjf (generated)

055100359.b3lyp_6-31g(d).firefly.inp (generated)

055100359.b3lyp_6-31g(d).smash.inp (generated)

055100359.b3lyp_6-31g(d).nwchem.inp (generated) 055100359.b3lyp_6-31g(d).log.xz 055100359.td-b3lyp_6-31g+(d).inp 055100359.td-b3lyp_6-31g+(d).log.xz

055100359.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100359.td-b3lyp_6-31+g(d).gjf (generated)

055100359.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100359.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100359.mol 055100359.PUBCHEM 055100359.mol (via Jmol)
055100360.b3lyp_6-31g(d).inp

055100360.b3lyp_6-31g(d).qchem.inp (generated)

055100360.b3lyp_6-31g(d).gjf (generated)

055100360.b3lyp_6-31g(d).firefly.inp (generated)

055100360.b3lyp_6-31g(d).smash.inp (generated)

055100360.b3lyp_6-31g(d).nwchem.inp (generated) 055100360.b3lyp_6-31g(d).log.xz 055100360.td-b3lyp_6-31g+(d).inp 055100360.td-b3lyp_6-31g+(d).log.xz

055100360.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100360.td-b3lyp_6-31+g(d).gjf (generated)

055100360.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100360.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100360.mol 055100360.PUBCHEM 055100360.mol (via Jmol)
055100361.b3lyp_6-31g(d).inp

055100361.b3lyp_6-31g(d).qchem.inp (generated)

055100361.b3lyp_6-31g(d).gjf (generated)

055100361.b3lyp_6-31g(d).firefly.inp (generated)

055100361.b3lyp_6-31g(d).smash.inp (generated)

055100361.b3lyp_6-31g(d).nwchem.inp (generated) 055100361.b3lyp_6-31g(d).log.xz 055100361.td-b3lyp_6-31g+(d).inp 055100361.td-b3lyp_6-31g+(d).log.xz

055100361.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100361.td-b3lyp_6-31+g(d).gjf (generated)

055100361.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100361.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100361.mol 055100361.PUBCHEM 055100361.mol (via Jmol)
055100372.b3lyp_6-31g(d).inp

055100372.b3lyp_6-31g(d).qchem.inp (generated)

055100372.b3lyp_6-31g(d).gjf (generated)

055100372.b3lyp_6-31g(d).firefly.inp (generated)

055100372.b3lyp_6-31g(d).smash.inp (generated)

055100372.b3lyp_6-31g(d).nwchem.inp (generated) 055100372.b3lyp_6-31g(d).log.xz 055100372.td-b3lyp_6-31g+(d).inp 055100372.td-b3lyp_6-31g+(d).log.xz

055100372.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100372.td-b3lyp_6-31+g(d).gjf (generated)

055100372.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100372.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100372.mol 055100372.PUBCHEM 055100372.mol (via Jmol)
055100374.b3lyp_6-31g(d).inp

055100374.b3lyp_6-31g(d).qchem.inp (generated)

055100374.b3lyp_6-31g(d).gjf (generated)

055100374.b3lyp_6-31g(d).firefly.inp (generated)

055100374.b3lyp_6-31g(d).smash.inp (generated)

055100374.b3lyp_6-31g(d).nwchem.inp (generated) 055100374.b3lyp_6-31g(d).log.xz 055100374.td-b3lyp_6-31g+(d).inp 055100374.td-b3lyp_6-31g+(d).log.xz

055100374.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100374.td-b3lyp_6-31+g(d).gjf (generated)

055100374.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100374.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100374.mol 055100374.PUBCHEM 055100374.mol (via Jmol)
055100375.b3lyp_6-31g(d).inp

055100375.b3lyp_6-31g(d).qchem.inp (generated)

055100375.b3lyp_6-31g(d).gjf (generated)

055100375.b3lyp_6-31g(d).firefly.inp (generated)

055100375.b3lyp_6-31g(d).smash.inp (generated)

055100375.b3lyp_6-31g(d).nwchem.inp (generated) 055100375.b3lyp_6-31g(d).log.xz 055100375.td-b3lyp_6-31g+(d).inp 055100375.td-b3lyp_6-31g+(d).log.xz

055100375.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100375.td-b3lyp_6-31+g(d).gjf (generated)

055100375.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100375.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100375.mol 055100375.PUBCHEM 055100375.mol (via Jmol)
055100378.b3lyp_6-31g(d).inp

055100378.b3lyp_6-31g(d).qchem.inp (generated)

055100378.b3lyp_6-31g(d).gjf (generated)

055100378.b3lyp_6-31g(d).firefly.inp (generated)

055100378.b3lyp_6-31g(d).smash.inp (generated)

055100378.b3lyp_6-31g(d).nwchem.inp (generated) 055100378.b3lyp_6-31g(d).log.xz 055100378.mol 055100378.PUBCHEM 055100378.mol (via Jmol)
055100380.b3lyp_6-31g(d).inp

055100380.b3lyp_6-31g(d).qchem.inp (generated)

055100380.b3lyp_6-31g(d).gjf (generated)

055100380.b3lyp_6-31g(d).firefly.inp (generated)

055100380.b3lyp_6-31g(d).smash.inp (generated)

055100380.b3lyp_6-31g(d).nwchem.inp (generated) 055100380.b3lyp_6-31g(d).log.xz 055100380.td-b3lyp_6-31g+(d).inp 055100380.td-b3lyp_6-31g+(d).log.xz

055100380.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100380.td-b3lyp_6-31+g(d).gjf (generated)

055100380.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100380.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100380.mol 055100380.PUBCHEM 055100380.mol (via Jmol)
055100386.b3lyp_6-31g(d).inp

055100386.b3lyp_6-31g(d).qchem.inp (generated)

055100386.b3lyp_6-31g(d).gjf (generated)

055100386.b3lyp_6-31g(d).firefly.inp (generated)

055100386.b3lyp_6-31g(d).smash.inp (generated)

055100386.b3lyp_6-31g(d).nwchem.inp (generated) 055100386.b3lyp_6-31g(d).log.xz 055100386.td-b3lyp_6-31g+(d).inp 055100386.td-b3lyp_6-31g+(d).log.xz

055100386.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100386.td-b3lyp_6-31+g(d).gjf (generated)

055100386.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100386.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100386.mol 055100386.PUBCHEM 055100386.mol (via Jmol)
055100387.b3lyp_6-31g(d).inp

055100387.b3lyp_6-31g(d).qchem.inp (generated)

055100387.b3lyp_6-31g(d).gjf (generated)

055100387.b3lyp_6-31g(d).firefly.inp (generated)

055100387.b3lyp_6-31g(d).smash.inp (generated)

055100387.b3lyp_6-31g(d).nwchem.inp (generated) 055100387.b3lyp_6-31g(d).log.xz 055100387.td-b3lyp_6-31g+(d).inp 055100387.td-b3lyp_6-31g+(d).log.xz

055100387.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100387.td-b3lyp_6-31+g(d).gjf (generated)

055100387.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100387.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100387.mol 055100387.PUBCHEM 055100387.mol (via Jmol)
055100403.b3lyp_6-31g(d).inp

055100403.b3lyp_6-31g(d).qchem.inp (generated)

055100403.b3lyp_6-31g(d).gjf (generated)

055100403.b3lyp_6-31g(d).firefly.inp (generated)

055100403.b3lyp_6-31g(d).smash.inp (generated)

055100403.b3lyp_6-31g(d).nwchem.inp (generated) 055100403.b3lyp_6-31g(d).log.xz 055100403.td-b3lyp_6-31g+(d).inp 055100403.td-b3lyp_6-31g+(d).log.xz

055100403.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100403.td-b3lyp_6-31+g(d).gjf (generated)

055100403.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100403.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100403.mol 055100403.PUBCHEM 055100403.mol (via Jmol)
055100407.b3lyp_6-31g(d).inp

055100407.b3lyp_6-31g(d).qchem.inp (generated)

055100407.b3lyp_6-31g(d).gjf (generated)

055100407.b3lyp_6-31g(d).firefly.inp (generated)

055100407.b3lyp_6-31g(d).smash.inp (generated)

055100407.b3lyp_6-31g(d).nwchem.inp (generated) 055100407.b3lyp_6-31g(d).log.xz 055100407.td-b3lyp_6-31g+(d).inp 055100407.td-b3lyp_6-31g+(d).log.xz

055100407.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100407.td-b3lyp_6-31+g(d).gjf (generated)

055100407.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100407.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100407.mol 055100407.PUBCHEM 055100407.mol (via Jmol)
055100422.b3lyp_6-31g(d).inp

055100422.b3lyp_6-31g(d).qchem.inp (generated)

055100422.b3lyp_6-31g(d).gjf (generated)

055100422.b3lyp_6-31g(d).firefly.inp (generated)

055100422.b3lyp_6-31g(d).smash.inp (generated)

055100422.b3lyp_6-31g(d).nwchem.inp (generated) 055100422.b3lyp_6-31g(d).log.xz 055100422.td-b3lyp_6-31g+(d).inp 055100422.td-b3lyp_6-31g+(d).log.xz

055100422.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100422.td-b3lyp_6-31+g(d).gjf (generated)

055100422.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100422.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100422.mol 055100422.PUBCHEM 055100422.mol (via Jmol)
055100434.b3lyp_6-31g(d).inp

055100434.b3lyp_6-31g(d).qchem.inp (generated)

055100434.b3lyp_6-31g(d).gjf (generated)

055100434.b3lyp_6-31g(d).firefly.inp (generated)

055100434.b3lyp_6-31g(d).smash.inp (generated)

055100434.b3lyp_6-31g(d).nwchem.inp (generated) 055100434.b3lyp_6-31g(d).log.xz 055100434.td-b3lyp_6-31g+(d).inp 055100434.td-b3lyp_6-31g+(d).log.xz

055100434.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100434.td-b3lyp_6-31+g(d).gjf (generated)

055100434.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100434.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100434.mol 055100434.PUBCHEM 055100434.mol (via Jmol)
055100439.b3lyp_6-31g(d).inp

055100439.b3lyp_6-31g(d).qchem.inp (generated)

055100439.b3lyp_6-31g(d).gjf (generated)

055100439.b3lyp_6-31g(d).firefly.inp (generated)

055100439.b3lyp_6-31g(d).smash.inp (generated)

055100439.b3lyp_6-31g(d).nwchem.inp (generated) 055100439.b3lyp_6-31g(d).log.xz 055100439.td-b3lyp_6-31g+(d).inp 055100439.td-b3lyp_6-31g+(d).log.xz

055100439.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100439.td-b3lyp_6-31+g(d).gjf (generated)

055100439.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100439.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100439.mol 055100439.PUBCHEM 055100439.mol (via Jmol)
055100453.b3lyp_6-31g(d).inp

055100453.b3lyp_6-31g(d).qchem.inp (generated)

055100453.b3lyp_6-31g(d).gjf (generated)

055100453.b3lyp_6-31g(d).firefly.inp (generated)

055100453.b3lyp_6-31g(d).smash.inp (generated)

055100453.b3lyp_6-31g(d).nwchem.inp (generated) 055100453.b3lyp_6-31g(d).log.xz 055100453.td-b3lyp_6-31g+(d).inp 055100453.td-b3lyp_6-31g+(d).log.xz

055100453.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100453.td-b3lyp_6-31+g(d).gjf (generated)

055100453.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100453.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100453.mol 055100453.PUBCHEM 055100453.mol (via Jmol)
055100455.b3lyp_6-31g(d).inp

055100455.b3lyp_6-31g(d).qchem.inp (generated)

055100455.b3lyp_6-31g(d).gjf (generated)

055100455.b3lyp_6-31g(d).firefly.inp (generated)

055100455.b3lyp_6-31g(d).smash.inp (generated)

055100455.b3lyp_6-31g(d).nwchem.inp (generated) 055100455.b3lyp_6-31g(d).log.xz 055100455.td-b3lyp_6-31g+(d).inp 055100455.td-b3lyp_6-31g+(d).log.xz

055100455.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100455.td-b3lyp_6-31+g(d).gjf (generated)

055100455.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100455.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100455.mol 055100455.PUBCHEM 055100455.mol (via Jmol)
055100456.b3lyp_6-31g(d).inp

055100456.b3lyp_6-31g(d).qchem.inp (generated)

055100456.b3lyp_6-31g(d).gjf (generated)

055100456.b3lyp_6-31g(d).firefly.inp (generated)

055100456.b3lyp_6-31g(d).smash.inp (generated)

055100456.b3lyp_6-31g(d).nwchem.inp (generated) 055100456.b3lyp_6-31g(d).log.xz 055100456.mol 055100456.PUBCHEM 055100456.mol (via Jmol)
055100458.b3lyp_6-31g(d).inp

055100458.b3lyp_6-31g(d).qchem.inp (generated)

055100458.b3lyp_6-31g(d).gjf (generated)

055100458.b3lyp_6-31g(d).firefly.inp (generated)

055100458.b3lyp_6-31g(d).smash.inp (generated)

055100458.b3lyp_6-31g(d).nwchem.inp (generated) 055100458.b3lyp_6-31g(d).log.xz 055100458.td-b3lyp_6-31g+(d).inp 055100458.td-b3lyp_6-31g+(d).log.xz

055100458.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100458.td-b3lyp_6-31+g(d).gjf (generated)

055100458.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100458.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100458.mol 055100458.PUBCHEM 055100458.mol (via Jmol)
055100460.b3lyp_6-31g(d).inp

055100460.b3lyp_6-31g(d).qchem.inp (generated)

055100460.b3lyp_6-31g(d).gjf (generated)

055100460.b3lyp_6-31g(d).firefly.inp (generated)

055100460.b3lyp_6-31g(d).smash.inp (generated)

055100460.b3lyp_6-31g(d).nwchem.inp (generated) 055100460.b3lyp_6-31g(d).log.xz 055100460.td-b3lyp_6-31g+(d).inp 055100460.td-b3lyp_6-31g+(d).log.xz

055100460.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100460.td-b3lyp_6-31+g(d).gjf (generated)

055100460.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100460.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100460.mol 055100460.PUBCHEM 055100460.mol (via Jmol)
055100465.b3lyp_6-31g(d).inp

055100465.b3lyp_6-31g(d).qchem.inp (generated)

055100465.b3lyp_6-31g(d).gjf (generated)

055100465.b3lyp_6-31g(d).firefly.inp (generated)

055100465.b3lyp_6-31g(d).smash.inp (generated)

055100465.b3lyp_6-31g(d).nwchem.inp (generated) 055100465.b3lyp_6-31g(d).log.xz 055100465.td-b3lyp_6-31g+(d).inp 055100465.td-b3lyp_6-31g+(d).log.xz

055100465.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100465.td-b3lyp_6-31+g(d).gjf (generated)

055100465.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100465.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100465.mol 055100465.PUBCHEM 055100465.mol (via Jmol)
055100478.b3lyp_6-31g(d).inp

055100478.b3lyp_6-31g(d).qchem.inp (generated)

055100478.b3lyp_6-31g(d).gjf (generated)

055100478.b3lyp_6-31g(d).firefly.inp (generated)

055100478.b3lyp_6-31g(d).smash.inp (generated)

055100478.b3lyp_6-31g(d).nwchem.inp (generated) 055100478.b3lyp_6-31g(d).log.xz 055100478.td-b3lyp_6-31g+(d).inp 055100478.td-b3lyp_6-31g+(d).log.xz

055100478.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100478.td-b3lyp_6-31+g(d).gjf (generated)

055100478.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100478.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100478.mol 055100478.PUBCHEM 055100478.mol (via Jmol)
055100501.b3lyp_6-31g(d).inp

055100501.b3lyp_6-31g(d).qchem.inp (generated)

055100501.b3lyp_6-31g(d).gjf (generated)

055100501.b3lyp_6-31g(d).firefly.inp (generated)

055100501.b3lyp_6-31g(d).smash.inp (generated)

055100501.b3lyp_6-31g(d).nwchem.inp (generated) 055100501.b3lyp_6-31g(d).log.xz 055100501.td-b3lyp_6-31g+(d).inp 055100501.td-b3lyp_6-31g+(d).log.xz

055100501.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100501.td-b3lyp_6-31+g(d).gjf (generated)

055100501.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100501.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100501.mol 055100501.PUBCHEM 055100501.mol (via Jmol)
055100509.b3lyp_6-31g(d).inp

055100509.b3lyp_6-31g(d).qchem.inp (generated)

055100509.b3lyp_6-31g(d).gjf (generated)

055100509.b3lyp_6-31g(d).firefly.inp (generated)

055100509.b3lyp_6-31g(d).smash.inp (generated)

055100509.b3lyp_6-31g(d).nwchem.inp (generated) 055100509.b3lyp_6-31g(d).log.xz 055100509.td-b3lyp_6-31g+(d).inp 055100509.td-b3lyp_6-31g+(d).log.xz

055100509.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100509.td-b3lyp_6-31+g(d).gjf (generated)

055100509.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100509.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100509.mol 055100509.PUBCHEM 055100509.mol (via Jmol)
055100524.b3lyp_6-31g(d).inp

055100524.b3lyp_6-31g(d).qchem.inp (generated)

055100524.b3lyp_6-31g(d).gjf (generated)

055100524.b3lyp_6-31g(d).firefly.inp (generated)

055100524.b3lyp_6-31g(d).smash.inp (generated)

055100524.b3lyp_6-31g(d).nwchem.inp (generated) 055100524.b3lyp_6-31g(d).log.xz 055100524.td-b3lyp_6-31g+(d).inp 055100524.td-b3lyp_6-31g+(d).log.xz

055100524.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100524.td-b3lyp_6-31+g(d).gjf (generated)

055100524.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100524.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100524.mol 055100524.PUBCHEM 055100524.mol (via Jmol)
055100529.b3lyp_6-31g(d).inp

055100529.b3lyp_6-31g(d).qchem.inp (generated)

055100529.b3lyp_6-31g(d).gjf (generated)

055100529.b3lyp_6-31g(d).firefly.inp (generated)

055100529.b3lyp_6-31g(d).smash.inp (generated)

055100529.b3lyp_6-31g(d).nwchem.inp (generated) 055100529.b3lyp_6-31g(d).log.xz 055100529.td-b3lyp_6-31g+(d).inp 055100529.td-b3lyp_6-31g+(d).log.xz

055100529.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100529.td-b3lyp_6-31+g(d).gjf (generated)

055100529.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100529.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100529.mol 055100529.PUBCHEM 055100529.mol (via Jmol)
055100532.b3lyp_6-31g(d).inp

055100532.b3lyp_6-31g(d).qchem.inp (generated)

055100532.b3lyp_6-31g(d).gjf (generated)

055100532.b3lyp_6-31g(d).firefly.inp (generated)

055100532.b3lyp_6-31g(d).smash.inp (generated)

055100532.b3lyp_6-31g(d).nwchem.inp (generated) 055100532.b3lyp_6-31g(d).log.xz 055100532.td-b3lyp_6-31g+(d).inp 055100532.td-b3lyp_6-31g+(d).log.xz

055100532.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100532.td-b3lyp_6-31+g(d).gjf (generated)

055100532.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100532.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100532.mol 055100532.PUBCHEM 055100532.mol (via Jmol)
055100548.b3lyp_6-31g(d).inp

055100548.b3lyp_6-31g(d).qchem.inp (generated)

055100548.b3lyp_6-31g(d).gjf (generated)

055100548.b3lyp_6-31g(d).firefly.inp (generated)

055100548.b3lyp_6-31g(d).smash.inp (generated)

055100548.b3lyp_6-31g(d).nwchem.inp (generated) 055100548.b3lyp_6-31g(d).log.xz 055100548.td-b3lyp_6-31g+(d).inp 055100548.td-b3lyp_6-31g+(d).log.xz

055100548.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100548.td-b3lyp_6-31+g(d).gjf (generated)

055100548.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100548.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100548.mol 055100548.PUBCHEM 055100548.mol (via Jmol)
055100549.b3lyp_6-31g(d).inp

055100549.b3lyp_6-31g(d).qchem.inp (generated)

055100549.b3lyp_6-31g(d).gjf (generated)

055100549.b3lyp_6-31g(d).firefly.inp (generated)

055100549.b3lyp_6-31g(d).smash.inp (generated)

055100549.b3lyp_6-31g(d).nwchem.inp (generated) 055100549.b3lyp_6-31g(d).log.xz 055100549.td-b3lyp_6-31g+(d).inp 055100549.td-b3lyp_6-31g+(d).log.xz

055100549.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100549.td-b3lyp_6-31+g(d).gjf (generated)

055100549.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100549.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100549.mol 055100549.PUBCHEM 055100549.mol (via Jmol)
055100550.b3lyp_6-31g(d).inp

055100550.b3lyp_6-31g(d).qchem.inp (generated)

055100550.b3lyp_6-31g(d).gjf (generated)

055100550.b3lyp_6-31g(d).firefly.inp (generated)

055100550.b3lyp_6-31g(d).smash.inp (generated)

055100550.b3lyp_6-31g(d).nwchem.inp (generated) 055100550.b3lyp_6-31g(d).log.xz 055100550.td-b3lyp_6-31g+(d).inp 055100550.td-b3lyp_6-31g+(d).log.xz

055100550.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100550.td-b3lyp_6-31+g(d).gjf (generated)

055100550.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100550.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100550.mol 055100550.PUBCHEM 055100550.mol (via Jmol)
055100551.b3lyp_6-31g(d).inp

055100551.b3lyp_6-31g(d).qchem.inp (generated)

055100551.b3lyp_6-31g(d).gjf (generated)

055100551.b3lyp_6-31g(d).firefly.inp (generated)

055100551.b3lyp_6-31g(d).smash.inp (generated)

055100551.b3lyp_6-31g(d).nwchem.inp (generated) 055100551.b3lyp_6-31g(d).log.xz 055100551.mol 055100551.PUBCHEM 055100551.mol (via Jmol)
055100552.b3lyp_6-31g(d).inp

055100552.b3lyp_6-31g(d).qchem.inp (generated)

055100552.b3lyp_6-31g(d).gjf (generated)

055100552.b3lyp_6-31g(d).firefly.inp (generated)

055100552.b3lyp_6-31g(d).smash.inp (generated)

055100552.b3lyp_6-31g(d).nwchem.inp (generated) 055100552.b3lyp_6-31g(d).log.xz 055100552.td-b3lyp_6-31g+(d).inp 055100552.td-b3lyp_6-31g+(d).log.xz

055100552.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100552.td-b3lyp_6-31+g(d).gjf (generated)

055100552.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100552.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100552.mol 055100552.PUBCHEM 055100552.mol (via Jmol)
055100553.b3lyp_6-31g(d).inp

055100553.b3lyp_6-31g(d).qchem.inp (generated)

055100553.b3lyp_6-31g(d).gjf (generated)

055100553.b3lyp_6-31g(d).firefly.inp (generated)

055100553.b3lyp_6-31g(d).smash.inp (generated)

055100553.b3lyp_6-31g(d).nwchem.inp (generated) 055100553.b3lyp_6-31g(d).log.xz 055100553.td-b3lyp_6-31g+(d).inp 055100553.td-b3lyp_6-31g+(d).log.xz

055100553.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100553.td-b3lyp_6-31+g(d).gjf (generated)

055100553.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100553.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100553.mol 055100553.PUBCHEM 055100553.mol (via Jmol)
055100562.b3lyp_6-31g(d).inp

055100562.b3lyp_6-31g(d).qchem.inp (generated)

055100562.b3lyp_6-31g(d).gjf (generated)

055100562.b3lyp_6-31g(d).firefly.inp (generated)

055100562.b3lyp_6-31g(d).smash.inp (generated)

055100562.b3lyp_6-31g(d).nwchem.inp (generated) 055100562.b3lyp_6-31g(d).log.xz 055100562.td-b3lyp_6-31g+(d).inp 055100562.td-b3lyp_6-31g+(d).log.xz

055100562.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100562.td-b3lyp_6-31+g(d).gjf (generated)

055100562.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100562.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100562.mol 055100562.PUBCHEM 055100562.mol (via Jmol)
055100563.b3lyp_6-31g(d).inp

055100563.b3lyp_6-31g(d).qchem.inp (generated)

055100563.b3lyp_6-31g(d).gjf (generated)

055100563.b3lyp_6-31g(d).firefly.inp (generated)

055100563.b3lyp_6-31g(d).smash.inp (generated)

055100563.b3lyp_6-31g(d).nwchem.inp (generated) 055100563.b3lyp_6-31g(d).log.xz 055100563.td-b3lyp_6-31g+(d).inp 055100563.td-b3lyp_6-31g+(d).log.xz

055100563.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100563.td-b3lyp_6-31+g(d).gjf (generated)

055100563.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100563.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100563.mol 055100563.PUBCHEM 055100563.mol (via Jmol)
055100565.b3lyp_6-31g(d).inp

055100565.b3lyp_6-31g(d).qchem.inp (generated)

055100565.b3lyp_6-31g(d).gjf (generated)

055100565.b3lyp_6-31g(d).firefly.inp (generated)

055100565.b3lyp_6-31g(d).smash.inp (generated)

055100565.b3lyp_6-31g(d).nwchem.inp (generated) 055100565.b3lyp_6-31g(d).log.xz 055100565.td-b3lyp_6-31g+(d).inp 055100565.td-b3lyp_6-31g+(d).log.xz

055100565.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100565.td-b3lyp_6-31+g(d).gjf (generated)

055100565.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100565.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100565.mol 055100565.PUBCHEM 055100565.mol (via Jmol)
055100584.b3lyp_6-31g(d).inp

055100584.b3lyp_6-31g(d).qchem.inp (generated)

055100584.b3lyp_6-31g(d).gjf (generated)

055100584.b3lyp_6-31g(d).firefly.inp (generated)

055100584.b3lyp_6-31g(d).smash.inp (generated)

055100584.b3lyp_6-31g(d).nwchem.inp (generated) 055100584.b3lyp_6-31g(d).log.xz 055100584.td-b3lyp_6-31g+(d).inp 055100584.td-b3lyp_6-31g+(d).log.xz

055100584.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100584.td-b3lyp_6-31+g(d).gjf (generated)

055100584.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100584.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100584.mol 055100584.PUBCHEM 055100584.mol (via Jmol)
055100585.b3lyp_6-31g(d).inp

055100585.b3lyp_6-31g(d).qchem.inp (generated)

055100585.b3lyp_6-31g(d).gjf (generated)

055100585.b3lyp_6-31g(d).firefly.inp (generated)

055100585.b3lyp_6-31g(d).smash.inp (generated)

055100585.b3lyp_6-31g(d).nwchem.inp (generated) 055100585.b3lyp_6-31g(d).log.xz 055100585.td-b3lyp_6-31g+(d).inp 055100585.td-b3lyp_6-31g+(d).log.xz

055100585.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100585.td-b3lyp_6-31+g(d).gjf (generated)

055100585.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100585.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100585.mol 055100585.PUBCHEM 055100585.mol (via Jmol)
055100597.b3lyp_6-31g(d).inp

055100597.b3lyp_6-31g(d).qchem.inp (generated)

055100597.b3lyp_6-31g(d).gjf (generated)

055100597.b3lyp_6-31g(d).firefly.inp (generated)

055100597.b3lyp_6-31g(d).smash.inp (generated)

055100597.b3lyp_6-31g(d).nwchem.inp (generated) 055100597.b3lyp_6-31g(d).log.xz 055100597.td-b3lyp_6-31g+(d).inp 055100597.td-b3lyp_6-31g+(d).log.xz

055100597.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100597.td-b3lyp_6-31+g(d).gjf (generated)

055100597.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100597.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100597.mol 055100597.PUBCHEM 055100597.mol (via Jmol)
055100601.b3lyp_6-31g(d).inp

055100601.b3lyp_6-31g(d).qchem.inp (generated)

055100601.b3lyp_6-31g(d).gjf (generated)

055100601.b3lyp_6-31g(d).firefly.inp (generated)

055100601.b3lyp_6-31g(d).smash.inp (generated)

055100601.b3lyp_6-31g(d).nwchem.inp (generated) 055100601.b3lyp_6-31g(d).log.xz 055100601.td-b3lyp_6-31g+(d).inp 055100601.td-b3lyp_6-31g+(d).log.xz

055100601.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100601.td-b3lyp_6-31+g(d).gjf (generated)

055100601.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100601.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100601.mol 055100601.PUBCHEM 055100601.mol (via Jmol)
055100602.b3lyp_6-31g(d).inp

055100602.b3lyp_6-31g(d).qchem.inp (generated)

055100602.b3lyp_6-31g(d).gjf (generated)

055100602.b3lyp_6-31g(d).firefly.inp (generated)

055100602.b3lyp_6-31g(d).smash.inp (generated)

055100602.b3lyp_6-31g(d).nwchem.inp (generated) 055100602.b3lyp_6-31g(d).log.xz 055100602.td-b3lyp_6-31g+(d).inp 055100602.td-b3lyp_6-31g+(d).log.xz

055100602.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100602.td-b3lyp_6-31+g(d).gjf (generated)

055100602.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100602.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100602.mol 055100602.PUBCHEM 055100602.mol (via Jmol)
055100610.b3lyp_6-31g(d).inp

055100610.b3lyp_6-31g(d).qchem.inp (generated)

055100610.b3lyp_6-31g(d).gjf (generated)

055100610.b3lyp_6-31g(d).firefly.inp (generated)

055100610.b3lyp_6-31g(d).smash.inp (generated)

055100610.b3lyp_6-31g(d).nwchem.inp (generated) 055100610.b3lyp_6-31g(d).log.xz 055100610.td-b3lyp_6-31g+(d).inp 055100610.td-b3lyp_6-31g+(d).log.xz

055100610.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100610.td-b3lyp_6-31+g(d).gjf (generated)

055100610.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100610.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100610.mol 055100610.PUBCHEM 055100610.mol (via Jmol)
055100613.b3lyp_6-31g(d).inp

055100613.b3lyp_6-31g(d).qchem.inp (generated)

055100613.b3lyp_6-31g(d).gjf (generated)

055100613.b3lyp_6-31g(d).firefly.inp (generated)

055100613.b3lyp_6-31g(d).smash.inp (generated)

055100613.b3lyp_6-31g(d).nwchem.inp (generated) 055100613.b3lyp_6-31g(d).log.xz 055100613.td-b3lyp_6-31g+(d).inp 055100613.td-b3lyp_6-31g+(d).log.xz

055100613.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100613.td-b3lyp_6-31+g(d).gjf (generated)

055100613.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100613.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100613.mol 055100613.PUBCHEM 055100613.mol (via Jmol)
055100624.b3lyp_6-31g(d).inp

055100624.b3lyp_6-31g(d).qchem.inp (generated)

055100624.b3lyp_6-31g(d).gjf (generated)

055100624.b3lyp_6-31g(d).firefly.inp (generated)

055100624.b3lyp_6-31g(d).smash.inp (generated)

055100624.b3lyp_6-31g(d).nwchem.inp (generated) 055100624.b3lyp_6-31g(d).log.xz 055100624.td-b3lyp_6-31g+(d).inp 055100624.td-b3lyp_6-31g+(d).log.xz

055100624.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100624.td-b3lyp_6-31+g(d).gjf (generated)

055100624.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100624.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100624.mol 055100624.PUBCHEM 055100624.mol (via Jmol)
055100628.b3lyp_6-31g(d).inp

055100628.b3lyp_6-31g(d).qchem.inp (generated)

055100628.b3lyp_6-31g(d).gjf (generated)

055100628.b3lyp_6-31g(d).firefly.inp (generated)

055100628.b3lyp_6-31g(d).smash.inp (generated)

055100628.b3lyp_6-31g(d).nwchem.inp (generated) 055100628.b3lyp_6-31g(d).log.xz 055100628.td-b3lyp_6-31g+(d).inp 055100628.td-b3lyp_6-31g+(d).log.xz

055100628.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100628.td-b3lyp_6-31+g(d).gjf (generated)

055100628.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100628.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100628.mol 055100628.PUBCHEM 055100628.mol (via Jmol)
055100630.b3lyp_6-31g(d).inp

055100630.b3lyp_6-31g(d).qchem.inp (generated)

055100630.b3lyp_6-31g(d).gjf (generated)

055100630.b3lyp_6-31g(d).firefly.inp (generated)

055100630.b3lyp_6-31g(d).smash.inp (generated)

055100630.b3lyp_6-31g(d).nwchem.inp (generated) 055100630.b3lyp_6-31g(d).log.xz 055100630.td-b3lyp_6-31g+(d).inp 055100630.td-b3lyp_6-31g+(d).log.xz

055100630.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100630.td-b3lyp_6-31+g(d).gjf (generated)

055100630.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100630.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100630.mol 055100630.PUBCHEM 055100630.mol (via Jmol)
055100633.b3lyp_6-31g(d).inp

055100633.b3lyp_6-31g(d).qchem.inp (generated)

055100633.b3lyp_6-31g(d).gjf (generated)

055100633.b3lyp_6-31g(d).firefly.inp (generated)

055100633.b3lyp_6-31g(d).smash.inp (generated)

055100633.b3lyp_6-31g(d).nwchem.inp (generated) 055100633.b3lyp_6-31g(d).log.xz 055100633.td-b3lyp_6-31g+(d).inp 055100633.td-b3lyp_6-31g+(d).log.xz

055100633.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100633.td-b3lyp_6-31+g(d).gjf (generated)

055100633.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100633.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100633.mol 055100633.PUBCHEM 055100633.mol (via Jmol)
055100634.b3lyp_6-31g(d).inp

055100634.b3lyp_6-31g(d).qchem.inp (generated)

055100634.b3lyp_6-31g(d).gjf (generated)

055100634.b3lyp_6-31g(d).firefly.inp (generated)

055100634.b3lyp_6-31g(d).smash.inp (generated)

055100634.b3lyp_6-31g(d).nwchem.inp (generated) 055100634.b3lyp_6-31g(d).log.xz 055100634.td-b3lyp_6-31g+(d).inp 055100634.td-b3lyp_6-31g+(d).log.xz

055100634.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100634.td-b3lyp_6-31+g(d).gjf (generated)

055100634.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100634.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100634.mol 055100634.PUBCHEM 055100634.mol (via Jmol)
055100656.b3lyp_6-31g(d).inp

055100656.b3lyp_6-31g(d).qchem.inp (generated)

055100656.b3lyp_6-31g(d).gjf (generated)

055100656.b3lyp_6-31g(d).firefly.inp (generated)

055100656.b3lyp_6-31g(d).smash.inp (generated)

055100656.b3lyp_6-31g(d).nwchem.inp (generated) 055100656.b3lyp_6-31g(d).log.xz 055100656.td-b3lyp_6-31g+(d).inp 055100656.td-b3lyp_6-31g+(d).log.xz

055100656.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100656.td-b3lyp_6-31+g(d).gjf (generated)

055100656.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100656.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100656.mol 055100656.PUBCHEM 055100656.mol (via Jmol)
055100662.b3lyp_6-31g(d).inp

055100662.b3lyp_6-31g(d).qchem.inp (generated)

055100662.b3lyp_6-31g(d).gjf (generated)

055100662.b3lyp_6-31g(d).firefly.inp (generated)

055100662.b3lyp_6-31g(d).smash.inp (generated)

055100662.b3lyp_6-31g(d).nwchem.inp (generated) 055100662.b3lyp_6-31g(d).log.xz 055100662.td-b3lyp_6-31g+(d).inp 055100662.td-b3lyp_6-31g+(d).log.xz

055100662.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100662.td-b3lyp_6-31+g(d).gjf (generated)

055100662.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100662.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100662.mol 055100662.PUBCHEM 055100662.mol (via Jmol)
055100682.b3lyp_6-31g(d).inp

055100682.b3lyp_6-31g(d).qchem.inp (generated)

055100682.b3lyp_6-31g(d).gjf (generated)

055100682.b3lyp_6-31g(d).firefly.inp (generated)

055100682.b3lyp_6-31g(d).smash.inp (generated)

055100682.b3lyp_6-31g(d).nwchem.inp (generated) 055100682.b3lyp_6-31g(d).log.xz 055100682.td-b3lyp_6-31g+(d).inp 055100682.td-b3lyp_6-31g+(d).log.xz

055100682.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100682.td-b3lyp_6-31+g(d).gjf (generated)

055100682.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100682.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100682.mol 055100682.PUBCHEM 055100682.mol (via Jmol)
055100689.b3lyp_6-31g(d).inp

055100689.b3lyp_6-31g(d).qchem.inp (generated)

055100689.b3lyp_6-31g(d).gjf (generated)

055100689.b3lyp_6-31g(d).firefly.inp (generated)

055100689.b3lyp_6-31g(d).smash.inp (generated)

055100689.b3lyp_6-31g(d).nwchem.inp (generated) 055100689.b3lyp_6-31g(d).log.xz 055100689.td-b3lyp_6-31g+(d).inp 055100689.td-b3lyp_6-31g+(d).log.xz

055100689.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100689.td-b3lyp_6-31+g(d).gjf (generated)

055100689.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100689.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100689.mol 055100689.PUBCHEM 055100689.mol (via Jmol)
055100694.b3lyp_6-31g(d).inp

055100694.b3lyp_6-31g(d).qchem.inp (generated)

055100694.b3lyp_6-31g(d).gjf (generated)

055100694.b3lyp_6-31g(d).firefly.inp (generated)

055100694.b3lyp_6-31g(d).smash.inp (generated)

055100694.b3lyp_6-31g(d).nwchem.inp (generated) 055100694.b3lyp_6-31g(d).log.xz 055100694.td-b3lyp_6-31g+(d).inp 055100694.td-b3lyp_6-31g+(d).log.xz

055100694.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100694.td-b3lyp_6-31+g(d).gjf (generated)

055100694.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100694.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100694.mol 055100694.PUBCHEM 055100694.mol (via Jmol)
055100695.b3lyp_6-31g(d).inp

055100695.b3lyp_6-31g(d).qchem.inp (generated)

055100695.b3lyp_6-31g(d).gjf (generated)

055100695.b3lyp_6-31g(d).firefly.inp (generated)

055100695.b3lyp_6-31g(d).smash.inp (generated)

055100695.b3lyp_6-31g(d).nwchem.inp (generated) 055100695.b3lyp_6-31g(d).log.xz 055100695.td-b3lyp_6-31g+(d).inp 055100695.td-b3lyp_6-31g+(d).log.xz

055100695.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100695.td-b3lyp_6-31+g(d).gjf (generated)

055100695.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100695.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100695.mol 055100695.PUBCHEM 055100695.mol (via Jmol)
055100725.b3lyp_6-31g(d).inp

055100725.b3lyp_6-31g(d).qchem.inp (generated)

055100725.b3lyp_6-31g(d).gjf (generated)

055100725.b3lyp_6-31g(d).firefly.inp (generated)

055100725.b3lyp_6-31g(d).smash.inp (generated)

055100725.b3lyp_6-31g(d).nwchem.inp (generated) 055100725.b3lyp_6-31g(d).log.xz 055100725.td-b3lyp_6-31g+(d).inp 055100725.td-b3lyp_6-31g+(d).log.xz

055100725.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100725.td-b3lyp_6-31+g(d).gjf (generated)

055100725.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100725.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100725.mol 055100725.PUBCHEM 055100725.mol (via Jmol)
055100730.b3lyp_6-31g(d).inp

055100730.b3lyp_6-31g(d).qchem.inp (generated)

055100730.b3lyp_6-31g(d).gjf (generated)

055100730.b3lyp_6-31g(d).firefly.inp (generated)

055100730.b3lyp_6-31g(d).smash.inp (generated)

055100730.b3lyp_6-31g(d).nwchem.inp (generated) 055100730.b3lyp_6-31g(d).log.xz 055100730.mol 055100730.PUBCHEM 055100730.mol (via Jmol)
055100742.b3lyp_6-31g(d).inp

055100742.b3lyp_6-31g(d).qchem.inp (generated)

055100742.b3lyp_6-31g(d).gjf (generated)

055100742.b3lyp_6-31g(d).firefly.inp (generated)

055100742.b3lyp_6-31g(d).smash.inp (generated)

055100742.b3lyp_6-31g(d).nwchem.inp (generated) 055100742.b3lyp_6-31g(d).log.xz 055100742.td-b3lyp_6-31g+(d).inp 055100742.td-b3lyp_6-31g+(d).log.xz

055100742.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100742.td-b3lyp_6-31+g(d).gjf (generated)

055100742.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100742.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100742.mol 055100742.PUBCHEM 055100742.mol (via Jmol)
055100743.b3lyp_6-31g(d).inp

055100743.b3lyp_6-31g(d).qchem.inp (generated)

055100743.b3lyp_6-31g(d).gjf (generated)

055100743.b3lyp_6-31g(d).firefly.inp (generated)

055100743.b3lyp_6-31g(d).smash.inp (generated)

055100743.b3lyp_6-31g(d).nwchem.inp (generated) 055100743.b3lyp_6-31g(d).log.xz 055100743.td-b3lyp_6-31g+(d).inp 055100743.td-b3lyp_6-31g+(d).log.xz

055100743.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100743.td-b3lyp_6-31+g(d).gjf (generated)

055100743.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100743.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100743.mol 055100743.PUBCHEM 055100743.mol (via Jmol)
055100744.b3lyp_6-31g(d).inp

055100744.b3lyp_6-31g(d).qchem.inp (generated)

055100744.b3lyp_6-31g(d).gjf (generated)

055100744.b3lyp_6-31g(d).firefly.inp (generated)

055100744.b3lyp_6-31g(d).smash.inp (generated)

055100744.b3lyp_6-31g(d).nwchem.inp (generated) 055100744.b3lyp_6-31g(d).log.xz 055100744.td-b3lyp_6-31g+(d).inp 055100744.td-b3lyp_6-31g+(d).log.xz

055100744.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100744.td-b3lyp_6-31+g(d).gjf (generated)

055100744.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100744.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100744.mol 055100744.PUBCHEM 055100744.mol (via Jmol)
055100754.b3lyp_6-31g(d).inp

055100754.b3lyp_6-31g(d).qchem.inp (generated)

055100754.b3lyp_6-31g(d).gjf (generated)

055100754.b3lyp_6-31g(d).firefly.inp (generated)

055100754.b3lyp_6-31g(d).smash.inp (generated)

055100754.b3lyp_6-31g(d).nwchem.inp (generated) 055100754.b3lyp_6-31g(d).log.xz 055100754.td-b3lyp_6-31g+(d).inp 055100754.td-b3lyp_6-31g+(d).log.xz

055100754.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100754.td-b3lyp_6-31+g(d).gjf (generated)

055100754.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100754.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100754.mol 055100754.PUBCHEM 055100754.mol (via Jmol)
055100774.b3lyp_6-31g(d).inp

055100774.b3lyp_6-31g(d).qchem.inp (generated)

055100774.b3lyp_6-31g(d).gjf (generated)

055100774.b3lyp_6-31g(d).firefly.inp (generated)

055100774.b3lyp_6-31g(d).smash.inp (generated)

055100774.b3lyp_6-31g(d).nwchem.inp (generated) 055100774.b3lyp_6-31g(d).log.xz 055100774.td-b3lyp_6-31g+(d).inp 055100774.td-b3lyp_6-31g+(d).log.xz

055100774.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100774.td-b3lyp_6-31+g(d).gjf (generated)

055100774.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100774.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100774.mol 055100774.PUBCHEM 055100774.mol (via Jmol)
055100775.b3lyp_6-31g(d).inp

055100775.b3lyp_6-31g(d).qchem.inp (generated)

055100775.b3lyp_6-31g(d).gjf (generated)

055100775.b3lyp_6-31g(d).firefly.inp (generated)

055100775.b3lyp_6-31g(d).smash.inp (generated)

055100775.b3lyp_6-31g(d).nwchem.inp (generated) 055100775.b3lyp_6-31g(d).log.xz 055100775.td-b3lyp_6-31g+(d).inp 055100775.td-b3lyp_6-31g+(d).log.xz

055100775.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100775.td-b3lyp_6-31+g(d).gjf (generated)

055100775.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100775.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100775.mol 055100775.PUBCHEM 055100775.mol (via Jmol)
055100791.b3lyp_6-31g(d).inp

055100791.b3lyp_6-31g(d).qchem.inp (generated)

055100791.b3lyp_6-31g(d).gjf (generated)

055100791.b3lyp_6-31g(d).firefly.inp (generated)

055100791.b3lyp_6-31g(d).smash.inp (generated)

055100791.b3lyp_6-31g(d).nwchem.inp (generated) 055100791.b3lyp_6-31g(d).log.xz 055100791.td-b3lyp_6-31g+(d).inp 055100791.td-b3lyp_6-31g+(d).log.xz

055100791.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100791.td-b3lyp_6-31+g(d).gjf (generated)

055100791.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100791.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100791.mol 055100791.PUBCHEM 055100791.mol (via Jmol)
055100795.b3lyp_6-31g(d).inp

055100795.b3lyp_6-31g(d).qchem.inp (generated)

055100795.b3lyp_6-31g(d).gjf (generated)

055100795.b3lyp_6-31g(d).firefly.inp (generated)

055100795.b3lyp_6-31g(d).smash.inp (generated)

055100795.b3lyp_6-31g(d).nwchem.inp (generated) 055100795.b3lyp_6-31g(d).log.xz 055100795.td-b3lyp_6-31g+(d).inp 055100795.td-b3lyp_6-31g+(d).log.xz

055100795.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100795.td-b3lyp_6-31+g(d).gjf (generated)

055100795.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100795.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100795.mol 055100795.PUBCHEM 055100795.mol (via Jmol)
055100796.b3lyp_6-31g(d).inp

055100796.b3lyp_6-31g(d).qchem.inp (generated)

055100796.b3lyp_6-31g(d).gjf (generated)

055100796.b3lyp_6-31g(d).firefly.inp (generated)

055100796.b3lyp_6-31g(d).smash.inp (generated)

055100796.b3lyp_6-31g(d).nwchem.inp (generated) 055100796.b3lyp_6-31g(d).log.xz 055100796.td-b3lyp_6-31g+(d).inp 055100796.td-b3lyp_6-31g+(d).log.xz

055100796.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100796.td-b3lyp_6-31+g(d).gjf (generated)

055100796.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100796.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100796.mol 055100796.PUBCHEM 055100796.mol (via Jmol)
055100800.b3lyp_6-31g(d).inp

055100800.b3lyp_6-31g(d).qchem.inp (generated)

055100800.b3lyp_6-31g(d).gjf (generated)

055100800.b3lyp_6-31g(d).firefly.inp (generated)

055100800.b3lyp_6-31g(d).smash.inp (generated)

055100800.b3lyp_6-31g(d).nwchem.inp (generated) 055100800.b3lyp_6-31g(d).log.xz 055100800.td-b3lyp_6-31g+(d).inp 055100800.td-b3lyp_6-31g+(d).log.xz

055100800.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100800.td-b3lyp_6-31+g(d).gjf (generated)

055100800.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100800.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100800.mol 055100800.PUBCHEM 055100800.mol (via Jmol)
055100801.b3lyp_6-31g(d).inp

055100801.b3lyp_6-31g(d).qchem.inp (generated)

055100801.b3lyp_6-31g(d).gjf (generated)

055100801.b3lyp_6-31g(d).firefly.inp (generated)

055100801.b3lyp_6-31g(d).smash.inp (generated)

055100801.b3lyp_6-31g(d).nwchem.inp (generated) 055100801.b3lyp_6-31g(d).log.xz 055100801.td-b3lyp_6-31g+(d).inp 055100801.td-b3lyp_6-31g+(d).log.xz

055100801.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100801.td-b3lyp_6-31+g(d).gjf (generated)

055100801.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100801.mol 055100801.PUBCHEM 055100801.mol (via Jmol)
055100808.b3lyp_6-31g(d).inp

055100808.b3lyp_6-31g(d).qchem.inp (generated)

055100808.b3lyp_6-31g(d).gjf (generated)

055100808.b3lyp_6-31g(d).firefly.inp (generated)

055100808.b3lyp_6-31g(d).smash.inp (generated)

055100808.b3lyp_6-31g(d).nwchem.inp (generated) 055100808.b3lyp_6-31g(d).log.xz 055100808.td-b3lyp_6-31g+(d).inp 055100808.td-b3lyp_6-31g+(d).log.xz

055100808.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100808.td-b3lyp_6-31+g(d).gjf (generated)

055100808.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100808.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100808.mol 055100808.PUBCHEM 055100808.mol (via Jmol)
055100825.b3lyp_6-31g(d).inp

055100825.b3lyp_6-31g(d).qchem.inp (generated)

055100825.b3lyp_6-31g(d).gjf (generated)

055100825.b3lyp_6-31g(d).firefly.inp (generated)

055100825.b3lyp_6-31g(d).smash.inp (generated)

055100825.b3lyp_6-31g(d).nwchem.inp (generated) 055100825.b3lyp_6-31g(d).log.xz 055100825.td-b3lyp_6-31g+(d).inp 055100825.td-b3lyp_6-31g+(d).log.xz

055100825.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100825.td-b3lyp_6-31+g(d).gjf (generated)

055100825.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100825.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100825.mol 055100825.PUBCHEM 055100825.mol (via Jmol)
055100837.b3lyp_6-31g(d).inp

055100837.b3lyp_6-31g(d).qchem.inp (generated)

055100837.b3lyp_6-31g(d).gjf (generated)

055100837.b3lyp_6-31g(d).firefly.inp (generated)

055100837.b3lyp_6-31g(d).smash.inp (generated)

055100837.b3lyp_6-31g(d).nwchem.inp (generated) 055100837.b3lyp_6-31g(d).log.xz 055100837.td-b3lyp_6-31g+(d).inp 055100837.td-b3lyp_6-31g+(d).log.xz

055100837.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100837.td-b3lyp_6-31+g(d).gjf (generated)

055100837.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100837.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100837.mol 055100837.PUBCHEM 055100837.mol (via Jmol)
055100840.b3lyp_6-31g(d).inp

055100840.b3lyp_6-31g(d).qchem.inp (generated)

055100840.b3lyp_6-31g(d).gjf (generated)

055100840.b3lyp_6-31g(d).firefly.inp (generated)

055100840.b3lyp_6-31g(d).smash.inp (generated)

055100840.b3lyp_6-31g(d).nwchem.inp (generated) 055100840.b3lyp_6-31g(d).log.xz 055100840.td-b3lyp_6-31g+(d).inp 055100840.td-b3lyp_6-31g+(d).log.xz

055100840.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100840.td-b3lyp_6-31+g(d).gjf (generated)

055100840.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100840.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100840.mol 055100840.PUBCHEM 055100840.mol (via Jmol)
055100842.b3lyp_6-31g(d).inp

055100842.b3lyp_6-31g(d).qchem.inp (generated)

055100842.b3lyp_6-31g(d).gjf (generated)

055100842.b3lyp_6-31g(d).firefly.inp (generated)

055100842.b3lyp_6-31g(d).smash.inp (generated)

055100842.b3lyp_6-31g(d).nwchem.inp (generated) 055100842.b3lyp_6-31g(d).log.xz 055100842.mol 055100842.PUBCHEM 055100842.mol (via Jmol)
055100867.b3lyp_6-31g(d).inp

055100867.b3lyp_6-31g(d).qchem.inp (generated)

055100867.b3lyp_6-31g(d).gjf (generated)

055100867.b3lyp_6-31g(d).firefly.inp (generated)

055100867.b3lyp_6-31g(d).smash.inp (generated)

055100867.b3lyp_6-31g(d).nwchem.inp (generated) 055100867.b3lyp_6-31g(d).log.xz 055100867.td-b3lyp_6-31g+(d).inp 055100867.td-b3lyp_6-31g+(d).log.xz

055100867.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100867.td-b3lyp_6-31+g(d).gjf (generated)

055100867.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100867.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100867.mol 055100867.PUBCHEM 055100867.mol (via Jmol)
055100870.b3lyp_6-31g(d).inp

055100870.b3lyp_6-31g(d).qchem.inp (generated)

055100870.b3lyp_6-31g(d).gjf (generated)

055100870.b3lyp_6-31g(d).firefly.inp (generated)

055100870.b3lyp_6-31g(d).smash.inp (generated)

055100870.b3lyp_6-31g(d).nwchem.inp (generated) 055100870.b3lyp_6-31g(d).log.xz 055100870.td-b3lyp_6-31g+(d).inp 055100870.td-b3lyp_6-31g+(d).log.xz

055100870.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100870.td-b3lyp_6-31+g(d).gjf (generated)

055100870.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100870.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100870.mol 055100870.PUBCHEM 055100870.mol (via Jmol)
055100873.b3lyp_6-31g(d).inp

055100873.b3lyp_6-31g(d).qchem.inp (generated)

055100873.b3lyp_6-31g(d).gjf (generated)

055100873.b3lyp_6-31g(d).firefly.inp (generated)

055100873.b3lyp_6-31g(d).smash.inp (generated)

055100873.b3lyp_6-31g(d).nwchem.inp (generated) 055100873.b3lyp_6-31g(d).log.xz 055100873.td-b3lyp_6-31g+(d).inp 055100873.td-b3lyp_6-31g+(d).log.xz

055100873.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100873.td-b3lyp_6-31+g(d).gjf (generated)

055100873.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100873.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100873.mol 055100873.PUBCHEM 055100873.mol (via Jmol)
055100876.b3lyp_6-31g(d).inp

055100876.b3lyp_6-31g(d).qchem.inp (generated)

055100876.b3lyp_6-31g(d).gjf (generated)

055100876.b3lyp_6-31g(d).firefly.inp (generated)

055100876.b3lyp_6-31g(d).smash.inp (generated)

055100876.b3lyp_6-31g(d).nwchem.inp (generated) 055100876.b3lyp_6-31g(d).log.xz 055100876.td-b3lyp_6-31g+(d).inp 055100876.td-b3lyp_6-31g+(d).log.xz

055100876.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100876.td-b3lyp_6-31+g(d).gjf (generated)

055100876.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100876.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100876.mol 055100876.PUBCHEM 055100876.mol (via Jmol)
055100886.b3lyp_6-31g(d).inp

055100886.b3lyp_6-31g(d).qchem.inp (generated)

055100886.b3lyp_6-31g(d).gjf (generated)

055100886.b3lyp_6-31g(d).firefly.inp (generated)

055100886.b3lyp_6-31g(d).smash.inp (generated)

055100886.b3lyp_6-31g(d).nwchem.inp (generated) 055100886.b3lyp_6-31g(d).log.xz 055100886.td-b3lyp_6-31g+(d).inp 055100886.td-b3lyp_6-31g+(d).log.xz

055100886.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100886.td-b3lyp_6-31+g(d).gjf (generated)

055100886.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100886.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100886.mol 055100886.PUBCHEM 055100886.mol (via Jmol)
055100904.b3lyp_6-31g(d).inp

055100904.b3lyp_6-31g(d).qchem.inp (generated)

055100904.b3lyp_6-31g(d).gjf (generated)

055100904.b3lyp_6-31g(d).firefly.inp (generated)

055100904.b3lyp_6-31g(d).smash.inp (generated)

055100904.b3lyp_6-31g(d).nwchem.inp (generated) 055100904.b3lyp_6-31g(d).log.xz 055100904.td-b3lyp_6-31g+(d).inp 055100904.td-b3lyp_6-31g+(d).log.xz

055100904.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100904.td-b3lyp_6-31+g(d).gjf (generated)

055100904.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100904.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100904.mol 055100904.PUBCHEM 055100904.mol (via Jmol)
055100906.b3lyp_6-31g(d).inp

055100906.b3lyp_6-31g(d).qchem.inp (generated)

055100906.b3lyp_6-31g(d).gjf (generated)

055100906.b3lyp_6-31g(d).firefly.inp (generated)

055100906.b3lyp_6-31g(d).smash.inp (generated)

055100906.b3lyp_6-31g(d).nwchem.inp (generated) 055100906.b3lyp_6-31g(d).log.xz 055100906.td-b3lyp_6-31g+(d).inp 055100906.td-b3lyp_6-31g+(d).log.xz

055100906.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100906.td-b3lyp_6-31+g(d).gjf (generated)

055100906.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100906.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100906.mol 055100906.PUBCHEM 055100906.mol (via Jmol)
055100907.b3lyp_6-31g(d).inp

055100907.b3lyp_6-31g(d).qchem.inp (generated)

055100907.b3lyp_6-31g(d).gjf (generated)

055100907.b3lyp_6-31g(d).firefly.inp (generated)

055100907.b3lyp_6-31g(d).smash.inp (generated)

055100907.b3lyp_6-31g(d).nwchem.inp (generated) 055100907.b3lyp_6-31g(d).log.xz 055100907.td-b3lyp_6-31g+(d).inp 055100907.td-b3lyp_6-31g+(d).log.xz

055100907.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100907.td-b3lyp_6-31+g(d).gjf (generated)

055100907.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100907.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100907.mol 055100907.PUBCHEM 055100907.mol (via Jmol)
055100914.b3lyp_6-31g(d).inp

055100914.b3lyp_6-31g(d).qchem.inp (generated)

055100914.b3lyp_6-31g(d).gjf (generated)

055100914.b3lyp_6-31g(d).firefly.inp (generated)

055100914.b3lyp_6-31g(d).smash.inp (generated)

055100914.b3lyp_6-31g(d).nwchem.inp (generated) 055100914.b3lyp_6-31g(d).log.xz 055100914.td-b3lyp_6-31g+(d).inp 055100914.td-b3lyp_6-31g+(d).log.xz

055100914.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100914.td-b3lyp_6-31+g(d).gjf (generated)

055100914.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100914.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100914.mol 055100914.PUBCHEM 055100914.mol (via Jmol)
055100919.b3lyp_6-31g(d).inp

055100919.b3lyp_6-31g(d).qchem.inp (generated)

055100919.b3lyp_6-31g(d).gjf (generated)

055100919.b3lyp_6-31g(d).firefly.inp (generated)

055100919.b3lyp_6-31g(d).smash.inp (generated)

055100919.b3lyp_6-31g(d).nwchem.inp (generated) 055100919.b3lyp_6-31g(d).log.xz 055100919.td-b3lyp_6-31g+(d).inp 055100919.td-b3lyp_6-31g+(d).log.xz

055100919.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100919.td-b3lyp_6-31+g(d).gjf (generated)

055100919.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100919.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100919.mol 055100919.PUBCHEM 055100919.mol (via Jmol)
055100921.b3lyp_6-31g(d).inp

055100921.b3lyp_6-31g(d).qchem.inp (generated)

055100921.b3lyp_6-31g(d).gjf (generated)

055100921.b3lyp_6-31g(d).firefly.inp (generated)

055100921.b3lyp_6-31g(d).smash.inp (generated)

055100921.b3lyp_6-31g(d).nwchem.inp (generated) 055100921.b3lyp_6-31g(d).log.xz 055100921.td-b3lyp_6-31g+(d).inp 055100921.td-b3lyp_6-31g+(d).log.xz

055100921.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100921.td-b3lyp_6-31+g(d).gjf (generated)

055100921.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100921.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100921.mol 055100921.PUBCHEM 055100921.mol (via Jmol)
055100933.b3lyp_6-31g(d).inp

055100933.b3lyp_6-31g(d).qchem.inp (generated)

055100933.b3lyp_6-31g(d).gjf (generated)

055100933.b3lyp_6-31g(d).firefly.inp (generated)

055100933.b3lyp_6-31g(d).smash.inp (generated)

055100933.b3lyp_6-31g(d).nwchem.inp (generated) 055100933.b3lyp_6-31g(d).log.xz 055100933.td-b3lyp_6-31g+(d).inp 055100933.td-b3lyp_6-31g+(d).log.xz

055100933.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100933.td-b3lyp_6-31+g(d).gjf (generated)

055100933.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100933.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100933.mol 055100933.PUBCHEM 055100933.mol (via Jmol)
055100934.b3lyp_6-31g(d).inp

055100934.b3lyp_6-31g(d).qchem.inp (generated)

055100934.b3lyp_6-31g(d).gjf (generated)

055100934.b3lyp_6-31g(d).firefly.inp (generated)

055100934.b3lyp_6-31g(d).smash.inp (generated)

055100934.b3lyp_6-31g(d).nwchem.inp (generated) 055100934.b3lyp_6-31g(d).log.xz 055100934.td-b3lyp_6-31g+(d).inp 055100934.td-b3lyp_6-31g+(d).log.xz

055100934.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100934.td-b3lyp_6-31+g(d).gjf (generated)

055100934.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100934.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100934.mol 055100934.PUBCHEM 055100934.mol (via Jmol)
055100953.b3lyp_6-31g(d).inp

055100953.b3lyp_6-31g(d).qchem.inp (generated)

055100953.b3lyp_6-31g(d).gjf (generated)

055100953.b3lyp_6-31g(d).firefly.inp (generated)

055100953.b3lyp_6-31g(d).smash.inp (generated)

055100953.b3lyp_6-31g(d).nwchem.inp (generated) 055100953.b3lyp_6-31g(d).log.xz 055100953.td-b3lyp_6-31g+(d).inp 055100953.td-b3lyp_6-31g+(d).log.xz

055100953.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100953.td-b3lyp_6-31+g(d).gjf (generated)

055100953.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100953.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100953.mol 055100953.PUBCHEM 055100953.mol (via Jmol)
055100957.b3lyp_6-31g(d).inp

055100957.b3lyp_6-31g(d).qchem.inp (generated)

055100957.b3lyp_6-31g(d).gjf (generated)

055100957.b3lyp_6-31g(d).firefly.inp (generated)

055100957.b3lyp_6-31g(d).smash.inp (generated)

055100957.b3lyp_6-31g(d).nwchem.inp (generated) 055100957.b3lyp_6-31g(d).log.xz 055100957.td-b3lyp_6-31g+(d).inp 055100957.td-b3lyp_6-31g+(d).log.xz

055100957.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100957.td-b3lyp_6-31+g(d).gjf (generated)

055100957.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100957.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100957.mol 055100957.PUBCHEM 055100957.mol (via Jmol)
055100968.b3lyp_6-31g(d).inp

055100968.b3lyp_6-31g(d).qchem.inp (generated)

055100968.b3lyp_6-31g(d).gjf (generated)

055100968.b3lyp_6-31g(d).firefly.inp (generated)

055100968.b3lyp_6-31g(d).smash.inp (generated)

055100968.b3lyp_6-31g(d).nwchem.inp (generated) 055100968.b3lyp_6-31g(d).log.xz 055100968.td-b3lyp_6-31g+(d).inp 055100968.td-b3lyp_6-31g+(d).log.xz

055100968.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100968.td-b3lyp_6-31+g(d).gjf (generated)

055100968.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100968.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100968.mol 055100968.PUBCHEM 055100968.mol (via Jmol)
055100971.b3lyp_6-31g(d).inp

055100971.b3lyp_6-31g(d).qchem.inp (generated)

055100971.b3lyp_6-31g(d).gjf (generated)

055100971.b3lyp_6-31g(d).firefly.inp (generated)

055100971.b3lyp_6-31g(d).smash.inp (generated)

055100971.b3lyp_6-31g(d).nwchem.inp (generated) 055100971.b3lyp_6-31g(d).log.xz 055100971.td-b3lyp_6-31g+(d).inp 055100971.td-b3lyp_6-31g+(d).log.xz

055100971.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100971.td-b3lyp_6-31+g(d).gjf (generated)

055100971.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100971.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100971.mol 055100971.PUBCHEM 055100971.mol (via Jmol)
055100987.b3lyp_6-31g(d).inp

055100987.b3lyp_6-31g(d).qchem.inp (generated)

055100987.b3lyp_6-31g(d).gjf (generated)

055100987.b3lyp_6-31g(d).firefly.inp (generated)

055100987.b3lyp_6-31g(d).smash.inp (generated)

055100987.b3lyp_6-31g(d).nwchem.inp (generated) 055100987.b3lyp_6-31g(d).log.xz 055100987.td-b3lyp_6-31g+(d).inp 055100987.td-b3lyp_6-31g+(d).log.xz

055100987.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100987.td-b3lyp_6-31+g(d).gjf (generated)

055100987.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100987.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100987.mol 055100987.PUBCHEM 055100987.mol (via Jmol)
055100988.b3lyp_6-31g(d).inp

055100988.b3lyp_6-31g(d).qchem.inp (generated)

055100988.b3lyp_6-31g(d).gjf (generated)

055100988.b3lyp_6-31g(d).firefly.inp (generated)

055100988.b3lyp_6-31g(d).smash.inp (generated)

055100988.b3lyp_6-31g(d).nwchem.inp (generated) 055100988.b3lyp_6-31g(d).log.xz 055100988.td-b3lyp_6-31g+(d).inp 055100988.td-b3lyp_6-31g+(d).log.xz

055100988.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100988.td-b3lyp_6-31+g(d).gjf (generated)

055100988.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100988.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100988.mol 055100988.PUBCHEM 055100988.mol (via Jmol)
055100998.b3lyp_6-31g(d).inp

055100998.b3lyp_6-31g(d).qchem.inp (generated)

055100998.b3lyp_6-31g(d).gjf (generated)

055100998.b3lyp_6-31g(d).firefly.inp (generated)

055100998.b3lyp_6-31g(d).smash.inp (generated)

055100998.b3lyp_6-31g(d).nwchem.inp (generated) 055100998.b3lyp_6-31g(d).log.xz 055100998.td-b3lyp_6-31g+(d).inp 055100998.td-b3lyp_6-31g+(d).log.xz

055100998.td-b3lyp_6-31+g(d).qchem.inp (generated)

055100998.td-b3lyp_6-31+g(d).gjf (generated)

055100998.td-b3lyp_6-31+g(d).firefly.inp (generated)

055100998.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055100998.mol 055100998.PUBCHEM 055100998.mol (via Jmol)
055101003.b3lyp_6-31g(d).inp

055101003.b3lyp_6-31g(d).qchem.inp (generated)

055101003.b3lyp_6-31g(d).gjf (generated)

055101003.b3lyp_6-31g(d).firefly.inp (generated)

055101003.b3lyp_6-31g(d).smash.inp (generated)

055101003.b3lyp_6-31g(d).nwchem.inp (generated) 055101003.b3lyp_6-31g(d).log.xz 055101003.td-b3lyp_6-31g+(d).inp 055101003.td-b3lyp_6-31g+(d).log.xz

055101003.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101003.td-b3lyp_6-31+g(d).gjf (generated)

055101003.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101003.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101003.mol 055101003.PUBCHEM 055101003.mol (via Jmol)
055101005.b3lyp_6-31g(d).inp

055101005.b3lyp_6-31g(d).qchem.inp (generated)

055101005.b3lyp_6-31g(d).gjf (generated)

055101005.b3lyp_6-31g(d).firefly.inp (generated)

055101005.b3lyp_6-31g(d).smash.inp (generated)

055101005.b3lyp_6-31g(d).nwchem.inp (generated) 055101005.b3lyp_6-31g(d).log.xz 055101005.td-b3lyp_6-31g+(d).inp 055101005.td-b3lyp_6-31g+(d).log.xz

055101005.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101005.td-b3lyp_6-31+g(d).gjf (generated)

055101005.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101005.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101005.mol 055101005.PUBCHEM 055101005.mol (via Jmol)
055101017.b3lyp_6-31g(d).inp

055101017.b3lyp_6-31g(d).qchem.inp (generated)

055101017.b3lyp_6-31g(d).gjf (generated)

055101017.b3lyp_6-31g(d).firefly.inp (generated)

055101017.b3lyp_6-31g(d).smash.inp (generated)

055101017.b3lyp_6-31g(d).nwchem.inp (generated) 055101017.b3lyp_6-31g(d).log.xz 055101017.td-b3lyp_6-31g+(d).inp 055101017.td-b3lyp_6-31g+(d).log.xz

055101017.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101017.td-b3lyp_6-31+g(d).gjf (generated)

055101017.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101017.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101017.mol 055101017.PUBCHEM 055101017.mol (via Jmol)
055101035.b3lyp_6-31g(d).inp

055101035.b3lyp_6-31g(d).qchem.inp (generated)

055101035.b3lyp_6-31g(d).gjf (generated)

055101035.b3lyp_6-31g(d).firefly.inp (generated)

055101035.b3lyp_6-31g(d).smash.inp (generated)

055101035.b3lyp_6-31g(d).nwchem.inp (generated) 055101035.b3lyp_6-31g(d).log.xz 055101035.td-b3lyp_6-31g+(d).inp 055101035.td-b3lyp_6-31g+(d).log.xz

055101035.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101035.td-b3lyp_6-31+g(d).gjf (generated)

055101035.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101035.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101035.mol 055101035.PUBCHEM 055101035.mol (via Jmol)
055101053.b3lyp_6-31g(d).inp

055101053.b3lyp_6-31g(d).qchem.inp (generated)

055101053.b3lyp_6-31g(d).gjf (generated)

055101053.b3lyp_6-31g(d).firefly.inp (generated)

055101053.b3lyp_6-31g(d).smash.inp (generated)

055101053.b3lyp_6-31g(d).nwchem.inp (generated) 055101053.b3lyp_6-31g(d).log.xz 055101053.td-b3lyp_6-31g+(d).inp 055101053.td-b3lyp_6-31g+(d).log.xz

055101053.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101053.td-b3lyp_6-31+g(d).gjf (generated)

055101053.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101053.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101053.mol 055101053.PUBCHEM 055101053.mol (via Jmol)
055101062.b3lyp_6-31g(d).inp

055101062.b3lyp_6-31g(d).qchem.inp (generated)

055101062.b3lyp_6-31g(d).gjf (generated)

055101062.b3lyp_6-31g(d).firefly.inp (generated)

055101062.b3lyp_6-31g(d).smash.inp (generated)

055101062.b3lyp_6-31g(d).nwchem.inp (generated) 055101062.b3lyp_6-31g(d).log.xz 055101062.td-b3lyp_6-31g+(d).inp 055101062.td-b3lyp_6-31g+(d).log.xz

055101062.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101062.td-b3lyp_6-31+g(d).gjf (generated)

055101062.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101062.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101062.mol 055101062.PUBCHEM 055101062.mol (via Jmol)
055101063.b3lyp_6-31g(d).inp

055101063.b3lyp_6-31g(d).qchem.inp (generated)

055101063.b3lyp_6-31g(d).gjf (generated)

055101063.b3lyp_6-31g(d).firefly.inp (generated)

055101063.b3lyp_6-31g(d).smash.inp (generated)

055101063.b3lyp_6-31g(d).nwchem.inp (generated) 055101063.b3lyp_6-31g(d).log.xz 055101063.td-b3lyp_6-31g+(d).inp 055101063.td-b3lyp_6-31g+(d).log.xz

055101063.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101063.td-b3lyp_6-31+g(d).gjf (generated)

055101063.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101063.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101063.mol 055101063.PUBCHEM 055101063.mol (via Jmol)
055101068.b3lyp_6-31g(d).inp

055101068.b3lyp_6-31g(d).qchem.inp (generated)

055101068.b3lyp_6-31g(d).gjf (generated)

055101068.b3lyp_6-31g(d).firefly.inp (generated)

055101068.b3lyp_6-31g(d).smash.inp (generated)

055101068.b3lyp_6-31g(d).nwchem.inp (generated) 055101068.b3lyp_6-31g(d).log.xz 055101068.td-b3lyp_6-31g+(d).inp 055101068.td-b3lyp_6-31g+(d).log.xz

055101068.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101068.td-b3lyp_6-31+g(d).gjf (generated)

055101068.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101068.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101068.mol 055101068.PUBCHEM 055101068.mol (via Jmol)
055101069.b3lyp_6-31g(d).inp

055101069.b3lyp_6-31g(d).qchem.inp (generated)

055101069.b3lyp_6-31g(d).gjf (generated)

055101069.b3lyp_6-31g(d).firefly.inp (generated)

055101069.b3lyp_6-31g(d).smash.inp (generated)

055101069.b3lyp_6-31g(d).nwchem.inp (generated) 055101069.b3lyp_6-31g(d).log.xz 055101069.td-b3lyp_6-31g+(d).inp 055101069.td-b3lyp_6-31g+(d).log.xz

055101069.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101069.td-b3lyp_6-31+g(d).gjf (generated)

055101069.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101069.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101069.mol 055101069.PUBCHEM 055101069.mol (via Jmol)
055101083.b3lyp_6-31g(d).inp

055101083.b3lyp_6-31g(d).qchem.inp (generated)

055101083.b3lyp_6-31g(d).gjf (generated)

055101083.b3lyp_6-31g(d).firefly.inp (generated)

055101083.b3lyp_6-31g(d).smash.inp (generated)

055101083.b3lyp_6-31g(d).nwchem.inp (generated) 055101083.b3lyp_6-31g(d).log.xz 055101083.td-b3lyp_6-31g+(d).inp 055101083.td-b3lyp_6-31g+(d).log.xz

055101083.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101083.td-b3lyp_6-31+g(d).gjf (generated)

055101083.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101083.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101083.mol 055101083.PUBCHEM 055101083.mol (via Jmol)
055101084.b3lyp_6-31g(d).inp

055101084.b3lyp_6-31g(d).qchem.inp (generated)

055101084.b3lyp_6-31g(d).gjf (generated)

055101084.b3lyp_6-31g(d).firefly.inp (generated)

055101084.b3lyp_6-31g(d).smash.inp (generated)

055101084.b3lyp_6-31g(d).nwchem.inp (generated) 055101084.b3lyp_6-31g(d).log.xz 055101084.td-b3lyp_6-31g+(d).inp 055101084.td-b3lyp_6-31g+(d).log.xz

055101084.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101084.td-b3lyp_6-31+g(d).gjf (generated)

055101084.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101084.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101084.mol 055101084.PUBCHEM 055101084.mol (via Jmol)
055101089.b3lyp_6-31g(d).inp

055101089.b3lyp_6-31g(d).qchem.inp (generated)

055101089.b3lyp_6-31g(d).gjf (generated)

055101089.b3lyp_6-31g(d).firefly.inp (generated)

055101089.b3lyp_6-31g(d).smash.inp (generated)

055101089.b3lyp_6-31g(d).nwchem.inp (generated) 055101089.b3lyp_6-31g(d).log.xz 055101089.td-b3lyp_6-31g+(d).inp 055101089.td-b3lyp_6-31g+(d).log.xz

055101089.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101089.td-b3lyp_6-31+g(d).gjf (generated)

055101089.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101089.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101089.mol 055101089.PUBCHEM 055101089.mol (via Jmol)
055101105.b3lyp_6-31g(d).inp

055101105.b3lyp_6-31g(d).qchem.inp (generated)

055101105.b3lyp_6-31g(d).gjf (generated)

055101105.b3lyp_6-31g(d).firefly.inp (generated)

055101105.b3lyp_6-31g(d).smash.inp (generated)

055101105.b3lyp_6-31g(d).nwchem.inp (generated) 055101105.b3lyp_6-31g(d).log.xz 055101105.td-b3lyp_6-31g+(d).inp 055101105.td-b3lyp_6-31g+(d).log.xz

055101105.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101105.td-b3lyp_6-31+g(d).gjf (generated)

055101105.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101105.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101105.mol 055101105.PUBCHEM 055101105.mol (via Jmol)
055101110.b3lyp_6-31g(d).inp

055101110.b3lyp_6-31g(d).qchem.inp (generated)

055101110.b3lyp_6-31g(d).gjf (generated)

055101110.b3lyp_6-31g(d).firefly.inp (generated)

055101110.b3lyp_6-31g(d).smash.inp (generated)

055101110.b3lyp_6-31g(d).nwchem.inp (generated) 055101110.b3lyp_6-31g(d).log.xz 055101110.td-b3lyp_6-31g+(d).inp 055101110.td-b3lyp_6-31g+(d).log.xz

055101110.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101110.td-b3lyp_6-31+g(d).gjf (generated)

055101110.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101110.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101110.mol 055101110.PUBCHEM 055101110.mol (via Jmol)
055101118.b3lyp_6-31g(d).inp

055101118.b3lyp_6-31g(d).qchem.inp (generated)

055101118.b3lyp_6-31g(d).gjf (generated)

055101118.b3lyp_6-31g(d).firefly.inp (generated)

055101118.b3lyp_6-31g(d).smash.inp (generated)

055101118.b3lyp_6-31g(d).nwchem.inp (generated) 055101118.b3lyp_6-31g(d).log.xz 055101118.td-b3lyp_6-31g+(d).inp 055101118.td-b3lyp_6-31g+(d).log.xz

055101118.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101118.td-b3lyp_6-31+g(d).gjf (generated)

055101118.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101118.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101118.mol 055101118.PUBCHEM 055101118.mol (via Jmol)
055101119.b3lyp_6-31g(d).inp

055101119.b3lyp_6-31g(d).qchem.inp (generated)

055101119.b3lyp_6-31g(d).gjf (generated)

055101119.b3lyp_6-31g(d).firefly.inp (generated)

055101119.b3lyp_6-31g(d).smash.inp (generated)

055101119.b3lyp_6-31g(d).nwchem.inp (generated) 055101119.b3lyp_6-31g(d).log.xz 055101119.td-b3lyp_6-31g+(d).inp 055101119.td-b3lyp_6-31g+(d).log.xz

055101119.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101119.td-b3lyp_6-31+g(d).gjf (generated)

055101119.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101119.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101119.mol 055101119.PUBCHEM 055101119.mol (via Jmol)
055101129.b3lyp_6-31g(d).inp

055101129.b3lyp_6-31g(d).qchem.inp (generated)

055101129.b3lyp_6-31g(d).gjf (generated)

055101129.b3lyp_6-31g(d).firefly.inp (generated)

055101129.b3lyp_6-31g(d).smash.inp (generated)

055101129.b3lyp_6-31g(d).nwchem.inp (generated) 055101129.b3lyp_6-31g(d).log.xz 055101129.td-b3lyp_6-31g+(d).inp 055101129.td-b3lyp_6-31g+(d).log.xz

055101129.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101129.td-b3lyp_6-31+g(d).gjf (generated)

055101129.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101129.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101129.mol 055101129.PUBCHEM 055101129.mol (via Jmol)
055101139.b3lyp_6-31g(d).inp

055101139.b3lyp_6-31g(d).qchem.inp (generated)

055101139.b3lyp_6-31g(d).gjf (generated)

055101139.b3lyp_6-31g(d).firefly.inp (generated)

055101139.b3lyp_6-31g(d).smash.inp (generated)

055101139.b3lyp_6-31g(d).nwchem.inp (generated) 055101139.b3lyp_6-31g(d).log.xz 055101139.td-b3lyp_6-31g+(d).inp 055101139.td-b3lyp_6-31g+(d).log.xz

055101139.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101139.td-b3lyp_6-31+g(d).gjf (generated)

055101139.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101139.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101139.mol 055101139.PUBCHEM 055101139.mol (via Jmol)
055101141.b3lyp_6-31g(d).inp

055101141.b3lyp_6-31g(d).qchem.inp (generated)

055101141.b3lyp_6-31g(d).gjf (generated)

055101141.b3lyp_6-31g(d).firefly.inp (generated)

055101141.b3lyp_6-31g(d).smash.inp (generated)

055101141.b3lyp_6-31g(d).nwchem.inp (generated) 055101141.b3lyp_6-31g(d).log.xz 055101141.mol 055101141.PUBCHEM 055101141.mol (via Jmol)
055101142.b3lyp_6-31g(d).inp

055101142.b3lyp_6-31g(d).qchem.inp (generated)

055101142.b3lyp_6-31g(d).gjf (generated)

055101142.b3lyp_6-31g(d).firefly.inp (generated)

055101142.b3lyp_6-31g(d).smash.inp (generated)

055101142.b3lyp_6-31g(d).nwchem.inp (generated) 055101142.b3lyp_6-31g(d).log.xz 055101142.td-b3lyp_6-31g+(d).inp 055101142.td-b3lyp_6-31g+(d).log.xz

055101142.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101142.td-b3lyp_6-31+g(d).gjf (generated)

055101142.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101142.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101142.mol 055101142.PUBCHEM 055101142.mol (via Jmol)
055101143.b3lyp_6-31g(d).inp

055101143.b3lyp_6-31g(d).qchem.inp (generated)

055101143.b3lyp_6-31g(d).gjf (generated)

055101143.b3lyp_6-31g(d).firefly.inp (generated)

055101143.b3lyp_6-31g(d).smash.inp (generated)

055101143.b3lyp_6-31g(d).nwchem.inp (generated) 055101143.b3lyp_6-31g(d).log.xz 055101143.td-b3lyp_6-31g+(d).inp 055101143.td-b3lyp_6-31g+(d).log.xz

055101143.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101143.td-b3lyp_6-31+g(d).gjf (generated)

055101143.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101143.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101143.mol 055101143.PUBCHEM 055101143.mol (via Jmol)
055101159.b3lyp_6-31g(d).inp

055101159.b3lyp_6-31g(d).qchem.inp (generated)

055101159.b3lyp_6-31g(d).gjf (generated)

055101159.b3lyp_6-31g(d).firefly.inp (generated)

055101159.b3lyp_6-31g(d).smash.inp (generated)

055101159.b3lyp_6-31g(d).nwchem.inp (generated) 055101159.b3lyp_6-31g(d).log.xz 055101159.td-b3lyp_6-31g+(d).inp 055101159.td-b3lyp_6-31g+(d).log.xz

055101159.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101159.td-b3lyp_6-31+g(d).gjf (generated)

055101159.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101159.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101159.mol 055101159.PUBCHEM 055101159.mol (via Jmol)
055101166.b3lyp_6-31g(d).inp

055101166.b3lyp_6-31g(d).qchem.inp (generated)

055101166.b3lyp_6-31g(d).gjf (generated)

055101166.b3lyp_6-31g(d).firefly.inp (generated)

055101166.b3lyp_6-31g(d).smash.inp (generated)

055101166.b3lyp_6-31g(d).nwchem.inp (generated) 055101166.b3lyp_6-31g(d).log.xz 055101166.td-b3lyp_6-31g+(d).inp 055101166.td-b3lyp_6-31g+(d).log.xz

055101166.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101166.td-b3lyp_6-31+g(d).gjf (generated)

055101166.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101166.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101166.mol 055101166.PUBCHEM 055101166.mol (via Jmol)
055101168.b3lyp_6-31g(d).inp

055101168.b3lyp_6-31g(d).qchem.inp (generated)

055101168.b3lyp_6-31g(d).gjf (generated)

055101168.b3lyp_6-31g(d).firefly.inp (generated)

055101168.b3lyp_6-31g(d).smash.inp (generated)

055101168.b3lyp_6-31g(d).nwchem.inp (generated) 055101168.b3lyp_6-31g(d).log.xz 055101168.mol 055101168.PUBCHEM 055101168.mol (via Jmol)
055101170.b3lyp_6-31g(d).inp

055101170.b3lyp_6-31g(d).qchem.inp (generated)

055101170.b3lyp_6-31g(d).gjf (generated)

055101170.b3lyp_6-31g(d).firefly.inp (generated)

055101170.b3lyp_6-31g(d).smash.inp (generated)

055101170.b3lyp_6-31g(d).nwchem.inp (generated) 055101170.b3lyp_6-31g(d).log.xz 055101170.td-b3lyp_6-31g+(d).inp 055101170.td-b3lyp_6-31g+(d).log.xz

055101170.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101170.td-b3lyp_6-31+g(d).gjf (generated)

055101170.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101170.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101170.mol 055101170.PUBCHEM 055101170.mol (via Jmol)
055101192.b3lyp_6-31g(d).inp

055101192.b3lyp_6-31g(d).qchem.inp (generated)

055101192.b3lyp_6-31g(d).gjf (generated)

055101192.b3lyp_6-31g(d).firefly.inp (generated)

055101192.b3lyp_6-31g(d).smash.inp (generated)

055101192.b3lyp_6-31g(d).nwchem.inp (generated) 055101192.b3lyp_6-31g(d).log.xz 055101192.td-b3lyp_6-31g+(d).inp 055101192.td-b3lyp_6-31g+(d).log.xz

055101192.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101192.td-b3lyp_6-31+g(d).gjf (generated)

055101192.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101192.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101192.mol 055101192.PUBCHEM 055101192.mol (via Jmol)
055101200.b3lyp_6-31g(d).inp

055101200.b3lyp_6-31g(d).qchem.inp (generated)

055101200.b3lyp_6-31g(d).gjf (generated)

055101200.b3lyp_6-31g(d).firefly.inp (generated)

055101200.b3lyp_6-31g(d).smash.inp (generated)

055101200.b3lyp_6-31g(d).nwchem.inp (generated) 055101200.b3lyp_6-31g(d).log.xz 055101200.td-b3lyp_6-31g+(d).inp 055101200.td-b3lyp_6-31g+(d).log.xz

055101200.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101200.td-b3lyp_6-31+g(d).gjf (generated)

055101200.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101200.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101200.mol 055101200.PUBCHEM 055101200.mol (via Jmol)
055101214.b3lyp_6-31g(d).inp

055101214.b3lyp_6-31g(d).qchem.inp (generated)

055101214.b3lyp_6-31g(d).gjf (generated)

055101214.b3lyp_6-31g(d).firefly.inp (generated)

055101214.b3lyp_6-31g(d).smash.inp (generated)

055101214.b3lyp_6-31g(d).nwchem.inp (generated) 055101214.b3lyp_6-31g(d).log.xz 055101214.td-b3lyp_6-31g+(d).inp 055101214.td-b3lyp_6-31g+(d).log.xz

055101214.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101214.td-b3lyp_6-31+g(d).gjf (generated)

055101214.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101214.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101214.mol 055101214.PUBCHEM 055101214.mol (via Jmol)
055101219.b3lyp_6-31g(d).inp

055101219.b3lyp_6-31g(d).qchem.inp (generated)

055101219.b3lyp_6-31g(d).gjf (generated)

055101219.b3lyp_6-31g(d).firefly.inp (generated)

055101219.b3lyp_6-31g(d).smash.inp (generated)

055101219.b3lyp_6-31g(d).nwchem.inp (generated) 055101219.b3lyp_6-31g(d).log.xz 055101219.td-b3lyp_6-31g+(d).inp 055101219.td-b3lyp_6-31g+(d).log.xz

055101219.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101219.td-b3lyp_6-31+g(d).gjf (generated)

055101219.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101219.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101219.mol 055101219.PUBCHEM 055101219.mol (via Jmol)
055101220.b3lyp_6-31g(d).inp

055101220.b3lyp_6-31g(d).qchem.inp (generated)

055101220.b3lyp_6-31g(d).gjf (generated)

055101220.b3lyp_6-31g(d).firefly.inp (generated)

055101220.b3lyp_6-31g(d).smash.inp (generated)

055101220.b3lyp_6-31g(d).nwchem.inp (generated) 055101220.b3lyp_6-31g(d).log.xz 055101220.td-b3lyp_6-31g+(d).inp 055101220.td-b3lyp_6-31g+(d).log.xz

055101220.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101220.td-b3lyp_6-31+g(d).gjf (generated)

055101220.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101220.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101220.mol 055101220.PUBCHEM 055101220.mol (via Jmol)
055101237.b3lyp_6-31g(d).inp

055101237.b3lyp_6-31g(d).qchem.inp (generated)

055101237.b3lyp_6-31g(d).gjf (generated)

055101237.b3lyp_6-31g(d).firefly.inp (generated)

055101237.b3lyp_6-31g(d).smash.inp (generated)

055101237.b3lyp_6-31g(d).nwchem.inp (generated) 055101237.b3lyp_6-31g(d).log.xz 055101237.td-b3lyp_6-31g+(d).inp 055101237.td-b3lyp_6-31g+(d).log.xz

055101237.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101237.td-b3lyp_6-31+g(d).gjf (generated)

055101237.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101237.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101237.mol 055101237.PUBCHEM 055101237.mol (via Jmol)
055101259.b3lyp_6-31g(d).inp

055101259.b3lyp_6-31g(d).qchem.inp (generated)

055101259.b3lyp_6-31g(d).gjf (generated)

055101259.b3lyp_6-31g(d).firefly.inp (generated)

055101259.b3lyp_6-31g(d).smash.inp (generated)

055101259.b3lyp_6-31g(d).nwchem.inp (generated) 055101259.b3lyp_6-31g(d).log.xz 055101259.td-b3lyp_6-31g+(d).inp 055101259.td-b3lyp_6-31g+(d).log.xz

055101259.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101259.td-b3lyp_6-31+g(d).gjf (generated)

055101259.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101259.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101259.mol 055101259.PUBCHEM 055101259.mol (via Jmol)
055101260.b3lyp_6-31g(d).inp

055101260.b3lyp_6-31g(d).qchem.inp (generated)

055101260.b3lyp_6-31g(d).gjf (generated)

055101260.b3lyp_6-31g(d).firefly.inp (generated)

055101260.b3lyp_6-31g(d).smash.inp (generated)

055101260.b3lyp_6-31g(d).nwchem.inp (generated) 055101260.b3lyp_6-31g(d).log.xz 055101260.td-b3lyp_6-31g+(d).inp 055101260.td-b3lyp_6-31g+(d).log.xz

055101260.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101260.td-b3lyp_6-31+g(d).gjf (generated)

055101260.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101260.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101260.mol 055101260.PUBCHEM 055101260.mol (via Jmol)
055101261.b3lyp_6-31g(d).inp

055101261.b3lyp_6-31g(d).qchem.inp (generated)

055101261.b3lyp_6-31g(d).gjf (generated)

055101261.b3lyp_6-31g(d).firefly.inp (generated)

055101261.b3lyp_6-31g(d).smash.inp (generated)

055101261.b3lyp_6-31g(d).nwchem.inp (generated) 055101261.b3lyp_6-31g(d).log.xz 055101261.td-b3lyp_6-31g+(d).inp 055101261.td-b3lyp_6-31g+(d).log.xz

055101261.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101261.td-b3lyp_6-31+g(d).gjf (generated)

055101261.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101261.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101261.mol 055101261.PUBCHEM 055101261.mol (via Jmol)
055101264.b3lyp_6-31g(d).inp

055101264.b3lyp_6-31g(d).qchem.inp (generated)

055101264.b3lyp_6-31g(d).gjf (generated)

055101264.b3lyp_6-31g(d).firefly.inp (generated)

055101264.b3lyp_6-31g(d).smash.inp (generated)

055101264.b3lyp_6-31g(d).nwchem.inp (generated) 055101264.b3lyp_6-31g(d).log.xz 055101264.td-b3lyp_6-31g+(d).inp 055101264.td-b3lyp_6-31g+(d).log.xz

055101264.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101264.td-b3lyp_6-31+g(d).gjf (generated)

055101264.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101264.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101264.mol 055101264.PUBCHEM 055101264.mol (via Jmol)
055101285.b3lyp_6-31g(d).inp

055101285.b3lyp_6-31g(d).qchem.inp (generated)

055101285.b3lyp_6-31g(d).gjf (generated)

055101285.b3lyp_6-31g(d).firefly.inp (generated)

055101285.b3lyp_6-31g(d).smash.inp (generated)

055101285.b3lyp_6-31g(d).nwchem.inp (generated) 055101285.b3lyp_6-31g(d).log.xz 055101285.td-b3lyp_6-31g+(d).inp 055101285.td-b3lyp_6-31g+(d).log.xz

055101285.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101285.td-b3lyp_6-31+g(d).gjf (generated)

055101285.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101285.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101285.mol 055101285.PUBCHEM 055101285.mol (via Jmol)
055101289.b3lyp_6-31g(d).inp

055101289.b3lyp_6-31g(d).qchem.inp (generated)

055101289.b3lyp_6-31g(d).gjf (generated)

055101289.b3lyp_6-31g(d).firefly.inp (generated)

055101289.b3lyp_6-31g(d).smash.inp (generated)

055101289.b3lyp_6-31g(d).nwchem.inp (generated) 055101289.b3lyp_6-31g(d).log.xz 055101289.td-b3lyp_6-31g+(d).inp 055101289.td-b3lyp_6-31g+(d).log.xz

055101289.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101289.td-b3lyp_6-31+g(d).gjf (generated)

055101289.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101289.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101289.mol 055101289.PUBCHEM 055101289.mol (via Jmol)
055101312.b3lyp_6-31g(d).inp

055101312.b3lyp_6-31g(d).qchem.inp (generated)

055101312.b3lyp_6-31g(d).gjf (generated)

055101312.b3lyp_6-31g(d).firefly.inp (generated)

055101312.b3lyp_6-31g(d).smash.inp (generated)

055101312.b3lyp_6-31g(d).nwchem.inp (generated) 055101312.b3lyp_6-31g(d).log.xz 055101312.mol 055101312.PUBCHEM 055101312.mol (via Jmol)
055101313.b3lyp_6-31g(d).inp

055101313.b3lyp_6-31g(d).qchem.inp (generated)

055101313.b3lyp_6-31g(d).gjf (generated)

055101313.b3lyp_6-31g(d).firefly.inp (generated)

055101313.b3lyp_6-31g(d).smash.inp (generated)

055101313.b3lyp_6-31g(d).nwchem.inp (generated) 055101313.b3lyp_6-31g(d).log.xz 055101313.td-b3lyp_6-31g+(d).inp 055101313.td-b3lyp_6-31g+(d).log.xz

055101313.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101313.td-b3lyp_6-31+g(d).gjf (generated)

055101313.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101313.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101313.mol 055101313.PUBCHEM 055101313.mol (via Jmol)
055101319.b3lyp_6-31g(d).inp

055101319.b3lyp_6-31g(d).qchem.inp (generated)

055101319.b3lyp_6-31g(d).gjf (generated)

055101319.b3lyp_6-31g(d).firefly.inp (generated)

055101319.b3lyp_6-31g(d).smash.inp (generated)

055101319.b3lyp_6-31g(d).nwchem.inp (generated) 055101319.b3lyp_6-31g(d).log.xz 055101319.td-b3lyp_6-31g+(d).inp 055101319.td-b3lyp_6-31g+(d).log.xz

055101319.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101319.td-b3lyp_6-31+g(d).gjf (generated)

055101319.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101319.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101319.mol 055101319.PUBCHEM 055101319.mol (via Jmol)
055101329.b3lyp_6-31g(d).inp

055101329.b3lyp_6-31g(d).qchem.inp (generated)

055101329.b3lyp_6-31g(d).gjf (generated)

055101329.b3lyp_6-31g(d).firefly.inp (generated)

055101329.b3lyp_6-31g(d).smash.inp (generated)

055101329.b3lyp_6-31g(d).nwchem.inp (generated) 055101329.b3lyp_6-31g(d).log.xz 055101329.td-b3lyp_6-31g+(d).inp 055101329.td-b3lyp_6-31g+(d).log.xz

055101329.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101329.td-b3lyp_6-31+g(d).gjf (generated)

055101329.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101329.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101329.mol 055101329.PUBCHEM 055101329.mol (via Jmol)
055101333.b3lyp_6-31g(d).inp

055101333.b3lyp_6-31g(d).qchem.inp (generated)

055101333.b3lyp_6-31g(d).gjf (generated)

055101333.b3lyp_6-31g(d).firefly.inp (generated)

055101333.b3lyp_6-31g(d).smash.inp (generated)

055101333.b3lyp_6-31g(d).nwchem.inp (generated) 055101333.b3lyp_6-31g(d).log.xz 055101333.td-b3lyp_6-31g+(d).inp 055101333.td-b3lyp_6-31g+(d).log.xz

055101333.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101333.td-b3lyp_6-31+g(d).gjf (generated)

055101333.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101333.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101333.mol 055101333.PUBCHEM 055101333.mol (via Jmol)
055101336.b3lyp_6-31g(d).inp

055101336.b3lyp_6-31g(d).qchem.inp (generated)

055101336.b3lyp_6-31g(d).gjf (generated)

055101336.b3lyp_6-31g(d).firefly.inp (generated)

055101336.b3lyp_6-31g(d).smash.inp (generated)

055101336.b3lyp_6-31g(d).nwchem.inp (generated) 055101336.b3lyp_6-31g(d).log.xz 055101336.td-b3lyp_6-31g+(d).inp 055101336.td-b3lyp_6-31g+(d).log.xz

055101336.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101336.td-b3lyp_6-31+g(d).gjf (generated)

055101336.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101336.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101336.mol 055101336.PUBCHEM 055101336.mol (via Jmol)
055101339.b3lyp_6-31g(d).inp

055101339.b3lyp_6-31g(d).qchem.inp (generated)

055101339.b3lyp_6-31g(d).gjf (generated)

055101339.b3lyp_6-31g(d).firefly.inp (generated)

055101339.b3lyp_6-31g(d).smash.inp (generated)

055101339.b3lyp_6-31g(d).nwchem.inp (generated) 055101339.b3lyp_6-31g(d).log.xz 055101339.td-b3lyp_6-31g+(d).inp 055101339.td-b3lyp_6-31g+(d).log.xz

055101339.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101339.td-b3lyp_6-31+g(d).gjf (generated)

055101339.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101339.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101339.mol 055101339.PUBCHEM 055101339.mol (via Jmol)
055101357.b3lyp_6-31g(d).inp

055101357.b3lyp_6-31g(d).qchem.inp (generated)

055101357.b3lyp_6-31g(d).gjf (generated)

055101357.b3lyp_6-31g(d).firefly.inp (generated)

055101357.b3lyp_6-31g(d).smash.inp (generated)

055101357.b3lyp_6-31g(d).nwchem.inp (generated) 055101357.b3lyp_6-31g(d).log.xz 055101357.td-b3lyp_6-31g+(d).inp 055101357.td-b3lyp_6-31g+(d).log.xz

055101357.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101357.td-b3lyp_6-31+g(d).gjf (generated)

055101357.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101357.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101357.mol 055101357.PUBCHEM 055101357.mol (via Jmol)
055101376.b3lyp_6-31g(d).inp

055101376.b3lyp_6-31g(d).qchem.inp (generated)

055101376.b3lyp_6-31g(d).gjf (generated)

055101376.b3lyp_6-31g(d).firefly.inp (generated)

055101376.b3lyp_6-31g(d).smash.inp (generated)

055101376.b3lyp_6-31g(d).nwchem.inp (generated) 055101376.b3lyp_6-31g(d).log.xz 055101376.td-b3lyp_6-31g+(d).inp 055101376.td-b3lyp_6-31g+(d).log.xz

055101376.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101376.td-b3lyp_6-31+g(d).gjf (generated)

055101376.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101376.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101376.mol 055101376.PUBCHEM 055101376.mol (via Jmol)
055101385.b3lyp_6-31g(d).inp

055101385.b3lyp_6-31g(d).qchem.inp (generated)

055101385.b3lyp_6-31g(d).gjf (generated)

055101385.b3lyp_6-31g(d).firefly.inp (generated)

055101385.b3lyp_6-31g(d).smash.inp (generated)

055101385.b3lyp_6-31g(d).nwchem.inp (generated) 055101385.b3lyp_6-31g(d).log.xz 055101385.td-b3lyp_6-31g+(d).inp 055101385.td-b3lyp_6-31g+(d).log.xz

055101385.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101385.td-b3lyp_6-31+g(d).gjf (generated)

055101385.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101385.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101385.mol 055101385.PUBCHEM 055101385.mol (via Jmol)
055101387.b3lyp_6-31g(d).inp

055101387.b3lyp_6-31g(d).qchem.inp (generated)

055101387.b3lyp_6-31g(d).gjf (generated)

055101387.b3lyp_6-31g(d).firefly.inp (generated)

055101387.b3lyp_6-31g(d).smash.inp (generated)

055101387.b3lyp_6-31g(d).nwchem.inp (generated) 055101387.b3lyp_6-31g(d).log.xz 055101387.td-b3lyp_6-31g+(d).inp 055101387.td-b3lyp_6-31g+(d).log.xz

055101387.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101387.td-b3lyp_6-31+g(d).gjf (generated)

055101387.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101387.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101387.mol 055101387.PUBCHEM 055101387.mol (via Jmol)
055101400.b3lyp_6-31g(d).inp

055101400.b3lyp_6-31g(d).qchem.inp (generated)

055101400.b3lyp_6-31g(d).gjf (generated)

055101400.b3lyp_6-31g(d).firefly.inp (generated)

055101400.b3lyp_6-31g(d).smash.inp (generated)

055101400.b3lyp_6-31g(d).nwchem.inp (generated) 055101400.b3lyp_6-31g(d).log.xz 055101400.td-b3lyp_6-31g+(d).inp 055101400.td-b3lyp_6-31g+(d).log.xz

055101400.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101400.td-b3lyp_6-31+g(d).gjf (generated)

055101400.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101400.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101400.mol 055101400.PUBCHEM 055101400.mol (via Jmol)
055101405.b3lyp_6-31g(d).inp

055101405.b3lyp_6-31g(d).qchem.inp (generated)

055101405.b3lyp_6-31g(d).gjf (generated)

055101405.b3lyp_6-31g(d).firefly.inp (generated)

055101405.b3lyp_6-31g(d).smash.inp (generated)

055101405.b3lyp_6-31g(d).nwchem.inp (generated) 055101405.b3lyp_6-31g(d).log.xz 055101405.td-b3lyp_6-31g+(d).inp 055101405.td-b3lyp_6-31g+(d).log.xz

055101405.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101405.td-b3lyp_6-31+g(d).gjf (generated)

055101405.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101405.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101405.mol 055101405.PUBCHEM 055101405.mol (via Jmol)
055101414.b3lyp_6-31g(d).inp

055101414.b3lyp_6-31g(d).qchem.inp (generated)

055101414.b3lyp_6-31g(d).gjf (generated)

055101414.b3lyp_6-31g(d).firefly.inp (generated)

055101414.b3lyp_6-31g(d).smash.inp (generated)

055101414.b3lyp_6-31g(d).nwchem.inp (generated) 055101414.b3lyp_6-31g(d).log.xz 055101414.td-b3lyp_6-31g+(d).inp 055101414.td-b3lyp_6-31g+(d).log.xz

055101414.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101414.td-b3lyp_6-31+g(d).gjf (generated)

055101414.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101414.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101414.mol 055101414.PUBCHEM 055101414.mol (via Jmol)
055101415.b3lyp_6-31g(d).inp

055101415.b3lyp_6-31g(d).qchem.inp (generated)

055101415.b3lyp_6-31g(d).gjf (generated)

055101415.b3lyp_6-31g(d).firefly.inp (generated)

055101415.b3lyp_6-31g(d).smash.inp (generated)

055101415.b3lyp_6-31g(d).nwchem.inp (generated) 055101415.b3lyp_6-31g(d).log.xz 055101415.mol 055101415.PUBCHEM 055101415.mol (via Jmol)
055101422.b3lyp_6-31g(d).inp

055101422.b3lyp_6-31g(d).qchem.inp (generated)

055101422.b3lyp_6-31g(d).gjf (generated)

055101422.b3lyp_6-31g(d).firefly.inp (generated)

055101422.b3lyp_6-31g(d).smash.inp (generated)

055101422.b3lyp_6-31g(d).nwchem.inp (generated) 055101422.b3lyp_6-31g(d).log.xz 055101422.td-b3lyp_6-31g+(d).inp 055101422.td-b3lyp_6-31g+(d).log.xz

055101422.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101422.td-b3lyp_6-31+g(d).gjf (generated)

055101422.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101422.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101422.mol 055101422.PUBCHEM 055101422.mol (via Jmol)
055101445.b3lyp_6-31g(d).inp

055101445.b3lyp_6-31g(d).qchem.inp (generated)

055101445.b3lyp_6-31g(d).gjf (generated)

055101445.b3lyp_6-31g(d).firefly.inp (generated)

055101445.b3lyp_6-31g(d).smash.inp (generated)

055101445.b3lyp_6-31g(d).nwchem.inp (generated) 055101445.b3lyp_6-31g(d).log.xz 055101445.td-b3lyp_6-31g+(d).inp 055101445.td-b3lyp_6-31g+(d).log.xz

055101445.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101445.td-b3lyp_6-31+g(d).gjf (generated)

055101445.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101445.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101445.mol 055101445.PUBCHEM 055101445.mol (via Jmol)
055101446.b3lyp_6-31g(d).inp

055101446.b3lyp_6-31g(d).qchem.inp (generated)

055101446.b3lyp_6-31g(d).gjf (generated)

055101446.b3lyp_6-31g(d).firefly.inp (generated)

055101446.b3lyp_6-31g(d).smash.inp (generated)

055101446.b3lyp_6-31g(d).nwchem.inp (generated) 055101446.b3lyp_6-31g(d).log.xz 055101446.td-b3lyp_6-31g+(d).inp 055101446.td-b3lyp_6-31g+(d).log.xz

055101446.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101446.td-b3lyp_6-31+g(d).gjf (generated)

055101446.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101446.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101446.mol 055101446.PUBCHEM 055101446.mol (via Jmol)
055101450.b3lyp_6-31g(d).inp

055101450.b3lyp_6-31g(d).qchem.inp (generated)

055101450.b3lyp_6-31g(d).gjf (generated)

055101450.b3lyp_6-31g(d).firefly.inp (generated)

055101450.b3lyp_6-31g(d).smash.inp (generated)

055101450.b3lyp_6-31g(d).nwchem.inp (generated) 055101450.b3lyp_6-31g(d).log.xz 055101450.td-b3lyp_6-31g+(d).inp 055101450.td-b3lyp_6-31g+(d).log.xz

055101450.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101450.td-b3lyp_6-31+g(d).gjf (generated)

055101450.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101450.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101450.mol 055101450.PUBCHEM 055101450.mol (via Jmol)
055101452.b3lyp_6-31g(d).inp

055101452.b3lyp_6-31g(d).qchem.inp (generated)

055101452.b3lyp_6-31g(d).gjf (generated)

055101452.b3lyp_6-31g(d).firefly.inp (generated)

055101452.b3lyp_6-31g(d).smash.inp (generated)

055101452.b3lyp_6-31g(d).nwchem.inp (generated) 055101452.b3lyp_6-31g(d).log.xz 055101452.td-b3lyp_6-31g+(d).inp 055101452.td-b3lyp_6-31g+(d).log.xz

055101452.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101452.td-b3lyp_6-31+g(d).gjf (generated)

055101452.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101452.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101452.mol 055101452.PUBCHEM 055101452.mol (via Jmol)
055101453.b3lyp_6-31g(d).inp

055101453.b3lyp_6-31g(d).qchem.inp (generated)

055101453.b3lyp_6-31g(d).gjf (generated)

055101453.b3lyp_6-31g(d).firefly.inp (generated)

055101453.b3lyp_6-31g(d).smash.inp (generated)

055101453.b3lyp_6-31g(d).nwchem.inp (generated) 055101453.b3lyp_6-31g(d).log.xz 055101453.td-b3lyp_6-31g+(d).inp 055101453.td-b3lyp_6-31g+(d).log.xz

055101453.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101453.td-b3lyp_6-31+g(d).gjf (generated)

055101453.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101453.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101453.mol 055101453.PUBCHEM 055101453.mol (via Jmol)
055101454.b3lyp_6-31g(d).inp

055101454.b3lyp_6-31g(d).qchem.inp (generated)

055101454.b3lyp_6-31g(d).gjf (generated)

055101454.b3lyp_6-31g(d).firefly.inp (generated)

055101454.b3lyp_6-31g(d).smash.inp (generated)

055101454.b3lyp_6-31g(d).nwchem.inp (generated) 055101454.b3lyp_6-31g(d).log.xz 055101454.td-b3lyp_6-31g+(d).inp 055101454.td-b3lyp_6-31g+(d).log.xz

055101454.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101454.td-b3lyp_6-31+g(d).gjf (generated)

055101454.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101454.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101454.mol 055101454.PUBCHEM 055101454.mol (via Jmol)
055101482.b3lyp_6-31g(d).inp

055101482.b3lyp_6-31g(d).qchem.inp (generated)

055101482.b3lyp_6-31g(d).gjf (generated)

055101482.b3lyp_6-31g(d).firefly.inp (generated)

055101482.b3lyp_6-31g(d).smash.inp (generated)

055101482.b3lyp_6-31g(d).nwchem.inp (generated) 055101482.b3lyp_6-31g(d).log.xz 055101482.td-b3lyp_6-31g+(d).inp 055101482.td-b3lyp_6-31g+(d).log.xz

055101482.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101482.td-b3lyp_6-31+g(d).gjf (generated)

055101482.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101482.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101482.mol 055101482.PUBCHEM 055101482.mol (via Jmol)
055101483.b3lyp_6-31g(d).inp

055101483.b3lyp_6-31g(d).qchem.inp (generated)

055101483.b3lyp_6-31g(d).gjf (generated)

055101483.b3lyp_6-31g(d).firefly.inp (generated)

055101483.b3lyp_6-31g(d).smash.inp (generated)

055101483.b3lyp_6-31g(d).nwchem.inp (generated) 055101483.b3lyp_6-31g(d).log.xz 055101483.td-b3lyp_6-31g+(d).inp 055101483.td-b3lyp_6-31g+(d).log.xz

055101483.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101483.td-b3lyp_6-31+g(d).gjf (generated)

055101483.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101483.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101483.mol 055101483.PUBCHEM 055101483.mol (via Jmol)
055101484.b3lyp_6-31g(d).inp

055101484.b3lyp_6-31g(d).qchem.inp (generated)

055101484.b3lyp_6-31g(d).gjf (generated)

055101484.b3lyp_6-31g(d).firefly.inp (generated)

055101484.b3lyp_6-31g(d).smash.inp (generated)

055101484.b3lyp_6-31g(d).nwchem.inp (generated) 055101484.b3lyp_6-31g(d).log.xz 055101484.td-b3lyp_6-31g+(d).inp 055101484.td-b3lyp_6-31g+(d).log.xz

055101484.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101484.td-b3lyp_6-31+g(d).gjf (generated)

055101484.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101484.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101484.mol 055101484.PUBCHEM 055101484.mol (via Jmol)
055101492.b3lyp_6-31g(d).inp

055101492.b3lyp_6-31g(d).qchem.inp (generated)

055101492.b3lyp_6-31g(d).gjf (generated)

055101492.b3lyp_6-31g(d).firefly.inp (generated)

055101492.b3lyp_6-31g(d).smash.inp (generated)

055101492.b3lyp_6-31g(d).nwchem.inp (generated) 055101492.b3lyp_6-31g(d).log.xz 055101492.td-b3lyp_6-31g+(d).inp 055101492.td-b3lyp_6-31g+(d).log.xz

055101492.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101492.td-b3lyp_6-31+g(d).gjf (generated)

055101492.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101492.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101492.mol 055101492.PUBCHEM 055101492.mol (via Jmol)
055101496.b3lyp_6-31g(d).inp

055101496.b3lyp_6-31g(d).qchem.inp (generated)

055101496.b3lyp_6-31g(d).gjf (generated)

055101496.b3lyp_6-31g(d).firefly.inp (generated)

055101496.b3lyp_6-31g(d).smash.inp (generated)

055101496.b3lyp_6-31g(d).nwchem.inp (generated) 055101496.b3lyp_6-31g(d).log.xz 055101496.mol 055101496.PUBCHEM 055101496.mol (via Jmol)
055101498.b3lyp_6-31g(d).inp

055101498.b3lyp_6-31g(d).qchem.inp (generated)

055101498.b3lyp_6-31g(d).gjf (generated)

055101498.b3lyp_6-31g(d).firefly.inp (generated)

055101498.b3lyp_6-31g(d).smash.inp (generated)

055101498.b3lyp_6-31g(d).nwchem.inp (generated) 055101498.b3lyp_6-31g(d).log.xz 055101498.td-b3lyp_6-31g+(d).inp 055101498.td-b3lyp_6-31g+(d).log.xz

055101498.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101498.td-b3lyp_6-31+g(d).gjf (generated)

055101498.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101498.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101498.mol 055101498.PUBCHEM 055101498.mol (via Jmol)
055101524.b3lyp_6-31g(d).inp

055101524.b3lyp_6-31g(d).qchem.inp (generated)

055101524.b3lyp_6-31g(d).gjf (generated)

055101524.b3lyp_6-31g(d).firefly.inp (generated)

055101524.b3lyp_6-31g(d).smash.inp (generated)

055101524.b3lyp_6-31g(d).nwchem.inp (generated) 055101524.b3lyp_6-31g(d).log.xz 055101524.td-b3lyp_6-31g+(d).inp 055101524.td-b3lyp_6-31g+(d).log.xz

055101524.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101524.td-b3lyp_6-31+g(d).gjf (generated)

055101524.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101524.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101524.mol 055101524.PUBCHEM 055101524.mol (via Jmol)
055101529.b3lyp_6-31g(d).inp

055101529.b3lyp_6-31g(d).qchem.inp (generated)

055101529.b3lyp_6-31g(d).gjf (generated)

055101529.b3lyp_6-31g(d).firefly.inp (generated)

055101529.b3lyp_6-31g(d).smash.inp (generated)

055101529.b3lyp_6-31g(d).nwchem.inp (generated) 055101529.b3lyp_6-31g(d).log.xz 055101529.td-b3lyp_6-31g+(d).inp 055101529.td-b3lyp_6-31g+(d).log.xz

055101529.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101529.td-b3lyp_6-31+g(d).gjf (generated)

055101529.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101529.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101529.mol 055101529.PUBCHEM 055101529.mol (via Jmol)
055101544.b3lyp_6-31g(d).inp

055101544.b3lyp_6-31g(d).qchem.inp (generated)

055101544.b3lyp_6-31g(d).gjf (generated)

055101544.b3lyp_6-31g(d).firefly.inp (generated)

055101544.b3lyp_6-31g(d).smash.inp (generated)

055101544.b3lyp_6-31g(d).nwchem.inp (generated) 055101544.b3lyp_6-31g(d).log.xz 055101544.td-b3lyp_6-31g+(d).inp 055101544.td-b3lyp_6-31g+(d).log.xz

055101544.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101544.td-b3lyp_6-31+g(d).gjf (generated)

055101544.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101544.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101544.mol 055101544.PUBCHEM 055101544.mol (via Jmol)
055101545.b3lyp_6-31g(d).inp

055101545.b3lyp_6-31g(d).qchem.inp (generated)

055101545.b3lyp_6-31g(d).gjf (generated)

055101545.b3lyp_6-31g(d).firefly.inp (generated)

055101545.b3lyp_6-31g(d).smash.inp (generated)

055101545.b3lyp_6-31g(d).nwchem.inp (generated) 055101545.b3lyp_6-31g(d).log.xz 055101545.td-b3lyp_6-31g+(d).inp 055101545.td-b3lyp_6-31g+(d).log.xz

055101545.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101545.td-b3lyp_6-31+g(d).gjf (generated)

055101545.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101545.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101545.mol 055101545.PUBCHEM 055101545.mol (via Jmol)
055101546.b3lyp_6-31g(d).inp

055101546.b3lyp_6-31g(d).qchem.inp (generated)

055101546.b3lyp_6-31g(d).gjf (generated)

055101546.b3lyp_6-31g(d).firefly.inp (generated)

055101546.b3lyp_6-31g(d).smash.inp (generated)

055101546.b3lyp_6-31g(d).nwchem.inp (generated) 055101546.b3lyp_6-31g(d).log.xz 055101546.mol 055101546.PUBCHEM 055101546.mol (via Jmol)
055101550.b3lyp_6-31g(d).inp

055101550.b3lyp_6-31g(d).qchem.inp (generated)

055101550.b3lyp_6-31g(d).gjf (generated)

055101550.b3lyp_6-31g(d).firefly.inp (generated)

055101550.b3lyp_6-31g(d).smash.inp (generated)

055101550.b3lyp_6-31g(d).nwchem.inp (generated) 055101550.b3lyp_6-31g(d).log.xz 055101550.td-b3lyp_6-31g+(d).inp 055101550.td-b3lyp_6-31g+(d).log.xz

055101550.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101550.td-b3lyp_6-31+g(d).gjf (generated)

055101550.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101550.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101550.mol 055101550.PUBCHEM 055101550.mol (via Jmol)
055101552.b3lyp_6-31g(d).inp

055101552.b3lyp_6-31g(d).qchem.inp (generated)

055101552.b3lyp_6-31g(d).gjf (generated)

055101552.b3lyp_6-31g(d).firefly.inp (generated)

055101552.b3lyp_6-31g(d).smash.inp (generated)

055101552.b3lyp_6-31g(d).nwchem.inp (generated) 055101552.b3lyp_6-31g(d).log.xz 055101552.td-b3lyp_6-31g+(d).inp 055101552.td-b3lyp_6-31g+(d).log.xz

055101552.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101552.td-b3lyp_6-31+g(d).gjf (generated)

055101552.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101552.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101552.mol 055101552.PUBCHEM 055101552.mol (via Jmol)
055101555.b3lyp_6-31g(d).inp

055101555.b3lyp_6-31g(d).qchem.inp (generated)

055101555.b3lyp_6-31g(d).gjf (generated)

055101555.b3lyp_6-31g(d).firefly.inp (generated)

055101555.b3lyp_6-31g(d).smash.inp (generated)

055101555.b3lyp_6-31g(d).nwchem.inp (generated) 055101555.b3lyp_6-31g(d).log.xz 055101555.td-b3lyp_6-31g+(d).inp 055101555.td-b3lyp_6-31g+(d).log.xz

055101555.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101555.td-b3lyp_6-31+g(d).gjf (generated)

055101555.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101555.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101555.mol 055101555.PUBCHEM 055101555.mol (via Jmol)
055101557.b3lyp_6-31g(d).inp

055101557.b3lyp_6-31g(d).qchem.inp (generated)

055101557.b3lyp_6-31g(d).gjf (generated)

055101557.b3lyp_6-31g(d).firefly.inp (generated)

055101557.b3lyp_6-31g(d).smash.inp (generated)

055101557.b3lyp_6-31g(d).nwchem.inp (generated) 055101557.b3lyp_6-31g(d).log.xz 055101557.td-b3lyp_6-31g+(d).inp 055101557.td-b3lyp_6-31g+(d).log.xz

055101557.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101557.td-b3lyp_6-31+g(d).gjf (generated)

055101557.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101557.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101557.mol 055101557.PUBCHEM 055101557.mol (via Jmol)
055101570.b3lyp_6-31g(d).inp

055101570.b3lyp_6-31g(d).qchem.inp (generated)

055101570.b3lyp_6-31g(d).gjf (generated)

055101570.b3lyp_6-31g(d).firefly.inp (generated)

055101570.b3lyp_6-31g(d).smash.inp (generated)

055101570.b3lyp_6-31g(d).nwchem.inp (generated) 055101570.b3lyp_6-31g(d).log.xz 055101570.td-b3lyp_6-31g+(d).inp 055101570.td-b3lyp_6-31g+(d).log.xz

055101570.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101570.td-b3lyp_6-31+g(d).gjf (generated)

055101570.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101570.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101570.mol 055101570.PUBCHEM 055101570.mol (via Jmol)
055101574.b3lyp_6-31g(d).inp

055101574.b3lyp_6-31g(d).qchem.inp (generated)

055101574.b3lyp_6-31g(d).gjf (generated)

055101574.b3lyp_6-31g(d).firefly.inp (generated)

055101574.b3lyp_6-31g(d).smash.inp (generated)

055101574.b3lyp_6-31g(d).nwchem.inp (generated) 055101574.b3lyp_6-31g(d).log.xz 055101574.td-b3lyp_6-31g+(d).inp 055101574.td-b3lyp_6-31g+(d).log.xz

055101574.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101574.td-b3lyp_6-31+g(d).gjf (generated)

055101574.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101574.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101574.mol 055101574.PUBCHEM 055101574.mol (via Jmol)
055101580.b3lyp_6-31g(d).inp

055101580.b3lyp_6-31g(d).qchem.inp (generated)

055101580.b3lyp_6-31g(d).gjf (generated)

055101580.b3lyp_6-31g(d).firefly.inp (generated)

055101580.b3lyp_6-31g(d).smash.inp (generated)

055101580.b3lyp_6-31g(d).nwchem.inp (generated) 055101580.b3lyp_6-31g(d).log.xz 055101580.td-b3lyp_6-31g+(d).inp 055101580.td-b3lyp_6-31g+(d).log.xz

055101580.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101580.td-b3lyp_6-31+g(d).gjf (generated)

055101580.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101580.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101580.mol 055101580.PUBCHEM 055101580.mol (via Jmol)
055101595.b3lyp_6-31g(d).inp

055101595.b3lyp_6-31g(d).qchem.inp (generated)

055101595.b3lyp_6-31g(d).gjf (generated)

055101595.b3lyp_6-31g(d).firefly.inp (generated)

055101595.b3lyp_6-31g(d).smash.inp (generated)

055101595.b3lyp_6-31g(d).nwchem.inp (generated) 055101595.b3lyp_6-31g(d).log.xz 055101595.td-b3lyp_6-31g+(d).inp 055101595.td-b3lyp_6-31g+(d).log.xz

055101595.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101595.td-b3lyp_6-31+g(d).gjf (generated)

055101595.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101595.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101595.mol 055101595.PUBCHEM 055101595.mol (via Jmol)
055101599.b3lyp_6-31g(d).inp

055101599.b3lyp_6-31g(d).qchem.inp (generated)

055101599.b3lyp_6-31g(d).gjf (generated)

055101599.b3lyp_6-31g(d).firefly.inp (generated)

055101599.b3lyp_6-31g(d).smash.inp (generated)

055101599.b3lyp_6-31g(d).nwchem.inp (generated) 055101599.b3lyp_6-31g(d).log.xz 055101599.td-b3lyp_6-31g+(d).inp 055101599.td-b3lyp_6-31g+(d).log.xz

055101599.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101599.td-b3lyp_6-31+g(d).gjf (generated)

055101599.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101599.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101599.mol 055101599.PUBCHEM 055101599.mol (via Jmol)
055101603.b3lyp_6-31g(d).inp

055101603.b3lyp_6-31g(d).qchem.inp (generated)

055101603.b3lyp_6-31g(d).gjf (generated)

055101603.b3lyp_6-31g(d).firefly.inp (generated)

055101603.b3lyp_6-31g(d).smash.inp (generated)

055101603.b3lyp_6-31g(d).nwchem.inp (generated) 055101603.b3lyp_6-31g(d).log.xz 055101603.td-b3lyp_6-31g+(d).inp 055101603.td-b3lyp_6-31g+(d).log.xz

055101603.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101603.td-b3lyp_6-31+g(d).gjf (generated)

055101603.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101603.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101603.mol 055101603.PUBCHEM 055101603.mol (via Jmol)
055101607.b3lyp_6-31g(d).inp

055101607.b3lyp_6-31g(d).qchem.inp (generated)

055101607.b3lyp_6-31g(d).gjf (generated)

055101607.b3lyp_6-31g(d).firefly.inp (generated)

055101607.b3lyp_6-31g(d).smash.inp (generated)

055101607.b3lyp_6-31g(d).nwchem.inp (generated) 055101607.b3lyp_6-31g(d).log.xz 055101607.td-b3lyp_6-31g+(d).inp 055101607.td-b3lyp_6-31g+(d).log.xz

055101607.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101607.td-b3lyp_6-31+g(d).gjf (generated)

055101607.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101607.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101607.mol 055101607.PUBCHEM 055101607.mol (via Jmol)
055101621.b3lyp_6-31g(d).inp

055101621.b3lyp_6-31g(d).qchem.inp (generated)

055101621.b3lyp_6-31g(d).gjf (generated)

055101621.b3lyp_6-31g(d).firefly.inp (generated)

055101621.b3lyp_6-31g(d).smash.inp (generated)

055101621.b3lyp_6-31g(d).nwchem.inp (generated) 055101621.b3lyp_6-31g(d).log.xz 055101621.td-b3lyp_6-31g+(d).inp 055101621.td-b3lyp_6-31g+(d).log.xz

055101621.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101621.td-b3lyp_6-31+g(d).gjf (generated)

055101621.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101621.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101621.mol 055101621.PUBCHEM 055101621.mol (via Jmol)
055101629.b3lyp_6-31g(d).inp

055101629.b3lyp_6-31g(d).qchem.inp (generated)

055101629.b3lyp_6-31g(d).gjf (generated)

055101629.b3lyp_6-31g(d).firefly.inp (generated)

055101629.b3lyp_6-31g(d).smash.inp (generated)

055101629.b3lyp_6-31g(d).nwchem.inp (generated) 055101629.b3lyp_6-31g(d).log.xz 055101629.td-b3lyp_6-31g+(d).inp 055101629.td-b3lyp_6-31g+(d).log.xz

055101629.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101629.td-b3lyp_6-31+g(d).gjf (generated)

055101629.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101629.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101629.mol 055101629.PUBCHEM 055101629.mol (via Jmol)
055101632.b3lyp_6-31g(d).inp

055101632.b3lyp_6-31g(d).qchem.inp (generated)

055101632.b3lyp_6-31g(d).gjf (generated)

055101632.b3lyp_6-31g(d).firefly.inp (generated)

055101632.b3lyp_6-31g(d).smash.inp (generated)

055101632.b3lyp_6-31g(d).nwchem.inp (generated) 055101632.b3lyp_6-31g(d).log.xz 055101632.td-b3lyp_6-31g+(d).inp 055101632.td-b3lyp_6-31g+(d).log.xz

055101632.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101632.td-b3lyp_6-31+g(d).gjf (generated)

055101632.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101632.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101632.mol 055101632.PUBCHEM 055101632.mol (via Jmol)
055101634.b3lyp_6-31g(d).inp

055101634.b3lyp_6-31g(d).qchem.inp (generated)

055101634.b3lyp_6-31g(d).gjf (generated)

055101634.b3lyp_6-31g(d).firefly.inp (generated)

055101634.b3lyp_6-31g(d).smash.inp (generated)

055101634.b3lyp_6-31g(d).nwchem.inp (generated) 055101634.b3lyp_6-31g(d).log.xz 055101634.td-b3lyp_6-31g+(d).inp 055101634.td-b3lyp_6-31g+(d).log.xz

055101634.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101634.td-b3lyp_6-31+g(d).gjf (generated)

055101634.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101634.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101634.mol 055101634.PUBCHEM 055101634.mol (via Jmol)
055101635.b3lyp_6-31g(d).inp

055101635.b3lyp_6-31g(d).qchem.inp (generated)

055101635.b3lyp_6-31g(d).gjf (generated)

055101635.b3lyp_6-31g(d).firefly.inp (generated)

055101635.b3lyp_6-31g(d).smash.inp (generated)

055101635.b3lyp_6-31g(d).nwchem.inp (generated) 055101635.b3lyp_6-31g(d).log.xz 055101635.td-b3lyp_6-31g+(d).inp 055101635.td-b3lyp_6-31g+(d).log.xz

055101635.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101635.td-b3lyp_6-31+g(d).gjf (generated)

055101635.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101635.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101635.mol 055101635.PUBCHEM 055101635.mol (via Jmol)
055101648.b3lyp_6-31g(d).inp

055101648.b3lyp_6-31g(d).qchem.inp (generated)

055101648.b3lyp_6-31g(d).gjf (generated)

055101648.b3lyp_6-31g(d).firefly.inp (generated)

055101648.b3lyp_6-31g(d).smash.inp (generated)

055101648.b3lyp_6-31g(d).nwchem.inp (generated) 055101648.b3lyp_6-31g(d).log.xz 055101648.td-b3lyp_6-31g+(d).inp 055101648.td-b3lyp_6-31g+(d).log.xz

055101648.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101648.td-b3lyp_6-31+g(d).gjf (generated)

055101648.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101648.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101648.mol 055101648.PUBCHEM 055101648.mol (via Jmol)
055101650.b3lyp_6-31g(d).inp

055101650.b3lyp_6-31g(d).qchem.inp (generated)

055101650.b3lyp_6-31g(d).gjf (generated)

055101650.b3lyp_6-31g(d).firefly.inp (generated)

055101650.b3lyp_6-31g(d).smash.inp (generated)

055101650.b3lyp_6-31g(d).nwchem.inp (generated) 055101650.b3lyp_6-31g(d).log.xz 055101650.td-b3lyp_6-31g+(d).inp 055101650.td-b3lyp_6-31g+(d).log.xz

055101650.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101650.td-b3lyp_6-31+g(d).gjf (generated)

055101650.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101650.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101650.mol 055101650.PUBCHEM 055101650.mol (via Jmol)
055101651.b3lyp_6-31g(d).inp

055101651.b3lyp_6-31g(d).qchem.inp (generated)

055101651.b3lyp_6-31g(d).gjf (generated)

055101651.b3lyp_6-31g(d).firefly.inp (generated)

055101651.b3lyp_6-31g(d).smash.inp (generated)

055101651.b3lyp_6-31g(d).nwchem.inp (generated) 055101651.b3lyp_6-31g(d).log.xz 055101651.td-b3lyp_6-31g+(d).inp 055101651.td-b3lyp_6-31g+(d).log.xz

055101651.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101651.td-b3lyp_6-31+g(d).gjf (generated)

055101651.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101651.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101651.mol 055101651.PUBCHEM 055101651.mol (via Jmol)
055101678.b3lyp_6-31g(d).inp

055101678.b3lyp_6-31g(d).qchem.inp (generated)

055101678.b3lyp_6-31g(d).gjf (generated)

055101678.b3lyp_6-31g(d).firefly.inp (generated)

055101678.b3lyp_6-31g(d).smash.inp (generated)

055101678.b3lyp_6-31g(d).nwchem.inp (generated) 055101678.b3lyp_6-31g(d).log.xz 055101678.td-b3lyp_6-31g+(d).inp 055101678.td-b3lyp_6-31g+(d).log.xz

055101678.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101678.td-b3lyp_6-31+g(d).gjf (generated)

055101678.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101678.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101678.mol 055101678.PUBCHEM 055101678.mol (via Jmol)
055101679.b3lyp_6-31g(d).inp

055101679.b3lyp_6-31g(d).qchem.inp (generated)

055101679.b3lyp_6-31g(d).gjf (generated)

055101679.b3lyp_6-31g(d).firefly.inp (generated)

055101679.b3lyp_6-31g(d).smash.inp (generated)

055101679.b3lyp_6-31g(d).nwchem.inp (generated) 055101679.b3lyp_6-31g(d).log.xz 055101679.td-b3lyp_6-31g+(d).inp 055101679.td-b3lyp_6-31g+(d).log.xz

055101679.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101679.td-b3lyp_6-31+g(d).gjf (generated)

055101679.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101679.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101679.mol 055101679.PUBCHEM 055101679.mol (via Jmol)
055101693.b3lyp_6-31g(d).inp

055101693.b3lyp_6-31g(d).qchem.inp (generated)

055101693.b3lyp_6-31g(d).gjf (generated)

055101693.b3lyp_6-31g(d).firefly.inp (generated)

055101693.b3lyp_6-31g(d).smash.inp (generated)

055101693.b3lyp_6-31g(d).nwchem.inp (generated) 055101693.b3lyp_6-31g(d).log.xz 055101693.td-b3lyp_6-31g+(d).inp 055101693.td-b3lyp_6-31g+(d).log.xz

055101693.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101693.td-b3lyp_6-31+g(d).gjf (generated)

055101693.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101693.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101693.mol 055101693.PUBCHEM 055101693.mol (via Jmol)
055101694.b3lyp_6-31g(d).inp

055101694.b3lyp_6-31g(d).qchem.inp (generated)

055101694.b3lyp_6-31g(d).gjf (generated)

055101694.b3lyp_6-31g(d).firefly.inp (generated)

055101694.b3lyp_6-31g(d).smash.inp (generated)

055101694.b3lyp_6-31g(d).nwchem.inp (generated) 055101694.b3lyp_6-31g(d).log.xz 055101694.td-b3lyp_6-31g+(d).inp 055101694.td-b3lyp_6-31g+(d).log.xz

055101694.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101694.td-b3lyp_6-31+g(d).gjf (generated)

055101694.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101694.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101694.mol 055101694.PUBCHEM 055101694.mol (via Jmol)
055101701.b3lyp_6-31g(d).inp

055101701.b3lyp_6-31g(d).qchem.inp (generated)

055101701.b3lyp_6-31g(d).gjf (generated)

055101701.b3lyp_6-31g(d).firefly.inp (generated)

055101701.b3lyp_6-31g(d).smash.inp (generated)

055101701.b3lyp_6-31g(d).nwchem.inp (generated) 055101701.b3lyp_6-31g(d).log.xz 055101701.td-b3lyp_6-31g+(d).inp 055101701.td-b3lyp_6-31g+(d).log.xz

055101701.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101701.td-b3lyp_6-31+g(d).gjf (generated)

055101701.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101701.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101701.mol 055101701.PUBCHEM 055101701.mol (via Jmol)
055101728.b3lyp_6-31g(d).inp

055101728.b3lyp_6-31g(d).qchem.inp (generated)

055101728.b3lyp_6-31g(d).gjf (generated)

055101728.b3lyp_6-31g(d).firefly.inp (generated)

055101728.b3lyp_6-31g(d).smash.inp (generated)

055101728.b3lyp_6-31g(d).nwchem.inp (generated) 055101728.b3lyp_6-31g(d).log.xz 055101728.td-b3lyp_6-31g+(d).inp 055101728.td-b3lyp_6-31g+(d).log.xz

055101728.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101728.td-b3lyp_6-31+g(d).gjf (generated)

055101728.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101728.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101728.mol 055101728.PUBCHEM 055101728.mol (via Jmol)
055101748.b3lyp_6-31g(d).inp

055101748.b3lyp_6-31g(d).qchem.inp (generated)

055101748.b3lyp_6-31g(d).gjf (generated)

055101748.b3lyp_6-31g(d).firefly.inp (generated)

055101748.b3lyp_6-31g(d).smash.inp (generated)

055101748.b3lyp_6-31g(d).nwchem.inp (generated) 055101748.b3lyp_6-31g(d).log.xz 055101748.td-b3lyp_6-31g+(d).inp 055101748.td-b3lyp_6-31g+(d).log.xz

055101748.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101748.td-b3lyp_6-31+g(d).gjf (generated)

055101748.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101748.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101748.mol 055101748.PUBCHEM 055101748.mol (via Jmol)
055101749.b3lyp_6-31g(d).inp

055101749.b3lyp_6-31g(d).qchem.inp (generated)

055101749.b3lyp_6-31g(d).gjf (generated)

055101749.b3lyp_6-31g(d).firefly.inp (generated)

055101749.b3lyp_6-31g(d).smash.inp (generated)

055101749.b3lyp_6-31g(d).nwchem.inp (generated) 055101749.b3lyp_6-31g(d).log.xz 055101749.td-b3lyp_6-31g+(d).inp 055101749.td-b3lyp_6-31g+(d).log.xz

055101749.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101749.td-b3lyp_6-31+g(d).gjf (generated)

055101749.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101749.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101749.mol 055101749.PUBCHEM 055101749.mol (via Jmol)
055101764.b3lyp_6-31g(d).inp

055101764.b3lyp_6-31g(d).qchem.inp (generated)

055101764.b3lyp_6-31g(d).gjf (generated)

055101764.b3lyp_6-31g(d).firefly.inp (generated)

055101764.b3lyp_6-31g(d).smash.inp (generated)

055101764.b3lyp_6-31g(d).nwchem.inp (generated) 055101764.b3lyp_6-31g(d).log.xz 055101764.td-b3lyp_6-31g+(d).inp 055101764.td-b3lyp_6-31g+(d).log.xz

055101764.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101764.td-b3lyp_6-31+g(d).gjf (generated)

055101764.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101764.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101764.mol 055101764.PUBCHEM 055101764.mol (via Jmol)
055101770.b3lyp_6-31g(d).inp

055101770.b3lyp_6-31g(d).qchem.inp (generated)

055101770.b3lyp_6-31g(d).gjf (generated)

055101770.b3lyp_6-31g(d).firefly.inp (generated)

055101770.b3lyp_6-31g(d).smash.inp (generated)

055101770.b3lyp_6-31g(d).nwchem.inp (generated) 055101770.b3lyp_6-31g(d).log.xz 055101770.td-b3lyp_6-31g+(d).inp 055101770.td-b3lyp_6-31g+(d).log.xz

055101770.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101770.td-b3lyp_6-31+g(d).gjf (generated)

055101770.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101770.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101770.mol 055101770.PUBCHEM 055101770.mol (via Jmol)
055101772.b3lyp_6-31g(d).inp

055101772.b3lyp_6-31g(d).qchem.inp (generated)

055101772.b3lyp_6-31g(d).gjf (generated)

055101772.b3lyp_6-31g(d).firefly.inp (generated)

055101772.b3lyp_6-31g(d).smash.inp (generated)

055101772.b3lyp_6-31g(d).nwchem.inp (generated) 055101772.b3lyp_6-31g(d).log.xz 055101772.td-b3lyp_6-31g+(d).inp 055101772.td-b3lyp_6-31g+(d).log.xz

055101772.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101772.td-b3lyp_6-31+g(d).gjf (generated)

055101772.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101772.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101772.mol 055101772.PUBCHEM 055101772.mol (via Jmol)
055101773.b3lyp_6-31g(d).inp

055101773.b3lyp_6-31g(d).qchem.inp (generated)

055101773.b3lyp_6-31g(d).gjf (generated)

055101773.b3lyp_6-31g(d).firefly.inp (generated)

055101773.b3lyp_6-31g(d).smash.inp (generated)

055101773.b3lyp_6-31g(d).nwchem.inp (generated) 055101773.b3lyp_6-31g(d).log.xz 055101773.td-b3lyp_6-31g+(d).inp 055101773.td-b3lyp_6-31g+(d).log.xz

055101773.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101773.td-b3lyp_6-31+g(d).gjf (generated)

055101773.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101773.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101773.mol 055101773.PUBCHEM 055101773.mol (via Jmol)
055101788.b3lyp_6-31g(d).inp

055101788.b3lyp_6-31g(d).qchem.inp (generated)

055101788.b3lyp_6-31g(d).gjf (generated)

055101788.b3lyp_6-31g(d).firefly.inp (generated)

055101788.b3lyp_6-31g(d).smash.inp (generated)

055101788.b3lyp_6-31g(d).nwchem.inp (generated) 055101788.b3lyp_6-31g(d).log.xz 055101788.mol 055101788.PUBCHEM 055101788.mol (via Jmol)
055101830.b3lyp_6-31g(d).inp

055101830.b3lyp_6-31g(d).qchem.inp (generated)

055101830.b3lyp_6-31g(d).gjf (generated)

055101830.b3lyp_6-31g(d).firefly.inp (generated)

055101830.b3lyp_6-31g(d).smash.inp (generated)

055101830.b3lyp_6-31g(d).nwchem.inp (generated) 055101830.b3lyp_6-31g(d).log.xz 055101830.td-b3lyp_6-31g+(d).inp 055101830.td-b3lyp_6-31g+(d).log.xz

055101830.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101830.td-b3lyp_6-31+g(d).gjf (generated)

055101830.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101830.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101830.mol 055101830.PUBCHEM 055101830.mol (via Jmol)
055101833.b3lyp_6-31g(d).inp

055101833.b3lyp_6-31g(d).qchem.inp (generated)

055101833.b3lyp_6-31g(d).gjf (generated)

055101833.b3lyp_6-31g(d).firefly.inp (generated)

055101833.b3lyp_6-31g(d).smash.inp (generated)

055101833.b3lyp_6-31g(d).nwchem.inp (generated) 055101833.b3lyp_6-31g(d).log.xz 055101833.td-b3lyp_6-31g+(d).inp 055101833.td-b3lyp_6-31g+(d).log.xz

055101833.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101833.td-b3lyp_6-31+g(d).gjf (generated)

055101833.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101833.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101833.mol 055101833.PUBCHEM 055101833.mol (via Jmol)
055101844.b3lyp_6-31g(d).inp

055101844.b3lyp_6-31g(d).qchem.inp (generated)

055101844.b3lyp_6-31g(d).gjf (generated)

055101844.b3lyp_6-31g(d).firefly.inp (generated)

055101844.b3lyp_6-31g(d).smash.inp (generated)

055101844.b3lyp_6-31g(d).nwchem.inp (generated) 055101844.b3lyp_6-31g(d).log.xz 055101844.td-b3lyp_6-31g+(d).inp 055101844.td-b3lyp_6-31g+(d).log.xz

055101844.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101844.td-b3lyp_6-31+g(d).gjf (generated)

055101844.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101844.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101844.mol 055101844.PUBCHEM 055101844.mol (via Jmol)
055101879.b3lyp_6-31g(d).inp

055101879.b3lyp_6-31g(d).qchem.inp (generated)

055101879.b3lyp_6-31g(d).gjf (generated)

055101879.b3lyp_6-31g(d).firefly.inp (generated)

055101879.b3lyp_6-31g(d).smash.inp (generated)

055101879.b3lyp_6-31g(d).nwchem.inp (generated) 055101879.b3lyp_6-31g(d).log.xz 055101879.mol 055101879.PUBCHEM 055101879.mol (via Jmol)
055101883.b3lyp_6-31g(d).inp

055101883.b3lyp_6-31g(d).qchem.inp (generated)

055101883.b3lyp_6-31g(d).gjf (generated)

055101883.b3lyp_6-31g(d).firefly.inp (generated)

055101883.b3lyp_6-31g(d).smash.inp (generated)

055101883.b3lyp_6-31g(d).nwchem.inp (generated) 055101883.b3lyp_6-31g(d).log.xz 055101883.mol 055101883.PUBCHEM 055101883.mol (via Jmol)
055101884.b3lyp_6-31g(d).inp

055101884.b3lyp_6-31g(d).qchem.inp (generated)

055101884.b3lyp_6-31g(d).gjf (generated)

055101884.b3lyp_6-31g(d).firefly.inp (generated)

055101884.b3lyp_6-31g(d).smash.inp (generated)

055101884.b3lyp_6-31g(d).nwchem.inp (generated) 055101884.b3lyp_6-31g(d).log.xz 055101884.td-b3lyp_6-31g+(d).inp 055101884.td-b3lyp_6-31g+(d).log.xz

055101884.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101884.td-b3lyp_6-31+g(d).gjf (generated)

055101884.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101884.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101884.mol 055101884.PUBCHEM 055101884.mol (via Jmol)
055101892.b3lyp_6-31g(d).inp

055101892.b3lyp_6-31g(d).qchem.inp (generated)

055101892.b3lyp_6-31g(d).gjf (generated)

055101892.b3lyp_6-31g(d).firefly.inp (generated)

055101892.b3lyp_6-31g(d).smash.inp (generated)

055101892.b3lyp_6-31g(d).nwchem.inp (generated) 055101892.b3lyp_6-31g(d).log.xz 055101892.mol 055101892.PUBCHEM 055101892.mol (via Jmol)
055101907.b3lyp_6-31g(d).inp

055101907.b3lyp_6-31g(d).qchem.inp (generated)

055101907.b3lyp_6-31g(d).gjf (generated)

055101907.b3lyp_6-31g(d).firefly.inp (generated)

055101907.b3lyp_6-31g(d).smash.inp (generated)

055101907.b3lyp_6-31g(d).nwchem.inp (generated) 055101907.b3lyp_6-31g(d).log.xz 055101907.td-b3lyp_6-31g+(d).inp 055101907.td-b3lyp_6-31g+(d).log.xz

055101907.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101907.td-b3lyp_6-31+g(d).gjf (generated)

055101907.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101907.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101907.mol 055101907.PUBCHEM 055101907.mol (via Jmol)
055101910.b3lyp_6-31g(d).inp

055101910.b3lyp_6-31g(d).qchem.inp (generated)

055101910.b3lyp_6-31g(d).gjf (generated)

055101910.b3lyp_6-31g(d).firefly.inp (generated)

055101910.b3lyp_6-31g(d).smash.inp (generated)

055101910.b3lyp_6-31g(d).nwchem.inp (generated) 055101910.b3lyp_6-31g(d).log.xz 055101910.td-b3lyp_6-31g+(d).inp 055101910.td-b3lyp_6-31g+(d).log.xz

055101910.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101910.td-b3lyp_6-31+g(d).gjf (generated)

055101910.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101910.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101910.mol 055101910.PUBCHEM 055101910.mol (via Jmol)
055101913.b3lyp_6-31g(d).inp

055101913.b3lyp_6-31g(d).qchem.inp (generated)

055101913.b3lyp_6-31g(d).gjf (generated)

055101913.b3lyp_6-31g(d).firefly.inp (generated)

055101913.b3lyp_6-31g(d).smash.inp (generated)

055101913.b3lyp_6-31g(d).nwchem.inp (generated) 055101913.b3lyp_6-31g(d).log.xz 055101913.td-b3lyp_6-31g+(d).inp 055101913.td-b3lyp_6-31g+(d).log.xz

055101913.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101913.td-b3lyp_6-31+g(d).gjf (generated)

055101913.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101913.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101913.mol 055101913.PUBCHEM 055101913.mol (via Jmol)
055101921.b3lyp_6-31g(d).inp

055101921.b3lyp_6-31g(d).qchem.inp (generated)

055101921.b3lyp_6-31g(d).gjf (generated)

055101921.b3lyp_6-31g(d).firefly.inp (generated)

055101921.b3lyp_6-31g(d).smash.inp (generated)

055101921.b3lyp_6-31g(d).nwchem.inp (generated) 055101921.b3lyp_6-31g(d).log.xz 055101921.td-b3lyp_6-31g+(d).inp 055101921.td-b3lyp_6-31g+(d).log.xz

055101921.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101921.td-b3lyp_6-31+g(d).gjf (generated)

055101921.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101921.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101921.mol 055101921.PUBCHEM 055101921.mol (via Jmol)
055101938.b3lyp_6-31g(d).inp

055101938.b3lyp_6-31g(d).qchem.inp (generated)

055101938.b3lyp_6-31g(d).gjf (generated)

055101938.b3lyp_6-31g(d).firefly.inp (generated)

055101938.b3lyp_6-31g(d).smash.inp (generated)

055101938.b3lyp_6-31g(d).nwchem.inp (generated) 055101938.b3lyp_6-31g(d).log.xz 055101938.td-b3lyp_6-31g+(d).inp 055101938.td-b3lyp_6-31g+(d).log.xz

055101938.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101938.td-b3lyp_6-31+g(d).gjf (generated)

055101938.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101938.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101938.mol 055101938.PUBCHEM 055101938.mol (via Jmol)
055101955.b3lyp_6-31g(d).inp

055101955.b3lyp_6-31g(d).qchem.inp (generated)

055101955.b3lyp_6-31g(d).gjf (generated)

055101955.b3lyp_6-31g(d).firefly.inp (generated)

055101955.b3lyp_6-31g(d).smash.inp (generated)

055101955.b3lyp_6-31g(d).nwchem.inp (generated) 055101955.b3lyp_6-31g(d).log.xz 055101955.mol 055101955.PUBCHEM 055101955.mol (via Jmol)
055101956.b3lyp_6-31g(d).inp

055101956.b3lyp_6-31g(d).qchem.inp (generated)

055101956.b3lyp_6-31g(d).gjf (generated)

055101956.b3lyp_6-31g(d).firefly.inp (generated)

055101956.b3lyp_6-31g(d).smash.inp (generated)

055101956.b3lyp_6-31g(d).nwchem.inp (generated) 055101956.b3lyp_6-31g(d).log.xz 055101956.td-b3lyp_6-31g+(d).inp 055101956.td-b3lyp_6-31g+(d).log.xz

055101956.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101956.td-b3lyp_6-31+g(d).gjf (generated)

055101956.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101956.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101956.mol 055101956.PUBCHEM 055101956.mol (via Jmol)
055101960.b3lyp_6-31g(d).inp

055101960.b3lyp_6-31g(d).qchem.inp (generated)

055101960.b3lyp_6-31g(d).gjf (generated)

055101960.b3lyp_6-31g(d).firefly.inp (generated)

055101960.b3lyp_6-31g(d).smash.inp (generated)

055101960.b3lyp_6-31g(d).nwchem.inp (generated) 055101960.b3lyp_6-31g(d).log.xz 055101960.td-b3lyp_6-31g+(d).inp 055101960.td-b3lyp_6-31g+(d).log.xz

055101960.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101960.td-b3lyp_6-31+g(d).gjf (generated)

055101960.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101960.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101960.mol 055101960.PUBCHEM 055101960.mol (via Jmol)
055101976.b3lyp_6-31g(d).inp

055101976.b3lyp_6-31g(d).qchem.inp (generated)

055101976.b3lyp_6-31g(d).gjf (generated)

055101976.b3lyp_6-31g(d).firefly.inp (generated)

055101976.b3lyp_6-31g(d).smash.inp (generated)

055101976.b3lyp_6-31g(d).nwchem.inp (generated) 055101976.b3lyp_6-31g(d).log.xz 055101976.td-b3lyp_6-31g+(d).inp 055101976.td-b3lyp_6-31g+(d).log.xz

055101976.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101976.td-b3lyp_6-31+g(d).gjf (generated)

055101976.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101976.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101976.mol 055101976.PUBCHEM 055101976.mol (via Jmol)
055101996.b3lyp_6-31g(d).inp

055101996.b3lyp_6-31g(d).qchem.inp (generated)

055101996.b3lyp_6-31g(d).gjf (generated)

055101996.b3lyp_6-31g(d).firefly.inp (generated)

055101996.b3lyp_6-31g(d).smash.inp (generated)

055101996.b3lyp_6-31g(d).nwchem.inp (generated) 055101996.b3lyp_6-31g(d).log.xz 055101996.td-b3lyp_6-31g+(d).inp 055101996.td-b3lyp_6-31g+(d).log.xz

055101996.td-b3lyp_6-31+g(d).qchem.inp (generated)

055101996.td-b3lyp_6-31+g(d).gjf (generated)

055101996.td-b3lyp_6-31+g(d).firefly.inp (generated)

055101996.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055101996.mol 055101996.PUBCHEM 055101996.mol (via Jmol)
055102002.b3lyp_6-31g(d).inp

055102002.b3lyp_6-31g(d).qchem.inp (generated)

055102002.b3lyp_6-31g(d).gjf (generated)

055102002.b3lyp_6-31g(d).firefly.inp (generated)

055102002.b3lyp_6-31g(d).smash.inp (generated)

055102002.b3lyp_6-31g(d).nwchem.inp (generated) 055102002.b3lyp_6-31g(d).log.xz 055102002.td-b3lyp_6-31g+(d).inp 055102002.td-b3lyp_6-31g+(d).log.xz

055102002.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102002.td-b3lyp_6-31+g(d).gjf (generated)

055102002.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102002.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102002.mol 055102002.PUBCHEM 055102002.mol (via Jmol)
055102028.b3lyp_6-31g(d).inp

055102028.b3lyp_6-31g(d).qchem.inp (generated)

055102028.b3lyp_6-31g(d).gjf (generated)

055102028.b3lyp_6-31g(d).firefly.inp (generated)

055102028.b3lyp_6-31g(d).smash.inp (generated)

055102028.b3lyp_6-31g(d).nwchem.inp (generated) 055102028.b3lyp_6-31g(d).log.xz 055102028.td-b3lyp_6-31g+(d).inp 055102028.td-b3lyp_6-31g+(d).log.xz

055102028.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102028.td-b3lyp_6-31+g(d).gjf (generated)

055102028.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102028.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102028.mol 055102028.PUBCHEM 055102028.mol (via Jmol)
055102029.b3lyp_6-31g(d).inp

055102029.b3lyp_6-31g(d).qchem.inp (generated)

055102029.b3lyp_6-31g(d).gjf (generated)

055102029.b3lyp_6-31g(d).firefly.inp (generated)

055102029.b3lyp_6-31g(d).smash.inp (generated)

055102029.b3lyp_6-31g(d).nwchem.inp (generated) 055102029.b3lyp_6-31g(d).log.xz 055102029.td-b3lyp_6-31g+(d).inp 055102029.td-b3lyp_6-31g+(d).log.xz

055102029.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102029.td-b3lyp_6-31+g(d).gjf (generated)

055102029.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102029.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102029.mol 055102029.PUBCHEM 055102029.mol (via Jmol)
055102048.b3lyp_6-31g(d).inp

055102048.b3lyp_6-31g(d).qchem.inp (generated)

055102048.b3lyp_6-31g(d).gjf (generated)

055102048.b3lyp_6-31g(d).firefly.inp (generated)

055102048.b3lyp_6-31g(d).smash.inp (generated)

055102048.b3lyp_6-31g(d).nwchem.inp (generated) 055102048.b3lyp_6-31g(d).log.xz 055102048.mol 055102048.PUBCHEM 055102048.mol (via Jmol)
055102049.b3lyp_6-31g(d).inp

055102049.b3lyp_6-31g(d).qchem.inp (generated)

055102049.b3lyp_6-31g(d).gjf (generated)

055102049.b3lyp_6-31g(d).firefly.inp (generated)

055102049.b3lyp_6-31g(d).smash.inp (generated)

055102049.b3lyp_6-31g(d).nwchem.inp (generated) 055102049.b3lyp_6-31g(d).log.xz 055102049.td-b3lyp_6-31g+(d).inp 055102049.td-b3lyp_6-31g+(d).log.xz

055102049.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102049.td-b3lyp_6-31+g(d).gjf (generated)

055102049.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102049.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102049.mol 055102049.PUBCHEM 055102049.mol (via Jmol)
055102064.b3lyp_6-31g(d).inp

055102064.b3lyp_6-31g(d).qchem.inp (generated)

055102064.b3lyp_6-31g(d).gjf (generated)

055102064.b3lyp_6-31g(d).firefly.inp (generated)

055102064.b3lyp_6-31g(d).smash.inp (generated)

055102064.b3lyp_6-31g(d).nwchem.inp (generated) 055102064.b3lyp_6-31g(d).log.xz 055102064.td-b3lyp_6-31g+(d).inp 055102064.td-b3lyp_6-31g+(d).log.xz

055102064.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102064.td-b3lyp_6-31+g(d).gjf (generated)

055102064.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102064.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102064.mol 055102064.PUBCHEM 055102064.mol (via Jmol)
055102068.b3lyp_6-31g(d).inp

055102068.b3lyp_6-31g(d).qchem.inp (generated)

055102068.b3lyp_6-31g(d).gjf (generated)

055102068.b3lyp_6-31g(d).firefly.inp (generated)

055102068.b3lyp_6-31g(d).smash.inp (generated)

055102068.b3lyp_6-31g(d).nwchem.inp (generated) 055102068.b3lyp_6-31g(d).log.xz 055102068.td-b3lyp_6-31g+(d).inp 055102068.td-b3lyp_6-31g+(d).log.xz

055102068.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102068.td-b3lyp_6-31+g(d).gjf (generated)

055102068.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102068.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102068.mol 055102068.PUBCHEM 055102068.mol (via Jmol)
055102075.b3lyp_6-31g(d).inp

055102075.b3lyp_6-31g(d).qchem.inp (generated)

055102075.b3lyp_6-31g(d).gjf (generated)

055102075.b3lyp_6-31g(d).firefly.inp (generated)

055102075.b3lyp_6-31g(d).smash.inp (generated)

055102075.b3lyp_6-31g(d).nwchem.inp (generated) 055102075.b3lyp_6-31g(d).log.xz 055102075.td-b3lyp_6-31g+(d).inp 055102075.td-b3lyp_6-31g+(d).log.xz

055102075.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102075.td-b3lyp_6-31+g(d).gjf (generated)

055102075.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102075.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102075.mol 055102075.PUBCHEM 055102075.mol (via Jmol)
055102113.b3lyp_6-31g(d).inp

055102113.b3lyp_6-31g(d).qchem.inp (generated)

055102113.b3lyp_6-31g(d).gjf (generated)

055102113.b3lyp_6-31g(d).firefly.inp (generated)

055102113.b3lyp_6-31g(d).smash.inp (generated)

055102113.b3lyp_6-31g(d).nwchem.inp (generated) 055102113.b3lyp_6-31g(d).log.xz 055102113.td-b3lyp_6-31g+(d).inp 055102113.td-b3lyp_6-31g+(d).log.xz

055102113.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102113.td-b3lyp_6-31+g(d).gjf (generated)

055102113.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102113.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102113.mol 055102113.PUBCHEM 055102113.mol (via Jmol)
055102114.b3lyp_6-31g(d).inp

055102114.b3lyp_6-31g(d).qchem.inp (generated)

055102114.b3lyp_6-31g(d).gjf (generated)

055102114.b3lyp_6-31g(d).firefly.inp (generated)

055102114.b3lyp_6-31g(d).smash.inp (generated)

055102114.b3lyp_6-31g(d).nwchem.inp (generated) 055102114.b3lyp_6-31g(d).log.xz 055102114.td-b3lyp_6-31g+(d).inp 055102114.td-b3lyp_6-31g+(d).log.xz

055102114.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102114.td-b3lyp_6-31+g(d).gjf (generated)

055102114.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102114.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102114.mol 055102114.PUBCHEM 055102114.mol (via Jmol)
055102116.b3lyp_6-31g(d).inp

055102116.b3lyp_6-31g(d).qchem.inp (generated)

055102116.b3lyp_6-31g(d).gjf (generated)

055102116.b3lyp_6-31g(d).firefly.inp (generated)

055102116.b3lyp_6-31g(d).smash.inp (generated)

055102116.b3lyp_6-31g(d).nwchem.inp (generated) 055102116.b3lyp_6-31g(d).log.xz 055102116.td-b3lyp_6-31g+(d).inp 055102116.td-b3lyp_6-31g+(d).log.xz

055102116.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102116.td-b3lyp_6-31+g(d).gjf (generated)

055102116.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102116.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102116.mol 055102116.PUBCHEM 055102116.mol (via Jmol)
055102117.b3lyp_6-31g(d).inp

055102117.b3lyp_6-31g(d).qchem.inp (generated)

055102117.b3lyp_6-31g(d).gjf (generated)

055102117.b3lyp_6-31g(d).firefly.inp (generated)

055102117.b3lyp_6-31g(d).smash.inp (generated)

055102117.b3lyp_6-31g(d).nwchem.inp (generated) 055102117.b3lyp_6-31g(d).log.xz 055102117.td-b3lyp_6-31g+(d).inp 055102117.td-b3lyp_6-31g+(d).log.xz

055102117.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102117.td-b3lyp_6-31+g(d).gjf (generated)

055102117.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102117.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102117.mol 055102117.PUBCHEM 055102117.mol (via Jmol)
055102118.b3lyp_6-31g(d).inp

055102118.b3lyp_6-31g(d).qchem.inp (generated)

055102118.b3lyp_6-31g(d).gjf (generated)

055102118.b3lyp_6-31g(d).firefly.inp (generated)

055102118.b3lyp_6-31g(d).smash.inp (generated)

055102118.b3lyp_6-31g(d).nwchem.inp (generated) 055102118.b3lyp_6-31g(d).log.xz 055102118.td-b3lyp_6-31g+(d).inp 055102118.td-b3lyp_6-31g+(d).log.xz

055102118.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102118.td-b3lyp_6-31+g(d).gjf (generated)

055102118.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102118.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102118.mol 055102118.PUBCHEM 055102118.mol (via Jmol)
055102123.b3lyp_6-31g(d).inp

055102123.b3lyp_6-31g(d).qchem.inp (generated)

055102123.b3lyp_6-31g(d).gjf (generated)

055102123.b3lyp_6-31g(d).firefly.inp (generated)

055102123.b3lyp_6-31g(d).smash.inp (generated)

055102123.b3lyp_6-31g(d).nwchem.inp (generated) 055102123.b3lyp_6-31g(d).log.xz 055102123.td-b3lyp_6-31g+(d).inp 055102123.td-b3lyp_6-31g+(d).log.xz

055102123.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102123.td-b3lyp_6-31+g(d).gjf (generated)

055102123.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102123.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102123.mol 055102123.PUBCHEM 055102123.mol (via Jmol)
055102146.b3lyp_6-31g(d).inp

055102146.b3lyp_6-31g(d).qchem.inp (generated)

055102146.b3lyp_6-31g(d).gjf (generated)

055102146.b3lyp_6-31g(d).firefly.inp (generated)

055102146.b3lyp_6-31g(d).smash.inp (generated)

055102146.b3lyp_6-31g(d).nwchem.inp (generated) 055102146.b3lyp_6-31g(d).log.xz 055102146.mol 055102146.PUBCHEM 055102146.mol (via Jmol)
055102163.b3lyp_6-31g(d).inp

055102163.b3lyp_6-31g(d).qchem.inp (generated)

055102163.b3lyp_6-31g(d).gjf (generated)

055102163.b3lyp_6-31g(d).firefly.inp (generated)

055102163.b3lyp_6-31g(d).smash.inp (generated)

055102163.b3lyp_6-31g(d).nwchem.inp (generated) 055102163.b3lyp_6-31g(d).log.xz 055102163.td-b3lyp_6-31g+(d).inp 055102163.td-b3lyp_6-31g+(d).log.xz

055102163.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102163.td-b3lyp_6-31+g(d).gjf (generated)

055102163.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102163.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102163.mol 055102163.PUBCHEM 055102163.mol (via Jmol)
055102173.b3lyp_6-31g(d).inp

055102173.b3lyp_6-31g(d).qchem.inp (generated)

055102173.b3lyp_6-31g(d).gjf (generated)

055102173.b3lyp_6-31g(d).firefly.inp (generated)

055102173.b3lyp_6-31g(d).smash.inp (generated)

055102173.b3lyp_6-31g(d).nwchem.inp (generated) 055102173.b3lyp_6-31g(d).log.xz 055102173.td-b3lyp_6-31g+(d).inp 055102173.td-b3lyp_6-31g+(d).log.xz

055102173.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102173.td-b3lyp_6-31+g(d).gjf (generated)

055102173.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102173.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102173.mol 055102173.PUBCHEM 055102173.mol (via Jmol)
055102174.b3lyp_6-31g(d).inp

055102174.b3lyp_6-31g(d).qchem.inp (generated)

055102174.b3lyp_6-31g(d).gjf (generated)

055102174.b3lyp_6-31g(d).firefly.inp (generated)

055102174.b3lyp_6-31g(d).smash.inp (generated)

055102174.b3lyp_6-31g(d).nwchem.inp (generated) 055102174.b3lyp_6-31g(d).log.xz 055102174.td-b3lyp_6-31g+(d).inp 055102174.td-b3lyp_6-31g+(d).log.xz

055102174.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102174.td-b3lyp_6-31+g(d).gjf (generated)

055102174.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102174.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102174.mol 055102174.PUBCHEM 055102174.mol (via Jmol)
055102191.b3lyp_6-31g(d).inp

055102191.b3lyp_6-31g(d).qchem.inp (generated)

055102191.b3lyp_6-31g(d).gjf (generated)

055102191.b3lyp_6-31g(d).firefly.inp (generated)

055102191.b3lyp_6-31g(d).smash.inp (generated)

055102191.b3lyp_6-31g(d).nwchem.inp (generated) 055102191.b3lyp_6-31g(d).log.xz 055102191.td-b3lyp_6-31g+(d).inp 055102191.td-b3lyp_6-31g+(d).log.xz

055102191.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102191.td-b3lyp_6-31+g(d).gjf (generated)

055102191.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102191.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102191.mol 055102191.PUBCHEM 055102191.mol (via Jmol)
055102210.b3lyp_6-31g(d).inp

055102210.b3lyp_6-31g(d).qchem.inp (generated)

055102210.b3lyp_6-31g(d).gjf (generated)

055102210.b3lyp_6-31g(d).firefly.inp (generated)

055102210.b3lyp_6-31g(d).smash.inp (generated)

055102210.b3lyp_6-31g(d).nwchem.inp (generated) 055102210.b3lyp_6-31g(d).log.xz 055102210.td-b3lyp_6-31g+(d).inp 055102210.td-b3lyp_6-31g+(d).log.xz

055102210.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102210.td-b3lyp_6-31+g(d).gjf (generated)

055102210.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102210.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102210.mol 055102210.PUBCHEM 055102210.mol (via Jmol)
055102213.b3lyp_6-31g(d).inp

055102213.b3lyp_6-31g(d).qchem.inp (generated)

055102213.b3lyp_6-31g(d).gjf (generated)

055102213.b3lyp_6-31g(d).firefly.inp (generated)

055102213.b3lyp_6-31g(d).smash.inp (generated)

055102213.b3lyp_6-31g(d).nwchem.inp (generated) 055102213.b3lyp_6-31g(d).log.xz 055102213.td-b3lyp_6-31g+(d).inp 055102213.td-b3lyp_6-31g+(d).log.xz

055102213.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102213.td-b3lyp_6-31+g(d).gjf (generated)

055102213.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102213.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102213.mol 055102213.PUBCHEM 055102213.mol (via Jmol)
055102217.b3lyp_6-31g(d).inp

055102217.b3lyp_6-31g(d).qchem.inp (generated)

055102217.b3lyp_6-31g(d).gjf (generated)

055102217.b3lyp_6-31g(d).firefly.inp (generated)

055102217.b3lyp_6-31g(d).smash.inp (generated)

055102217.b3lyp_6-31g(d).nwchem.inp (generated) 055102217.b3lyp_6-31g(d).log.xz 055102217.mol 055102217.PUBCHEM 055102217.mol (via Jmol)
055102218.b3lyp_6-31g(d).inp

055102218.b3lyp_6-31g(d).qchem.inp (generated)

055102218.b3lyp_6-31g(d).gjf (generated)

055102218.b3lyp_6-31g(d).firefly.inp (generated)

055102218.b3lyp_6-31g(d).smash.inp (generated)

055102218.b3lyp_6-31g(d).nwchem.inp (generated) 055102218.b3lyp_6-31g(d).log.xz 055102218.td-b3lyp_6-31g+(d).inp 055102218.td-b3lyp_6-31g+(d).log.xz

055102218.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102218.td-b3lyp_6-31+g(d).gjf (generated)

055102218.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102218.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102218.mol 055102218.PUBCHEM 055102218.mol (via Jmol)
055102224.b3lyp_6-31g(d).inp

055102224.b3lyp_6-31g(d).qchem.inp (generated)

055102224.b3lyp_6-31g(d).gjf (generated)

055102224.b3lyp_6-31g(d).firefly.inp (generated)

055102224.b3lyp_6-31g(d).smash.inp (generated)

055102224.b3lyp_6-31g(d).nwchem.inp (generated) 055102224.b3lyp_6-31g(d).log.xz 055102224.td-b3lyp_6-31g+(d).inp 055102224.td-b3lyp_6-31g+(d).log.xz

055102224.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102224.td-b3lyp_6-31+g(d).gjf (generated)

055102224.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102224.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102224.mol 055102224.PUBCHEM 055102224.mol (via Jmol)
055102238.b3lyp_6-31g(d).inp

055102238.b3lyp_6-31g(d).qchem.inp (generated)

055102238.b3lyp_6-31g(d).gjf (generated)

055102238.b3lyp_6-31g(d).firefly.inp (generated)

055102238.b3lyp_6-31g(d).smash.inp (generated)

055102238.b3lyp_6-31g(d).nwchem.inp (generated) 055102238.b3lyp_6-31g(d).log.xz 055102238.td-b3lyp_6-31g+(d).inp 055102238.td-b3lyp_6-31g+(d).log.xz

055102238.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102238.td-b3lyp_6-31+g(d).gjf (generated)

055102238.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102238.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102238.mol 055102238.PUBCHEM 055102238.mol (via Jmol)
055102270.b3lyp_6-31g(d).inp

055102270.b3lyp_6-31g(d).qchem.inp (generated)

055102270.b3lyp_6-31g(d).gjf (generated)

055102270.b3lyp_6-31g(d).firefly.inp (generated)

055102270.b3lyp_6-31g(d).smash.inp (generated)

055102270.b3lyp_6-31g(d).nwchem.inp (generated) 055102270.b3lyp_6-31g(d).log.xz 055102270.td-b3lyp_6-31g+(d).inp 055102270.td-b3lyp_6-31g+(d).log.xz

055102270.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102270.td-b3lyp_6-31+g(d).gjf (generated)

055102270.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102270.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102270.mol 055102270.PUBCHEM 055102270.mol (via Jmol)
055102271.b3lyp_6-31g(d).inp

055102271.b3lyp_6-31g(d).qchem.inp (generated)

055102271.b3lyp_6-31g(d).gjf (generated)

055102271.b3lyp_6-31g(d).firefly.inp (generated)

055102271.b3lyp_6-31g(d).smash.inp (generated)

055102271.b3lyp_6-31g(d).nwchem.inp (generated) 055102271.b3lyp_6-31g(d).log.xz 055102271.td-b3lyp_6-31g+(d).inp 055102271.td-b3lyp_6-31g+(d).log.xz

055102271.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102271.td-b3lyp_6-31+g(d).gjf (generated)

055102271.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102271.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102271.mol 055102271.PUBCHEM 055102271.mol (via Jmol)
055102273.b3lyp_6-31g(d).inp

055102273.b3lyp_6-31g(d).qchem.inp (generated)

055102273.b3lyp_6-31g(d).gjf (generated)

055102273.b3lyp_6-31g(d).firefly.inp (generated)

055102273.b3lyp_6-31g(d).smash.inp (generated)

055102273.b3lyp_6-31g(d).nwchem.inp (generated) 055102273.b3lyp_6-31g(d).log.xz 055102273.td-b3lyp_6-31g+(d).inp 055102273.td-b3lyp_6-31g+(d).log.xz

055102273.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102273.td-b3lyp_6-31+g(d).gjf (generated)

055102273.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102273.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102273.mol 055102273.PUBCHEM 055102273.mol (via Jmol)
055102274.b3lyp_6-31g(d).inp

055102274.b3lyp_6-31g(d).qchem.inp (generated)

055102274.b3lyp_6-31g(d).gjf (generated)

055102274.b3lyp_6-31g(d).firefly.inp (generated)

055102274.b3lyp_6-31g(d).smash.inp (generated)

055102274.b3lyp_6-31g(d).nwchem.inp (generated) 055102274.b3lyp_6-31g(d).log.xz 055102274.mol 055102274.PUBCHEM 055102274.mol (via Jmol)
055102287.b3lyp_6-31g(d).inp

055102287.b3lyp_6-31g(d).qchem.inp (generated)

055102287.b3lyp_6-31g(d).gjf (generated)

055102287.b3lyp_6-31g(d).firefly.inp (generated)

055102287.b3lyp_6-31g(d).smash.inp (generated)

055102287.b3lyp_6-31g(d).nwchem.inp (generated) 055102287.b3lyp_6-31g(d).log.xz 055102287.td-b3lyp_6-31g+(d).inp 055102287.td-b3lyp_6-31g+(d).log.xz

055102287.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102287.td-b3lyp_6-31+g(d).gjf (generated)

055102287.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102287.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102287.mol 055102287.PUBCHEM 055102287.mol (via Jmol)
055102300.b3lyp_6-31g(d).inp

055102300.b3lyp_6-31g(d).qchem.inp (generated)

055102300.b3lyp_6-31g(d).gjf (generated)

055102300.b3lyp_6-31g(d).firefly.inp (generated)

055102300.b3lyp_6-31g(d).smash.inp (generated)

055102300.b3lyp_6-31g(d).nwchem.inp (generated) 055102300.b3lyp_6-31g(d).log.xz 055102300.td-b3lyp_6-31g+(d).inp 055102300.td-b3lyp_6-31g+(d).log.xz

055102300.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102300.td-b3lyp_6-31+g(d).gjf (generated)

055102300.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102300.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102300.mol 055102300.PUBCHEM 055102300.mol (via Jmol)
055102302.b3lyp_6-31g(d).inp

055102302.b3lyp_6-31g(d).qchem.inp (generated)

055102302.b3lyp_6-31g(d).gjf (generated)

055102302.b3lyp_6-31g(d).firefly.inp (generated)

055102302.b3lyp_6-31g(d).smash.inp (generated)

055102302.b3lyp_6-31g(d).nwchem.inp (generated) 055102302.b3lyp_6-31g(d).log.xz 055102302.td-b3lyp_6-31g+(d).inp 055102302.td-b3lyp_6-31g+(d).log.xz

055102302.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102302.td-b3lyp_6-31+g(d).gjf (generated)

055102302.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102302.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102302.mol 055102302.PUBCHEM 055102302.mol (via Jmol)
055102303.b3lyp_6-31g(d).inp

055102303.b3lyp_6-31g(d).qchem.inp (generated)

055102303.b3lyp_6-31g(d).gjf (generated)

055102303.b3lyp_6-31g(d).firefly.inp (generated)

055102303.b3lyp_6-31g(d).smash.inp (generated)

055102303.b3lyp_6-31g(d).nwchem.inp (generated) 055102303.b3lyp_6-31g(d).log.xz 055102303.td-b3lyp_6-31g+(d).inp 055102303.td-b3lyp_6-31g+(d).log.xz

055102303.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102303.td-b3lyp_6-31+g(d).gjf (generated)

055102303.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102303.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102303.mol 055102303.PUBCHEM 055102303.mol (via Jmol)
055102305.b3lyp_6-31g(d).inp

055102305.b3lyp_6-31g(d).qchem.inp (generated)

055102305.b3lyp_6-31g(d).gjf (generated)

055102305.b3lyp_6-31g(d).firefly.inp (generated)

055102305.b3lyp_6-31g(d).smash.inp (generated)

055102305.b3lyp_6-31g(d).nwchem.inp (generated) 055102305.b3lyp_6-31g(d).log.xz 055102305.td-b3lyp_6-31g+(d).inp 055102305.td-b3lyp_6-31g+(d).log.xz

055102305.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102305.td-b3lyp_6-31+g(d).gjf (generated)

055102305.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102305.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102305.mol 055102305.PUBCHEM 055102305.mol (via Jmol)
055102322.b3lyp_6-31g(d).inp

055102322.b3lyp_6-31g(d).qchem.inp (generated)

055102322.b3lyp_6-31g(d).gjf (generated)

055102322.b3lyp_6-31g(d).firefly.inp (generated)

055102322.b3lyp_6-31g(d).smash.inp (generated)

055102322.b3lyp_6-31g(d).nwchem.inp (generated) 055102322.b3lyp_6-31g(d).log.xz 055102322.td-b3lyp_6-31g+(d).inp 055102322.td-b3lyp_6-31g+(d).log.xz

055102322.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102322.td-b3lyp_6-31+g(d).gjf (generated)

055102322.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102322.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102322.mol 055102322.PUBCHEM 055102322.mol (via Jmol)
055102327.b3lyp_6-31g(d).inp

055102327.b3lyp_6-31g(d).qchem.inp (generated)

055102327.b3lyp_6-31g(d).gjf (generated)

055102327.b3lyp_6-31g(d).firefly.inp (generated)

055102327.b3lyp_6-31g(d).smash.inp (generated)

055102327.b3lyp_6-31g(d).nwchem.inp (generated) 055102327.b3lyp_6-31g(d).log.xz 055102327.td-b3lyp_6-31g+(d).inp 055102327.td-b3lyp_6-31g+(d).log.xz

055102327.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102327.td-b3lyp_6-31+g(d).gjf (generated)

055102327.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102327.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102327.mol 055102327.PUBCHEM 055102327.mol (via Jmol)
055102355.b3lyp_6-31g(d).inp

055102355.b3lyp_6-31g(d).qchem.inp (generated)

055102355.b3lyp_6-31g(d).gjf (generated)

055102355.b3lyp_6-31g(d).firefly.inp (generated)

055102355.b3lyp_6-31g(d).smash.inp (generated)

055102355.b3lyp_6-31g(d).nwchem.inp (generated) 055102355.b3lyp_6-31g(d).log.xz 055102355.td-b3lyp_6-31g+(d).inp 055102355.td-b3lyp_6-31g+(d).log.xz

055102355.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102355.td-b3lyp_6-31+g(d).gjf (generated)

055102355.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102355.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102355.mol 055102355.PUBCHEM 055102355.mol (via Jmol)
055102366.b3lyp_6-31g(d).inp

055102366.b3lyp_6-31g(d).qchem.inp (generated)

055102366.b3lyp_6-31g(d).gjf (generated)

055102366.b3lyp_6-31g(d).firefly.inp (generated)

055102366.b3lyp_6-31g(d).smash.inp (generated)

055102366.b3lyp_6-31g(d).nwchem.inp (generated) 055102366.b3lyp_6-31g(d).log.xz 055102366.td-b3lyp_6-31g+(d).inp 055102366.td-b3lyp_6-31g+(d).log.xz

055102366.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102366.td-b3lyp_6-31+g(d).gjf (generated)

055102366.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102366.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102366.mol 055102366.PUBCHEM 055102366.mol (via Jmol)
055102368.b3lyp_6-31g(d).inp

055102368.b3lyp_6-31g(d).qchem.inp (generated)

055102368.b3lyp_6-31g(d).gjf (generated)

055102368.b3lyp_6-31g(d).firefly.inp (generated)

055102368.b3lyp_6-31g(d).smash.inp (generated)

055102368.b3lyp_6-31g(d).nwchem.inp (generated) 055102368.b3lyp_6-31g(d).log.xz 055102368.td-b3lyp_6-31g+(d).inp 055102368.td-b3lyp_6-31g+(d).log.xz

055102368.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102368.td-b3lyp_6-31+g(d).gjf (generated)

055102368.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102368.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102368.mol 055102368.PUBCHEM 055102368.mol (via Jmol)
055102370.b3lyp_6-31g(d).inp

055102370.b3lyp_6-31g(d).qchem.inp (generated)

055102370.b3lyp_6-31g(d).gjf (generated)

055102370.b3lyp_6-31g(d).firefly.inp (generated)

055102370.b3lyp_6-31g(d).smash.inp (generated)

055102370.b3lyp_6-31g(d).nwchem.inp (generated) 055102370.b3lyp_6-31g(d).log.xz 055102370.td-b3lyp_6-31g+(d).inp 055102370.td-b3lyp_6-31g+(d).log.xz

055102370.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102370.td-b3lyp_6-31+g(d).gjf (generated)

055102370.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102370.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102370.mol 055102370.PUBCHEM 055102370.mol (via Jmol)
055102381.b3lyp_6-31g(d).inp

055102381.b3lyp_6-31g(d).qchem.inp (generated)

055102381.b3lyp_6-31g(d).gjf (generated)

055102381.b3lyp_6-31g(d).firefly.inp (generated)

055102381.b3lyp_6-31g(d).smash.inp (generated)

055102381.b3lyp_6-31g(d).nwchem.inp (generated) 055102381.b3lyp_6-31g(d).log.xz 055102381.td-b3lyp_6-31g+(d).inp 055102381.td-b3lyp_6-31g+(d).log.xz

055102381.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102381.td-b3lyp_6-31+g(d).gjf (generated)

055102381.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102381.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102381.mol 055102381.PUBCHEM 055102381.mol (via Jmol)
055102384.b3lyp_6-31g(d).inp

055102384.b3lyp_6-31g(d).qchem.inp (generated)

055102384.b3lyp_6-31g(d).gjf (generated)

055102384.b3lyp_6-31g(d).firefly.inp (generated)

055102384.b3lyp_6-31g(d).smash.inp (generated)

055102384.b3lyp_6-31g(d).nwchem.inp (generated) 055102384.b3lyp_6-31g(d).log.xz 055102384.td-b3lyp_6-31g+(d).inp 055102384.td-b3lyp_6-31g+(d).log.xz

055102384.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102384.td-b3lyp_6-31+g(d).gjf (generated)

055102384.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102384.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102384.mol 055102384.PUBCHEM 055102384.mol (via Jmol)
055102388.b3lyp_6-31g(d).inp

055102388.b3lyp_6-31g(d).qchem.inp (generated)

055102388.b3lyp_6-31g(d).gjf (generated)

055102388.b3lyp_6-31g(d).firefly.inp (generated)

055102388.b3lyp_6-31g(d).smash.inp (generated)

055102388.b3lyp_6-31g(d).nwchem.inp (generated) 055102388.b3lyp_6-31g(d).log.xz 055102388.td-b3lyp_6-31g+(d).inp 055102388.td-b3lyp_6-31g+(d).log.xz

055102388.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102388.td-b3lyp_6-31+g(d).gjf (generated)

055102388.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102388.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102388.mol 055102388.PUBCHEM 055102388.mol (via Jmol)
055102389.b3lyp_6-31g(d).inp

055102389.b3lyp_6-31g(d).qchem.inp (generated)

055102389.b3lyp_6-31g(d).gjf (generated)

055102389.b3lyp_6-31g(d).firefly.inp (generated)

055102389.b3lyp_6-31g(d).smash.inp (generated)

055102389.b3lyp_6-31g(d).nwchem.inp (generated) 055102389.b3lyp_6-31g(d).log.xz 055102389.td-b3lyp_6-31g+(d).inp 055102389.td-b3lyp_6-31g+(d).log.xz

055102389.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102389.td-b3lyp_6-31+g(d).gjf (generated)

055102389.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102389.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102389.mol 055102389.PUBCHEM 055102389.mol (via Jmol)
055102401.b3lyp_6-31g(d).inp

055102401.b3lyp_6-31g(d).qchem.inp (generated)

055102401.b3lyp_6-31g(d).gjf (generated)

055102401.b3lyp_6-31g(d).firefly.inp (generated)

055102401.b3lyp_6-31g(d).smash.inp (generated)

055102401.b3lyp_6-31g(d).nwchem.inp (generated) 055102401.b3lyp_6-31g(d).log.xz 055102401.td-b3lyp_6-31g+(d).inp 055102401.td-b3lyp_6-31g+(d).log.xz

055102401.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102401.td-b3lyp_6-31+g(d).gjf (generated)

055102401.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102401.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102401.mol 055102401.PUBCHEM 055102401.mol (via Jmol)
055102402.b3lyp_6-31g(d).inp

055102402.b3lyp_6-31g(d).qchem.inp (generated)

055102402.b3lyp_6-31g(d).gjf (generated)

055102402.b3lyp_6-31g(d).firefly.inp (generated)

055102402.b3lyp_6-31g(d).smash.inp (generated)

055102402.b3lyp_6-31g(d).nwchem.inp (generated) 055102402.b3lyp_6-31g(d).log.xz 055102402.td-b3lyp_6-31g+(d).inp 055102402.td-b3lyp_6-31g+(d).log.xz

055102402.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102402.td-b3lyp_6-31+g(d).gjf (generated)

055102402.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102402.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102402.mol 055102402.PUBCHEM 055102402.mol (via Jmol)
055102404.b3lyp_6-31g(d).inp

055102404.b3lyp_6-31g(d).qchem.inp (generated)

055102404.b3lyp_6-31g(d).gjf (generated)

055102404.b3lyp_6-31g(d).firefly.inp (generated)

055102404.b3lyp_6-31g(d).smash.inp (generated)

055102404.b3lyp_6-31g(d).nwchem.inp (generated) 055102404.b3lyp_6-31g(d).log.xz 055102404.td-b3lyp_6-31g+(d).inp 055102404.td-b3lyp_6-31g+(d).log.xz

055102404.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102404.td-b3lyp_6-31+g(d).gjf (generated)

055102404.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102404.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102404.mol 055102404.PUBCHEM 055102404.mol (via Jmol)
055102416.b3lyp_6-31g(d).inp

055102416.b3lyp_6-31g(d).qchem.inp (generated)

055102416.b3lyp_6-31g(d).gjf (generated)

055102416.b3lyp_6-31g(d).firefly.inp (generated)

055102416.b3lyp_6-31g(d).smash.inp (generated)

055102416.b3lyp_6-31g(d).nwchem.inp (generated) 055102416.b3lyp_6-31g(d).log.xz 055102416.td-b3lyp_6-31g+(d).inp 055102416.td-b3lyp_6-31g+(d).log.xz

055102416.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102416.td-b3lyp_6-31+g(d).gjf (generated)

055102416.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102416.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102416.mol 055102416.PUBCHEM 055102416.mol (via Jmol)
055102426.b3lyp_6-31g(d).inp

055102426.b3lyp_6-31g(d).qchem.inp (generated)

055102426.b3lyp_6-31g(d).gjf (generated)

055102426.b3lyp_6-31g(d).firefly.inp (generated)

055102426.b3lyp_6-31g(d).smash.inp (generated)

055102426.b3lyp_6-31g(d).nwchem.inp (generated) 055102426.b3lyp_6-31g(d).log.xz 055102426.td-b3lyp_6-31g+(d).inp 055102426.td-b3lyp_6-31g+(d).log.xz

055102426.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102426.td-b3lyp_6-31+g(d).gjf (generated)

055102426.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102426.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102426.mol 055102426.PUBCHEM 055102426.mol (via Jmol)
055102451.b3lyp_6-31g(d).inp

055102451.b3lyp_6-31g(d).qchem.inp (generated)

055102451.b3lyp_6-31g(d).gjf (generated)

055102451.b3lyp_6-31g(d).firefly.inp (generated)

055102451.b3lyp_6-31g(d).smash.inp (generated)

055102451.b3lyp_6-31g(d).nwchem.inp (generated) 055102451.b3lyp_6-31g(d).log.xz 055102451.td-b3lyp_6-31g+(d).inp 055102451.td-b3lyp_6-31g+(d).log.xz

055102451.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102451.td-b3lyp_6-31+g(d).gjf (generated)

055102451.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102451.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102451.mol 055102451.PUBCHEM 055102451.mol (via Jmol)
055102453.b3lyp_6-31g(d).inp

055102453.b3lyp_6-31g(d).qchem.inp (generated)

055102453.b3lyp_6-31g(d).gjf (generated)

055102453.b3lyp_6-31g(d).firefly.inp (generated)

055102453.b3lyp_6-31g(d).smash.inp (generated)

055102453.b3lyp_6-31g(d).nwchem.inp (generated) 055102453.b3lyp_6-31g(d).log.xz 055102453.td-b3lyp_6-31g+(d).inp 055102453.td-b3lyp_6-31g+(d).log.xz

055102453.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102453.td-b3lyp_6-31+g(d).gjf (generated)

055102453.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102453.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102453.mol 055102453.PUBCHEM 055102453.mol (via Jmol)
055102454.b3lyp_6-31g(d).inp

055102454.b3lyp_6-31g(d).qchem.inp (generated)

055102454.b3lyp_6-31g(d).gjf (generated)

055102454.b3lyp_6-31g(d).firefly.inp (generated)

055102454.b3lyp_6-31g(d).smash.inp (generated)

055102454.b3lyp_6-31g(d).nwchem.inp (generated) 055102454.b3lyp_6-31g(d).log.xz 055102454.td-b3lyp_6-31g+(d).inp 055102454.td-b3lyp_6-31g+(d).log.xz

055102454.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102454.td-b3lyp_6-31+g(d).gjf (generated)

055102454.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102454.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102454.mol 055102454.PUBCHEM 055102454.mol (via Jmol)
055102467.b3lyp_6-31g(d).inp

055102467.b3lyp_6-31g(d).qchem.inp (generated)

055102467.b3lyp_6-31g(d).gjf (generated)

055102467.b3lyp_6-31g(d).firefly.inp (generated)

055102467.b3lyp_6-31g(d).smash.inp (generated)

055102467.b3lyp_6-31g(d).nwchem.inp (generated) 055102467.b3lyp_6-31g(d).log.xz 055102467.td-b3lyp_6-31g+(d).inp 055102467.td-b3lyp_6-31g+(d).log.xz

055102467.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102467.td-b3lyp_6-31+g(d).gjf (generated)

055102467.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102467.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102467.mol 055102467.PUBCHEM 055102467.mol (via Jmol)
055102468.b3lyp_6-31g(d).inp

055102468.b3lyp_6-31g(d).qchem.inp (generated)

055102468.b3lyp_6-31g(d).gjf (generated)

055102468.b3lyp_6-31g(d).firefly.inp (generated)

055102468.b3lyp_6-31g(d).smash.inp (generated)

055102468.b3lyp_6-31g(d).nwchem.inp (generated) 055102468.b3lyp_6-31g(d).log.xz 055102468.td-b3lyp_6-31g+(d).inp 055102468.td-b3lyp_6-31g+(d).log.xz

055102468.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102468.td-b3lyp_6-31+g(d).gjf (generated)

055102468.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102468.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102468.mol 055102468.PUBCHEM 055102468.mol (via Jmol)
055102496.b3lyp_6-31g(d).inp

055102496.b3lyp_6-31g(d).qchem.inp (generated)

055102496.b3lyp_6-31g(d).gjf (generated)

055102496.b3lyp_6-31g(d).firefly.inp (generated)

055102496.b3lyp_6-31g(d).smash.inp (generated)

055102496.b3lyp_6-31g(d).nwchem.inp (generated) 055102496.b3lyp_6-31g(d).log.xz 055102496.td-b3lyp_6-31g+(d).inp 055102496.td-b3lyp_6-31g+(d).log.xz

055102496.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102496.td-b3lyp_6-31+g(d).gjf (generated)

055102496.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102496.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102496.mol 055102496.PUBCHEM 055102496.mol (via Jmol)
055102499.b3lyp_6-31g(d).inp

055102499.b3lyp_6-31g(d).qchem.inp (generated)

055102499.b3lyp_6-31g(d).gjf (generated)

055102499.b3lyp_6-31g(d).firefly.inp (generated)

055102499.b3lyp_6-31g(d).smash.inp (generated)

055102499.b3lyp_6-31g(d).nwchem.inp (generated) 055102499.b3lyp_6-31g(d).log.xz 055102499.td-b3lyp_6-31g+(d).inp 055102499.td-b3lyp_6-31g+(d).log.xz

055102499.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102499.td-b3lyp_6-31+g(d).gjf (generated)

055102499.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102499.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102499.mol 055102499.PUBCHEM 055102499.mol (via Jmol)
055102503.b3lyp_6-31g(d).inp

055102503.b3lyp_6-31g(d).qchem.inp (generated)

055102503.b3lyp_6-31g(d).gjf (generated)

055102503.b3lyp_6-31g(d).firefly.inp (generated)

055102503.b3lyp_6-31g(d).smash.inp (generated)

055102503.b3lyp_6-31g(d).nwchem.inp (generated) 055102503.b3lyp_6-31g(d).log.xz 055102503.td-b3lyp_6-31g+(d).inp 055102503.td-b3lyp_6-31g+(d).log.xz

055102503.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102503.td-b3lyp_6-31+g(d).gjf (generated)

055102503.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102503.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102503.mol 055102503.PUBCHEM 055102503.mol (via Jmol)
055102505.b3lyp_6-31g(d).inp

055102505.b3lyp_6-31g(d).qchem.inp (generated)

055102505.b3lyp_6-31g(d).gjf (generated)

055102505.b3lyp_6-31g(d).firefly.inp (generated)

055102505.b3lyp_6-31g(d).smash.inp (generated)

055102505.b3lyp_6-31g(d).nwchem.inp (generated) 055102505.b3lyp_6-31g(d).log.xz 055102505.td-b3lyp_6-31g+(d).inp 055102505.td-b3lyp_6-31g+(d).log.xz

055102505.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102505.td-b3lyp_6-31+g(d).gjf (generated)

055102505.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102505.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102505.mol 055102505.PUBCHEM 055102505.mol (via Jmol)
055102521.b3lyp_6-31g(d).inp

055102521.b3lyp_6-31g(d).qchem.inp (generated)

055102521.b3lyp_6-31g(d).gjf (generated)

055102521.b3lyp_6-31g(d).firefly.inp (generated)

055102521.b3lyp_6-31g(d).smash.inp (generated)

055102521.b3lyp_6-31g(d).nwchem.inp (generated) 055102521.b3lyp_6-31g(d).log.xz 055102521.td-b3lyp_6-31g+(d).inp 055102521.td-b3lyp_6-31g+(d).log.xz

055102521.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102521.td-b3lyp_6-31+g(d).gjf (generated)

055102521.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102521.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102521.mol 055102521.PUBCHEM 055102521.mol (via Jmol)
055102537.b3lyp_6-31g(d).inp

055102537.b3lyp_6-31g(d).qchem.inp (generated)

055102537.b3lyp_6-31g(d).gjf (generated)

055102537.b3lyp_6-31g(d).firefly.inp (generated)

055102537.b3lyp_6-31g(d).smash.inp (generated)

055102537.b3lyp_6-31g(d).nwchem.inp (generated) 055102537.b3lyp_6-31g(d).log.xz 055102537.td-b3lyp_6-31g+(d).inp 055102537.td-b3lyp_6-31g+(d).log.xz

055102537.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102537.td-b3lyp_6-31+g(d).gjf (generated)

055102537.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102537.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102537.mol 055102537.PUBCHEM 055102537.mol (via Jmol)
055102546.b3lyp_6-31g(d).inp

055102546.b3lyp_6-31g(d).qchem.inp (generated)

055102546.b3lyp_6-31g(d).gjf (generated)

055102546.b3lyp_6-31g(d).firefly.inp (generated)

055102546.b3lyp_6-31g(d).smash.inp (generated)

055102546.b3lyp_6-31g(d).nwchem.inp (generated) 055102546.b3lyp_6-31g(d).log.xz 055102546.td-b3lyp_6-31g+(d).inp 055102546.td-b3lyp_6-31g+(d).log.xz

055102546.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102546.td-b3lyp_6-31+g(d).gjf (generated)

055102546.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102546.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102546.mol 055102546.PUBCHEM 055102546.mol (via Jmol)
055102548.b3lyp_6-31g(d).inp

055102548.b3lyp_6-31g(d).qchem.inp (generated)

055102548.b3lyp_6-31g(d).gjf (generated)

055102548.b3lyp_6-31g(d).firefly.inp (generated)

055102548.b3lyp_6-31g(d).smash.inp (generated)

055102548.b3lyp_6-31g(d).nwchem.inp (generated) 055102548.b3lyp_6-31g(d).log.xz 055102548.td-b3lyp_6-31g+(d).inp 055102548.td-b3lyp_6-31g+(d).log.xz

055102548.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102548.td-b3lyp_6-31+g(d).gjf (generated)

055102548.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102548.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102548.mol 055102548.PUBCHEM 055102548.mol (via Jmol)
055102578.b3lyp_6-31g(d).inp

055102578.b3lyp_6-31g(d).qchem.inp (generated)

055102578.b3lyp_6-31g(d).gjf (generated)

055102578.b3lyp_6-31g(d).firefly.inp (generated)

055102578.b3lyp_6-31g(d).smash.inp (generated)

055102578.b3lyp_6-31g(d).nwchem.inp (generated) 055102578.b3lyp_6-31g(d).log.xz 055102578.td-b3lyp_6-31g+(d).inp 055102578.td-b3lyp_6-31g+(d).log.xz

055102578.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102578.td-b3lyp_6-31+g(d).gjf (generated)

055102578.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102578.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102578.mol 055102578.PUBCHEM 055102578.mol (via Jmol)
055102625.b3lyp_6-31g(d).inp

055102625.b3lyp_6-31g(d).qchem.inp (generated)

055102625.b3lyp_6-31g(d).gjf (generated)

055102625.b3lyp_6-31g(d).firefly.inp (generated)

055102625.b3lyp_6-31g(d).smash.inp (generated)

055102625.b3lyp_6-31g(d).nwchem.inp (generated) 055102625.b3lyp_6-31g(d).log.xz 055102625.td-b3lyp_6-31g+(d).inp 055102625.td-b3lyp_6-31g+(d).log.xz

055102625.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102625.td-b3lyp_6-31+g(d).gjf (generated)

055102625.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102625.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102625.mol 055102625.PUBCHEM 055102625.mol (via Jmol)
055102634.b3lyp_6-31g(d).inp

055102634.b3lyp_6-31g(d).qchem.inp (generated)

055102634.b3lyp_6-31g(d).gjf (generated)

055102634.b3lyp_6-31g(d).firefly.inp (generated)

055102634.b3lyp_6-31g(d).smash.inp (generated)

055102634.b3lyp_6-31g(d).nwchem.inp (generated) 055102634.b3lyp_6-31g(d).log.xz 055102634.td-b3lyp_6-31g+(d).inp 055102634.td-b3lyp_6-31g+(d).log.xz

055102634.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102634.td-b3lyp_6-31+g(d).gjf (generated)

055102634.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102634.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102634.mol 055102634.PUBCHEM 055102634.mol (via Jmol)
055102638.b3lyp_6-31g(d).inp

055102638.b3lyp_6-31g(d).qchem.inp (generated)

055102638.b3lyp_6-31g(d).gjf (generated)

055102638.b3lyp_6-31g(d).firefly.inp (generated)

055102638.b3lyp_6-31g(d).smash.inp (generated)

055102638.b3lyp_6-31g(d).nwchem.inp (generated) 055102638.b3lyp_6-31g(d).log.xz 055102638.td-b3lyp_6-31g+(d).inp 055102638.td-b3lyp_6-31g+(d).log.xz

055102638.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102638.td-b3lyp_6-31+g(d).gjf (generated)

055102638.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102638.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102638.mol 055102638.PUBCHEM 055102638.mol (via Jmol)
055102645.b3lyp_6-31g(d).inp

055102645.b3lyp_6-31g(d).qchem.inp (generated)

055102645.b3lyp_6-31g(d).gjf (generated)

055102645.b3lyp_6-31g(d).firefly.inp (generated)

055102645.b3lyp_6-31g(d).smash.inp (generated)

055102645.b3lyp_6-31g(d).nwchem.inp (generated) 055102645.b3lyp_6-31g(d).log.xz 055102645.td-b3lyp_6-31g+(d).inp 055102645.td-b3lyp_6-31g+(d).log.xz

055102645.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102645.td-b3lyp_6-31+g(d).gjf (generated)

055102645.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102645.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102645.mol 055102645.PUBCHEM 055102645.mol (via Jmol)
055102654.b3lyp_6-31g(d).inp

055102654.b3lyp_6-31g(d).qchem.inp (generated)

055102654.b3lyp_6-31g(d).gjf (generated)

055102654.b3lyp_6-31g(d).firefly.inp (generated)

055102654.b3lyp_6-31g(d).smash.inp (generated)

055102654.b3lyp_6-31g(d).nwchem.inp (generated) 055102654.b3lyp_6-31g(d).log.xz 055102654.td-b3lyp_6-31g+(d).inp 055102654.td-b3lyp_6-31g+(d).log.xz

055102654.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102654.td-b3lyp_6-31+g(d).gjf (generated)

055102654.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102654.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102654.mol 055102654.PUBCHEM 055102654.mol (via Jmol)
055102662.b3lyp_6-31g(d).inp

055102662.b3lyp_6-31g(d).qchem.inp (generated)

055102662.b3lyp_6-31g(d).gjf (generated)

055102662.b3lyp_6-31g(d).firefly.inp (generated)

055102662.b3lyp_6-31g(d).smash.inp (generated)

055102662.b3lyp_6-31g(d).nwchem.inp (generated) 055102662.b3lyp_6-31g(d).log.xz 055102662.td-b3lyp_6-31g+(d).inp 055102662.td-b3lyp_6-31g+(d).log.xz

055102662.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102662.td-b3lyp_6-31+g(d).gjf (generated)

055102662.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102662.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102662.mol 055102662.PUBCHEM 055102662.mol (via Jmol)
055102674.b3lyp_6-31g(d).inp

055102674.b3lyp_6-31g(d).qchem.inp (generated)

055102674.b3lyp_6-31g(d).gjf (generated)

055102674.b3lyp_6-31g(d).firefly.inp (generated)

055102674.b3lyp_6-31g(d).smash.inp (generated)

055102674.b3lyp_6-31g(d).nwchem.inp (generated) 055102674.b3lyp_6-31g(d).log.xz 055102674.td-b3lyp_6-31g+(d).inp 055102674.td-b3lyp_6-31g+(d).log.xz

055102674.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102674.td-b3lyp_6-31+g(d).gjf (generated)

055102674.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102674.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102674.mol 055102674.PUBCHEM 055102674.mol (via Jmol)
055102677.b3lyp_6-31g(d).inp

055102677.b3lyp_6-31g(d).qchem.inp (generated)

055102677.b3lyp_6-31g(d).gjf (generated)

055102677.b3lyp_6-31g(d).firefly.inp (generated)

055102677.b3lyp_6-31g(d).smash.inp (generated)

055102677.b3lyp_6-31g(d).nwchem.inp (generated) 055102677.b3lyp_6-31g(d).log.xz 055102677.td-b3lyp_6-31g+(d).inp 055102677.td-b3lyp_6-31g+(d).log.xz

055102677.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102677.td-b3lyp_6-31+g(d).gjf (generated)

055102677.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102677.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102677.mol 055102677.PUBCHEM 055102677.mol (via Jmol)
055102678.b3lyp_6-31g(d).inp

055102678.b3lyp_6-31g(d).qchem.inp (generated)

055102678.b3lyp_6-31g(d).gjf (generated)

055102678.b3lyp_6-31g(d).firefly.inp (generated)

055102678.b3lyp_6-31g(d).smash.inp (generated)

055102678.b3lyp_6-31g(d).nwchem.inp (generated) 055102678.b3lyp_6-31g(d).log.xz 055102678.td-b3lyp_6-31g+(d).inp 055102678.td-b3lyp_6-31g+(d).log.xz

055102678.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102678.td-b3lyp_6-31+g(d).gjf (generated)

055102678.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102678.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102678.mol 055102678.PUBCHEM 055102678.mol (via Jmol)
055102684.b3lyp_6-31g(d).inp

055102684.b3lyp_6-31g(d).qchem.inp (generated)

055102684.b3lyp_6-31g(d).gjf (generated)

055102684.b3lyp_6-31g(d).firefly.inp (generated)

055102684.b3lyp_6-31g(d).smash.inp (generated)

055102684.b3lyp_6-31g(d).nwchem.inp (generated) 055102684.b3lyp_6-31g(d).log.xz 055102684.td-b3lyp_6-31g+(d).inp 055102684.td-b3lyp_6-31g+(d).log.xz

055102684.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102684.td-b3lyp_6-31+g(d).gjf (generated)

055102684.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102684.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102684.mol 055102684.PUBCHEM 055102684.mol (via Jmol)
055102695.b3lyp_6-31g(d).inp

055102695.b3lyp_6-31g(d).qchem.inp (generated)

055102695.b3lyp_6-31g(d).gjf (generated)

055102695.b3lyp_6-31g(d).firefly.inp (generated)

055102695.b3lyp_6-31g(d).smash.inp (generated)

055102695.b3lyp_6-31g(d).nwchem.inp (generated) 055102695.b3lyp_6-31g(d).log.xz 055102695.td-b3lyp_6-31g+(d).inp 055102695.td-b3lyp_6-31g+(d).log.xz

055102695.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102695.td-b3lyp_6-31+g(d).gjf (generated)

055102695.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102695.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102695.mol 055102695.PUBCHEM 055102695.mol (via Jmol)
055102697.b3lyp_6-31g(d).inp

055102697.b3lyp_6-31g(d).qchem.inp (generated)

055102697.b3lyp_6-31g(d).gjf (generated)

055102697.b3lyp_6-31g(d).firefly.inp (generated)

055102697.b3lyp_6-31g(d).smash.inp (generated)

055102697.b3lyp_6-31g(d).nwchem.inp (generated) 055102697.b3lyp_6-31g(d).log.xz 055102697.td-b3lyp_6-31g+(d).inp 055102697.td-b3lyp_6-31g+(d).log.xz

055102697.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102697.td-b3lyp_6-31+g(d).gjf (generated)

055102697.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102697.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102697.mol 055102697.PUBCHEM 055102697.mol (via Jmol)
055102713.b3lyp_6-31g(d).inp

055102713.b3lyp_6-31g(d).qchem.inp (generated)

055102713.b3lyp_6-31g(d).gjf (generated)

055102713.b3lyp_6-31g(d).firefly.inp (generated)

055102713.b3lyp_6-31g(d).smash.inp (generated)

055102713.b3lyp_6-31g(d).nwchem.inp (generated) 055102713.b3lyp_6-31g(d).log.xz 055102713.td-b3lyp_6-31g+(d).inp 055102713.td-b3lyp_6-31g+(d).log.xz

055102713.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102713.td-b3lyp_6-31+g(d).gjf (generated)

055102713.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102713.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102713.mol 055102713.PUBCHEM 055102713.mol (via Jmol)
055102714.b3lyp_6-31g(d).inp

055102714.b3lyp_6-31g(d).qchem.inp (generated)

055102714.b3lyp_6-31g(d).gjf (generated)

055102714.b3lyp_6-31g(d).firefly.inp (generated)

055102714.b3lyp_6-31g(d).smash.inp (generated)

055102714.b3lyp_6-31g(d).nwchem.inp (generated) 055102714.b3lyp_6-31g(d).log.xz 055102714.td-b3lyp_6-31g+(d).inp 055102714.td-b3lyp_6-31g+(d).log.xz

055102714.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102714.td-b3lyp_6-31+g(d).gjf (generated)

055102714.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102714.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102714.mol 055102714.PUBCHEM 055102714.mol (via Jmol)
055102738.b3lyp_6-31g(d).inp

055102738.b3lyp_6-31g(d).qchem.inp (generated)

055102738.b3lyp_6-31g(d).gjf (generated)

055102738.b3lyp_6-31g(d).firefly.inp (generated)

055102738.b3lyp_6-31g(d).smash.inp (generated)

055102738.b3lyp_6-31g(d).nwchem.inp (generated) 055102738.b3lyp_6-31g(d).log.xz 055102738.td-b3lyp_6-31g+(d).inp 055102738.td-b3lyp_6-31g+(d).log.xz

055102738.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102738.td-b3lyp_6-31+g(d).gjf (generated)

055102738.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102738.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102738.mol 055102738.PUBCHEM 055102738.mol (via Jmol)
055102741.b3lyp_6-31g(d).inp

055102741.b3lyp_6-31g(d).qchem.inp (generated)

055102741.b3lyp_6-31g(d).gjf (generated)

055102741.b3lyp_6-31g(d).firefly.inp (generated)

055102741.b3lyp_6-31g(d).smash.inp (generated)

055102741.b3lyp_6-31g(d).nwchem.inp (generated) 055102741.b3lyp_6-31g(d).log.xz 055102741.td-b3lyp_6-31g+(d).inp 055102741.td-b3lyp_6-31g+(d).log.xz

055102741.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102741.td-b3lyp_6-31+g(d).gjf (generated)

055102741.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102741.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102741.mol 055102741.PUBCHEM 055102741.mol (via Jmol)
055102745.b3lyp_6-31g(d).inp

055102745.b3lyp_6-31g(d).qchem.inp (generated)

055102745.b3lyp_6-31g(d).gjf (generated)

055102745.b3lyp_6-31g(d).firefly.inp (generated)

055102745.b3lyp_6-31g(d).smash.inp (generated)

055102745.b3lyp_6-31g(d).nwchem.inp (generated) 055102745.b3lyp_6-31g(d).log.xz 055102745.td-b3lyp_6-31g+(d).inp 055102745.td-b3lyp_6-31g+(d).log.xz

055102745.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102745.td-b3lyp_6-31+g(d).gjf (generated)

055102745.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102745.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102745.mol 055102745.PUBCHEM 055102745.mol (via Jmol)
055102748.b3lyp_6-31g(d).inp

055102748.b3lyp_6-31g(d).qchem.inp (generated)

055102748.b3lyp_6-31g(d).gjf (generated)

055102748.b3lyp_6-31g(d).firefly.inp (generated)

055102748.b3lyp_6-31g(d).smash.inp (generated)

055102748.b3lyp_6-31g(d).nwchem.inp (generated) 055102748.b3lyp_6-31g(d).log.xz 055102748.td-b3lyp_6-31g+(d).inp 055102748.td-b3lyp_6-31g+(d).log.xz

055102748.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102748.td-b3lyp_6-31+g(d).gjf (generated)

055102748.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102748.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102748.mol 055102748.PUBCHEM 055102748.mol (via Jmol)
055102763.b3lyp_6-31g(d).inp

055102763.b3lyp_6-31g(d).qchem.inp (generated)

055102763.b3lyp_6-31g(d).gjf (generated)

055102763.b3lyp_6-31g(d).firefly.inp (generated)

055102763.b3lyp_6-31g(d).smash.inp (generated)

055102763.b3lyp_6-31g(d).nwchem.inp (generated) 055102763.b3lyp_6-31g(d).log.xz 055102763.td-b3lyp_6-31g+(d).inp 055102763.td-b3lyp_6-31g+(d).log.xz

055102763.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102763.td-b3lyp_6-31+g(d).gjf (generated)

055102763.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102763.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102763.mol 055102763.PUBCHEM 055102763.mol (via Jmol)
055102769.b3lyp_6-31g(d).inp

055102769.b3lyp_6-31g(d).qchem.inp (generated)

055102769.b3lyp_6-31g(d).gjf (generated)

055102769.b3lyp_6-31g(d).firefly.inp (generated)

055102769.b3lyp_6-31g(d).smash.inp (generated)

055102769.b3lyp_6-31g(d).nwchem.inp (generated) 055102769.b3lyp_6-31g(d).log.xz 055102769.td-b3lyp_6-31g+(d).inp 055102769.td-b3lyp_6-31g+(d).log.xz

055102769.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102769.td-b3lyp_6-31+g(d).gjf (generated)

055102769.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102769.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102769.mol 055102769.PUBCHEM 055102769.mol (via Jmol)
055102775.b3lyp_6-31g(d).inp

055102775.b3lyp_6-31g(d).qchem.inp (generated)

055102775.b3lyp_6-31g(d).gjf (generated)

055102775.b3lyp_6-31g(d).firefly.inp (generated)

055102775.b3lyp_6-31g(d).smash.inp (generated)

055102775.b3lyp_6-31g(d).nwchem.inp (generated) 055102775.b3lyp_6-31g(d).log.xz 055102775.td-b3lyp_6-31g+(d).inp 055102775.td-b3lyp_6-31g+(d).log.xz

055102775.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102775.td-b3lyp_6-31+g(d).gjf (generated)

055102775.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102775.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102775.mol 055102775.PUBCHEM 055102775.mol (via Jmol)
055102809.b3lyp_6-31g(d).inp

055102809.b3lyp_6-31g(d).qchem.inp (generated)

055102809.b3lyp_6-31g(d).gjf (generated)

055102809.b3lyp_6-31g(d).firefly.inp (generated)

055102809.b3lyp_6-31g(d).smash.inp (generated)

055102809.b3lyp_6-31g(d).nwchem.inp (generated) 055102809.b3lyp_6-31g(d).log.xz 055102809.td-b3lyp_6-31g+(d).inp 055102809.td-b3lyp_6-31g+(d).log.xz

055102809.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102809.td-b3lyp_6-31+g(d).gjf (generated)

055102809.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102809.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102809.mol 055102809.PUBCHEM 055102809.mol (via Jmol)
055102811.b3lyp_6-31g(d).inp

055102811.b3lyp_6-31g(d).qchem.inp (generated)

055102811.b3lyp_6-31g(d).gjf (generated)

055102811.b3lyp_6-31g(d).firefly.inp (generated)

055102811.b3lyp_6-31g(d).smash.inp (generated)

055102811.b3lyp_6-31g(d).nwchem.inp (generated) 055102811.b3lyp_6-31g(d).log.xz 055102811.td-b3lyp_6-31g+(d).inp 055102811.td-b3lyp_6-31g+(d).log.xz

055102811.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102811.td-b3lyp_6-31+g(d).gjf (generated)

055102811.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102811.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102811.mol 055102811.PUBCHEM 055102811.mol (via Jmol)
055102815.b3lyp_6-31g(d).inp

055102815.b3lyp_6-31g(d).qchem.inp (generated)

055102815.b3lyp_6-31g(d).gjf (generated)

055102815.b3lyp_6-31g(d).firefly.inp (generated)

055102815.b3lyp_6-31g(d).smash.inp (generated)

055102815.b3lyp_6-31g(d).nwchem.inp (generated) 055102815.b3lyp_6-31g(d).log.xz 055102815.td-b3lyp_6-31g+(d).inp 055102815.td-b3lyp_6-31g+(d).log.xz

055102815.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102815.td-b3lyp_6-31+g(d).gjf (generated)

055102815.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102815.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102815.mol 055102815.PUBCHEM 055102815.mol (via Jmol)
055102816.b3lyp_6-31g(d).inp

055102816.b3lyp_6-31g(d).qchem.inp (generated)

055102816.b3lyp_6-31g(d).gjf (generated)

055102816.b3lyp_6-31g(d).firefly.inp (generated)

055102816.b3lyp_6-31g(d).smash.inp (generated)

055102816.b3lyp_6-31g(d).nwchem.inp (generated) 055102816.b3lyp_6-31g(d).log.xz 055102816.td-b3lyp_6-31g+(d).inp 055102816.td-b3lyp_6-31g+(d).log.xz

055102816.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102816.td-b3lyp_6-31+g(d).gjf (generated)

055102816.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102816.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102816.mol 055102816.PUBCHEM 055102816.mol (via Jmol)
055102818.b3lyp_6-31g(d).inp

055102818.b3lyp_6-31g(d).qchem.inp (generated)

055102818.b3lyp_6-31g(d).gjf (generated)

055102818.b3lyp_6-31g(d).firefly.inp (generated)

055102818.b3lyp_6-31g(d).smash.inp (generated)

055102818.b3lyp_6-31g(d).nwchem.inp (generated) 055102818.b3lyp_6-31g(d).log.xz 055102818.td-b3lyp_6-31g+(d).inp 055102818.td-b3lyp_6-31g+(d).log.xz

055102818.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102818.td-b3lyp_6-31+g(d).gjf (generated)

055102818.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102818.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102818.mol 055102818.PUBCHEM 055102818.mol (via Jmol)
055102825.b3lyp_6-31g(d).inp

055102825.b3lyp_6-31g(d).qchem.inp (generated)

055102825.b3lyp_6-31g(d).gjf (generated)

055102825.b3lyp_6-31g(d).firefly.inp (generated)

055102825.b3lyp_6-31g(d).smash.inp (generated)

055102825.b3lyp_6-31g(d).nwchem.inp (generated) 055102825.b3lyp_6-31g(d).log.xz 055102825.mol 055102825.PUBCHEM 055102825.mol (via Jmol)
055102829.b3lyp_6-31g(d).inp

055102829.b3lyp_6-31g(d).qchem.inp (generated)

055102829.b3lyp_6-31g(d).gjf (generated)

055102829.b3lyp_6-31g(d).firefly.inp (generated)

055102829.b3lyp_6-31g(d).smash.inp (generated)

055102829.b3lyp_6-31g(d).nwchem.inp (generated) 055102829.b3lyp_6-31g(d).log.xz 055102829.td-b3lyp_6-31g+(d).inp 055102829.td-b3lyp_6-31g+(d).log.xz

055102829.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102829.td-b3lyp_6-31+g(d).gjf (generated)

055102829.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102829.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102829.mol 055102829.PUBCHEM 055102829.mol (via Jmol)
055102831.b3lyp_6-31g(d).inp

055102831.b3lyp_6-31g(d).qchem.inp (generated)

055102831.b3lyp_6-31g(d).gjf (generated)

055102831.b3lyp_6-31g(d).firefly.inp (generated)

055102831.b3lyp_6-31g(d).smash.inp (generated)

055102831.b3lyp_6-31g(d).nwchem.inp (generated) 055102831.b3lyp_6-31g(d).log.xz 055102831.td-b3lyp_6-31g+(d).inp 055102831.td-b3lyp_6-31g+(d).log.xz

055102831.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102831.td-b3lyp_6-31+g(d).gjf (generated)

055102831.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102831.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102831.mol 055102831.PUBCHEM 055102831.mol (via Jmol)
055102834.b3lyp_6-31g(d).inp

055102834.b3lyp_6-31g(d).qchem.inp (generated)

055102834.b3lyp_6-31g(d).gjf (generated)

055102834.b3lyp_6-31g(d).firefly.inp (generated)

055102834.b3lyp_6-31g(d).smash.inp (generated)

055102834.b3lyp_6-31g(d).nwchem.inp (generated) 055102834.b3lyp_6-31g(d).log.xz 055102834.td-b3lyp_6-31g+(d).inp 055102834.td-b3lyp_6-31g+(d).log.xz

055102834.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102834.td-b3lyp_6-31+g(d).gjf (generated)

055102834.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102834.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102834.mol 055102834.PUBCHEM 055102834.mol (via Jmol)
055102841.b3lyp_6-31g(d).inp

055102841.b3lyp_6-31g(d).qchem.inp (generated)

055102841.b3lyp_6-31g(d).gjf (generated)

055102841.b3lyp_6-31g(d).firefly.inp (generated)

055102841.b3lyp_6-31g(d).smash.inp (generated)

055102841.b3lyp_6-31g(d).nwchem.inp (generated) 055102841.b3lyp_6-31g(d).log.xz 055102841.td-b3lyp_6-31g+(d).inp 055102841.td-b3lyp_6-31g+(d).log.xz

055102841.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102841.td-b3lyp_6-31+g(d).gjf (generated)

055102841.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102841.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102841.mol 055102841.PUBCHEM 055102841.mol (via Jmol)
055102862.b3lyp_6-31g(d).inp

055102862.b3lyp_6-31g(d).qchem.inp (generated)

055102862.b3lyp_6-31g(d).gjf (generated)

055102862.b3lyp_6-31g(d).firefly.inp (generated)

055102862.b3lyp_6-31g(d).smash.inp (generated)

055102862.b3lyp_6-31g(d).nwchem.inp (generated) 055102862.b3lyp_6-31g(d).log.xz 055102862.mol 055102862.PUBCHEM 055102862.mol (via Jmol)
055102873.b3lyp_6-31g(d).inp

055102873.b3lyp_6-31g(d).qchem.inp (generated)

055102873.b3lyp_6-31g(d).gjf (generated)

055102873.b3lyp_6-31g(d).firefly.inp (generated)

055102873.b3lyp_6-31g(d).smash.inp (generated)

055102873.b3lyp_6-31g(d).nwchem.inp (generated) 055102873.b3lyp_6-31g(d).log.xz 055102873.td-b3lyp_6-31g+(d).inp 055102873.td-b3lyp_6-31g+(d).log.xz

055102873.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102873.td-b3lyp_6-31+g(d).gjf (generated)

055102873.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102873.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102873.mol 055102873.PUBCHEM 055102873.mol (via Jmol)
055102905.b3lyp_6-31g(d).inp

055102905.b3lyp_6-31g(d).qchem.inp (generated)

055102905.b3lyp_6-31g(d).gjf (generated)

055102905.b3lyp_6-31g(d).firefly.inp (generated)

055102905.b3lyp_6-31g(d).smash.inp (generated)

055102905.b3lyp_6-31g(d).nwchem.inp (generated) 055102905.b3lyp_6-31g(d).log.xz 055102905.td-b3lyp_6-31g+(d).inp 055102905.td-b3lyp_6-31g+(d).log.xz

055102905.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102905.td-b3lyp_6-31+g(d).gjf (generated)

055102905.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102905.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102905.mol 055102905.PUBCHEM 055102905.mol (via Jmol)
055102919.b3lyp_6-31g(d).inp

055102919.b3lyp_6-31g(d).qchem.inp (generated)

055102919.b3lyp_6-31g(d).gjf (generated)

055102919.b3lyp_6-31g(d).firefly.inp (generated)

055102919.b3lyp_6-31g(d).smash.inp (generated)

055102919.b3lyp_6-31g(d).nwchem.inp (generated) 055102919.b3lyp_6-31g(d).log.xz 055102919.td-b3lyp_6-31g+(d).inp 055102919.td-b3lyp_6-31g+(d).log.xz

055102919.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102919.td-b3lyp_6-31+g(d).gjf (generated)

055102919.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102919.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102919.mol 055102919.PUBCHEM 055102919.mol (via Jmol)
055102923.b3lyp_6-31g(d).inp

055102923.b3lyp_6-31g(d).qchem.inp (generated)

055102923.b3lyp_6-31g(d).gjf (generated)

055102923.b3lyp_6-31g(d).firefly.inp (generated)

055102923.b3lyp_6-31g(d).smash.inp (generated)

055102923.b3lyp_6-31g(d).nwchem.inp (generated) 055102923.b3lyp_6-31g(d).log.xz 055102923.td-b3lyp_6-31g+(d).inp 055102923.td-b3lyp_6-31g+(d).log.xz

055102923.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102923.td-b3lyp_6-31+g(d).gjf (generated)

055102923.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102923.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102923.mol 055102923.PUBCHEM 055102923.mol (via Jmol)
055102924.b3lyp_6-31g(d).inp

055102924.b3lyp_6-31g(d).qchem.inp (generated)

055102924.b3lyp_6-31g(d).gjf (generated)

055102924.b3lyp_6-31g(d).firefly.inp (generated)

055102924.b3lyp_6-31g(d).smash.inp (generated)

055102924.b3lyp_6-31g(d).nwchem.inp (generated) 055102924.b3lyp_6-31g(d).log.xz 055102924.td-b3lyp_6-31g+(d).inp 055102924.td-b3lyp_6-31g+(d).log.xz

055102924.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102924.td-b3lyp_6-31+g(d).gjf (generated)

055102924.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102924.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102924.mol 055102924.PUBCHEM 055102924.mol (via Jmol)
055102925.b3lyp_6-31g(d).inp

055102925.b3lyp_6-31g(d).qchem.inp (generated)

055102925.b3lyp_6-31g(d).gjf (generated)

055102925.b3lyp_6-31g(d).firefly.inp (generated)

055102925.b3lyp_6-31g(d).smash.inp (generated)

055102925.b3lyp_6-31g(d).nwchem.inp (generated) 055102925.b3lyp_6-31g(d).log.xz 055102925.td-b3lyp_6-31g+(d).inp 055102925.td-b3lyp_6-31g+(d).log.xz

055102925.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102925.td-b3lyp_6-31+g(d).gjf (generated)

055102925.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102925.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102925.mol 055102925.PUBCHEM 055102925.mol (via Jmol)
055102927.b3lyp_6-31g(d).inp

055102927.b3lyp_6-31g(d).qchem.inp (generated)

055102927.b3lyp_6-31g(d).gjf (generated)

055102927.b3lyp_6-31g(d).firefly.inp (generated)

055102927.b3lyp_6-31g(d).smash.inp (generated)

055102927.b3lyp_6-31g(d).nwchem.inp (generated) 055102927.b3lyp_6-31g(d).log.xz 055102927.td-b3lyp_6-31g+(d).inp 055102927.td-b3lyp_6-31g+(d).log.xz

055102927.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102927.td-b3lyp_6-31+g(d).gjf (generated)

055102927.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102927.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102927.mol 055102927.PUBCHEM 055102927.mol (via Jmol)
055102939.b3lyp_6-31g(d).inp

055102939.b3lyp_6-31g(d).qchem.inp (generated)

055102939.b3lyp_6-31g(d).gjf (generated)

055102939.b3lyp_6-31g(d).firefly.inp (generated)

055102939.b3lyp_6-31g(d).smash.inp (generated)

055102939.b3lyp_6-31g(d).nwchem.inp (generated) 055102939.b3lyp_6-31g(d).log.xz 055102939.td-b3lyp_6-31g+(d).inp 055102939.td-b3lyp_6-31g+(d).log.xz

055102939.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102939.td-b3lyp_6-31+g(d).gjf (generated)

055102939.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102939.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102939.mol 055102939.PUBCHEM 055102939.mol (via Jmol)
055102950.b3lyp_6-31g(d).inp

055102950.b3lyp_6-31g(d).qchem.inp (generated)

055102950.b3lyp_6-31g(d).gjf (generated)

055102950.b3lyp_6-31g(d).firefly.inp (generated)

055102950.b3lyp_6-31g(d).smash.inp (generated)

055102950.b3lyp_6-31g(d).nwchem.inp (generated) 055102950.b3lyp_6-31g(d).log.xz 055102950.td-b3lyp_6-31g+(d).inp 055102950.td-b3lyp_6-31g+(d).log.xz

055102950.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102950.td-b3lyp_6-31+g(d).gjf (generated)

055102950.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102950.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102950.mol 055102950.PUBCHEM 055102950.mol (via Jmol)
055102953.b3lyp_6-31g(d).inp

055102953.b3lyp_6-31g(d).qchem.inp (generated)

055102953.b3lyp_6-31g(d).gjf (generated)

055102953.b3lyp_6-31g(d).firefly.inp (generated)

055102953.b3lyp_6-31g(d).smash.inp (generated)

055102953.b3lyp_6-31g(d).nwchem.inp (generated) 055102953.b3lyp_6-31g(d).log.xz 055102953.td-b3lyp_6-31g+(d).inp 055102953.td-b3lyp_6-31g+(d).log.xz

055102953.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102953.td-b3lyp_6-31+g(d).gjf (generated)

055102953.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102953.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102953.mol 055102953.PUBCHEM 055102953.mol (via Jmol)
055102954.b3lyp_6-31g(d).inp

055102954.b3lyp_6-31g(d).qchem.inp (generated)

055102954.b3lyp_6-31g(d).gjf (generated)

055102954.b3lyp_6-31g(d).firefly.inp (generated)

055102954.b3lyp_6-31g(d).smash.inp (generated)

055102954.b3lyp_6-31g(d).nwchem.inp (generated) 055102954.b3lyp_6-31g(d).log.xz 055102954.td-b3lyp_6-31g+(d).inp 055102954.td-b3lyp_6-31g+(d).log.xz

055102954.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102954.td-b3lyp_6-31+g(d).gjf (generated)

055102954.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102954.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102954.mol 055102954.PUBCHEM 055102954.mol (via Jmol)
055102955.b3lyp_6-31g(d).inp

055102955.b3lyp_6-31g(d).qchem.inp (generated)

055102955.b3lyp_6-31g(d).gjf (generated)

055102955.b3lyp_6-31g(d).firefly.inp (generated)

055102955.b3lyp_6-31g(d).smash.inp (generated)

055102955.b3lyp_6-31g(d).nwchem.inp (generated) 055102955.b3lyp_6-31g(d).log.xz 055102955.td-b3lyp_6-31g+(d).inp 055102955.td-b3lyp_6-31g+(d).log.xz

055102955.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102955.td-b3lyp_6-31+g(d).gjf (generated)

055102955.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102955.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102955.mol 055102955.PUBCHEM 055102955.mol (via Jmol)
055102956.b3lyp_6-31g(d).inp

055102956.b3lyp_6-31g(d).qchem.inp (generated)

055102956.b3lyp_6-31g(d).gjf (generated)

055102956.b3lyp_6-31g(d).firefly.inp (generated)

055102956.b3lyp_6-31g(d).smash.inp (generated)

055102956.b3lyp_6-31g(d).nwchem.inp (generated) 055102956.b3lyp_6-31g(d).log.xz 055102956.td-b3lyp_6-31g+(d).inp 055102956.td-b3lyp_6-31g+(d).log.xz

055102956.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102956.td-b3lyp_6-31+g(d).gjf (generated)

055102956.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102956.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102956.mol 055102956.PUBCHEM 055102956.mol (via Jmol)
055102957.b3lyp_6-31g(d).inp

055102957.b3lyp_6-31g(d).qchem.inp (generated)

055102957.b3lyp_6-31g(d).gjf (generated)

055102957.b3lyp_6-31g(d).firefly.inp (generated)

055102957.b3lyp_6-31g(d).smash.inp (generated)

055102957.b3lyp_6-31g(d).nwchem.inp (generated) 055102957.b3lyp_6-31g(d).log.xz 055102957.td-b3lyp_6-31g+(d).inp 055102957.td-b3lyp_6-31g+(d).log.xz

055102957.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102957.td-b3lyp_6-31+g(d).gjf (generated)

055102957.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102957.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102957.mol 055102957.PUBCHEM 055102957.mol (via Jmol)
055102965.b3lyp_6-31g(d).inp

055102965.b3lyp_6-31g(d).qchem.inp (generated)

055102965.b3lyp_6-31g(d).gjf (generated)

055102965.b3lyp_6-31g(d).firefly.inp (generated)

055102965.b3lyp_6-31g(d).smash.inp (generated)

055102965.b3lyp_6-31g(d).nwchem.inp (generated) 055102965.b3lyp_6-31g(d).log.xz 055102965.td-b3lyp_6-31g+(d).inp 055102965.td-b3lyp_6-31g+(d).log.xz

055102965.td-b3lyp_6-31+g(d).qchem.inp (generated)

055102965.td-b3lyp_6-31+g(d).gjf (generated)

055102965.td-b3lyp_6-31+g(d).firefly.inp (generated)

055102965.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055102965.mol 055102965.PUBCHEM 055102965.mol (via Jmol)
055103002.b3lyp_6-31g(d).inp

055103002.b3lyp_6-31g(d).qchem.inp (generated)

055103002.b3lyp_6-31g(d).gjf (generated)

055103002.b3lyp_6-31g(d).firefly.inp (generated)

055103002.b3lyp_6-31g(d).smash.inp (generated)

055103002.b3lyp_6-31g(d).nwchem.inp (generated) 055103002.b3lyp_6-31g(d).log.xz 055103002.td-b3lyp_6-31g+(d).inp 055103002.td-b3lyp_6-31g+(d).log.xz

055103002.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103002.td-b3lyp_6-31+g(d).gjf (generated)

055103002.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103002.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103002.mol 055103002.PUBCHEM 055103002.mol (via Jmol)
055103015.b3lyp_6-31g(d).inp

055103015.b3lyp_6-31g(d).qchem.inp (generated)

055103015.b3lyp_6-31g(d).gjf (generated)

055103015.b3lyp_6-31g(d).firefly.inp (generated)

055103015.b3lyp_6-31g(d).smash.inp (generated)

055103015.b3lyp_6-31g(d).nwchem.inp (generated) 055103015.b3lyp_6-31g(d).log.xz 055103015.td-b3lyp_6-31g+(d).inp 055103015.td-b3lyp_6-31g+(d).log.xz

055103015.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103015.td-b3lyp_6-31+g(d).gjf (generated)

055103015.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103015.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103015.mol 055103015.PUBCHEM 055103015.mol (via Jmol)
055103017.b3lyp_6-31g(d).inp

055103017.b3lyp_6-31g(d).qchem.inp (generated)

055103017.b3lyp_6-31g(d).gjf (generated)

055103017.b3lyp_6-31g(d).firefly.inp (generated)

055103017.b3lyp_6-31g(d).smash.inp (generated)

055103017.b3lyp_6-31g(d).nwchem.inp (generated) 055103017.b3lyp_6-31g(d).log.xz 055103017.td-b3lyp_6-31g+(d).inp 055103017.td-b3lyp_6-31g+(d).log.xz

055103017.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103017.td-b3lyp_6-31+g(d).gjf (generated)

055103017.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103017.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103017.mol 055103017.PUBCHEM 055103017.mol (via Jmol)
055103026.b3lyp_6-31g(d).inp

055103026.b3lyp_6-31g(d).qchem.inp (generated)

055103026.b3lyp_6-31g(d).gjf (generated)

055103026.b3lyp_6-31g(d).firefly.inp (generated)

055103026.b3lyp_6-31g(d).smash.inp (generated)

055103026.b3lyp_6-31g(d).nwchem.inp (generated) 055103026.b3lyp_6-31g(d).log.xz 055103026.td-b3lyp_6-31g+(d).inp 055103026.td-b3lyp_6-31g+(d).log.xz

055103026.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103026.td-b3lyp_6-31+g(d).gjf (generated)

055103026.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103026.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103026.mol 055103026.PUBCHEM 055103026.mol (via Jmol)
055103034.b3lyp_6-31g(d).inp

055103034.b3lyp_6-31g(d).qchem.inp (generated)

055103034.b3lyp_6-31g(d).gjf (generated)

055103034.b3lyp_6-31g(d).firefly.inp (generated)

055103034.b3lyp_6-31g(d).smash.inp (generated)

055103034.b3lyp_6-31g(d).nwchem.inp (generated) 055103034.b3lyp_6-31g(d).log.xz 055103034.td-b3lyp_6-31g+(d).inp 055103034.td-b3lyp_6-31g+(d).log.xz

055103034.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103034.td-b3lyp_6-31+g(d).gjf (generated)

055103034.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103034.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103034.mol 055103034.PUBCHEM 055103034.mol (via Jmol)
055103052.b3lyp_6-31g(d).inp

055103052.b3lyp_6-31g(d).qchem.inp (generated)

055103052.b3lyp_6-31g(d).gjf (generated)

055103052.b3lyp_6-31g(d).firefly.inp (generated)

055103052.b3lyp_6-31g(d).smash.inp (generated)

055103052.b3lyp_6-31g(d).nwchem.inp (generated) 055103052.b3lyp_6-31g(d).log.xz 055103052.td-b3lyp_6-31g+(d).inp 055103052.td-b3lyp_6-31g+(d).log.xz

055103052.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103052.td-b3lyp_6-31+g(d).gjf (generated)

055103052.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103052.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103052.mol 055103052.PUBCHEM 055103052.mol (via Jmol)
055103056.b3lyp_6-31g(d).inp

055103056.b3lyp_6-31g(d).qchem.inp (generated)

055103056.b3lyp_6-31g(d).gjf (generated)

055103056.b3lyp_6-31g(d).firefly.inp (generated)

055103056.b3lyp_6-31g(d).smash.inp (generated)

055103056.b3lyp_6-31g(d).nwchem.inp (generated) 055103056.b3lyp_6-31g(d).log.xz 055103056.td-b3lyp_6-31g+(d).inp 055103056.td-b3lyp_6-31g+(d).log.xz

055103056.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103056.td-b3lyp_6-31+g(d).gjf (generated)

055103056.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103056.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103056.mol 055103056.PUBCHEM 055103056.mol (via Jmol)
055103058.b3lyp_6-31g(d).inp

055103058.b3lyp_6-31g(d).qchem.inp (generated)

055103058.b3lyp_6-31g(d).gjf (generated)

055103058.b3lyp_6-31g(d).firefly.inp (generated)

055103058.b3lyp_6-31g(d).smash.inp (generated)

055103058.b3lyp_6-31g(d).nwchem.inp (generated) 055103058.b3lyp_6-31g(d).log.xz 055103058.td-b3lyp_6-31g+(d).inp 055103058.td-b3lyp_6-31g+(d).log.xz

055103058.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103058.td-b3lyp_6-31+g(d).gjf (generated)

055103058.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103058.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103058.mol 055103058.PUBCHEM 055103058.mol (via Jmol)
055103059.b3lyp_6-31g(d).inp

055103059.b3lyp_6-31g(d).qchem.inp (generated)

055103059.b3lyp_6-31g(d).gjf (generated)

055103059.b3lyp_6-31g(d).firefly.inp (generated)

055103059.b3lyp_6-31g(d).smash.inp (generated)

055103059.b3lyp_6-31g(d).nwchem.inp (generated) 055103059.b3lyp_6-31g(d).log.xz 055103059.td-b3lyp_6-31g+(d).inp 055103059.td-b3lyp_6-31g+(d).log.xz

055103059.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103059.td-b3lyp_6-31+g(d).gjf (generated)

055103059.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103059.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103059.mol 055103059.PUBCHEM 055103059.mol (via Jmol)
055103061.b3lyp_6-31g(d).inp

055103061.b3lyp_6-31g(d).qchem.inp (generated)

055103061.b3lyp_6-31g(d).gjf (generated)

055103061.b3lyp_6-31g(d).firefly.inp (generated)

055103061.b3lyp_6-31g(d).smash.inp (generated)

055103061.b3lyp_6-31g(d).nwchem.inp (generated) 055103061.b3lyp_6-31g(d).log.xz 055103061.td-b3lyp_6-31g+(d).inp 055103061.td-b3lyp_6-31g+(d).log.xz

055103061.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103061.td-b3lyp_6-31+g(d).gjf (generated)

055103061.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103061.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103061.mol 055103061.PUBCHEM 055103061.mol (via Jmol)
055103064.b3lyp_6-31g(d).inp

055103064.b3lyp_6-31g(d).qchem.inp (generated)

055103064.b3lyp_6-31g(d).gjf (generated)

055103064.b3lyp_6-31g(d).firefly.inp (generated)

055103064.b3lyp_6-31g(d).smash.inp (generated)

055103064.b3lyp_6-31g(d).nwchem.inp (generated) 055103064.b3lyp_6-31g(d).log.xz 055103064.td-b3lyp_6-31g+(d).inp 055103064.td-b3lyp_6-31g+(d).log.xz

055103064.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103064.td-b3lyp_6-31+g(d).gjf (generated)

055103064.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103064.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103064.mol 055103064.PUBCHEM 055103064.mol (via Jmol)
055103065.b3lyp_6-31g(d).inp

055103065.b3lyp_6-31g(d).qchem.inp (generated)

055103065.b3lyp_6-31g(d).gjf (generated)

055103065.b3lyp_6-31g(d).firefly.inp (generated)

055103065.b3lyp_6-31g(d).smash.inp (generated)

055103065.b3lyp_6-31g(d).nwchem.inp (generated) 055103065.b3lyp_6-31g(d).log.xz 055103065.td-b3lyp_6-31g+(d).inp 055103065.td-b3lyp_6-31g+(d).log.xz

055103065.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103065.td-b3lyp_6-31+g(d).gjf (generated)

055103065.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103065.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103065.mol 055103065.PUBCHEM 055103065.mol (via Jmol)
055103073.b3lyp_6-31g(d).inp

055103073.b3lyp_6-31g(d).qchem.inp (generated)

055103073.b3lyp_6-31g(d).gjf (generated)

055103073.b3lyp_6-31g(d).firefly.inp (generated)

055103073.b3lyp_6-31g(d).smash.inp (generated)

055103073.b3lyp_6-31g(d).nwchem.inp (generated) 055103073.b3lyp_6-31g(d).log.xz 055103073.td-b3lyp_6-31g+(d).inp 055103073.td-b3lyp_6-31g+(d).log.xz

055103073.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103073.td-b3lyp_6-31+g(d).gjf (generated)

055103073.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103073.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103073.mol 055103073.PUBCHEM 055103073.mol (via Jmol)
055103085.b3lyp_6-31g(d).inp

055103085.b3lyp_6-31g(d).qchem.inp (generated)

055103085.b3lyp_6-31g(d).gjf (generated)

055103085.b3lyp_6-31g(d).firefly.inp (generated)

055103085.b3lyp_6-31g(d).smash.inp (generated)

055103085.b3lyp_6-31g(d).nwchem.inp (generated) 055103085.b3lyp_6-31g(d).log.xz 055103085.td-b3lyp_6-31g+(d).inp 055103085.td-b3lyp_6-31g+(d).log.xz

055103085.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103085.td-b3lyp_6-31+g(d).gjf (generated)

055103085.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103085.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103085.mol 055103085.PUBCHEM 055103085.mol (via Jmol)
055103100.b3lyp_6-31g(d).inp

055103100.b3lyp_6-31g(d).qchem.inp (generated)

055103100.b3lyp_6-31g(d).gjf (generated)

055103100.b3lyp_6-31g(d).firefly.inp (generated)

055103100.b3lyp_6-31g(d).smash.inp (generated)

055103100.b3lyp_6-31g(d).nwchem.inp (generated) 055103100.b3lyp_6-31g(d).log.xz 055103100.td-b3lyp_6-31g+(d).inp 055103100.td-b3lyp_6-31g+(d).log.xz

055103100.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103100.td-b3lyp_6-31+g(d).gjf (generated)

055103100.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103100.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103100.mol 055103100.PUBCHEM 055103100.mol (via Jmol)
055103102.b3lyp_6-31g(d).inp

055103102.b3lyp_6-31g(d).qchem.inp (generated)

055103102.b3lyp_6-31g(d).gjf (generated)

055103102.b3lyp_6-31g(d).firefly.inp (generated)

055103102.b3lyp_6-31g(d).smash.inp (generated)

055103102.b3lyp_6-31g(d).nwchem.inp (generated) 055103102.b3lyp_6-31g(d).log.xz 055103102.td-b3lyp_6-31g+(d).inp 055103102.td-b3lyp_6-31g+(d).log.xz

055103102.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103102.td-b3lyp_6-31+g(d).gjf (generated)

055103102.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103102.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103102.mol 055103102.PUBCHEM 055103102.mol (via Jmol)
055103105.b3lyp_6-31g(d).inp

055103105.b3lyp_6-31g(d).qchem.inp (generated)

055103105.b3lyp_6-31g(d).gjf (generated)

055103105.b3lyp_6-31g(d).firefly.inp (generated)

055103105.b3lyp_6-31g(d).smash.inp (generated)

055103105.b3lyp_6-31g(d).nwchem.inp (generated) 055103105.b3lyp_6-31g(d).log.xz 055103105.td-b3lyp_6-31g+(d).inp 055103105.td-b3lyp_6-31g+(d).log.xz

055103105.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103105.td-b3lyp_6-31+g(d).gjf (generated)

055103105.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103105.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103105.mol 055103105.PUBCHEM 055103105.mol (via Jmol)
055103112.b3lyp_6-31g(d).inp

055103112.b3lyp_6-31g(d).qchem.inp (generated)

055103112.b3lyp_6-31g(d).gjf (generated)

055103112.b3lyp_6-31g(d).firefly.inp (generated)

055103112.b3lyp_6-31g(d).smash.inp (generated)

055103112.b3lyp_6-31g(d).nwchem.inp (generated) 055103112.b3lyp_6-31g(d).log.xz 055103112.td-b3lyp_6-31g+(d).inp 055103112.td-b3lyp_6-31g+(d).log.xz

055103112.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103112.td-b3lyp_6-31+g(d).gjf (generated)

055103112.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103112.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103112.mol 055103112.PUBCHEM 055103112.mol (via Jmol)
055103116.b3lyp_6-31g(d).inp

055103116.b3lyp_6-31g(d).qchem.inp (generated)

055103116.b3lyp_6-31g(d).gjf (generated)

055103116.b3lyp_6-31g(d).firefly.inp (generated)

055103116.b3lyp_6-31g(d).smash.inp (generated)

055103116.b3lyp_6-31g(d).nwchem.inp (generated) 055103116.b3lyp_6-31g(d).log.xz 055103116.td-b3lyp_6-31g+(d).inp 055103116.td-b3lyp_6-31g+(d).log.xz

055103116.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103116.td-b3lyp_6-31+g(d).gjf (generated)

055103116.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103116.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103116.mol 055103116.PUBCHEM 055103116.mol (via Jmol)
055103117.b3lyp_6-31g(d).inp

055103117.b3lyp_6-31g(d).qchem.inp (generated)

055103117.b3lyp_6-31g(d).gjf (generated)

055103117.b3lyp_6-31g(d).firefly.inp (generated)

055103117.b3lyp_6-31g(d).smash.inp (generated)

055103117.b3lyp_6-31g(d).nwchem.inp (generated) 055103117.b3lyp_6-31g(d).log.xz 055103117.td-b3lyp_6-31g+(d).inp 055103117.td-b3lyp_6-31g+(d).log.xz

055103117.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103117.td-b3lyp_6-31+g(d).gjf (generated)

055103117.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103117.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103117.mol 055103117.PUBCHEM 055103117.mol (via Jmol)
055103118.b3lyp_6-31g(d).inp

055103118.b3lyp_6-31g(d).qchem.inp (generated)

055103118.b3lyp_6-31g(d).gjf (generated)

055103118.b3lyp_6-31g(d).firefly.inp (generated)

055103118.b3lyp_6-31g(d).smash.inp (generated)

055103118.b3lyp_6-31g(d).nwchem.inp (generated) 055103118.b3lyp_6-31g(d).log.xz 055103118.td-b3lyp_6-31g+(d).inp 055103118.td-b3lyp_6-31g+(d).log.xz

055103118.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103118.td-b3lyp_6-31+g(d).gjf (generated)

055103118.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103118.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103118.mol 055103118.PUBCHEM 055103118.mol (via Jmol)
055103121.b3lyp_6-31g(d).inp

055103121.b3lyp_6-31g(d).qchem.inp (generated)

055103121.b3lyp_6-31g(d).gjf (generated)

055103121.b3lyp_6-31g(d).firefly.inp (generated)

055103121.b3lyp_6-31g(d).smash.inp (generated)

055103121.b3lyp_6-31g(d).nwchem.inp (generated) 055103121.b3lyp_6-31g(d).log.xz 055103121.td-b3lyp_6-31g+(d).inp 055103121.td-b3lyp_6-31g+(d).log.xz

055103121.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103121.td-b3lyp_6-31+g(d).gjf (generated)

055103121.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103121.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103121.mol 055103121.PUBCHEM 055103121.mol (via Jmol)
055103126.b3lyp_6-31g(d).inp

055103126.b3lyp_6-31g(d).qchem.inp (generated)

055103126.b3lyp_6-31g(d).gjf (generated)

055103126.b3lyp_6-31g(d).firefly.inp (generated)

055103126.b3lyp_6-31g(d).smash.inp (generated)

055103126.b3lyp_6-31g(d).nwchem.inp (generated) 055103126.b3lyp_6-31g(d).log.xz 055103126.td-b3lyp_6-31g+(d).inp 055103126.td-b3lyp_6-31g+(d).log.xz

055103126.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103126.td-b3lyp_6-31+g(d).gjf (generated)

055103126.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103126.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103126.mol 055103126.PUBCHEM 055103126.mol (via Jmol)
055103131.b3lyp_6-31g(d).inp

055103131.b3lyp_6-31g(d).qchem.inp (generated)

055103131.b3lyp_6-31g(d).gjf (generated)

055103131.b3lyp_6-31g(d).firefly.inp (generated)

055103131.b3lyp_6-31g(d).smash.inp (generated)

055103131.b3lyp_6-31g(d).nwchem.inp (generated) 055103131.b3lyp_6-31g(d).log.xz 055103131.td-b3lyp_6-31g+(d).inp 055103131.td-b3lyp_6-31g+(d).log.xz

055103131.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103131.td-b3lyp_6-31+g(d).gjf (generated)

055103131.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103131.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103131.mol 055103131.PUBCHEM 055103131.mol (via Jmol)
055103136.b3lyp_6-31g(d).inp

055103136.b3lyp_6-31g(d).qchem.inp (generated)

055103136.b3lyp_6-31g(d).gjf (generated)

055103136.b3lyp_6-31g(d).firefly.inp (generated)

055103136.b3lyp_6-31g(d).smash.inp (generated)

055103136.b3lyp_6-31g(d).nwchem.inp (generated) 055103136.b3lyp_6-31g(d).log.xz 055103136.td-b3lyp_6-31g+(d).inp 055103136.td-b3lyp_6-31g+(d).log.xz

055103136.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103136.td-b3lyp_6-31+g(d).gjf (generated)

055103136.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103136.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103136.mol 055103136.PUBCHEM 055103136.mol (via Jmol)
055103146.b3lyp_6-31g(d).inp

055103146.b3lyp_6-31g(d).qchem.inp (generated)

055103146.b3lyp_6-31g(d).gjf (generated)

055103146.b3lyp_6-31g(d).firefly.inp (generated)

055103146.b3lyp_6-31g(d).smash.inp (generated)

055103146.b3lyp_6-31g(d).nwchem.inp (generated) 055103146.b3lyp_6-31g(d).log.xz 055103146.td-b3lyp_6-31g+(d).inp 055103146.td-b3lyp_6-31g+(d).log.xz

055103146.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103146.td-b3lyp_6-31+g(d).gjf (generated)

055103146.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103146.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103146.mol 055103146.PUBCHEM 055103146.mol (via Jmol)
055103148.b3lyp_6-31g(d).inp

055103148.b3lyp_6-31g(d).qchem.inp (generated)

055103148.b3lyp_6-31g(d).gjf (generated)

055103148.b3lyp_6-31g(d).firefly.inp (generated)

055103148.b3lyp_6-31g(d).smash.inp (generated)

055103148.b3lyp_6-31g(d).nwchem.inp (generated) 055103148.b3lyp_6-31g(d).log.xz 055103148.td-b3lyp_6-31g+(d).inp 055103148.td-b3lyp_6-31g+(d).log.xz

055103148.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103148.td-b3lyp_6-31+g(d).gjf (generated)

055103148.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103148.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103148.mol 055103148.PUBCHEM 055103148.mol (via Jmol)
055103149.b3lyp_6-31g(d).inp

055103149.b3lyp_6-31g(d).qchem.inp (generated)

055103149.b3lyp_6-31g(d).gjf (generated)

055103149.b3lyp_6-31g(d).firefly.inp (generated)

055103149.b3lyp_6-31g(d).smash.inp (generated)

055103149.b3lyp_6-31g(d).nwchem.inp (generated) 055103149.b3lyp_6-31g(d).log.xz 055103149.td-b3lyp_6-31g+(d).inp 055103149.td-b3lyp_6-31g+(d).log.xz

055103149.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103149.td-b3lyp_6-31+g(d).gjf (generated)

055103149.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103149.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103149.mol 055103149.PUBCHEM 055103149.mol (via Jmol)
055103150.b3lyp_6-31g(d).inp

055103150.b3lyp_6-31g(d).qchem.inp (generated)

055103150.b3lyp_6-31g(d).gjf (generated)

055103150.b3lyp_6-31g(d).firefly.inp (generated)

055103150.b3lyp_6-31g(d).smash.inp (generated)

055103150.b3lyp_6-31g(d).nwchem.inp (generated) 055103150.b3lyp_6-31g(d).log.xz 055103150.td-b3lyp_6-31g+(d).inp 055103150.td-b3lyp_6-31g+(d).log.xz

055103150.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103150.td-b3lyp_6-31+g(d).gjf (generated)

055103150.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103150.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103150.mol 055103150.PUBCHEM 055103150.mol (via Jmol)
055103153.b3lyp_6-31g(d).inp

055103153.b3lyp_6-31g(d).qchem.inp (generated)

055103153.b3lyp_6-31g(d).gjf (generated)

055103153.b3lyp_6-31g(d).firefly.inp (generated)

055103153.b3lyp_6-31g(d).smash.inp (generated)

055103153.b3lyp_6-31g(d).nwchem.inp (generated) 055103153.b3lyp_6-31g(d).log.xz 055103153.td-b3lyp_6-31g+(d).inp 055103153.td-b3lyp_6-31g+(d).log.xz

055103153.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103153.td-b3lyp_6-31+g(d).gjf (generated)

055103153.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103153.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103153.mol 055103153.PUBCHEM 055103153.mol (via Jmol)
055103161.b3lyp_6-31g(d).inp

055103161.b3lyp_6-31g(d).qchem.inp (generated)

055103161.b3lyp_6-31g(d).gjf (generated)

055103161.b3lyp_6-31g(d).firefly.inp (generated)

055103161.b3lyp_6-31g(d).smash.inp (generated)

055103161.b3lyp_6-31g(d).nwchem.inp (generated) 055103161.b3lyp_6-31g(d).log.xz 055103161.td-b3lyp_6-31g+(d).inp 055103161.td-b3lyp_6-31g+(d).log.xz

055103161.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103161.td-b3lyp_6-31+g(d).gjf (generated)

055103161.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103161.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103161.mol 055103161.PUBCHEM 055103161.mol (via Jmol)
055103164.b3lyp_6-31g(d).inp

055103164.b3lyp_6-31g(d).qchem.inp (generated)

055103164.b3lyp_6-31g(d).gjf (generated)

055103164.b3lyp_6-31g(d).firefly.inp (generated)

055103164.b3lyp_6-31g(d).smash.inp (generated)

055103164.b3lyp_6-31g(d).nwchem.inp (generated) 055103164.b3lyp_6-31g(d).log.xz 055103164.td-b3lyp_6-31g+(d).inp 055103164.td-b3lyp_6-31g+(d).log.xz

055103164.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103164.td-b3lyp_6-31+g(d).gjf (generated)

055103164.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103164.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103164.mol 055103164.PUBCHEM 055103164.mol (via Jmol)
055103169.b3lyp_6-31g(d).inp

055103169.b3lyp_6-31g(d).qchem.inp (generated)

055103169.b3lyp_6-31g(d).gjf (generated)

055103169.b3lyp_6-31g(d).firefly.inp (generated)

055103169.b3lyp_6-31g(d).smash.inp (generated)

055103169.b3lyp_6-31g(d).nwchem.inp (generated) 055103169.b3lyp_6-31g(d).log.xz 055103169.td-b3lyp_6-31g+(d).inp 055103169.td-b3lyp_6-31g+(d).log.xz

055103169.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103169.td-b3lyp_6-31+g(d).gjf (generated)

055103169.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103169.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103169.mol 055103169.PUBCHEM 055103169.mol (via Jmol)
055103178.b3lyp_6-31g(d).inp

055103178.b3lyp_6-31g(d).qchem.inp (generated)

055103178.b3lyp_6-31g(d).gjf (generated)

055103178.b3lyp_6-31g(d).firefly.inp (generated)

055103178.b3lyp_6-31g(d).smash.inp (generated)

055103178.b3lyp_6-31g(d).nwchem.inp (generated) 055103178.b3lyp_6-31g(d).log.xz 055103178.td-b3lyp_6-31g+(d).inp 055103178.td-b3lyp_6-31g+(d).log.xz

055103178.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103178.td-b3lyp_6-31+g(d).gjf (generated)

055103178.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103178.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103178.mol 055103178.PUBCHEM 055103178.mol (via Jmol)
055103179.b3lyp_6-31g(d).inp

055103179.b3lyp_6-31g(d).qchem.inp (generated)

055103179.b3lyp_6-31g(d).gjf (generated)

055103179.b3lyp_6-31g(d).firefly.inp (generated)

055103179.b3lyp_6-31g(d).smash.inp (generated)

055103179.b3lyp_6-31g(d).nwchem.inp (generated) 055103179.b3lyp_6-31g(d).log.xz 055103179.td-b3lyp_6-31g+(d).inp 055103179.td-b3lyp_6-31g+(d).log.xz

055103179.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103179.td-b3lyp_6-31+g(d).gjf (generated)

055103179.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103179.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103179.mol 055103179.PUBCHEM 055103179.mol (via Jmol)
055103200.b3lyp_6-31g(d).inp

055103200.b3lyp_6-31g(d).qchem.inp (generated)

055103200.b3lyp_6-31g(d).gjf (generated)

055103200.b3lyp_6-31g(d).firefly.inp (generated)

055103200.b3lyp_6-31g(d).smash.inp (generated)

055103200.b3lyp_6-31g(d).nwchem.inp (generated) 055103200.b3lyp_6-31g(d).log.xz 055103200.td-b3lyp_6-31g+(d).inp 055103200.td-b3lyp_6-31g+(d).log.xz

055103200.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103200.td-b3lyp_6-31+g(d).gjf (generated)

055103200.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103200.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103200.mol 055103200.PUBCHEM 055103200.mol (via Jmol)
055103207.b3lyp_6-31g(d).inp

055103207.b3lyp_6-31g(d).qchem.inp (generated)

055103207.b3lyp_6-31g(d).gjf (generated)

055103207.b3lyp_6-31g(d).firefly.inp (generated)

055103207.b3lyp_6-31g(d).smash.inp (generated)

055103207.b3lyp_6-31g(d).nwchem.inp (generated) 055103207.b3lyp_6-31g(d).log.xz 055103207.td-b3lyp_6-31g+(d).inp 055103207.td-b3lyp_6-31g+(d).log.xz

055103207.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103207.td-b3lyp_6-31+g(d).gjf (generated)

055103207.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103207.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103207.mol 055103207.PUBCHEM 055103207.mol (via Jmol)
055103215.b3lyp_6-31g(d).inp

055103215.b3lyp_6-31g(d).qchem.inp (generated)

055103215.b3lyp_6-31g(d).gjf (generated)

055103215.b3lyp_6-31g(d).firefly.inp (generated)

055103215.b3lyp_6-31g(d).smash.inp (generated)

055103215.b3lyp_6-31g(d).nwchem.inp (generated) 055103215.b3lyp_6-31g(d).log.xz 055103215.td-b3lyp_6-31g+(d).inp 055103215.td-b3lyp_6-31g+(d).log.xz

055103215.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103215.td-b3lyp_6-31+g(d).gjf (generated)

055103215.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103215.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103215.mol 055103215.PUBCHEM 055103215.mol (via Jmol)
055103216.b3lyp_6-31g(d).inp

055103216.b3lyp_6-31g(d).qchem.inp (generated)

055103216.b3lyp_6-31g(d).gjf (generated)

055103216.b3lyp_6-31g(d).firefly.inp (generated)

055103216.b3lyp_6-31g(d).smash.inp (generated)

055103216.b3lyp_6-31g(d).nwchem.inp (generated) 055103216.b3lyp_6-31g(d).log.xz 055103216.td-b3lyp_6-31g+(d).inp 055103216.td-b3lyp_6-31g+(d).log.xz

055103216.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103216.td-b3lyp_6-31+g(d).gjf (generated)

055103216.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103216.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103216.mol 055103216.PUBCHEM 055103216.mol (via Jmol)
055103220.b3lyp_6-31g(d).inp

055103220.b3lyp_6-31g(d).qchem.inp (generated)

055103220.b3lyp_6-31g(d).gjf (generated)

055103220.b3lyp_6-31g(d).firefly.inp (generated)

055103220.b3lyp_6-31g(d).smash.inp (generated)

055103220.b3lyp_6-31g(d).nwchem.inp (generated) 055103220.b3lyp_6-31g(d).log.xz 055103220.td-b3lyp_6-31g+(d).inp 055103220.td-b3lyp_6-31g+(d).log.xz

055103220.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103220.td-b3lyp_6-31+g(d).gjf (generated)

055103220.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103220.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103220.mol 055103220.PUBCHEM 055103220.mol (via Jmol)
055103228.b3lyp_6-31g(d).inp

055103228.b3lyp_6-31g(d).qchem.inp (generated)

055103228.b3lyp_6-31g(d).gjf (generated)

055103228.b3lyp_6-31g(d).firefly.inp (generated)

055103228.b3lyp_6-31g(d).smash.inp (generated)

055103228.b3lyp_6-31g(d).nwchem.inp (generated) 055103228.b3lyp_6-31g(d).log.xz 055103228.td-b3lyp_6-31g+(d).inp 055103228.td-b3lyp_6-31g+(d).log.xz

055103228.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103228.td-b3lyp_6-31+g(d).gjf (generated)

055103228.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103228.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103228.mol 055103228.PUBCHEM 055103228.mol (via Jmol)
055103242.b3lyp_6-31g(d).inp

055103242.b3lyp_6-31g(d).qchem.inp (generated)

055103242.b3lyp_6-31g(d).gjf (generated)

055103242.b3lyp_6-31g(d).firefly.inp (generated)

055103242.b3lyp_6-31g(d).smash.inp (generated)

055103242.b3lyp_6-31g(d).nwchem.inp (generated) 055103242.b3lyp_6-31g(d).log.xz 055103242.td-b3lyp_6-31g+(d).inp 055103242.td-b3lyp_6-31g+(d).log.xz

055103242.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103242.td-b3lyp_6-31+g(d).gjf (generated)

055103242.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103242.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103242.mol 055103242.PUBCHEM 055103242.mol (via Jmol)
055103243.b3lyp_6-31g(d).inp

055103243.b3lyp_6-31g(d).qchem.inp (generated)

055103243.b3lyp_6-31g(d).gjf (generated)

055103243.b3lyp_6-31g(d).firefly.inp (generated)

055103243.b3lyp_6-31g(d).smash.inp (generated)

055103243.b3lyp_6-31g(d).nwchem.inp (generated) 055103243.b3lyp_6-31g(d).log.xz 055103243.td-b3lyp_6-31g+(d).inp 055103243.td-b3lyp_6-31g+(d).log.xz

055103243.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103243.td-b3lyp_6-31+g(d).gjf (generated)

055103243.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103243.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103243.mol 055103243.PUBCHEM 055103243.mol (via Jmol)
055103244.b3lyp_6-31g(d).inp

055103244.b3lyp_6-31g(d).qchem.inp (generated)

055103244.b3lyp_6-31g(d).gjf (generated)

055103244.b3lyp_6-31g(d).firefly.inp (generated)

055103244.b3lyp_6-31g(d).smash.inp (generated)

055103244.b3lyp_6-31g(d).nwchem.inp (generated) 055103244.b3lyp_6-31g(d).log.xz 055103244.td-b3lyp_6-31g+(d).inp 055103244.td-b3lyp_6-31g+(d).log.xz

055103244.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103244.td-b3lyp_6-31+g(d).gjf (generated)

055103244.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103244.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103244.mol 055103244.PUBCHEM 055103244.mol (via Jmol)
055103252.b3lyp_6-31g(d).inp

055103252.b3lyp_6-31g(d).qchem.inp (generated)

055103252.b3lyp_6-31g(d).gjf (generated)

055103252.b3lyp_6-31g(d).firefly.inp (generated)

055103252.b3lyp_6-31g(d).smash.inp (generated)

055103252.b3lyp_6-31g(d).nwchem.inp (generated) 055103252.b3lyp_6-31g(d).log.xz 055103252.td-b3lyp_6-31g+(d).inp 055103252.td-b3lyp_6-31g+(d).log.xz

055103252.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103252.td-b3lyp_6-31+g(d).gjf (generated)

055103252.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103252.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103252.mol 055103252.PUBCHEM 055103252.mol (via Jmol)
055103255.b3lyp_6-31g(d).inp

055103255.b3lyp_6-31g(d).qchem.inp (generated)

055103255.b3lyp_6-31g(d).gjf (generated)

055103255.b3lyp_6-31g(d).firefly.inp (generated)

055103255.b3lyp_6-31g(d).smash.inp (generated)

055103255.b3lyp_6-31g(d).nwchem.inp (generated) 055103255.b3lyp_6-31g(d).log.xz 055103255.mol 055103255.PUBCHEM 055103255.mol (via Jmol)
055103265.b3lyp_6-31g(d).inp

055103265.b3lyp_6-31g(d).qchem.inp (generated)

055103265.b3lyp_6-31g(d).gjf (generated)

055103265.b3lyp_6-31g(d).firefly.inp (generated)

055103265.b3lyp_6-31g(d).smash.inp (generated)

055103265.b3lyp_6-31g(d).nwchem.inp (generated) 055103265.b3lyp_6-31g(d).log.xz 055103265.td-b3lyp_6-31g+(d).inp 055103265.td-b3lyp_6-31g+(d).log.xz

055103265.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103265.td-b3lyp_6-31+g(d).gjf (generated)

055103265.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103265.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103265.mol 055103265.PUBCHEM 055103265.mol (via Jmol)
055103268.b3lyp_6-31g(d).inp

055103268.b3lyp_6-31g(d).qchem.inp (generated)

055103268.b3lyp_6-31g(d).gjf (generated)

055103268.b3lyp_6-31g(d).firefly.inp (generated)

055103268.b3lyp_6-31g(d).smash.inp (generated)

055103268.b3lyp_6-31g(d).nwchem.inp (generated) 055103268.b3lyp_6-31g(d).log.xz 055103268.td-b3lyp_6-31g+(d).inp 055103268.td-b3lyp_6-31g+(d).log.xz

055103268.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103268.td-b3lyp_6-31+g(d).gjf (generated)

055103268.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103268.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103268.mol 055103268.PUBCHEM 055103268.mol (via Jmol)
055103270.b3lyp_6-31g(d).inp

055103270.b3lyp_6-31g(d).qchem.inp (generated)

055103270.b3lyp_6-31g(d).gjf (generated)

055103270.b3lyp_6-31g(d).firefly.inp (generated)

055103270.b3lyp_6-31g(d).smash.inp (generated)

055103270.b3lyp_6-31g(d).nwchem.inp (generated) 055103270.b3lyp_6-31g(d).log.xz 055103270.td-b3lyp_6-31g+(d).inp 055103270.td-b3lyp_6-31g+(d).log.xz

055103270.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103270.td-b3lyp_6-31+g(d).gjf (generated)

055103270.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103270.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103270.mol 055103270.PUBCHEM 055103270.mol (via Jmol)
055103291.b3lyp_6-31g(d).inp

055103291.b3lyp_6-31g(d).qchem.inp (generated)

055103291.b3lyp_6-31g(d).gjf (generated)

055103291.b3lyp_6-31g(d).firefly.inp (generated)

055103291.b3lyp_6-31g(d).smash.inp (generated)

055103291.b3lyp_6-31g(d).nwchem.inp (generated) 055103291.b3lyp_6-31g(d).log.xz 055103291.td-b3lyp_6-31g+(d).inp 055103291.td-b3lyp_6-31g+(d).log.xz

055103291.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103291.td-b3lyp_6-31+g(d).gjf (generated)

055103291.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103291.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103291.mol 055103291.PUBCHEM 055103291.mol (via Jmol)
055103296.b3lyp_6-31g(d).inp

055103296.b3lyp_6-31g(d).qchem.inp (generated)

055103296.b3lyp_6-31g(d).gjf (generated)

055103296.b3lyp_6-31g(d).firefly.inp (generated)

055103296.b3lyp_6-31g(d).smash.inp (generated)

055103296.b3lyp_6-31g(d).nwchem.inp (generated) 055103296.b3lyp_6-31g(d).log.xz 055103296.td-b3lyp_6-31g+(d).inp 055103296.td-b3lyp_6-31g+(d).log.xz

055103296.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103296.td-b3lyp_6-31+g(d).gjf (generated)

055103296.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103296.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103296.mol 055103296.PUBCHEM 055103296.mol (via Jmol)
055103297.b3lyp_6-31g(d).inp

055103297.b3lyp_6-31g(d).qchem.inp (generated)

055103297.b3lyp_6-31g(d).gjf (generated)

055103297.b3lyp_6-31g(d).firefly.inp (generated)

055103297.b3lyp_6-31g(d).smash.inp (generated)

055103297.b3lyp_6-31g(d).nwchem.inp (generated) 055103297.b3lyp_6-31g(d).log.xz 055103297.td-b3lyp_6-31g+(d).inp 055103297.td-b3lyp_6-31g+(d).log.xz

055103297.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103297.td-b3lyp_6-31+g(d).gjf (generated)

055103297.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103297.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103297.mol 055103297.PUBCHEM 055103297.mol (via Jmol)
055103299.b3lyp_6-31g(d).inp

055103299.b3lyp_6-31g(d).qchem.inp (generated)

055103299.b3lyp_6-31g(d).gjf (generated)

055103299.b3lyp_6-31g(d).firefly.inp (generated)

055103299.b3lyp_6-31g(d).smash.inp (generated)

055103299.b3lyp_6-31g(d).nwchem.inp (generated) 055103299.b3lyp_6-31g(d).log.xz 055103299.td-b3lyp_6-31g+(d).inp 055103299.td-b3lyp_6-31g+(d).log.xz

055103299.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103299.td-b3lyp_6-31+g(d).gjf (generated)

055103299.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103299.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103299.mol 055103299.PUBCHEM 055103299.mol (via Jmol)
055103300.b3lyp_6-31g(d).inp

055103300.b3lyp_6-31g(d).qchem.inp (generated)

055103300.b3lyp_6-31g(d).gjf (generated)

055103300.b3lyp_6-31g(d).firefly.inp (generated)

055103300.b3lyp_6-31g(d).smash.inp (generated)

055103300.b3lyp_6-31g(d).nwchem.inp (generated) 055103300.b3lyp_6-31g(d).log.xz 055103300.td-b3lyp_6-31g+(d).inp 055103300.td-b3lyp_6-31g+(d).log.xz

055103300.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103300.td-b3lyp_6-31+g(d).gjf (generated)

055103300.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103300.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103300.mol 055103300.PUBCHEM 055103300.mol (via Jmol)
055103301.b3lyp_6-31g(d).inp

055103301.b3lyp_6-31g(d).qchem.inp (generated)

055103301.b3lyp_6-31g(d).gjf (generated)

055103301.b3lyp_6-31g(d).firefly.inp (generated)

055103301.b3lyp_6-31g(d).smash.inp (generated)

055103301.b3lyp_6-31g(d).nwchem.inp (generated) 055103301.b3lyp_6-31g(d).log.xz 055103301.td-b3lyp_6-31g+(d).inp 055103301.td-b3lyp_6-31g+(d).log.xz

055103301.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103301.td-b3lyp_6-31+g(d).gjf (generated)

055103301.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103301.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103301.mol 055103301.PUBCHEM 055103301.mol (via Jmol)
055103304.b3lyp_6-31g(d).inp

055103304.b3lyp_6-31g(d).qchem.inp (generated)

055103304.b3lyp_6-31g(d).gjf (generated)

055103304.b3lyp_6-31g(d).firefly.inp (generated)

055103304.b3lyp_6-31g(d).smash.inp (generated)

055103304.b3lyp_6-31g(d).nwchem.inp (generated) 055103304.b3lyp_6-31g(d).log.xz 055103304.td-b3lyp_6-31g+(d).inp 055103304.td-b3lyp_6-31g+(d).log.xz

055103304.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103304.td-b3lyp_6-31+g(d).gjf (generated)

055103304.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103304.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103304.mol 055103304.PUBCHEM 055103304.mol (via Jmol)
055103337.b3lyp_6-31g(d).inp

055103337.b3lyp_6-31g(d).qchem.inp (generated)

055103337.b3lyp_6-31g(d).gjf (generated)

055103337.b3lyp_6-31g(d).firefly.inp (generated)

055103337.b3lyp_6-31g(d).smash.inp (generated)

055103337.b3lyp_6-31g(d).nwchem.inp (generated) 055103337.b3lyp_6-31g(d).log.xz 055103337.td-b3lyp_6-31g+(d).inp 055103337.td-b3lyp_6-31g+(d).log.xz

055103337.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103337.td-b3lyp_6-31+g(d).gjf (generated)

055103337.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103337.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103337.mol 055103337.PUBCHEM 055103337.mol (via Jmol)
055103338.b3lyp_6-31g(d).inp

055103338.b3lyp_6-31g(d).qchem.inp (generated)

055103338.b3lyp_6-31g(d).gjf (generated)

055103338.b3lyp_6-31g(d).firefly.inp (generated)

055103338.b3lyp_6-31g(d).smash.inp (generated)

055103338.b3lyp_6-31g(d).nwchem.inp (generated) 055103338.b3lyp_6-31g(d).log.xz 055103338.td-b3lyp_6-31g+(d).inp 055103338.td-b3lyp_6-31g+(d).log.xz

055103338.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103338.td-b3lyp_6-31+g(d).gjf (generated)

055103338.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103338.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103338.mol 055103338.PUBCHEM 055103338.mol (via Jmol)
055103342.b3lyp_6-31g(d).inp

055103342.b3lyp_6-31g(d).qchem.inp (generated)

055103342.b3lyp_6-31g(d).gjf (generated)

055103342.b3lyp_6-31g(d).firefly.inp (generated)

055103342.b3lyp_6-31g(d).smash.inp (generated)

055103342.b3lyp_6-31g(d).nwchem.inp (generated) 055103342.b3lyp_6-31g(d).log.xz 055103342.td-b3lyp_6-31g+(d).inp 055103342.td-b3lyp_6-31g+(d).log.xz

055103342.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103342.td-b3lyp_6-31+g(d).gjf (generated)

055103342.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103342.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103342.mol 055103342.PUBCHEM 055103342.mol (via Jmol)
055103349.b3lyp_6-31g(d).inp

055103349.b3lyp_6-31g(d).qchem.inp (generated)

055103349.b3lyp_6-31g(d).gjf (generated)

055103349.b3lyp_6-31g(d).firefly.inp (generated)

055103349.b3lyp_6-31g(d).smash.inp (generated)

055103349.b3lyp_6-31g(d).nwchem.inp (generated) 055103349.b3lyp_6-31g(d).log.xz 055103349.td-b3lyp_6-31g+(d).inp 055103349.td-b3lyp_6-31g+(d).log.xz

055103349.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103349.td-b3lyp_6-31+g(d).gjf (generated)

055103349.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103349.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103349.mol 055103349.PUBCHEM 055103349.mol (via Jmol)
055103351.b3lyp_6-31g(d).inp

055103351.b3lyp_6-31g(d).qchem.inp (generated)

055103351.b3lyp_6-31g(d).gjf (generated)

055103351.b3lyp_6-31g(d).firefly.inp (generated)

055103351.b3lyp_6-31g(d).smash.inp (generated)

055103351.b3lyp_6-31g(d).nwchem.inp (generated) 055103351.b3lyp_6-31g(d).log.xz 055103351.td-b3lyp_6-31g+(d).inp 055103351.td-b3lyp_6-31g+(d).log.xz

055103351.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103351.td-b3lyp_6-31+g(d).gjf (generated)

055103351.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103351.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103351.mol 055103351.PUBCHEM 055103351.mol (via Jmol)
055103357.b3lyp_6-31g(d).inp

055103357.b3lyp_6-31g(d).qchem.inp (generated)

055103357.b3lyp_6-31g(d).gjf (generated)

055103357.b3lyp_6-31g(d).firefly.inp (generated)

055103357.b3lyp_6-31g(d).smash.inp (generated)

055103357.b3lyp_6-31g(d).nwchem.inp (generated) 055103357.b3lyp_6-31g(d).log.xz 055103357.td-b3lyp_6-31g+(d).inp 055103357.td-b3lyp_6-31g+(d).log.xz

055103357.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103357.td-b3lyp_6-31+g(d).gjf (generated)

055103357.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103357.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103357.mol 055103357.PUBCHEM 055103357.mol (via Jmol)
055103359.b3lyp_6-31g(d).inp

055103359.b3lyp_6-31g(d).qchem.inp (generated)

055103359.b3lyp_6-31g(d).gjf (generated)

055103359.b3lyp_6-31g(d).firefly.inp (generated)

055103359.b3lyp_6-31g(d).smash.inp (generated)

055103359.b3lyp_6-31g(d).nwchem.inp (generated) 055103359.b3lyp_6-31g(d).log.xz 055103359.td-b3lyp_6-31g+(d).inp 055103359.td-b3lyp_6-31g+(d).log.xz

055103359.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103359.td-b3lyp_6-31+g(d).gjf (generated)

055103359.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103359.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103359.mol 055103359.PUBCHEM 055103359.mol (via Jmol)
055103362.b3lyp_6-31g(d).inp

055103362.b3lyp_6-31g(d).qchem.inp (generated)

055103362.b3lyp_6-31g(d).gjf (generated)

055103362.b3lyp_6-31g(d).firefly.inp (generated)

055103362.b3lyp_6-31g(d).smash.inp (generated)

055103362.b3lyp_6-31g(d).nwchem.inp (generated) 055103362.b3lyp_6-31g(d).log.xz 055103362.td-b3lyp_6-31g+(d).inp 055103362.td-b3lyp_6-31g+(d).log.xz

055103362.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103362.td-b3lyp_6-31+g(d).gjf (generated)

055103362.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103362.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103362.mol 055103362.PUBCHEM 055103362.mol (via Jmol)
055103375.b3lyp_6-31g(d).inp

055103375.b3lyp_6-31g(d).qchem.inp (generated)

055103375.b3lyp_6-31g(d).gjf (generated)

055103375.b3lyp_6-31g(d).firefly.inp (generated)

055103375.b3lyp_6-31g(d).smash.inp (generated)

055103375.b3lyp_6-31g(d).nwchem.inp (generated) 055103375.b3lyp_6-31g(d).log.xz 055103375.td-b3lyp_6-31g+(d).inp 055103375.td-b3lyp_6-31g+(d).log.xz

055103375.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103375.td-b3lyp_6-31+g(d).gjf (generated)

055103375.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103375.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103375.mol 055103375.PUBCHEM 055103375.mol (via Jmol)
055103386.b3lyp_6-31g(d).inp

055103386.b3lyp_6-31g(d).qchem.inp (generated)

055103386.b3lyp_6-31g(d).gjf (generated)

055103386.b3lyp_6-31g(d).firefly.inp (generated)

055103386.b3lyp_6-31g(d).smash.inp (generated)

055103386.b3lyp_6-31g(d).nwchem.inp (generated) 055103386.b3lyp_6-31g(d).log.xz 055103386.td-b3lyp_6-31g+(d).inp 055103386.td-b3lyp_6-31g+(d).log.xz

055103386.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103386.td-b3lyp_6-31+g(d).gjf (generated)

055103386.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103386.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103386.mol 055103386.PUBCHEM 055103386.mol (via Jmol)
055103387.b3lyp_6-31g(d).inp

055103387.b3lyp_6-31g(d).qchem.inp (generated)

055103387.b3lyp_6-31g(d).gjf (generated)

055103387.b3lyp_6-31g(d).firefly.inp (generated)

055103387.b3lyp_6-31g(d).smash.inp (generated)

055103387.b3lyp_6-31g(d).nwchem.inp (generated) 055103387.b3lyp_6-31g(d).log.xz 055103387.td-b3lyp_6-31g+(d).inp 055103387.td-b3lyp_6-31g+(d).log.xz

055103387.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103387.td-b3lyp_6-31+g(d).gjf (generated)

055103387.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103387.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103387.mol 055103387.PUBCHEM 055103387.mol (via Jmol)
055103392.b3lyp_6-31g(d).inp

055103392.b3lyp_6-31g(d).qchem.inp (generated)

055103392.b3lyp_6-31g(d).gjf (generated)

055103392.b3lyp_6-31g(d).firefly.inp (generated)

055103392.b3lyp_6-31g(d).smash.inp (generated)

055103392.b3lyp_6-31g(d).nwchem.inp (generated) 055103392.b3lyp_6-31g(d).log.xz 055103392.td-b3lyp_6-31g+(d).inp 055103392.td-b3lyp_6-31g+(d).log.xz

055103392.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103392.td-b3lyp_6-31+g(d).gjf (generated)

055103392.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103392.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103392.mol 055103392.PUBCHEM 055103392.mol (via Jmol)
055103414.b3lyp_6-31g(d).inp

055103414.b3lyp_6-31g(d).qchem.inp (generated)

055103414.b3lyp_6-31g(d).gjf (generated)

055103414.b3lyp_6-31g(d).firefly.inp (generated)

055103414.b3lyp_6-31g(d).smash.inp (generated)

055103414.b3lyp_6-31g(d).nwchem.inp (generated) 055103414.b3lyp_6-31g(d).log.xz 055103414.td-b3lyp_6-31g+(d).inp 055103414.td-b3lyp_6-31g+(d).log.xz

055103414.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103414.td-b3lyp_6-31+g(d).gjf (generated)

055103414.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103414.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103414.mol 055103414.PUBCHEM 055103414.mol (via Jmol)
055103417.b3lyp_6-31g(d).inp

055103417.b3lyp_6-31g(d).qchem.inp (generated)

055103417.b3lyp_6-31g(d).gjf (generated)

055103417.b3lyp_6-31g(d).firefly.inp (generated)

055103417.b3lyp_6-31g(d).smash.inp (generated)

055103417.b3lyp_6-31g(d).nwchem.inp (generated) 055103417.b3lyp_6-31g(d).log.xz 055103417.td-b3lyp_6-31g+(d).inp 055103417.td-b3lyp_6-31g+(d).log.xz

055103417.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103417.td-b3lyp_6-31+g(d).gjf (generated)

055103417.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103417.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103417.mol 055103417.PUBCHEM 055103417.mol (via Jmol)
055103433.b3lyp_6-31g(d).inp

055103433.b3lyp_6-31g(d).qchem.inp (generated)

055103433.b3lyp_6-31g(d).gjf (generated)

055103433.b3lyp_6-31g(d).firefly.inp (generated)

055103433.b3lyp_6-31g(d).smash.inp (generated)

055103433.b3lyp_6-31g(d).nwchem.inp (generated) 055103433.b3lyp_6-31g(d).log.xz 055103433.td-b3lyp_6-31g+(d).inp 055103433.td-b3lyp_6-31g+(d).log.xz

055103433.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103433.td-b3lyp_6-31+g(d).gjf (generated)

055103433.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103433.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103433.mol 055103433.PUBCHEM 055103433.mol (via Jmol)
055103435.b3lyp_6-31g(d).inp

055103435.b3lyp_6-31g(d).qchem.inp (generated)

055103435.b3lyp_6-31g(d).gjf (generated)

055103435.b3lyp_6-31g(d).firefly.inp (generated)

055103435.b3lyp_6-31g(d).smash.inp (generated)

055103435.b3lyp_6-31g(d).nwchem.inp (generated) 055103435.b3lyp_6-31g(d).log.xz 055103435.td-b3lyp_6-31g+(d).inp 055103435.td-b3lyp_6-31g+(d).log.xz

055103435.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103435.td-b3lyp_6-31+g(d).gjf (generated)

055103435.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103435.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103435.mol 055103435.PUBCHEM 055103435.mol (via Jmol)
055103441.b3lyp_6-31g(d).inp

055103441.b3lyp_6-31g(d).qchem.inp (generated)

055103441.b3lyp_6-31g(d).gjf (generated)

055103441.b3lyp_6-31g(d).firefly.inp (generated)

055103441.b3lyp_6-31g(d).smash.inp (generated)

055103441.b3lyp_6-31g(d).nwchem.inp (generated) 055103441.b3lyp_6-31g(d).log.xz 055103441.td-b3lyp_6-31g+(d).inp 055103441.td-b3lyp_6-31g+(d).log.xz

055103441.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103441.td-b3lyp_6-31+g(d).gjf (generated)

055103441.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103441.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103441.mol 055103441.PUBCHEM 055103441.mol (via Jmol)
055103452.b3lyp_6-31g(d).inp

055103452.b3lyp_6-31g(d).qchem.inp (generated)

055103452.b3lyp_6-31g(d).gjf (generated)

055103452.b3lyp_6-31g(d).firefly.inp (generated)

055103452.b3lyp_6-31g(d).smash.inp (generated)

055103452.b3lyp_6-31g(d).nwchem.inp (generated) 055103452.b3lyp_6-31g(d).log.xz 055103452.mol 055103452.PUBCHEM 055103452.mol (via Jmol)
055103463.b3lyp_6-31g(d).inp

055103463.b3lyp_6-31g(d).qchem.inp (generated)

055103463.b3lyp_6-31g(d).gjf (generated)

055103463.b3lyp_6-31g(d).firefly.inp (generated)

055103463.b3lyp_6-31g(d).smash.inp (generated)

055103463.b3lyp_6-31g(d).nwchem.inp (generated) 055103463.b3lyp_6-31g(d).log.xz 055103463.td-b3lyp_6-31g+(d).inp 055103463.td-b3lyp_6-31g+(d).log.xz

055103463.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103463.td-b3lyp_6-31+g(d).gjf (generated)

055103463.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103463.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103463.mol 055103463.PUBCHEM 055103463.mol (via Jmol)
055103465.b3lyp_6-31g(d).inp

055103465.b3lyp_6-31g(d).qchem.inp (generated)

055103465.b3lyp_6-31g(d).gjf (generated)

055103465.b3lyp_6-31g(d).firefly.inp (generated)

055103465.b3lyp_6-31g(d).smash.inp (generated)

055103465.b3lyp_6-31g(d).nwchem.inp (generated) 055103465.b3lyp_6-31g(d).log.xz 055103465.td-b3lyp_6-31g+(d).inp 055103465.td-b3lyp_6-31g+(d).log.xz

055103465.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103465.td-b3lyp_6-31+g(d).gjf (generated)

055103465.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103465.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103465.mol 055103465.PUBCHEM 055103465.mol (via Jmol)
055103475.b3lyp_6-31g(d).inp

055103475.b3lyp_6-31g(d).qchem.inp (generated)

055103475.b3lyp_6-31g(d).gjf (generated)

055103475.b3lyp_6-31g(d).firefly.inp (generated)

055103475.b3lyp_6-31g(d).smash.inp (generated)

055103475.b3lyp_6-31g(d).nwchem.inp (generated) 055103475.b3lyp_6-31g(d).log.xz 055103475.mol 055103475.PUBCHEM 055103475.mol (via Jmol)
055103476.b3lyp_6-31g(d).inp

055103476.b3lyp_6-31g(d).qchem.inp (generated)

055103476.b3lyp_6-31g(d).gjf (generated)

055103476.b3lyp_6-31g(d).firefly.inp (generated)

055103476.b3lyp_6-31g(d).smash.inp (generated)

055103476.b3lyp_6-31g(d).nwchem.inp (generated) 055103476.b3lyp_6-31g(d).log.xz 055103476.td-b3lyp_6-31g+(d).inp 055103476.td-b3lyp_6-31g+(d).log.xz

055103476.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103476.td-b3lyp_6-31+g(d).gjf (generated)

055103476.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103476.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103476.mol 055103476.PUBCHEM 055103476.mol (via Jmol)
055103492.b3lyp_6-31g(d).inp

055103492.b3lyp_6-31g(d).qchem.inp (generated)

055103492.b3lyp_6-31g(d).gjf (generated)

055103492.b3lyp_6-31g(d).firefly.inp (generated)

055103492.b3lyp_6-31g(d).smash.inp (generated)

055103492.b3lyp_6-31g(d).nwchem.inp (generated) 055103492.b3lyp_6-31g(d).log.xz 055103492.td-b3lyp_6-31g+(d).inp 055103492.td-b3lyp_6-31g+(d).log.xz

055103492.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103492.td-b3lyp_6-31+g(d).gjf (generated)

055103492.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103492.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103492.mol 055103492.PUBCHEM 055103492.mol (via Jmol)
055103494.b3lyp_6-31g(d).inp

055103494.b3lyp_6-31g(d).qchem.inp (generated)

055103494.b3lyp_6-31g(d).gjf (generated)

055103494.b3lyp_6-31g(d).firefly.inp (generated)

055103494.b3lyp_6-31g(d).smash.inp (generated)

055103494.b3lyp_6-31g(d).nwchem.inp (generated) 055103494.b3lyp_6-31g(d).log.xz 055103494.td-b3lyp_6-31g+(d).inp 055103494.td-b3lyp_6-31g+(d).log.xz

055103494.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103494.td-b3lyp_6-31+g(d).gjf (generated)

055103494.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103494.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103494.mol 055103494.PUBCHEM 055103494.mol (via Jmol)
055103504.b3lyp_6-31g(d).inp

055103504.b3lyp_6-31g(d).qchem.inp (generated)

055103504.b3lyp_6-31g(d).gjf (generated)

055103504.b3lyp_6-31g(d).firefly.inp (generated)

055103504.b3lyp_6-31g(d).smash.inp (generated)

055103504.b3lyp_6-31g(d).nwchem.inp (generated) 055103504.b3lyp_6-31g(d).log.xz 055103504.td-b3lyp_6-31g+(d).inp 055103504.td-b3lyp_6-31g+(d).log.xz

055103504.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103504.td-b3lyp_6-31+g(d).gjf (generated)

055103504.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103504.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103504.mol 055103504.PUBCHEM 055103504.mol (via Jmol)
055103507.b3lyp_6-31g(d).inp

055103507.b3lyp_6-31g(d).qchem.inp (generated)

055103507.b3lyp_6-31g(d).gjf (generated)

055103507.b3lyp_6-31g(d).firefly.inp (generated)

055103507.b3lyp_6-31g(d).smash.inp (generated)

055103507.b3lyp_6-31g(d).nwchem.inp (generated) 055103507.b3lyp_6-31g(d).log.xz 055103507.td-b3lyp_6-31g+(d).inp 055103507.td-b3lyp_6-31g+(d).log.xz

055103507.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103507.td-b3lyp_6-31+g(d).gjf (generated)

055103507.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103507.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103507.mol 055103507.PUBCHEM 055103507.mol (via Jmol)
055103508.b3lyp_6-31g(d).inp

055103508.b3lyp_6-31g(d).qchem.inp (generated)

055103508.b3lyp_6-31g(d).gjf (generated)

055103508.b3lyp_6-31g(d).firefly.inp (generated)

055103508.b3lyp_6-31g(d).smash.inp (generated)

055103508.b3lyp_6-31g(d).nwchem.inp (generated) 055103508.b3lyp_6-31g(d).log.xz 055103508.mol 055103508.PUBCHEM 055103508.mol (via Jmol)
055103514.b3lyp_6-31g(d).inp

055103514.b3lyp_6-31g(d).qchem.inp (generated)

055103514.b3lyp_6-31g(d).gjf (generated)

055103514.b3lyp_6-31g(d).firefly.inp (generated)

055103514.b3lyp_6-31g(d).smash.inp (generated)

055103514.b3lyp_6-31g(d).nwchem.inp (generated) 055103514.b3lyp_6-31g(d).log.xz 055103514.td-b3lyp_6-31g+(d).inp 055103514.td-b3lyp_6-31g+(d).log.xz

055103514.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103514.td-b3lyp_6-31+g(d).gjf (generated)

055103514.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103514.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103514.mol 055103514.PUBCHEM 055103514.mol (via Jmol)
055103520.b3lyp_6-31g(d).inp

055103520.b3lyp_6-31g(d).qchem.inp (generated)

055103520.b3lyp_6-31g(d).gjf (generated)

055103520.b3lyp_6-31g(d).firefly.inp (generated)

055103520.b3lyp_6-31g(d).smash.inp (generated)

055103520.b3lyp_6-31g(d).nwchem.inp (generated) 055103520.b3lyp_6-31g(d).log.xz 055103520.td-b3lyp_6-31g+(d).inp 055103520.td-b3lyp_6-31g+(d).log.xz

055103520.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103520.td-b3lyp_6-31+g(d).gjf (generated)

055103520.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103520.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103520.mol 055103520.PUBCHEM 055103520.mol (via Jmol)
055103539.b3lyp_6-31g(d).inp

055103539.b3lyp_6-31g(d).qchem.inp (generated)

055103539.b3lyp_6-31g(d).gjf (generated)

055103539.b3lyp_6-31g(d).firefly.inp (generated)

055103539.b3lyp_6-31g(d).smash.inp (generated)

055103539.b3lyp_6-31g(d).nwchem.inp (generated) 055103539.b3lyp_6-31g(d).log.xz 055103539.td-b3lyp_6-31g+(d).inp 055103539.td-b3lyp_6-31g+(d).log.xz

055103539.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103539.td-b3lyp_6-31+g(d).gjf (generated)

055103539.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103539.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103539.mol 055103539.PUBCHEM 055103539.mol (via Jmol)
055103547.b3lyp_6-31g(d).inp

055103547.b3lyp_6-31g(d).qchem.inp (generated)

055103547.b3lyp_6-31g(d).gjf (generated)

055103547.b3lyp_6-31g(d).firefly.inp (generated)

055103547.b3lyp_6-31g(d).smash.inp (generated)

055103547.b3lyp_6-31g(d).nwchem.inp (generated) 055103547.b3lyp_6-31g(d).log.xz 055103547.td-b3lyp_6-31g+(d).inp 055103547.td-b3lyp_6-31g+(d).log.xz

055103547.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103547.td-b3lyp_6-31+g(d).gjf (generated)

055103547.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103547.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103547.mol 055103547.PUBCHEM 055103547.mol (via Jmol)
055103568.b3lyp_6-31g(d).inp

055103568.b3lyp_6-31g(d).qchem.inp (generated)

055103568.b3lyp_6-31g(d).gjf (generated)

055103568.b3lyp_6-31g(d).firefly.inp (generated)

055103568.b3lyp_6-31g(d).smash.inp (generated)

055103568.b3lyp_6-31g(d).nwchem.inp (generated) 055103568.b3lyp_6-31g(d).log.xz 055103568.td-b3lyp_6-31g+(d).inp 055103568.td-b3lyp_6-31g+(d).log.xz

055103568.td-b3lyp_6-31+g(d).qchem.inp (generated)

055103568.td-b3lyp_6-31+g(d).gjf (generated)

055103568.td-b3lyp_6-31+g(d).firefly.inp (generated)

055103568.td-b3lyp_6-31+g(d).nwchem.inp (generated) 055103568.mol 055103568.PUBCHEM 055103568.mol (via Jmol)
055103602.b3lyp_6-31g(d).inp

05510360