Index of

Last updated : Thu Jul 27 01:56:05 JST 2017
Total : 492 (379) in this page
001075041.b3lyp_6-31g(d).inp

001075041.b3lyp_6-31g(d).qchem.inp (generated)

001075041.b3lyp_6-31g(d).gjf (generated)

001075041.b3lyp_6-31g(d).firefly.inp (generated)

001075041.b3lyp_6-31g(d).smash.inp (generated)

001075041.b3lyp_6-31g(d).nwchem.inp (generated) 001075041.b3lyp_6-31g(d).log.xz 001075041.td-b3lyp_6-31g+(d).inp 001075041.td-b3lyp_6-31g+(d).log.xz

001075041.td-b3lyp_6-31+g(d).qchem.inp (generated)

001075041.td-b3lyp_6-31+g(d).gjf (generated)

001075041.td-b3lyp_6-31+g(d).firefly.inp (generated)

001075041.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001075041.mol 001075041.PUBCHEM 001075041.mol (via Jmol)
001075605.b3lyp_6-31g(d).inp

001075605.b3lyp_6-31g(d).qchem.inp (generated)

001075605.b3lyp_6-31g(d).gjf (generated)

001075605.b3lyp_6-31g(d).firefly.inp (generated)

001075605.b3lyp_6-31g(d).smash.inp (generated)

001075605.b3lyp_6-31g(d).nwchem.inp (generated) 001075605.b3lyp_6-31g(d).log.xz 001075605.td-b3lyp_6-31g+(d).inp 001075605.td-b3lyp_6-31g+(d).log.xz

001075605.td-b3lyp_6-31+g(d).qchem.inp (generated)

001075605.td-b3lyp_6-31+g(d).gjf (generated)

001075605.td-b3lyp_6-31+g(d).firefly.inp (generated)

001075605.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001075605.mol 001075605.PUBCHEM 001075605.mol (via Jmol)
001075689.b3lyp_6-31g(d).inp

001075689.b3lyp_6-31g(d).qchem.inp (generated)

001075689.b3lyp_6-31g(d).gjf (generated)

001075689.b3lyp_6-31g(d).firefly.inp (generated)

001075689.b3lyp_6-31g(d).smash.inp (generated)

001075689.b3lyp_6-31g(d).nwchem.inp (generated) 001075689.b3lyp_6-31g(d).log.xz 001075689.td-b3lyp_6-31g+(d).inp 001075689.td-b3lyp_6-31g+(d).log.xz

001075689.td-b3lyp_6-31+g(d).qchem.inp (generated)

001075689.td-b3lyp_6-31+g(d).gjf (generated)

001075689.td-b3lyp_6-31+g(d).firefly.inp (generated)

001075689.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001075689.mol 001075689.PUBCHEM 001075689.mol (via Jmol)
001075881.b3lyp_6-31g(d).inp

001075881.b3lyp_6-31g(d).qchem.inp (generated)

001075881.b3lyp_6-31g(d).gjf (generated)

001075881.b3lyp_6-31g(d).firefly.inp (generated)

001075881.b3lyp_6-31g(d).smash.inp (generated)

001075881.b3lyp_6-31g(d).nwchem.inp (generated) 001075881.b3lyp_6-31g(d).log.xz 001075881.td-b3lyp_6-31g+(d).inp 001075881.td-b3lyp_6-31g+(d).log.xz

001075881.td-b3lyp_6-31+g(d).qchem.inp (generated)

001075881.td-b3lyp_6-31+g(d).gjf (generated)

001075881.td-b3lyp_6-31+g(d).firefly.inp (generated)

001075881.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001075881.mol 001075881.PUBCHEM 001075881.mol (via Jmol)
001075882.b3lyp_6-31g(d).inp

001075882.b3lyp_6-31g(d).qchem.inp (generated)

001075882.b3lyp_6-31g(d).gjf (generated)

001075882.b3lyp_6-31g(d).firefly.inp (generated)

001075882.b3lyp_6-31g(d).smash.inp (generated)

001075882.b3lyp_6-31g(d).nwchem.inp (generated) 001075882.b3lyp_6-31g(d).log.xz 001075882.td-b3lyp_6-31g+(d).inp 001075882.td-b3lyp_6-31g+(d).log.xz

001075882.td-b3lyp_6-31+g(d).qchem.inp (generated)

001075882.td-b3lyp_6-31+g(d).gjf (generated)

001075882.td-b3lyp_6-31+g(d).firefly.inp (generated)

001075882.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001075882.mol 001075882.PUBCHEM 001075882.mol (via Jmol)
001075919.b3lyp_6-31g(d).inp

001075919.b3lyp_6-31g(d).qchem.inp (generated)

001075919.b3lyp_6-31g(d).gjf (generated)

001075919.b3lyp_6-31g(d).firefly.inp (generated)

001075919.b3lyp_6-31g(d).smash.inp (generated)

001075919.b3lyp_6-31g(d).nwchem.inp (generated) 001075919.b3lyp_6-31g(d).log.xz 001075919.td-b3lyp_6-31g+(d).inp 001075919.td-b3lyp_6-31g+(d).log.xz

001075919.td-b3lyp_6-31+g(d).qchem.inp (generated)

001075919.td-b3lyp_6-31+g(d).gjf (generated)

001075919.td-b3lyp_6-31+g(d).firefly.inp (generated)

001075919.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001075919.mol 001075919.PUBCHEM 001075919.mol (via Jmol)
001075920.b3lyp_6-31g(d).inp

001075920.b3lyp_6-31g(d).qchem.inp (generated)

001075920.b3lyp_6-31g(d).gjf (generated)

001075920.b3lyp_6-31g(d).firefly.inp (generated)

001075920.b3lyp_6-31g(d).smash.inp (generated)

001075920.b3lyp_6-31g(d).nwchem.inp (generated) 001075920.b3lyp_6-31g(d).log.xz 001075920.td-b3lyp_6-31g+(d).inp 001075920.td-b3lyp_6-31g+(d).log.xz

001075920.td-b3lyp_6-31+g(d).qchem.inp (generated)

001075920.td-b3lyp_6-31+g(d).gjf (generated)

001075920.td-b3lyp_6-31+g(d).firefly.inp (generated)

001075920.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001075920.mol 001075920.PUBCHEM 001075920.mol (via Jmol)
001075945.b3lyp_6-31g(d).inp

001075945.b3lyp_6-31g(d).qchem.inp (generated)

001075945.b3lyp_6-31g(d).gjf (generated)

001075945.b3lyp_6-31g(d).firefly.inp (generated)

001075945.b3lyp_6-31g(d).smash.inp (generated)

001075945.b3lyp_6-31g(d).nwchem.inp (generated) 001075945.b3lyp_6-31g(d).log.xz 001075945.td-b3lyp_6-31g+(d).inp 001075945.td-b3lyp_6-31g+(d).log.xz

001075945.td-b3lyp_6-31+g(d).qchem.inp (generated)

001075945.td-b3lyp_6-31+g(d).gjf (generated)

001075945.td-b3lyp_6-31+g(d).firefly.inp (generated)

001075945.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001075945.mol 001075945.PUBCHEM 001075945.mol (via Jmol)
001076086.b3lyp_6-31g(d).inp

001076086.b3lyp_6-31g(d).qchem.inp (generated)

001076086.b3lyp_6-31g(d).gjf (generated)

001076086.b3lyp_6-31g(d).firefly.inp (generated)

001076086.b3lyp_6-31g(d).smash.inp (generated)

001076086.b3lyp_6-31g(d).nwchem.inp (generated) 001076086.b3lyp_6-31g(d).log.xz 001076086.td-b3lyp_6-31g+(d).inp 001076086.td-b3lyp_6-31g+(d).log.xz

001076086.td-b3lyp_6-31+g(d).qchem.inp (generated)

001076086.td-b3lyp_6-31+g(d).gjf (generated)

001076086.td-b3lyp_6-31+g(d).firefly.inp (generated)

001076086.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001076086.mol 001076086.PUBCHEM 001076086.mol (via Jmol)
001076116.b3lyp_6-31g(d).inp

001076116.b3lyp_6-31g(d).qchem.inp (generated)

001076116.b3lyp_6-31g(d).gjf (generated)

001076116.b3lyp_6-31g(d).firefly.inp (generated)

001076116.b3lyp_6-31g(d).smash.inp (generated)

001076116.b3lyp_6-31g(d).nwchem.inp (generated) 001076116.b3lyp_6-31g(d).log.xz 001076116.td-b3lyp_6-31g+(d).inp 001076116.td-b3lyp_6-31g+(d).log.xz

001076116.td-b3lyp_6-31+g(d).qchem.inp (generated)

001076116.td-b3lyp_6-31+g(d).gjf (generated)

001076116.td-b3lyp_6-31+g(d).firefly.inp (generated)

001076116.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001076116.mol 001076116.PUBCHEM 001076116.mol (via Jmol)
001076193.b3lyp_6-31g(d).inp

001076193.b3lyp_6-31g(d).qchem.inp (generated)

001076193.b3lyp_6-31g(d).gjf (generated)

001076193.b3lyp_6-31g(d).firefly.inp (generated)

001076193.b3lyp_6-31g(d).smash.inp (generated)

001076193.b3lyp_6-31g(d).nwchem.inp (generated) 001076193.b3lyp_6-31g(d).log.xz 001076193.td-b3lyp_6-31g+(d).inp 001076193.td-b3lyp_6-31g+(d).log.xz

001076193.td-b3lyp_6-31+g(d).qchem.inp (generated)

001076193.td-b3lyp_6-31+g(d).gjf (generated)

001076193.td-b3lyp_6-31+g(d).firefly.inp (generated)

001076193.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001076193.mol 001076193.PUBCHEM 001076193.mol (via Jmol)
001076262.b3lyp_6-31g(d).inp

001076262.b3lyp_6-31g(d).qchem.inp (generated)

001076262.b3lyp_6-31g(d).gjf (generated)

001076262.b3lyp_6-31g(d).firefly.inp (generated)

001076262.b3lyp_6-31g(d).smash.inp (generated)

001076262.b3lyp_6-31g(d).nwchem.inp (generated) 001076262.b3lyp_6-31g(d).log.xz 001076262.td-b3lyp_6-31g+(d).inp 001076262.td-b3lyp_6-31g+(d).log.xz

001076262.td-b3lyp_6-31+g(d).qchem.inp (generated)

001076262.td-b3lyp_6-31+g(d).gjf (generated)

001076262.td-b3lyp_6-31+g(d).firefly.inp (generated)

001076262.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001076262.mol 001076262.PUBCHEM 001076262.mol (via Jmol)
001076263.b3lyp_6-31g(d).inp

001076263.b3lyp_6-31g(d).qchem.inp (generated)

001076263.b3lyp_6-31g(d).gjf (generated)

001076263.b3lyp_6-31g(d).firefly.inp (generated)

001076263.b3lyp_6-31g(d).smash.inp (generated)

001076263.b3lyp_6-31g(d).nwchem.inp (generated) 001076263.b3lyp_6-31g(d).log.xz 001076263.td-b3lyp_6-31g+(d).inp 001076263.td-b3lyp_6-31g+(d).log.xz

001076263.td-b3lyp_6-31+g(d).qchem.inp (generated)

001076263.td-b3lyp_6-31+g(d).gjf (generated)

001076263.td-b3lyp_6-31+g(d).firefly.inp (generated)

001076263.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001076263.mol 001076263.PUBCHEM 001076263.mol (via Jmol)
001076510.b3lyp_6-31g(d).inp

001076510.b3lyp_6-31g(d).qchem.inp (generated)

001076510.b3lyp_6-31g(d).gjf (generated)

001076510.b3lyp_6-31g(d).firefly.inp (generated)

001076510.b3lyp_6-31g(d).smash.inp (generated)

001076510.b3lyp_6-31g(d).nwchem.inp (generated) 001076510.b3lyp_6-31g(d).log.xz 001076510.td-b3lyp_6-31g+(d).inp 001076510.td-b3lyp_6-31g+(d).log.xz

001076510.td-b3lyp_6-31+g(d).qchem.inp (generated)

001076510.td-b3lyp_6-31+g(d).gjf (generated)

001076510.td-b3lyp_6-31+g(d).firefly.inp (generated)

001076510.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001076510.mol 001076510.PUBCHEM 001076510.mol (via Jmol)
001076796.b3lyp_6-31g(d).inp

001076796.b3lyp_6-31g(d).qchem.inp (generated)

001076796.b3lyp_6-31g(d).gjf (generated)

001076796.b3lyp_6-31g(d).firefly.inp (generated)

001076796.b3lyp_6-31g(d).smash.inp (generated)

001076796.b3lyp_6-31g(d).nwchem.inp (generated) 001076796.b3lyp_6-31g(d).log.xz 001076796.td-b3lyp_6-31g+(d).inp 001076796.td-b3lyp_6-31g+(d).log.xz

001076796.td-b3lyp_6-31+g(d).qchem.inp (generated)

001076796.td-b3lyp_6-31+g(d).gjf (generated)

001076796.td-b3lyp_6-31+g(d).firefly.inp (generated)

001076796.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001076796.mol 001076796.PUBCHEM 001076796.mol (via Jmol)
001076805.b3lyp_6-31g(d).inp

001076805.b3lyp_6-31g(d).qchem.inp (generated)

001076805.b3lyp_6-31g(d).gjf (generated)

001076805.b3lyp_6-31g(d).firefly.inp (generated)

001076805.b3lyp_6-31g(d).smash.inp (generated)

001076805.b3lyp_6-31g(d).nwchem.inp (generated) 001076805.b3lyp_6-31g(d).log.xz 001076805.mol 001076805.PUBCHEM 001076805.mol (via Jmol)
001077152.b3lyp_6-31g(d).inp

001077152.b3lyp_6-31g(d).qchem.inp (generated)

001077152.b3lyp_6-31g(d).gjf (generated)

001077152.b3lyp_6-31g(d).firefly.inp (generated)

001077152.b3lyp_6-31g(d).smash.inp (generated)

001077152.b3lyp_6-31g(d).nwchem.inp (generated) 001077152.b3lyp_6-31g(d).log.xz 001077152.td-b3lyp_6-31g+(d).inp 001077152.td-b3lyp_6-31g+(d).log.xz

001077152.td-b3lyp_6-31+g(d).qchem.inp (generated)

001077152.td-b3lyp_6-31+g(d).gjf (generated)

001077152.td-b3lyp_6-31+g(d).firefly.inp (generated)

001077152.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001077152.mol 001077152.PUBCHEM 001077152.mol (via Jmol)
001077196.b3lyp_6-31g(d).inp

001077196.b3lyp_6-31g(d).qchem.inp (generated)

001077196.b3lyp_6-31g(d).gjf (generated)

001077196.b3lyp_6-31g(d).firefly.inp (generated)

001077196.b3lyp_6-31g(d).smash.inp (generated)

001077196.b3lyp_6-31g(d).nwchem.inp (generated) 001077196.b3lyp_6-31g(d).log.xz 001077196.td-b3lyp_6-31g+(d).inp 001077196.td-b3lyp_6-31g+(d).log.xz

001077196.td-b3lyp_6-31+g(d).qchem.inp (generated)

001077196.td-b3lyp_6-31+g(d).gjf (generated)

001077196.td-b3lyp_6-31+g(d).firefly.inp (generated)

001077196.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001077196.mol 001077196.PUBCHEM 001077196.mol (via Jmol)
001077631.b3lyp_6-31g(d).inp

001077631.b3lyp_6-31g(d).qchem.inp (generated)

001077631.b3lyp_6-31g(d).gjf (generated)

001077631.b3lyp_6-31g(d).firefly.inp (generated)

001077631.b3lyp_6-31g(d).smash.inp (generated)

001077631.b3lyp_6-31g(d).nwchem.inp (generated) 001077631.b3lyp_6-31g(d).log.xz 001077631.td-b3lyp_6-31g+(d).inp 001077631.td-b3lyp_6-31g+(d).log.xz

001077631.td-b3lyp_6-31+g(d).qchem.inp (generated)

001077631.td-b3lyp_6-31+g(d).gjf (generated)

001077631.td-b3lyp_6-31+g(d).firefly.inp (generated)

001077631.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001077631.mol 001077631.PUBCHEM 001077631.mol (via Jmol)
001078061.b3lyp_6-31g(d).inp

001078061.b3lyp_6-31g(d).qchem.inp (generated)

001078061.b3lyp_6-31g(d).gjf (generated)

001078061.b3lyp_6-31g(d).firefly.inp (generated)

001078061.b3lyp_6-31g(d).smash.inp (generated)

001078061.b3lyp_6-31g(d).nwchem.inp (generated) 001078061.b3lyp_6-31g(d).log.xz 001078061.td-b3lyp_6-31g+(d).inp 001078061.td-b3lyp_6-31g+(d).log.xz

001078061.td-b3lyp_6-31+g(d).qchem.inp (generated)

001078061.td-b3lyp_6-31+g(d).gjf (generated)

001078061.td-b3lyp_6-31+g(d).firefly.inp (generated)

001078061.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001078061.mol 001078061.PUBCHEM 001078061.mol (via Jmol)
001078062.b3lyp_6-31g(d).inp

001078062.b3lyp_6-31g(d).qchem.inp (generated)

001078062.b3lyp_6-31g(d).gjf (generated)

001078062.b3lyp_6-31g(d).firefly.inp (generated)

001078062.b3lyp_6-31g(d).smash.inp (generated)

001078062.b3lyp_6-31g(d).nwchem.inp (generated) 001078062.b3lyp_6-31g(d).log.xz 001078062.td-b3lyp_6-31g+(d).inp 001078062.td-b3lyp_6-31g+(d).log.xz

001078062.td-b3lyp_6-31+g(d).qchem.inp (generated)

001078062.td-b3lyp_6-31+g(d).gjf (generated)

001078062.td-b3lyp_6-31+g(d).firefly.inp (generated)

001078062.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001078062.mol 001078062.PUBCHEM 001078062.mol (via Jmol)
001078086.b3lyp_6-31g(d).inp

001078086.b3lyp_6-31g(d).qchem.inp (generated)

001078086.b3lyp_6-31g(d).gjf (generated)

001078086.b3lyp_6-31g(d).firefly.inp (generated)

001078086.b3lyp_6-31g(d).smash.inp (generated)

001078086.b3lyp_6-31g(d).nwchem.inp (generated) 001078086.b3lyp_6-31g(d).log.xz 001078086.td-b3lyp_6-31g+(d).inp 001078086.td-b3lyp_6-31g+(d).log.xz

001078086.td-b3lyp_6-31+g(d).qchem.inp (generated)

001078086.td-b3lyp_6-31+g(d).gjf (generated)

001078086.td-b3lyp_6-31+g(d).firefly.inp (generated)

001078086.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001078086.mol 001078086.PUBCHEM 001078086.mol (via Jmol)
001078087.b3lyp_6-31g(d).inp

001078087.b3lyp_6-31g(d).qchem.inp (generated)

001078087.b3lyp_6-31g(d).gjf (generated)

001078087.b3lyp_6-31g(d).firefly.inp (generated)

001078087.b3lyp_6-31g(d).smash.inp (generated)

001078087.b3lyp_6-31g(d).nwchem.inp (generated) 001078087.b3lyp_6-31g(d).log.xz 001078087.mol 001078087.PUBCHEM 001078087.mol (via Jmol)
001078088.b3lyp_6-31g(d).inp

001078088.b3lyp_6-31g(d).qchem.inp (generated)

001078088.b3lyp_6-31g(d).gjf (generated)

001078088.b3lyp_6-31g(d).firefly.inp (generated)

001078088.b3lyp_6-31g(d).smash.inp (generated)

001078088.b3lyp_6-31g(d).nwchem.inp (generated) 001078088.b3lyp_6-31g(d).log.xz 001078088.mol 001078088.PUBCHEM 001078088.mol (via Jmol)
001078402.b3lyp_6-31g(d).inp

001078402.b3lyp_6-31g(d).qchem.inp (generated)

001078402.b3lyp_6-31g(d).gjf (generated)

001078402.b3lyp_6-31g(d).firefly.inp (generated)

001078402.b3lyp_6-31g(d).smash.inp (generated)

001078402.b3lyp_6-31g(d).nwchem.inp (generated) 001078402.b3lyp_6-31g(d).log.xz 001078402.td-b3lyp_6-31g+(d).inp 001078402.td-b3lyp_6-31g+(d).log.xz

001078402.td-b3lyp_6-31+g(d).qchem.inp (generated)

001078402.td-b3lyp_6-31+g(d).gjf (generated)

001078402.td-b3lyp_6-31+g(d).firefly.inp (generated)

001078402.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001078402.mol 001078402.PUBCHEM 001078402.mol (via Jmol)
001078504.b3lyp_6-31g(d).inp

001078504.b3lyp_6-31g(d).qchem.inp (generated)

001078504.b3lyp_6-31g(d).gjf (generated)

001078504.b3lyp_6-31g(d).firefly.inp (generated)

001078504.b3lyp_6-31g(d).smash.inp (generated)

001078504.b3lyp_6-31g(d).nwchem.inp (generated) 001078504.b3lyp_6-31g(d).log.xz 001078504.mol 001078504.PUBCHEM 001078504.mol (via Jmol)
001078595.b3lyp_6-31g(d).inp

001078595.b3lyp_6-31g(d).qchem.inp (generated)

001078595.b3lyp_6-31g(d).gjf (generated)

001078595.b3lyp_6-31g(d).firefly.inp (generated)

001078595.b3lyp_6-31g(d).smash.inp (generated)

001078595.b3lyp_6-31g(d).nwchem.inp (generated) 001078595.b3lyp_6-31g(d).log.xz 001078595.td-b3lyp_6-31g+(d).inp 001078595.td-b3lyp_6-31g+(d).log.xz

001078595.td-b3lyp_6-31+g(d).qchem.inp (generated)

001078595.td-b3lyp_6-31+g(d).gjf (generated)

001078595.td-b3lyp_6-31+g(d).firefly.inp (generated)

001078595.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001078595.mol 001078595.PUBCHEM 001078595.mol (via Jmol)
001078638.b3lyp_6-31g(d).inp

001078638.b3lyp_6-31g(d).qchem.inp (generated)

001078638.b3lyp_6-31g(d).gjf (generated)

001078638.b3lyp_6-31g(d).firefly.inp (generated)

001078638.b3lyp_6-31g(d).smash.inp (generated)

001078638.b3lyp_6-31g(d).nwchem.inp (generated) 001078638.b3lyp_6-31g(d).log.xz 001078638.td-b3lyp_6-31g+(d).inp 001078638.td-b3lyp_6-31g+(d).log.xz

001078638.td-b3lyp_6-31+g(d).qchem.inp (generated)

001078638.td-b3lyp_6-31+g(d).gjf (generated)

001078638.td-b3lyp_6-31+g(d).firefly.inp (generated)

001078638.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001078638.mol 001078638.PUBCHEM 001078638.mol (via Jmol)
001078641.b3lyp_6-31g(d).inp

001078641.b3lyp_6-31g(d).qchem.inp (generated)

001078641.b3lyp_6-31g(d).gjf (generated)

001078641.b3lyp_6-31g(d).firefly.inp (generated)

001078641.b3lyp_6-31g(d).smash.inp (generated)

001078641.b3lyp_6-31g(d).nwchem.inp (generated) 001078641.b3lyp_6-31g(d).log.xz 001078641.td-b3lyp_6-31g+(d).inp 001078641.td-b3lyp_6-31g+(d).log.xz

001078641.td-b3lyp_6-31+g(d).qchem.inp (generated)

001078641.td-b3lyp_6-31+g(d).gjf (generated)

001078641.td-b3lyp_6-31+g(d).firefly.inp (generated)

001078641.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001078641.mol 001078641.PUBCHEM 001078641.mol (via Jmol)
001078642.b3lyp_6-31g(d).inp

001078642.b3lyp_6-31g(d).qchem.inp (generated)

001078642.b3lyp_6-31g(d).gjf (generated)

001078642.b3lyp_6-31g(d).firefly.inp (generated)

001078642.b3lyp_6-31g(d).smash.inp (generated)

001078642.b3lyp_6-31g(d).nwchem.inp (generated) 001078642.b3lyp_6-31g(d).log.xz 001078642.td-b3lyp_6-31g+(d).inp 001078642.td-b3lyp_6-31g+(d).log.xz

001078642.td-b3lyp_6-31+g(d).qchem.inp (generated)

001078642.td-b3lyp_6-31+g(d).gjf (generated)

001078642.td-b3lyp_6-31+g(d).firefly.inp (generated)

001078642.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001078642.mol 001078642.PUBCHEM 001078642.mol (via Jmol)
001078643.b3lyp_6-31g(d).inp

001078643.b3lyp_6-31g(d).qchem.inp (generated)

001078643.b3lyp_6-31g(d).gjf (generated)

001078643.b3lyp_6-31g(d).firefly.inp (generated)

001078643.b3lyp_6-31g(d).smash.inp (generated)

001078643.b3lyp_6-31g(d).nwchem.inp (generated) 001078643.b3lyp_6-31g(d).log.xz 001078643.td-b3lyp_6-31g+(d).inp 001078643.td-b3lyp_6-31g+(d).log.xz

001078643.td-b3lyp_6-31+g(d).qchem.inp (generated)

001078643.td-b3lyp_6-31+g(d).gjf (generated)

001078643.td-b3lyp_6-31+g(d).firefly.inp (generated)

001078643.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001078643.mol 001078643.PUBCHEM 001078643.mol (via Jmol)
001078644.b3lyp_6-31g(d).inp

001078644.b3lyp_6-31g(d).qchem.inp (generated)

001078644.b3lyp_6-31g(d).gjf (generated)

001078644.b3lyp_6-31g(d).firefly.inp (generated)

001078644.b3lyp_6-31g(d).smash.inp (generated)

001078644.b3lyp_6-31g(d).nwchem.inp (generated) 001078644.b3lyp_6-31g(d).log.xz 001078644.td-b3lyp_6-31g+(d).inp 001078644.td-b3lyp_6-31g+(d).log.xz

001078644.td-b3lyp_6-31+g(d).qchem.inp (generated)

001078644.td-b3lyp_6-31+g(d).gjf (generated)

001078644.td-b3lyp_6-31+g(d).firefly.inp (generated)

001078644.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001078644.mol 001078644.PUBCHEM 001078644.mol (via Jmol)
001078645.b3lyp_6-31g(d).inp

001078645.b3lyp_6-31g(d).qchem.inp (generated)

001078645.b3lyp_6-31g(d).gjf (generated)

001078645.b3lyp_6-31g(d).firefly.inp (generated)

001078645.b3lyp_6-31g(d).smash.inp (generated)

001078645.b3lyp_6-31g(d).nwchem.inp (generated) 001078645.b3lyp_6-31g(d).log.xz 001078645.td-b3lyp_6-31g+(d).inp 001078645.td-b3lyp_6-31g+(d).log.xz

001078645.td-b3lyp_6-31+g(d).qchem.inp (generated)

001078645.td-b3lyp_6-31+g(d).gjf (generated)

001078645.td-b3lyp_6-31+g(d).firefly.inp (generated)

001078645.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001078645.mol 001078645.PUBCHEM 001078645.mol (via Jmol)
001078646.b3lyp_6-31g(d).inp

001078646.b3lyp_6-31g(d).qchem.inp (generated)

001078646.b3lyp_6-31g(d).gjf (generated)

001078646.b3lyp_6-31g(d).firefly.inp (generated)

001078646.b3lyp_6-31g(d).smash.inp (generated)

001078646.b3lyp_6-31g(d).nwchem.inp (generated) 001078646.b3lyp_6-31g(d).log.xz 001078646.td-b3lyp_6-31g+(d).inp 001078646.td-b3lyp_6-31g+(d).log.xz

001078646.td-b3lyp_6-31+g(d).qchem.inp (generated)

001078646.td-b3lyp_6-31+g(d).gjf (generated)

001078646.td-b3lyp_6-31+g(d).firefly.inp (generated)

001078646.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001078646.mol 001078646.PUBCHEM 001078646.mol (via Jmol)
001078647.b3lyp_6-31g(d).inp

001078647.b3lyp_6-31g(d).qchem.inp (generated)

001078647.b3lyp_6-31g(d).gjf (generated)

001078647.b3lyp_6-31g(d).firefly.inp (generated)

001078647.b3lyp_6-31g(d).smash.inp (generated)

001078647.b3lyp_6-31g(d).nwchem.inp (generated) 001078647.b3lyp_6-31g(d).log.xz 001078647.td-b3lyp_6-31g+(d).inp 001078647.td-b3lyp_6-31g+(d).log.xz

001078647.td-b3lyp_6-31+g(d).qchem.inp (generated)

001078647.td-b3lyp_6-31+g(d).gjf (generated)

001078647.td-b3lyp_6-31+g(d).firefly.inp (generated)

001078647.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001078647.mol 001078647.PUBCHEM 001078647.mol (via Jmol)
001078667.b3lyp_6-31g(d).inp

001078667.b3lyp_6-31g(d).qchem.inp (generated)

001078667.b3lyp_6-31g(d).gjf (generated)

001078667.b3lyp_6-31g(d).firefly.inp (generated)

001078667.b3lyp_6-31g(d).smash.inp (generated)

001078667.b3lyp_6-31g(d).nwchem.inp (generated) 001078667.b3lyp_6-31g(d).log.xz 001078667.mol 001078667.PUBCHEM 001078667.mol (via Jmol)
001078669.b3lyp_6-31g(d).inp

001078669.b3lyp_6-31g(d).qchem.inp (generated)

001078669.b3lyp_6-31g(d).gjf (generated)

001078669.b3lyp_6-31g(d).firefly.inp (generated)

001078669.b3lyp_6-31g(d).smash.inp (generated)

001078669.b3lyp_6-31g(d).nwchem.inp (generated) 001078669.b3lyp_6-31g(d).log.xz 001078669.td-b3lyp_6-31g+(d).inp 001078669.td-b3lyp_6-31g+(d).log.xz

001078669.td-b3lyp_6-31+g(d).qchem.inp (generated)

001078669.td-b3lyp_6-31+g(d).gjf (generated)

001078669.td-b3lyp_6-31+g(d).firefly.inp (generated)

001078669.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001078669.mol 001078669.PUBCHEM 001078669.mol (via Jmol)
001078898.b3lyp_6-31g(d).inp

001078898.b3lyp_6-31g(d).qchem.inp (generated)

001078898.b3lyp_6-31g(d).gjf (generated)

001078898.b3lyp_6-31g(d).firefly.inp (generated)

001078898.b3lyp_6-31g(d).smash.inp (generated)

001078898.b3lyp_6-31g(d).nwchem.inp (generated) 001078898.b3lyp_6-31g(d).log.xz 001078898.mol 001078898.PUBCHEM 001078898.mol (via Jmol)
001078975.b3lyp_6-31g(d).inp

001078975.b3lyp_6-31g(d).qchem.inp (generated)

001078975.b3lyp_6-31g(d).gjf (generated)

001078975.b3lyp_6-31g(d).firefly.inp (generated)

001078975.b3lyp_6-31g(d).smash.inp (generated)

001078975.b3lyp_6-31g(d).nwchem.inp (generated) 001078975.b3lyp_6-31g(d).log.xz 001078975.td-b3lyp_6-31g+(d).inp 001078975.td-b3lyp_6-31g+(d).log.xz

001078975.td-b3lyp_6-31+g(d).qchem.inp (generated)

001078975.td-b3lyp_6-31+g(d).gjf (generated)

001078975.td-b3lyp_6-31+g(d).firefly.inp (generated)

001078975.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001078975.mol 001078975.PUBCHEM 001078975.mol (via Jmol)
001079137.b3lyp_6-31g(d).inp

001079137.b3lyp_6-31g(d).qchem.inp (generated)

001079137.b3lyp_6-31g(d).gjf (generated)

001079137.b3lyp_6-31g(d).firefly.inp (generated)

001079137.b3lyp_6-31g(d).smash.inp (generated)

001079137.b3lyp_6-31g(d).nwchem.inp (generated) 001079137.b3lyp_6-31g(d).log.xz 001079137.td-b3lyp_6-31g+(d).inp 001079137.td-b3lyp_6-31g+(d).log.xz

001079137.td-b3lyp_6-31+g(d).qchem.inp (generated)

001079137.td-b3lyp_6-31+g(d).gjf (generated)

001079137.td-b3lyp_6-31+g(d).firefly.inp (generated)

001079137.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001079137.mol 001079137.PUBCHEM 001079137.mol (via Jmol)
001079138.b3lyp_6-31g(d).inp

001079138.b3lyp_6-31g(d).qchem.inp (generated)

001079138.b3lyp_6-31g(d).gjf (generated)

001079138.b3lyp_6-31g(d).firefly.inp (generated)

001079138.b3lyp_6-31g(d).smash.inp (generated)

001079138.b3lyp_6-31g(d).nwchem.inp (generated) 001079138.b3lyp_6-31g(d).log.xz 001079138.td-b3lyp_6-31g+(d).inp 001079138.td-b3lyp_6-31g+(d).log.xz

001079138.td-b3lyp_6-31+g(d).qchem.inp (generated)

001079138.td-b3lyp_6-31+g(d).gjf (generated)

001079138.td-b3lyp_6-31+g(d).firefly.inp (generated)

001079138.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001079138.mol 001079138.PUBCHEM 001079138.mol (via Jmol)
001079146.b3lyp_6-31g(d).inp

001079146.b3lyp_6-31g(d).qchem.inp (generated)

001079146.b3lyp_6-31g(d).gjf (generated)

001079146.b3lyp_6-31g(d).firefly.inp (generated)

001079146.b3lyp_6-31g(d).smash.inp (generated)

001079146.b3lyp_6-31g(d).nwchem.inp (generated) 001079146.b3lyp_6-31g(d).log.xz 001079146.td-b3lyp_6-31g+(d).inp 001079146.td-b3lyp_6-31g+(d).log.xz

001079146.td-b3lyp_6-31+g(d).qchem.inp (generated)

001079146.td-b3lyp_6-31+g(d).gjf (generated)

001079146.td-b3lyp_6-31+g(d).firefly.inp (generated)

001079146.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001079146.mol 001079146.PUBCHEM 001079146.mol (via Jmol)
001079159.b3lyp_6-31g(d).inp

001079159.b3lyp_6-31g(d).qchem.inp (generated)

001079159.b3lyp_6-31g(d).gjf (generated)

001079159.b3lyp_6-31g(d).firefly.inp (generated)

001079159.b3lyp_6-31g(d).smash.inp (generated)

001079159.b3lyp_6-31g(d).nwchem.inp (generated) 001079159.b3lyp_6-31g(d).log.xz 001079159.mol 001079159.PUBCHEM 001079159.mol (via Jmol)
001079216.b3lyp_6-31g(d).inp

001079216.b3lyp_6-31g(d).qchem.inp (generated)

001079216.b3lyp_6-31g(d).gjf (generated)

001079216.b3lyp_6-31g(d).firefly.inp (generated)

001079216.b3lyp_6-31g(d).smash.inp (generated)

001079216.b3lyp_6-31g(d).nwchem.inp (generated) 001079216.b3lyp_6-31g(d).log.xz 001079216.td-b3lyp_6-31g+(d).inp 001079216.td-b3lyp_6-31g+(d).log.xz

001079216.td-b3lyp_6-31+g(d).qchem.inp (generated)

001079216.td-b3lyp_6-31+g(d).gjf (generated)

001079216.td-b3lyp_6-31+g(d).firefly.inp (generated)

001079216.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001079216.mol 001079216.PUBCHEM 001079216.mol (via Jmol)
001079271.b3lyp_6-31g(d).inp

001079271.b3lyp_6-31g(d).qchem.inp (generated)

001079271.b3lyp_6-31g(d).gjf (generated)

001079271.b3lyp_6-31g(d).firefly.inp (generated)

001079271.b3lyp_6-31g(d).smash.inp (generated)

001079271.b3lyp_6-31g(d).nwchem.inp (generated) 001079271.b3lyp_6-31g(d).log.xz 001079271.mol 001079271.PUBCHEM 001079271.mol (via Jmol)
001079347.b3lyp_6-31g(d).inp

001079347.b3lyp_6-31g(d).qchem.inp (generated)

001079347.b3lyp_6-31g(d).gjf (generated)

001079347.b3lyp_6-31g(d).firefly.inp (generated)

001079347.b3lyp_6-31g(d).smash.inp (generated)

001079347.b3lyp_6-31g(d).nwchem.inp (generated) 001079347.b3lyp_6-31g(d).log.xz 001079347.td-b3lyp_6-31g+(d).inp 001079347.td-b3lyp_6-31g+(d).log.xz

001079347.td-b3lyp_6-31+g(d).qchem.inp (generated)

001079347.td-b3lyp_6-31+g(d).gjf (generated)

001079347.td-b3lyp_6-31+g(d).firefly.inp (generated)

001079347.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001079347.mol 001079347.PUBCHEM 001079347.mol (via Jmol)
001079391.b3lyp_6-31g(d).inp

001079391.b3lyp_6-31g(d).qchem.inp (generated)

001079391.b3lyp_6-31g(d).gjf (generated)

001079391.b3lyp_6-31g(d).firefly.inp (generated)

001079391.b3lyp_6-31g(d).smash.inp (generated)

001079391.b3lyp_6-31g(d).nwchem.inp (generated) 001079391.b3lyp_6-31g(d).log.xz 001079391.td-b3lyp_6-31g+(d).inp 001079391.td-b3lyp_6-31g+(d).log.xz

001079391.td-b3lyp_6-31+g(d).qchem.inp (generated)

001079391.td-b3lyp_6-31+g(d).gjf (generated)

001079391.td-b3lyp_6-31+g(d).firefly.inp (generated)

001079391.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001079391.mol 001079391.PUBCHEM 001079391.mol (via Jmol)
001079392.b3lyp_6-31g(d).inp

001079392.b3lyp_6-31g(d).qchem.inp (generated)

001079392.b3lyp_6-31g(d).gjf (generated)

001079392.b3lyp_6-31g(d).firefly.inp (generated)

001079392.b3lyp_6-31g(d).smash.inp (generated)

001079392.b3lyp_6-31g(d).nwchem.inp (generated) 001079392.b3lyp_6-31g(d).log.xz 001079392.td-b3lyp_6-31g+(d).inp 001079392.td-b3lyp_6-31g+(d).log.xz

001079392.td-b3lyp_6-31+g(d).qchem.inp (generated)

001079392.td-b3lyp_6-31+g(d).gjf (generated)

001079392.td-b3lyp_6-31+g(d).firefly.inp (generated)

001079392.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001079392.mol 001079392.PUBCHEM 001079392.mol (via Jmol)
001079393.b3lyp_6-31g(d).inp

001079393.b3lyp_6-31g(d).qchem.inp (generated)

001079393.b3lyp_6-31g(d).gjf (generated)

001079393.b3lyp_6-31g(d).firefly.inp (generated)

001079393.b3lyp_6-31g(d).smash.inp (generated)

001079393.b3lyp_6-31g(d).nwchem.inp (generated) 001079393.b3lyp_6-31g(d).log.xz 001079393.td-b3lyp_6-31g+(d).inp 001079393.td-b3lyp_6-31g+(d).log.xz

001079393.td-b3lyp_6-31+g(d).qchem.inp (generated)

001079393.td-b3lyp_6-31+g(d).gjf (generated)

001079393.td-b3lyp_6-31+g(d).firefly.inp (generated)

001079393.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001079393.mol 001079393.PUBCHEM 001079393.mol (via Jmol)
001079722.b3lyp_6-31g(d).inp

001079722.b3lyp_6-31g(d).qchem.inp (generated)

001079722.b3lyp_6-31g(d).gjf (generated)

001079722.b3lyp_6-31g(d).firefly.inp (generated)

001079722.b3lyp_6-31g(d).smash.inp (generated)

001079722.b3lyp_6-31g(d).nwchem.inp (generated) 001079722.b3lyp_6-31g(d).log.xz 001079722.mol 001079722.PUBCHEM 001079722.mol (via Jmol)
001079723.b3lyp_6-31g(d).inp

001079723.b3lyp_6-31g(d).qchem.inp (generated)

001079723.b3lyp_6-31g(d).gjf (generated)

001079723.b3lyp_6-31g(d).firefly.inp (generated)

001079723.b3lyp_6-31g(d).smash.inp (generated)

001079723.b3lyp_6-31g(d).nwchem.inp (generated) 001079723.b3lyp_6-31g(d).log.xz 001079723.td-b3lyp_6-31g+(d).inp 001079723.td-b3lyp_6-31g+(d).log.xz

001079723.td-b3lyp_6-31+g(d).qchem.inp (generated)

001079723.td-b3lyp_6-31+g(d).gjf (generated)

001079723.td-b3lyp_6-31+g(d).firefly.inp (generated)

001079723.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001079723.mol 001079723.PUBCHEM 001079723.mol (via Jmol)
001079724.b3lyp_6-31g(d).inp

001079724.b3lyp_6-31g(d).qchem.inp (generated)

001079724.b3lyp_6-31g(d).gjf (generated)

001079724.b3lyp_6-31g(d).firefly.inp (generated)

001079724.b3lyp_6-31g(d).smash.inp (generated)

001079724.b3lyp_6-31g(d).nwchem.inp (generated) 001079724.b3lyp_6-31g(d).log.xz 001079724.td-b3lyp_6-31g+(d).inp 001079724.td-b3lyp_6-31g+(d).log.xz

001079724.td-b3lyp_6-31+g(d).qchem.inp (generated)

001079724.td-b3lyp_6-31+g(d).gjf (generated)

001079724.td-b3lyp_6-31+g(d).firefly.inp (generated)

001079724.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001079724.mol 001079724.PUBCHEM 001079724.mol (via Jmol)
001079735.b3lyp_6-31g(d).inp

001079735.b3lyp_6-31g(d).qchem.inp (generated)

001079735.b3lyp_6-31g(d).gjf (generated)

001079735.b3lyp_6-31g(d).firefly.inp (generated)

001079735.b3lyp_6-31g(d).smash.inp (generated)

001079735.b3lyp_6-31g(d).nwchem.inp (generated) 001079735.b3lyp_6-31g(d).log.xz 001079735.mol 001079735.PUBCHEM 001079735.mol (via Jmol)
001079736.b3lyp_6-31g(d).inp

001079736.b3lyp_6-31g(d).qchem.inp (generated)

001079736.b3lyp_6-31g(d).gjf (generated)

001079736.b3lyp_6-31g(d).firefly.inp (generated)

001079736.b3lyp_6-31g(d).smash.inp (generated)

001079736.b3lyp_6-31g(d).nwchem.inp (generated) 001079736.b3lyp_6-31g(d).log.xz 001079736.mol 001079736.PUBCHEM 001079736.mol (via Jmol)
001079739.b3lyp_6-31g(d).inp

001079739.b3lyp_6-31g(d).qchem.inp (generated)

001079739.b3lyp_6-31g(d).gjf (generated)

001079739.b3lyp_6-31g(d).firefly.inp (generated)

001079739.b3lyp_6-31g(d).smash.inp (generated)

001079739.b3lyp_6-31g(d).nwchem.inp (generated) 001079739.b3lyp_6-31g(d).log.xz 001079739.mol 001079739.PUBCHEM 001079739.mol (via Jmol)
001079755.b3lyp_6-31g(d).inp

001079755.b3lyp_6-31g(d).qchem.inp (generated)

001079755.b3lyp_6-31g(d).gjf (generated)

001079755.b3lyp_6-31g(d).firefly.inp (generated)

001079755.b3lyp_6-31g(d).smash.inp (generated)

001079755.b3lyp_6-31g(d).nwchem.inp (generated) 001079755.b3lyp_6-31g(d).log.xz 001079755.td-b3lyp_6-31g+(d).inp 001079755.td-b3lyp_6-31g+(d).log.xz

001079755.td-b3lyp_6-31+g(d).qchem.inp (generated)

001079755.td-b3lyp_6-31+g(d).gjf (generated)

001079755.td-b3lyp_6-31+g(d).firefly.inp (generated)

001079755.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001079755.mol 001079755.PUBCHEM 001079755.mol (via Jmol)
001079789.b3lyp_6-31g(d).inp

001079789.b3lyp_6-31g(d).qchem.inp (generated)

001079789.b3lyp_6-31g(d).gjf (generated)

001079789.b3lyp_6-31g(d).firefly.inp (generated)

001079789.b3lyp_6-31g(d).smash.inp (generated)

001079789.b3lyp_6-31g(d).nwchem.inp (generated) 001079789.b3lyp_6-31g(d).log.xz 001079789.td-b3lyp_6-31g+(d).inp 001079789.td-b3lyp_6-31g+(d).log.xz

001079789.td-b3lyp_6-31+g(d).qchem.inp (generated)

001079789.td-b3lyp_6-31+g(d).gjf (generated)

001079789.td-b3lyp_6-31+g(d).firefly.inp (generated)

001079789.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001079789.mol 001079789.PUBCHEM 001079789.mol (via Jmol)
001079792.b3lyp_6-31g(d).inp

001079792.b3lyp_6-31g(d).qchem.inp (generated)

001079792.b3lyp_6-31g(d).gjf (generated)

001079792.b3lyp_6-31g(d).firefly.inp (generated)

001079792.b3lyp_6-31g(d).smash.inp (generated)

001079792.b3lyp_6-31g(d).nwchem.inp (generated) 001079792.b3lyp_6-31g(d).log.xz 001079792.td-b3lyp_6-31g+(d).inp 001079792.td-b3lyp_6-31g+(d).log.xz

001079792.td-b3lyp_6-31+g(d).qchem.inp (generated)

001079792.td-b3lyp_6-31+g(d).gjf (generated)

001079792.td-b3lyp_6-31+g(d).firefly.inp (generated)

001079792.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001079792.mol 001079792.PUBCHEM 001079792.mol (via Jmol)
001079815.b3lyp_6-31g(d).inp

001079815.b3lyp_6-31g(d).qchem.inp (generated)

001079815.b3lyp_6-31g(d).gjf (generated)

001079815.b3lyp_6-31g(d).firefly.inp (generated)

001079815.b3lyp_6-31g(d).smash.inp (generated)

001079815.b3lyp_6-31g(d).nwchem.inp (generated) 001079815.b3lyp_6-31g(d).log.xz 001079815.td-b3lyp_6-31g+(d).inp 001079815.td-b3lyp_6-31g+(d).log.xz

001079815.td-b3lyp_6-31+g(d).qchem.inp (generated)

001079815.td-b3lyp_6-31+g(d).gjf (generated)

001079815.td-b3lyp_6-31+g(d).firefly.inp (generated)

001079815.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001079815.mol 001079815.PUBCHEM 001079815.mol (via Jmol)
001079836.b3lyp_6-31g(d).inp

001079836.b3lyp_6-31g(d).qchem.inp (generated)

001079836.b3lyp_6-31g(d).gjf (generated)

001079836.b3lyp_6-31g(d).firefly.inp (generated)

001079836.b3lyp_6-31g(d).smash.inp (generated)

001079836.b3lyp_6-31g(d).nwchem.inp (generated) 001079836.b3lyp_6-31g(d).log.xz 001079836.td-b3lyp_6-31g+(d).inp 001079836.td-b3lyp_6-31g+(d).log.xz

001079836.td-b3lyp_6-31+g(d).qchem.inp (generated)

001079836.td-b3lyp_6-31+g(d).gjf (generated)

001079836.td-b3lyp_6-31+g(d).firefly.inp (generated)

001079836.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001079836.mol 001079836.PUBCHEM 001079836.mol (via Jmol)
001079837.b3lyp_6-31g(d).inp

001079837.b3lyp_6-31g(d).qchem.inp (generated)

001079837.b3lyp_6-31g(d).gjf (generated)

001079837.b3lyp_6-31g(d).firefly.inp (generated)

001079837.b3lyp_6-31g(d).smash.inp (generated)

001079837.b3lyp_6-31g(d).nwchem.inp (generated) 001079837.b3lyp_6-31g(d).log.xz 001079837.td-b3lyp_6-31g+(d).inp 001079837.td-b3lyp_6-31g+(d).log.xz

001079837.td-b3lyp_6-31+g(d).qchem.inp (generated)

001079837.td-b3lyp_6-31+g(d).gjf (generated)

001079837.td-b3lyp_6-31+g(d).firefly.inp (generated)

001079837.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001079837.mol 001079837.PUBCHEM 001079837.mol (via Jmol)
001079838.b3lyp_6-31g(d).inp

001079838.b3lyp_6-31g(d).qchem.inp (generated)

001079838.b3lyp_6-31g(d).gjf (generated)

001079838.b3lyp_6-31g(d).firefly.inp (generated)

001079838.b3lyp_6-31g(d).smash.inp (generated)

001079838.b3lyp_6-31g(d).nwchem.inp (generated) 001079838.b3lyp_6-31g(d).log.xz 001079838.td-b3lyp_6-31g+(d).inp 001079838.td-b3lyp_6-31g+(d).log.xz

001079838.td-b3lyp_6-31+g(d).qchem.inp (generated)

001079838.td-b3lyp_6-31+g(d).gjf (generated)

001079838.td-b3lyp_6-31+g(d).firefly.inp (generated)

001079838.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001079838.mol 001079838.PUBCHEM 001079838.mol (via Jmol)
001079839.b3lyp_6-31g(d).inp

001079839.b3lyp_6-31g(d).qchem.inp (generated)

001079839.b3lyp_6-31g(d).gjf (generated)

001079839.b3lyp_6-31g(d).firefly.inp (generated)

001079839.b3lyp_6-31g(d).smash.inp (generated)

001079839.b3lyp_6-31g(d).nwchem.inp (generated) 001079839.b3lyp_6-31g(d).log.xz 001079839.td-b3lyp_6-31g+(d).inp 001079839.td-b3lyp_6-31g+(d).log.xz

001079839.td-b3lyp_6-31+g(d).qchem.inp (generated)

001079839.td-b3lyp_6-31+g(d).gjf (generated)

001079839.td-b3lyp_6-31+g(d).firefly.inp (generated)

001079839.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001079839.mol 001079839.PUBCHEM 001079839.mol (via Jmol)
001079878.b3lyp_6-31g(d).inp

001079878.b3lyp_6-31g(d).qchem.inp (generated)

001079878.b3lyp_6-31g(d).gjf (generated)

001079878.b3lyp_6-31g(d).firefly.inp (generated)

001079878.b3lyp_6-31g(d).smash.inp (generated)

001079878.b3lyp_6-31g(d).nwchem.inp (generated) 001079878.b3lyp_6-31g(d).log.xz 001079878.td-b3lyp_6-31g+(d).inp 001079878.td-b3lyp_6-31g+(d).log.xz

001079878.td-b3lyp_6-31+g(d).qchem.inp (generated)

001079878.td-b3lyp_6-31+g(d).gjf (generated)

001079878.td-b3lyp_6-31+g(d).firefly.inp (generated)

001079878.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001079878.mol 001079878.PUBCHEM 001079878.mol (via Jmol)
001079884.b3lyp_6-31g(d).inp

001079884.b3lyp_6-31g(d).qchem.inp (generated)

001079884.b3lyp_6-31g(d).gjf (generated)

001079884.b3lyp_6-31g(d).firefly.inp (generated)

001079884.b3lyp_6-31g(d).smash.inp (generated)

001079884.b3lyp_6-31g(d).nwchem.inp (generated) 001079884.b3lyp_6-31g(d).log.xz 001079884.td-b3lyp_6-31g+(d).inp 001079884.td-b3lyp_6-31g+(d).log.xz

001079884.td-b3lyp_6-31+g(d).qchem.inp (generated)

001079884.td-b3lyp_6-31+g(d).gjf (generated)

001079884.td-b3lyp_6-31+g(d).firefly.inp (generated)

001079884.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001079884.mol 001079884.PUBCHEM 001079884.mol (via Jmol)
001079885.b3lyp_6-31g(d).inp

001079885.b3lyp_6-31g(d).qchem.inp (generated)

001079885.b3lyp_6-31g(d).gjf (generated)

001079885.b3lyp_6-31g(d).firefly.inp (generated)

001079885.b3lyp_6-31g(d).smash.inp (generated)

001079885.b3lyp_6-31g(d).nwchem.inp (generated) 001079885.b3lyp_6-31g(d).log.xz 001079885.td-b3lyp_6-31g+(d).inp 001079885.td-b3lyp_6-31g+(d).log.xz

001079885.td-b3lyp_6-31+g(d).qchem.inp (generated)

001079885.td-b3lyp_6-31+g(d).gjf (generated)

001079885.td-b3lyp_6-31+g(d).firefly.inp (generated)

001079885.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001079885.mol 001079885.PUBCHEM 001079885.mol (via Jmol)
001079886.b3lyp_6-31g(d).inp

001079886.b3lyp_6-31g(d).qchem.inp (generated)

001079886.b3lyp_6-31g(d).gjf (generated)

001079886.b3lyp_6-31g(d).firefly.inp (generated)

001079886.b3lyp_6-31g(d).smash.inp (generated)

001079886.b3lyp_6-31g(d).nwchem.inp (generated) 001079886.b3lyp_6-31g(d).log.xz 001079886.td-b3lyp_6-31g+(d).inp 001079886.td-b3lyp_6-31g+(d).log.xz

001079886.td-b3lyp_6-31+g(d).qchem.inp (generated)

001079886.td-b3lyp_6-31+g(d).gjf (generated)

001079886.td-b3lyp_6-31+g(d).firefly.inp (generated)

001079886.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001079886.mol 001079886.PUBCHEM 001079886.mol (via Jmol)
001080105.b3lyp_6-31g(d).inp

001080105.b3lyp_6-31g(d).qchem.inp (generated)

001080105.b3lyp_6-31g(d).gjf (generated)

001080105.b3lyp_6-31g(d).firefly.inp (generated)

001080105.b3lyp_6-31g(d).smash.inp (generated)

001080105.b3lyp_6-31g(d).nwchem.inp (generated) 001080105.b3lyp_6-31g(d).log.xz 001080105.td-b3lyp_6-31g+(d).inp 001080105.td-b3lyp_6-31g+(d).log.xz

001080105.td-b3lyp_6-31+g(d).qchem.inp (generated)

001080105.td-b3lyp_6-31+g(d).gjf (generated)

001080105.td-b3lyp_6-31+g(d).firefly.inp (generated)

001080105.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001080105.mol 001080105.PUBCHEM 001080105.mol (via Jmol)
001080113.b3lyp_6-31g(d).inp

001080113.b3lyp_6-31g(d).qchem.inp (generated)

001080113.b3lyp_6-31g(d).gjf (generated)

001080113.b3lyp_6-31g(d).firefly.inp (generated)

001080113.b3lyp_6-31g(d).smash.inp (generated)

001080113.b3lyp_6-31g(d).nwchem.inp (generated) 001080113.b3lyp_6-31g(d).log.xz 001080113.td-b3lyp_6-31g+(d).inp 001080113.td-b3lyp_6-31g+(d).log.xz

001080113.td-b3lyp_6-31+g(d).qchem.inp (generated)

001080113.td-b3lyp_6-31+g(d).gjf (generated)

001080113.td-b3lyp_6-31+g(d).firefly.inp (generated)

001080113.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001080113.mol 001080113.PUBCHEM 001080113.mol (via Jmol)
001080114.b3lyp_6-31g(d).inp

001080114.b3lyp_6-31g(d).qchem.inp (generated)

001080114.b3lyp_6-31g(d).gjf (generated)

001080114.b3lyp_6-31g(d).firefly.inp (generated)

001080114.b3lyp_6-31g(d).smash.inp (generated)

001080114.b3lyp_6-31g(d).nwchem.inp (generated) 001080114.b3lyp_6-31g(d).log.xz 001080114.td-b3lyp_6-31g+(d).inp 001080114.td-b3lyp_6-31g+(d).log.xz

001080114.td-b3lyp_6-31+g(d).qchem.inp (generated)

001080114.td-b3lyp_6-31+g(d).gjf (generated)

001080114.td-b3lyp_6-31+g(d).firefly.inp (generated)

001080114.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001080114.mol 001080114.PUBCHEM 001080114.mol (via Jmol)
001080119.b3lyp_6-31g(d).inp

001080119.b3lyp_6-31g(d).qchem.inp (generated)

001080119.b3lyp_6-31g(d).gjf (generated)

001080119.b3lyp_6-31g(d).firefly.inp (generated)

001080119.b3lyp_6-31g(d).smash.inp (generated)

001080119.b3lyp_6-31g(d).nwchem.inp (generated) 001080119.b3lyp_6-31g(d).log.xz 001080119.td-b3lyp_6-31g+(d).inp 001080119.td-b3lyp_6-31g+(d).log.xz

001080119.td-b3lyp_6-31+g(d).qchem.inp (generated)

001080119.td-b3lyp_6-31+g(d).gjf (generated)

001080119.td-b3lyp_6-31+g(d).firefly.inp (generated)

001080119.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001080119.mol 001080119.PUBCHEM 001080119.mol (via Jmol)
001080251.b3lyp_6-31g(d).inp

001080251.b3lyp_6-31g(d).qchem.inp (generated)

001080251.b3lyp_6-31g(d).gjf (generated)

001080251.b3lyp_6-31g(d).firefly.inp (generated)

001080251.b3lyp_6-31g(d).smash.inp (generated)

001080251.b3lyp_6-31g(d).nwchem.inp (generated) 001080251.b3lyp_6-31g(d).log.xz 001080251.td-b3lyp_6-31g+(d).inp 001080251.td-b3lyp_6-31g+(d).log.xz

001080251.td-b3lyp_6-31+g(d).qchem.inp (generated)

001080251.td-b3lyp_6-31+g(d).gjf (generated)

001080251.td-b3lyp_6-31+g(d).firefly.inp (generated)

001080251.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001080251.mol 001080251.PUBCHEM 001080251.mol (via Jmol)
001080267.b3lyp_6-31g(d).inp

001080267.b3lyp_6-31g(d).qchem.inp (generated)

001080267.b3lyp_6-31g(d).gjf (generated)

001080267.b3lyp_6-31g(d).firefly.inp (generated)

001080267.b3lyp_6-31g(d).smash.inp (generated)

001080267.b3lyp_6-31g(d).nwchem.inp (generated) 001080267.b3lyp_6-31g(d).log.xz 001080267.td-b3lyp_6-31g+(d).inp 001080267.td-b3lyp_6-31g+(d).log.xz

001080267.td-b3lyp_6-31+g(d).qchem.inp (generated)

001080267.td-b3lyp_6-31+g(d).gjf (generated)

001080267.td-b3lyp_6-31+g(d).firefly.inp (generated)

001080267.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001080267.mol 001080267.PUBCHEM 001080267.mol (via Jmol)
001080325.b3lyp_6-31g(d).inp

001080325.b3lyp_6-31g(d).qchem.inp (generated)

001080325.b3lyp_6-31g(d).gjf (generated)

001080325.b3lyp_6-31g(d).firefly.inp (generated)

001080325.b3lyp_6-31g(d).smash.inp (generated)

001080325.b3lyp_6-31g(d).nwchem.inp (generated) 001080325.b3lyp_6-31g(d).log.xz 001080325.td-b3lyp_6-31g+(d).inp 001080325.td-b3lyp_6-31g+(d).log.xz

001080325.td-b3lyp_6-31+g(d).qchem.inp (generated)

001080325.td-b3lyp_6-31+g(d).gjf (generated)

001080325.td-b3lyp_6-31+g(d).firefly.inp (generated)

001080325.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001080325.mol 001080325.PUBCHEM 001080325.mol (via Jmol)
001080327.b3lyp_6-31g(d).inp

001080327.b3lyp_6-31g(d).qchem.inp (generated)

001080327.b3lyp_6-31g(d).gjf (generated)

001080327.b3lyp_6-31g(d).firefly.inp (generated)

001080327.b3lyp_6-31g(d).smash.inp (generated)

001080327.b3lyp_6-31g(d).nwchem.inp (generated) 001080327.b3lyp_6-31g(d).log.xz 001080327.td-b3lyp_6-31g+(d).inp 001080327.td-b3lyp_6-31g+(d).log.xz

001080327.td-b3lyp_6-31+g(d).qchem.inp (generated)

001080327.td-b3lyp_6-31+g(d).gjf (generated)

001080327.td-b3lyp_6-31+g(d).firefly.inp (generated)

001080327.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001080327.mol 001080327.PUBCHEM 001080327.mol (via Jmol)
001080354.b3lyp_6-31g(d).inp

001080354.b3lyp_6-31g(d).qchem.inp (generated)

001080354.b3lyp_6-31g(d).gjf (generated)

001080354.b3lyp_6-31g(d).firefly.inp (generated)

001080354.b3lyp_6-31g(d).smash.inp (generated)

001080354.b3lyp_6-31g(d).nwchem.inp (generated) 001080354.b3lyp_6-31g(d).log.xz 001080354.td-b3lyp_6-31g+(d).inp 001080354.td-b3lyp_6-31g+(d).log.xz

001080354.td-b3lyp_6-31+g(d).qchem.inp (generated)

001080354.td-b3lyp_6-31+g(d).gjf (generated)

001080354.td-b3lyp_6-31+g(d).firefly.inp (generated)

001080354.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001080354.mol 001080354.PUBCHEM 001080354.mol (via Jmol)
001080485.b3lyp_6-31g(d).inp

001080485.b3lyp_6-31g(d).qchem.inp (generated)

001080485.b3lyp_6-31g(d).gjf (generated)

001080485.b3lyp_6-31g(d).firefly.inp (generated)

001080485.b3lyp_6-31g(d).smash.inp (generated)

001080485.b3lyp_6-31g(d).nwchem.inp (generated) 001080485.b3lyp_6-31g(d).log.xz 001080485.td-b3lyp_6-31g+(d).inp 001080485.td-b3lyp_6-31g+(d).log.xz

001080485.td-b3lyp_6-31+g(d).qchem.inp (generated)

001080485.td-b3lyp_6-31+g(d).gjf (generated)

001080485.td-b3lyp_6-31+g(d).firefly.inp (generated)

001080485.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001080485.mol 001080485.PUBCHEM 001080485.mol (via Jmol)
001080486.b3lyp_6-31g(d).inp

001080486.b3lyp_6-31g(d).qchem.inp (generated)

001080486.b3lyp_6-31g(d).gjf (generated)

001080486.b3lyp_6-31g(d).firefly.inp (generated)

001080486.b3lyp_6-31g(d).smash.inp (generated)

001080486.b3lyp_6-31g(d).nwchem.inp (generated) 001080486.b3lyp_6-31g(d).log.xz 001080486.td-b3lyp_6-31g+(d).inp 001080486.td-b3lyp_6-31g+(d).log.xz

001080486.td-b3lyp_6-31+g(d).qchem.inp (generated)

001080486.td-b3lyp_6-31+g(d).gjf (generated)

001080486.td-b3lyp_6-31+g(d).firefly.inp (generated)

001080486.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001080486.mol 001080486.PUBCHEM 001080486.mol (via Jmol)
001080487.b3lyp_6-31g(d).inp

001080487.b3lyp_6-31g(d).qchem.inp (generated)

001080487.b3lyp_6-31g(d).gjf (generated)

001080487.b3lyp_6-31g(d).firefly.inp (generated)

001080487.b3lyp_6-31g(d).smash.inp (generated)

001080487.b3lyp_6-31g(d).nwchem.inp (generated) 001080487.b3lyp_6-31g(d).log.xz 001080487.td-b3lyp_6-31g+(d).inp 001080487.td-b3lyp_6-31g+(d).log.xz

001080487.td-b3lyp_6-31+g(d).qchem.inp (generated)

001080487.td-b3lyp_6-31+g(d).gjf (generated)

001080487.td-b3lyp_6-31+g(d).firefly.inp (generated)

001080487.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001080487.mol 001080487.PUBCHEM 001080487.mol (via Jmol)
001080489.b3lyp_6-31g(d).inp

001080489.b3lyp_6-31g(d).qchem.inp (generated)

001080489.b3lyp_6-31g(d).gjf (generated)

001080489.b3lyp_6-31g(d).firefly.inp (generated)

001080489.b3lyp_6-31g(d).smash.inp (generated)

001080489.b3lyp_6-31g(d).nwchem.inp (generated) 001080489.b3lyp_6-31g(d).log.xz 001080489.td-b3lyp_6-31g+(d).inp 001080489.td-b3lyp_6-31g+(d).log.xz

001080489.td-b3lyp_6-31+g(d).qchem.inp (generated)

001080489.td-b3lyp_6-31+g(d).gjf (generated)

001080489.td-b3lyp_6-31+g(d).firefly.inp (generated)

001080489.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001080489.mol 001080489.PUBCHEM 001080489.mol (via Jmol)
001080491.b3lyp_6-31g(d).inp

001080491.b3lyp_6-31g(d).qchem.inp (generated)

001080491.b3lyp_6-31g(d).gjf (generated)

001080491.b3lyp_6-31g(d).firefly.inp (generated)

001080491.b3lyp_6-31g(d).smash.inp (generated)

001080491.b3lyp_6-31g(d).nwchem.inp (generated) 001080491.b3lyp_6-31g(d).log.xz 001080491.td-b3lyp_6-31g+(d).inp 001080491.td-b3lyp_6-31g+(d).log.xz

001080491.td-b3lyp_6-31+g(d).qchem.inp (generated)

001080491.td-b3lyp_6-31+g(d).gjf (generated)

001080491.td-b3lyp_6-31+g(d).firefly.inp (generated)

001080491.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001080491.mol 001080491.PUBCHEM 001080491.mol (via Jmol)
001080492.b3lyp_6-31g(d).inp

001080492.b3lyp_6-31g(d).qchem.inp (generated)

001080492.b3lyp_6-31g(d).gjf (generated)

001080492.b3lyp_6-31g(d).firefly.inp (generated)

001080492.b3lyp_6-31g(d).smash.inp (generated)

001080492.b3lyp_6-31g(d).nwchem.inp (generated) 001080492.b3lyp_6-31g(d).log.xz 001080492.td-b3lyp_6-31g+(d).inp 001080492.td-b3lyp_6-31g+(d).log.xz

001080492.td-b3lyp_6-31+g(d).qchem.inp (generated)

001080492.td-b3lyp_6-31+g(d).gjf (generated)

001080492.td-b3lyp_6-31+g(d).firefly.inp (generated)

001080492.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001080492.mol 001080492.PUBCHEM 001080492.mol (via Jmol)
001080498.b3lyp_6-31g(d).inp

001080498.b3lyp_6-31g(d).qchem.inp (generated)

001080498.b3lyp_6-31g(d).gjf (generated)

001080498.b3lyp_6-31g(d).firefly.inp (generated)

001080498.b3lyp_6-31g(d).smash.inp (generated)

001080498.b3lyp_6-31g(d).nwchem.inp (generated) 001080498.b3lyp_6-31g(d).log.xz 001080498.td-b3lyp_6-31g+(d).inp 001080498.td-b3lyp_6-31g+(d).log.xz

001080498.td-b3lyp_6-31+g(d).qchem.inp (generated)

001080498.td-b3lyp_6-31+g(d).gjf (generated)

001080498.td-b3lyp_6-31+g(d).firefly.inp (generated)

001080498.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001080498.mol 001080498.PUBCHEM 001080498.mol (via Jmol)
001080589.b3lyp_6-31g(d).inp

001080589.b3lyp_6-31g(d).qchem.inp (generated)

001080589.b3lyp_6-31g(d).gjf (generated)

001080589.b3lyp_6-31g(d).firefly.inp (generated)

001080589.b3lyp_6-31g(d).smash.inp (generated)

001080589.b3lyp_6-31g(d).nwchem.inp (generated) 001080589.b3lyp_6-31g(d).log.xz 001080589.mol 001080589.PUBCHEM 001080589.mol (via Jmol)
001080590.b3lyp_6-31g(d).inp

001080590.b3lyp_6-31g(d).qchem.inp (generated)

001080590.b3lyp_6-31g(d).gjf (generated)

001080590.b3lyp_6-31g(d).firefly.inp (generated)

001080590.b3lyp_6-31g(d).smash.inp (generated)

001080590.b3lyp_6-31g(d).nwchem.inp (generated) 001080590.b3lyp_6-31g(d).log.xz 001080590.mol 001080590.PUBCHEM 001080590.mol (via Jmol)
001080679.b3lyp_6-31g(d).inp

001080679.b3lyp_6-31g(d).qchem.inp (generated)

001080679.b3lyp_6-31g(d).gjf (generated)

001080679.b3lyp_6-31g(d).firefly.inp (generated)

001080679.b3lyp_6-31g(d).smash.inp (generated)

001080679.b3lyp_6-31g(d).nwchem.inp (generated) 001080679.b3lyp_6-31g(d).log.xz 001080679.td-b3lyp_6-31g+(d).inp 001080679.td-b3lyp_6-31g+(d).log.xz

001080679.td-b3lyp_6-31+g(d).qchem.inp (generated)

001080679.td-b3lyp_6-31+g(d).gjf (generated)

001080679.td-b3lyp_6-31+g(d).firefly.inp (generated)

001080679.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001080679.mol 001080679.PUBCHEM 001080679.mol (via Jmol)
001080953.b3lyp_6-31g(d).inp

001080953.b3lyp_6-31g(d).qchem.inp (generated)

001080953.b3lyp_6-31g(d).gjf (generated)

001080953.b3lyp_6-31g(d).firefly.inp (generated)

001080953.b3lyp_6-31g(d).smash.inp (generated)

001080953.b3lyp_6-31g(d).nwchem.inp (generated) 001080953.b3lyp_6-31g(d).log.xz 001080953.mol 001080953.PUBCHEM 001080953.mol (via Jmol)
001080968.b3lyp_6-31g(d).inp

001080968.b3lyp_6-31g(d).qchem.inp (generated)

001080968.b3lyp_6-31g(d).gjf (generated)

001080968.b3lyp_6-31g(d).firefly.inp (generated)

001080968.b3lyp_6-31g(d).smash.inp (generated)

001080968.b3lyp_6-31g(d).nwchem.inp (generated) 001080968.b3lyp_6-31g(d).log.xz 001080968.td-b3lyp_6-31g+(d).inp 001080968.td-b3lyp_6-31g+(d).log.xz

001080968.td-b3lyp_6-31+g(d).qchem.inp (generated)

001080968.td-b3lyp_6-31+g(d).gjf (generated)

001080968.td-b3lyp_6-31+g(d).firefly.inp (generated)

001080968.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001080968.mol 001080968.PUBCHEM 001080968.mol (via Jmol)
001080969.b3lyp_6-31g(d).inp

001080969.b3lyp_6-31g(d).qchem.inp (generated)

001080969.b3lyp_6-31g(d).gjf (generated)

001080969.b3lyp_6-31g(d).firefly.inp (generated)

001080969.b3lyp_6-31g(d).smash.inp (generated)

001080969.b3lyp_6-31g(d).nwchem.inp (generated) 001080969.b3lyp_6-31g(d).log.xz 001080969.td-b3lyp_6-31g+(d).inp 001080969.td-b3lyp_6-31g+(d).log.xz

001080969.td-b3lyp_6-31+g(d).qchem.inp (generated)

001080969.td-b3lyp_6-31+g(d).gjf (generated)

001080969.td-b3lyp_6-31+g(d).firefly.inp (generated)

001080969.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001080969.mol 001080969.PUBCHEM 001080969.mol (via Jmol)
001080977.b3lyp_6-31g(d).inp

001080977.b3lyp_6-31g(d).qchem.inp (generated)

001080977.b3lyp_6-31g(d).gjf (generated)

001080977.b3lyp_6-31g(d).firefly.inp (generated)

001080977.b3lyp_6-31g(d).smash.inp (generated)

001080977.b3lyp_6-31g(d).nwchem.inp (generated) 001080977.b3lyp_6-31g(d).log.xz 001080977.td-b3lyp_6-31g+(d).inp 001080977.td-b3lyp_6-31g+(d).log.xz

001080977.td-b3lyp_6-31+g(d).qchem.inp (generated)

001080977.td-b3lyp_6-31+g(d).gjf (generated)

001080977.td-b3lyp_6-31+g(d).firefly.inp (generated)

001080977.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001080977.mol 001080977.PUBCHEM 001080977.mol (via Jmol)
001080978.b3lyp_6-31g(d).inp

001080978.b3lyp_6-31g(d).qchem.inp (generated)

001080978.b3lyp_6-31g(d).gjf (generated)

001080978.b3lyp_6-31g(d).firefly.inp (generated)

001080978.b3lyp_6-31g(d).smash.inp (generated)

001080978.b3lyp_6-31g(d).nwchem.inp (generated) 001080978.b3lyp_6-31g(d).log.xz 001080978.td-b3lyp_6-31g+(d).inp 001080978.td-b3lyp_6-31g+(d).log.xz

001080978.td-b3lyp_6-31+g(d).qchem.inp (generated)

001080978.td-b3lyp_6-31+g(d).gjf (generated)

001080978.td-b3lyp_6-31+g(d).firefly.inp (generated)

001080978.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001080978.mol 001080978.PUBCHEM 001080978.mol (via Jmol)
001080988.b3lyp_6-31g(d).inp

001080988.b3lyp_6-31g(d).qchem.inp (generated)

001080988.b3lyp_6-31g(d).gjf (generated)

001080988.b3lyp_6-31g(d).firefly.inp (generated)

001080988.b3lyp_6-31g(d).smash.inp (generated)

001080988.b3lyp_6-31g(d).nwchem.inp (generated) 001080988.b3lyp_6-31g(d).log.xz 001080988.mol 001080988.PUBCHEM 001080988.mol (via Jmol)
001080992.b3lyp_6-31g(d).inp

001080992.b3lyp_6-31g(d).qchem.inp (generated)

001080992.b3lyp_6-31g(d).gjf (generated)

001080992.b3lyp_6-31g(d).firefly.inp (generated)

001080992.b3lyp_6-31g(d).smash.inp (generated)

001080992.b3lyp_6-31g(d).nwchem.inp (generated) 001080992.b3lyp_6-31g(d).log.xz 001080992.td-b3lyp_6-31g+(d).inp 001080992.td-b3lyp_6-31g+(d).log.xz

001080992.td-b3lyp_6-31+g(d).qchem.inp (generated)

001080992.td-b3lyp_6-31+g(d).gjf (generated)

001080992.td-b3lyp_6-31+g(d).firefly.inp (generated)

001080992.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001080992.mol 001080992.PUBCHEM 001080992.mol (via Jmol)
001081235.b3lyp_6-31g(d).inp

001081235.b3lyp_6-31g(d).qchem.inp (generated)

001081235.b3lyp_6-31g(d).gjf (generated)

001081235.b3lyp_6-31g(d).firefly.inp (generated)

001081235.b3lyp_6-31g(d).smash.inp (generated)

001081235.b3lyp_6-31g(d).nwchem.inp (generated) 001081235.b3lyp_6-31g(d).log.xz 001081235.td-b3lyp_6-31g+(d).inp 001081235.td-b3lyp_6-31g+(d).log.xz

001081235.td-b3lyp_6-31+g(d).qchem.inp (generated)

001081235.td-b3lyp_6-31+g(d).gjf (generated)

001081235.td-b3lyp_6-31+g(d).firefly.inp (generated)

001081235.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001081235.mol 001081235.PUBCHEM 001081235.mol (via Jmol)
001081236.b3lyp_6-31g(d).inp

001081236.b3lyp_6-31g(d).qchem.inp (generated)

001081236.b3lyp_6-31g(d).gjf (generated)

001081236.b3lyp_6-31g(d).firefly.inp (generated)

001081236.b3lyp_6-31g(d).smash.inp (generated)

001081236.b3lyp_6-31g(d).nwchem.inp (generated) 001081236.b3lyp_6-31g(d).log.xz 001081236.td-b3lyp_6-31g+(d).inp 001081236.td-b3lyp_6-31g+(d).log.xz

001081236.td-b3lyp_6-31+g(d).qchem.inp (generated)

001081236.td-b3lyp_6-31+g(d).gjf (generated)

001081236.td-b3lyp_6-31+g(d).firefly.inp (generated)

001081236.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001081236.mol 001081236.PUBCHEM 001081236.mol (via Jmol)
001081275.b3lyp_6-31g(d).inp

001081275.b3lyp_6-31g(d).qchem.inp (generated)

001081275.b3lyp_6-31g(d).gjf (generated)

001081275.b3lyp_6-31g(d).firefly.inp (generated)

001081275.b3lyp_6-31g(d).smash.inp (generated)

001081275.b3lyp_6-31g(d).nwchem.inp (generated) 001081275.b3lyp_6-31g(d).log.xz 001081275.td-b3lyp_6-31g+(d).inp 001081275.td-b3lyp_6-31g+(d).log.xz

001081275.td-b3lyp_6-31+g(d).qchem.inp (generated)

001081275.td-b3lyp_6-31+g(d).gjf (generated)

001081275.td-b3lyp_6-31+g(d).firefly.inp (generated)

001081275.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001081275.mol 001081275.PUBCHEM 001081275.mol (via Jmol)
001081357.b3lyp_6-31g(d).inp

001081357.b3lyp_6-31g(d).qchem.inp (generated)

001081357.b3lyp_6-31g(d).gjf (generated)

001081357.b3lyp_6-31g(d).firefly.inp (generated)

001081357.b3lyp_6-31g(d).smash.inp (generated)

001081357.b3lyp_6-31g(d).nwchem.inp (generated) 001081357.b3lyp_6-31g(d).log.xz 001081357.mol 001081357.PUBCHEM 001081357.mol (via Jmol)
001081500.b3lyp_6-31g(d).inp

001081500.b3lyp_6-31g(d).qchem.inp (generated)

001081500.b3lyp_6-31g(d).gjf (generated)

001081500.b3lyp_6-31g(d).firefly.inp (generated)

001081500.b3lyp_6-31g(d).smash.inp (generated)

001081500.b3lyp_6-31g(d).nwchem.inp (generated) 001081500.b3lyp_6-31g(d).log.xz 001081500.td-b3lyp_6-31g+(d).inp 001081500.td-b3lyp_6-31g+(d).log.xz

001081500.td-b3lyp_6-31+g(d).qchem.inp (generated)

001081500.td-b3lyp_6-31+g(d).gjf (generated)

001081500.td-b3lyp_6-31+g(d).firefly.inp (generated)

001081500.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001081500.mol 001081500.PUBCHEM 001081500.mol (via Jmol)
001081501.b3lyp_6-31g(d).inp

001081501.b3lyp_6-31g(d).qchem.inp (generated)

001081501.b3lyp_6-31g(d).gjf (generated)

001081501.b3lyp_6-31g(d).firefly.inp (generated)

001081501.b3lyp_6-31g(d).smash.inp (generated)

001081501.b3lyp_6-31g(d).nwchem.inp (generated) 001081501.b3lyp_6-31g(d).log.xz 001081501.td-b3lyp_6-31g+(d).inp 001081501.td-b3lyp_6-31g+(d).log.xz

001081501.td-b3lyp_6-31+g(d).qchem.inp (generated)

001081501.td-b3lyp_6-31+g(d).gjf (generated)

001081501.td-b3lyp_6-31+g(d).firefly.inp (generated)

001081501.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001081501.mol 001081501.PUBCHEM 001081501.mol (via Jmol)
001081536.b3lyp_6-31g(d).inp

001081536.b3lyp_6-31g(d).qchem.inp (generated)

001081536.b3lyp_6-31g(d).gjf (generated)

001081536.b3lyp_6-31g(d).firefly.inp (generated)

001081536.b3lyp_6-31g(d).smash.inp (generated)

001081536.b3lyp_6-31g(d).nwchem.inp (generated) 001081536.b3lyp_6-31g(d).log.xz 001081536.td-b3lyp_6-31g+(d).inp 001081536.td-b3lyp_6-31g+(d).log.xz

001081536.td-b3lyp_6-31+g(d).qchem.inp (generated)

001081536.td-b3lyp_6-31+g(d).gjf (generated)

001081536.td-b3lyp_6-31+g(d).firefly.inp (generated)

001081536.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001081536.mol 001081536.PUBCHEM 001081536.mol (via Jmol)
001081702.b3lyp_6-31g(d).inp

001081702.b3lyp_6-31g(d).qchem.inp (generated)

001081702.b3lyp_6-31g(d).gjf (generated)

001081702.b3lyp_6-31g(d).firefly.inp (generated)

001081702.b3lyp_6-31g(d).smash.inp (generated)

001081702.b3lyp_6-31g(d).nwchem.inp (generated) 001081702.b3lyp_6-31g(d).log.xz 001081702.td-b3lyp_6-31g+(d).inp 001081702.td-b3lyp_6-31g+(d).log.xz

001081702.td-b3lyp_6-31+g(d).qchem.inp (generated)

001081702.td-b3lyp_6-31+g(d).gjf (generated)

001081702.td-b3lyp_6-31+g(d).firefly.inp (generated)

001081702.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001081702.mol 001081702.PUBCHEM 001081702.mol (via Jmol)
001081703.b3lyp_6-31g(d).inp

001081703.b3lyp_6-31g(d).qchem.inp (generated)

001081703.b3lyp_6-31g(d).gjf (generated)

001081703.b3lyp_6-31g(d).firefly.inp (generated)

001081703.b3lyp_6-31g(d).smash.inp (generated)

001081703.b3lyp_6-31g(d).nwchem.inp (generated) 001081703.b3lyp_6-31g(d).log.xz 001081703.td-b3lyp_6-31g+(d).inp 001081703.td-b3lyp_6-31g+(d).log.xz

001081703.td-b3lyp_6-31+g(d).qchem.inp (generated)

001081703.td-b3lyp_6-31+g(d).gjf (generated)

001081703.td-b3lyp_6-31+g(d).firefly.inp (generated)

001081703.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001081703.mol 001081703.PUBCHEM 001081703.mol (via Jmol)
001081722.b3lyp_6-31g(d).inp

001081722.b3lyp_6-31g(d).qchem.inp (generated)

001081722.b3lyp_6-31g(d).gjf (generated)

001081722.b3lyp_6-31g(d).firefly.inp (generated)

001081722.b3lyp_6-31g(d).smash.inp (generated)

001081722.b3lyp_6-31g(d).nwchem.inp (generated) 001081722.b3lyp_6-31g(d).log.xz 001081722.td-b3lyp_6-31g+(d).inp 001081722.td-b3lyp_6-31g+(d).log.xz

001081722.td-b3lyp_6-31+g(d).qchem.inp (generated)

001081722.td-b3lyp_6-31+g(d).gjf (generated)

001081722.td-b3lyp_6-31+g(d).firefly.inp (generated)

001081722.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001081722.mol 001081722.PUBCHEM 001081722.mol (via Jmol)
001081818.b3lyp_6-31g(d).inp

001081818.b3lyp_6-31g(d).qchem.inp (generated)

001081818.b3lyp_6-31g(d).gjf (generated)

001081818.b3lyp_6-31g(d).firefly.inp (generated)

001081818.b3lyp_6-31g(d).smash.inp (generated)

001081818.b3lyp_6-31g(d).nwchem.inp (generated) 001081818.b3lyp_6-31g(d).log.xz 001081818.td-b3lyp_6-31g+(d).inp 001081818.td-b3lyp_6-31g+(d).log.xz

001081818.td-b3lyp_6-31+g(d).qchem.inp (generated)

001081818.td-b3lyp_6-31+g(d).gjf (generated)

001081818.td-b3lyp_6-31+g(d).firefly.inp (generated)

001081818.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001081818.mol 001081818.PUBCHEM 001081818.mol (via Jmol)
001081836.b3lyp_6-31g(d).inp

001081836.b3lyp_6-31g(d).qchem.inp (generated)

001081836.b3lyp_6-31g(d).gjf (generated)

001081836.b3lyp_6-31g(d).firefly.inp (generated)

001081836.b3lyp_6-31g(d).smash.inp (generated)

001081836.b3lyp_6-31g(d).nwchem.inp (generated) 001081836.b3lyp_6-31g(d).log.xz 001081836.td-b3lyp_6-31g+(d).inp 001081836.td-b3lyp_6-31g+(d).log.xz

001081836.td-b3lyp_6-31+g(d).qchem.inp (generated)

001081836.td-b3lyp_6-31+g(d).gjf (generated)

001081836.td-b3lyp_6-31+g(d).firefly.inp (generated)

001081836.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001081836.mol 001081836.PUBCHEM 001081836.mol (via Jmol)
001081837.b3lyp_6-31g(d).inp

001081837.b3lyp_6-31g(d).qchem.inp (generated)

001081837.b3lyp_6-31g(d).gjf (generated)

001081837.b3lyp_6-31g(d).firefly.inp (generated)

001081837.b3lyp_6-31g(d).smash.inp (generated)

001081837.b3lyp_6-31g(d).nwchem.inp (generated) 001081837.b3lyp_6-31g(d).log.xz 001081837.td-b3lyp_6-31g+(d).inp 001081837.td-b3lyp_6-31g+(d).log.xz

001081837.td-b3lyp_6-31+g(d).qchem.inp (generated)

001081837.td-b3lyp_6-31+g(d).gjf (generated)

001081837.td-b3lyp_6-31+g(d).firefly.inp (generated)

001081837.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001081837.mol 001081837.PUBCHEM 001081837.mol (via Jmol)
001081838.b3lyp_6-31g(d).inp

001081838.b3lyp_6-31g(d).qchem.inp (generated)

001081838.b3lyp_6-31g(d).gjf (generated)

001081838.b3lyp_6-31g(d).firefly.inp (generated)

001081838.b3lyp_6-31g(d).smash.inp (generated)

001081838.b3lyp_6-31g(d).nwchem.inp (generated) 001081838.b3lyp_6-31g(d).log.xz 001081838.td-b3lyp_6-31g+(d).inp 001081838.td-b3lyp_6-31g+(d).log.xz

001081838.td-b3lyp_6-31+g(d).qchem.inp (generated)

001081838.td-b3lyp_6-31+g(d).gjf (generated)

001081838.td-b3lyp_6-31+g(d).firefly.inp (generated)

001081838.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001081838.mol 001081838.PUBCHEM 001081838.mol (via Jmol)
001082255.b3lyp_6-31g(d).inp

001082255.b3lyp_6-31g(d).qchem.inp (generated)

001082255.b3lyp_6-31g(d).gjf (generated)

001082255.b3lyp_6-31g(d).firefly.inp (generated)

001082255.b3lyp_6-31g(d).smash.inp (generated)

001082255.b3lyp_6-31g(d).nwchem.inp (generated) 001082255.b3lyp_6-31g(d).log.xz 001082255.mol 001082255.PUBCHEM 001082255.mol (via Jmol)
001082256.b3lyp_6-31g(d).inp

001082256.b3lyp_6-31g(d).qchem.inp (generated)

001082256.b3lyp_6-31g(d).gjf (generated)

001082256.b3lyp_6-31g(d).firefly.inp (generated)

001082256.b3lyp_6-31g(d).smash.inp (generated)

001082256.b3lyp_6-31g(d).nwchem.inp (generated) 001082256.b3lyp_6-31g(d).log.xz 001082256.mol 001082256.PUBCHEM 001082256.mol (via Jmol)
001082635.b3lyp_6-31g(d).inp

001082635.b3lyp_6-31g(d).qchem.inp (generated)

001082635.b3lyp_6-31g(d).gjf (generated)

001082635.b3lyp_6-31g(d).firefly.inp (generated)

001082635.b3lyp_6-31g(d).smash.inp (generated)

001082635.b3lyp_6-31g(d).nwchem.inp (generated) 001082635.b3lyp_6-31g(d).log.xz 001082635.td-b3lyp_6-31g+(d).inp 001082635.td-b3lyp_6-31g+(d).log.xz

001082635.td-b3lyp_6-31+g(d).qchem.inp (generated)

001082635.td-b3lyp_6-31+g(d).gjf (generated)

001082635.td-b3lyp_6-31+g(d).firefly.inp (generated)

001082635.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001082635.mol 001082635.PUBCHEM 001082635.mol (via Jmol)
001082698.b3lyp_6-31g(d).inp

001082698.b3lyp_6-31g(d).qchem.inp (generated)

001082698.b3lyp_6-31g(d).gjf (generated)

001082698.b3lyp_6-31g(d).firefly.inp (generated)

001082698.b3lyp_6-31g(d).smash.inp (generated)

001082698.b3lyp_6-31g(d).nwchem.inp (generated) 001082698.b3lyp_6-31g(d).log.xz 001082698.td-b3lyp_6-31g+(d).inp 001082698.td-b3lyp_6-31g+(d).log.xz

001082698.td-b3lyp_6-31+g(d).qchem.inp (generated)

001082698.td-b3lyp_6-31+g(d).gjf (generated)

001082698.td-b3lyp_6-31+g(d).firefly.inp (generated)

001082698.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001082698.mol 001082698.PUBCHEM 001082698.mol (via Jmol)
001082699.b3lyp_6-31g(d).inp

001082699.b3lyp_6-31g(d).qchem.inp (generated)

001082699.b3lyp_6-31g(d).gjf (generated)

001082699.b3lyp_6-31g(d).firefly.inp (generated)

001082699.b3lyp_6-31g(d).smash.inp (generated)

001082699.b3lyp_6-31g(d).nwchem.inp (generated) 001082699.b3lyp_6-31g(d).log.xz 001082699.td-b3lyp_6-31g+(d).inp 001082699.td-b3lyp_6-31g+(d).log.xz

001082699.td-b3lyp_6-31+g(d).qchem.inp (generated)

001082699.td-b3lyp_6-31+g(d).gjf (generated)

001082699.td-b3lyp_6-31+g(d).firefly.inp (generated)

001082699.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001082699.mol 001082699.PUBCHEM 001082699.mol (via Jmol)
001082700.b3lyp_6-31g(d).inp

001082700.b3lyp_6-31g(d).qchem.inp (generated)

001082700.b3lyp_6-31g(d).gjf (generated)

001082700.b3lyp_6-31g(d).firefly.inp (generated)

001082700.b3lyp_6-31g(d).smash.inp (generated)

001082700.b3lyp_6-31g(d).nwchem.inp (generated) 001082700.b3lyp_6-31g(d).log.xz 001082700.td-b3lyp_6-31g+(d).inp 001082700.td-b3lyp_6-31g+(d).log.xz

001082700.td-b3lyp_6-31+g(d).qchem.inp (generated)

001082700.td-b3lyp_6-31+g(d).gjf (generated)

001082700.td-b3lyp_6-31+g(d).firefly.inp (generated)

001082700.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001082700.mol 001082700.PUBCHEM 001082700.mol (via Jmol)
001082701.b3lyp_6-31g(d).inp

001082701.b3lyp_6-31g(d).qchem.inp (generated)

001082701.b3lyp_6-31g(d).gjf (generated)

001082701.b3lyp_6-31g(d).firefly.inp (generated)

001082701.b3lyp_6-31g(d).smash.inp (generated)

001082701.b3lyp_6-31g(d).nwchem.inp (generated) 001082701.b3lyp_6-31g(d).log.xz 001082701.td-b3lyp_6-31g+(d).inp 001082701.td-b3lyp_6-31g+(d).log.xz

001082701.td-b3lyp_6-31+g(d).qchem.inp (generated)

001082701.td-b3lyp_6-31+g(d).gjf (generated)

001082701.td-b3lyp_6-31+g(d).firefly.inp (generated)

001082701.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001082701.mol 001082701.PUBCHEM 001082701.mol (via Jmol)
001082702.b3lyp_6-31g(d).inp

001082702.b3lyp_6-31g(d).qchem.inp (generated)

001082702.b3lyp_6-31g(d).gjf (generated)

001082702.b3lyp_6-31g(d).firefly.inp (generated)

001082702.b3lyp_6-31g(d).smash.inp (generated)

001082702.b3lyp_6-31g(d).nwchem.inp (generated) 001082702.b3lyp_6-31g(d).log.xz 001082702.td-b3lyp_6-31g+(d).inp 001082702.td-b3lyp_6-31g+(d).log.xz

001082702.td-b3lyp_6-31+g(d).qchem.inp (generated)

001082702.td-b3lyp_6-31+g(d).gjf (generated)

001082702.td-b3lyp_6-31+g(d).firefly.inp (generated)

001082702.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001082702.mol 001082702.PUBCHEM 001082702.mol (via Jmol)
001082703.b3lyp_6-31g(d).inp

001082703.b3lyp_6-31g(d).qchem.inp (generated)

001082703.b3lyp_6-31g(d).gjf (generated)

001082703.b3lyp_6-31g(d).firefly.inp (generated)

001082703.b3lyp_6-31g(d).smash.inp (generated)

001082703.b3lyp_6-31g(d).nwchem.inp (generated) 001082703.b3lyp_6-31g(d).log.xz 001082703.td-b3lyp_6-31g+(d).inp 001082703.td-b3lyp_6-31g+(d).log.xz

001082703.td-b3lyp_6-31+g(d).qchem.inp (generated)

001082703.td-b3lyp_6-31+g(d).gjf (generated)

001082703.td-b3lyp_6-31+g(d).firefly.inp (generated)

001082703.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001082703.mol 001082703.PUBCHEM 001082703.mol (via Jmol)
001082704.b3lyp_6-31g(d).inp

001082704.b3lyp_6-31g(d).qchem.inp (generated)

001082704.b3lyp_6-31g(d).gjf (generated)

001082704.b3lyp_6-31g(d).firefly.inp (generated)

001082704.b3lyp_6-31g(d).smash.inp (generated)

001082704.b3lyp_6-31g(d).nwchem.inp (generated) 001082704.b3lyp_6-31g(d).log.xz 001082704.td-b3lyp_6-31g+(d).inp 001082704.td-b3lyp_6-31g+(d).log.xz

001082704.td-b3lyp_6-31+g(d).qchem.inp (generated)

001082704.td-b3lyp_6-31+g(d).gjf (generated)

001082704.td-b3lyp_6-31+g(d).firefly.inp (generated)

001082704.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001082704.mol 001082704.PUBCHEM 001082704.mol (via Jmol)
001082887.b3lyp_6-31g(d).inp

001082887.b3lyp_6-31g(d).qchem.inp (generated)

001082887.b3lyp_6-31g(d).gjf (generated)

001082887.b3lyp_6-31g(d).firefly.inp (generated)

001082887.b3lyp_6-31g(d).smash.inp (generated)

001082887.b3lyp_6-31g(d).nwchem.inp (generated) 001082887.b3lyp_6-31g(d).log.xz 001082887.mol 001082887.PUBCHEM 001082887.mol (via Jmol)
001082919.b3lyp_6-31g(d).inp

001082919.b3lyp_6-31g(d).qchem.inp (generated)

001082919.b3lyp_6-31g(d).gjf (generated)

001082919.b3lyp_6-31g(d).firefly.inp (generated)

001082919.b3lyp_6-31g(d).smash.inp (generated)

001082919.b3lyp_6-31g(d).nwchem.inp (generated) 001082919.b3lyp_6-31g(d).log.xz 001082919.td-b3lyp_6-31g+(d).inp 001082919.td-b3lyp_6-31g+(d).log.xz

001082919.td-b3lyp_6-31+g(d).qchem.inp (generated)

001082919.td-b3lyp_6-31+g(d).gjf (generated)

001082919.td-b3lyp_6-31+g(d).firefly.inp (generated)

001082919.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001082919.mol 001082919.PUBCHEM 001082919.mol (via Jmol)
001082989.b3lyp_6-31g(d).inp

001082989.b3lyp_6-31g(d).qchem.inp (generated)

001082989.b3lyp_6-31g(d).gjf (generated)

001082989.b3lyp_6-31g(d).firefly.inp (generated)

001082989.b3lyp_6-31g(d).smash.inp (generated)

001082989.b3lyp_6-31g(d).nwchem.inp (generated) 001082989.b3lyp_6-31g(d).log.xz 001082989.td-b3lyp_6-31g+(d).inp 001082989.td-b3lyp_6-31g+(d).log.xz

001082989.td-b3lyp_6-31+g(d).qchem.inp (generated)

001082989.td-b3lyp_6-31+g(d).gjf (generated)

001082989.td-b3lyp_6-31+g(d).firefly.inp (generated)

001082989.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001082989.mol 001082989.PUBCHEM 001082989.mol (via Jmol)
001083172.b3lyp_6-31g(d).inp

001083172.b3lyp_6-31g(d).qchem.inp (generated)

001083172.b3lyp_6-31g(d).gjf (generated)

001083172.b3lyp_6-31g(d).firefly.inp (generated)

001083172.b3lyp_6-31g(d).smash.inp (generated)

001083172.b3lyp_6-31g(d).nwchem.inp (generated) 001083172.b3lyp_6-31g(d).log.xz 001083172.td-b3lyp_6-31g+(d).inp 001083172.td-b3lyp_6-31g+(d).log.xz

001083172.td-b3lyp_6-31+g(d).qchem.inp (generated)

001083172.td-b3lyp_6-31+g(d).gjf (generated)

001083172.td-b3lyp_6-31+g(d).firefly.inp (generated)

001083172.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001083172.mol 001083172.PUBCHEM 001083172.mol (via Jmol)
001083210.b3lyp_6-31g(d).inp

001083210.b3lyp_6-31g(d).qchem.inp (generated)

001083210.b3lyp_6-31g(d).gjf (generated)

001083210.b3lyp_6-31g(d).firefly.inp (generated)

001083210.b3lyp_6-31g(d).smash.inp (generated)

001083210.b3lyp_6-31g(d).nwchem.inp (generated) 001083210.b3lyp_6-31g(d).log.xz 001083210.td-b3lyp_6-31g+(d).inp 001083210.td-b3lyp_6-31g+(d).log.xz

001083210.td-b3lyp_6-31+g(d).qchem.inp (generated)

001083210.td-b3lyp_6-31+g(d).gjf (generated)

001083210.td-b3lyp_6-31+g(d).firefly.inp (generated)

001083210.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001083210.mol 001083210.PUBCHEM 001083210.mol (via Jmol)
001083407.b3lyp_6-31g(d).inp

001083407.b3lyp_6-31g(d).qchem.inp (generated)

001083407.b3lyp_6-31g(d).gjf (generated)

001083407.b3lyp_6-31g(d).firefly.inp (generated)

001083407.b3lyp_6-31g(d).smash.inp (generated)

001083407.b3lyp_6-31g(d).nwchem.inp (generated) 001083407.b3lyp_6-31g(d).log.xz 001083407.mol 001083407.PUBCHEM 001083407.mol (via Jmol)
001084008.b3lyp_6-31g(d).inp

001084008.b3lyp_6-31g(d).qchem.inp (generated)

001084008.b3lyp_6-31g(d).gjf (generated)

001084008.b3lyp_6-31g(d).firefly.inp (generated)

001084008.b3lyp_6-31g(d).smash.inp (generated)

001084008.b3lyp_6-31g(d).nwchem.inp (generated) 001084008.b3lyp_6-31g(d).log.xz 001084008.mol 001084008.PUBCHEM 001084008.mol (via Jmol)
001084009.b3lyp_6-31g(d).inp

001084009.b3lyp_6-31g(d).qchem.inp (generated)

001084009.b3lyp_6-31g(d).gjf (generated)

001084009.b3lyp_6-31g(d).firefly.inp (generated)

001084009.b3lyp_6-31g(d).smash.inp (generated)

001084009.b3lyp_6-31g(d).nwchem.inp (generated) 001084009.b3lyp_6-31g(d).log.xz 001084009.mol 001084009.PUBCHEM 001084009.mol (via Jmol)
001084296.b3lyp_6-31g(d).inp

001084296.b3lyp_6-31g(d).qchem.inp (generated)

001084296.b3lyp_6-31g(d).gjf (generated)

001084296.b3lyp_6-31g(d).firefly.inp (generated)

001084296.b3lyp_6-31g(d).smash.inp (generated)

001084296.b3lyp_6-31g(d).nwchem.inp (generated) 001084296.b3lyp_6-31g(d).log.xz 001084296.td-b3lyp_6-31g+(d).inp 001084296.td-b3lyp_6-31g+(d).log.xz

001084296.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084296.td-b3lyp_6-31+g(d).gjf (generated)

001084296.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084296.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084296.mol 001084296.PUBCHEM 001084296.mol (via Jmol)
001084304.b3lyp_6-31g(d).inp

001084304.b3lyp_6-31g(d).qchem.inp (generated)

001084304.b3lyp_6-31g(d).gjf (generated)

001084304.b3lyp_6-31g(d).firefly.inp (generated)

001084304.b3lyp_6-31g(d).smash.inp (generated)

001084304.b3lyp_6-31g(d).nwchem.inp (generated) 001084304.b3lyp_6-31g(d).log.xz 001084304.mol 001084304.PUBCHEM 001084304.mol (via Jmol)
001084305.b3lyp_6-31g(d).inp

001084305.b3lyp_6-31g(d).qchem.inp (generated)

001084305.b3lyp_6-31g(d).gjf (generated)

001084305.b3lyp_6-31g(d).firefly.inp (generated)

001084305.b3lyp_6-31g(d).smash.inp (generated)

001084305.b3lyp_6-31g(d).nwchem.inp (generated) 001084305.b3lyp_6-31g(d).log.xz 001084305.mol 001084305.PUBCHEM 001084305.mol (via Jmol)
001084363.b3lyp_6-31g(d).inp

001084363.b3lyp_6-31g(d).qchem.inp (generated)

001084363.b3lyp_6-31g(d).gjf (generated)

001084363.b3lyp_6-31g(d).firefly.inp (generated)

001084363.b3lyp_6-31g(d).smash.inp (generated)

001084363.b3lyp_6-31g(d).nwchem.inp (generated) 001084363.b3lyp_6-31g(d).log.xz 001084363.td-b3lyp_6-31g+(d).inp 001084363.td-b3lyp_6-31g+(d).log.xz

001084363.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084363.td-b3lyp_6-31+g(d).gjf (generated)

001084363.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084363.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084363.mol 001084363.PUBCHEM 001084363.mol (via Jmol)
001084373.b3lyp_6-31g(d).inp

001084373.b3lyp_6-31g(d).qchem.inp (generated)

001084373.b3lyp_6-31g(d).gjf (generated)

001084373.b3lyp_6-31g(d).firefly.inp (generated)

001084373.b3lyp_6-31g(d).smash.inp (generated)

001084373.b3lyp_6-31g(d).nwchem.inp (generated) 001084373.b3lyp_6-31g(d).log.xz 001084373.td-b3lyp_6-31g+(d).inp 001084373.td-b3lyp_6-31g+(d).log.xz

001084373.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084373.td-b3lyp_6-31+g(d).gjf (generated)

001084373.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084373.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084373.mol 001084373.PUBCHEM 001084373.mol (via Jmol)
001084418.b3lyp_6-31g(d).inp

001084418.b3lyp_6-31g(d).qchem.inp (generated)

001084418.b3lyp_6-31g(d).gjf (generated)

001084418.b3lyp_6-31g(d).firefly.inp (generated)

001084418.b3lyp_6-31g(d).smash.inp (generated)

001084418.b3lyp_6-31g(d).nwchem.inp (generated) 001084418.b3lyp_6-31g(d).log.xz 001084418.td-b3lyp_6-31g+(d).inp 001084418.td-b3lyp_6-31g+(d).log.xz

001084418.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084418.td-b3lyp_6-31+g(d).gjf (generated)

001084418.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084418.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084418.mol 001084418.PUBCHEM 001084418.mol (via Jmol)
001084419.b3lyp_6-31g(d).inp

001084419.b3lyp_6-31g(d).qchem.inp (generated)

001084419.b3lyp_6-31g(d).gjf (generated)

001084419.b3lyp_6-31g(d).firefly.inp (generated)

001084419.b3lyp_6-31g(d).smash.inp (generated)

001084419.b3lyp_6-31g(d).nwchem.inp (generated) 001084419.b3lyp_6-31g(d).log.xz 001084419.td-b3lyp_6-31g+(d).inp 001084419.td-b3lyp_6-31g+(d).log.xz

001084419.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084419.td-b3lyp_6-31+g(d).gjf (generated)

001084419.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084419.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084419.mol 001084419.PUBCHEM 001084419.mol (via Jmol)
001084592.b3lyp_6-31g(d).inp

001084592.b3lyp_6-31g(d).qchem.inp (generated)

001084592.b3lyp_6-31g(d).gjf (generated)

001084592.b3lyp_6-31g(d).firefly.inp (generated)

001084592.b3lyp_6-31g(d).smash.inp (generated)

001084592.b3lyp_6-31g(d).nwchem.inp (generated) 001084592.b3lyp_6-31g(d).log.xz 001084592.td-b3lyp_6-31g+(d).inp 001084592.td-b3lyp_6-31g+(d).log.xz

001084592.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084592.td-b3lyp_6-31+g(d).gjf (generated)

001084592.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084592.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084592.mol 001084592.PUBCHEM 001084592.mol (via Jmol)
001084662.b3lyp_6-31g(d).inp

001084662.b3lyp_6-31g(d).qchem.inp (generated)

001084662.b3lyp_6-31g(d).gjf (generated)

001084662.b3lyp_6-31g(d).firefly.inp (generated)

001084662.b3lyp_6-31g(d).smash.inp (generated)

001084662.b3lyp_6-31g(d).nwchem.inp (generated) 001084662.b3lyp_6-31g(d).log.xz 001084662.td-b3lyp_6-31g+(d).inp 001084662.td-b3lyp_6-31g+(d).log.xz

001084662.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084662.td-b3lyp_6-31+g(d).gjf (generated)

001084662.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084662.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084662.mol 001084662.PUBCHEM 001084662.mol (via Jmol)
001084663.b3lyp_6-31g(d).inp

001084663.b3lyp_6-31g(d).qchem.inp (generated)

001084663.b3lyp_6-31g(d).gjf (generated)

001084663.b3lyp_6-31g(d).firefly.inp (generated)

001084663.b3lyp_6-31g(d).smash.inp (generated)

001084663.b3lyp_6-31g(d).nwchem.inp (generated) 001084663.b3lyp_6-31g(d).log.xz 001084663.mol 001084663.PUBCHEM 001084663.mol (via Jmol)
001084686.b3lyp_6-31g(d).inp

001084686.b3lyp_6-31g(d).qchem.inp (generated)

001084686.b3lyp_6-31g(d).gjf (generated)

001084686.b3lyp_6-31g(d).firefly.inp (generated)

001084686.b3lyp_6-31g(d).smash.inp (generated)

001084686.b3lyp_6-31g(d).nwchem.inp (generated) 001084686.b3lyp_6-31g(d).log.xz 001084686.td-b3lyp_6-31g+(d).inp 001084686.td-b3lyp_6-31g+(d).log.xz

001084686.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084686.td-b3lyp_6-31+g(d).gjf (generated)

001084686.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084686.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084686.mol 001084686.PUBCHEM 001084686.mol (via Jmol)
001084713.b3lyp_6-31g(d).inp

001084713.b3lyp_6-31g(d).qchem.inp (generated)

001084713.b3lyp_6-31g(d).gjf (generated)

001084713.b3lyp_6-31g(d).firefly.inp (generated)

001084713.b3lyp_6-31g(d).smash.inp (generated)

001084713.b3lyp_6-31g(d).nwchem.inp (generated) 001084713.b3lyp_6-31g(d).log.xz 001084713.td-b3lyp_6-31g+(d).inp 001084713.td-b3lyp_6-31g+(d).log.xz

001084713.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084713.td-b3lyp_6-31+g(d).gjf (generated)

001084713.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084713.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084713.mol 001084713.PUBCHEM 001084713.mol (via Jmol)
001084714.b3lyp_6-31g(d).inp

001084714.b3lyp_6-31g(d).qchem.inp (generated)

001084714.b3lyp_6-31g(d).gjf (generated)

001084714.b3lyp_6-31g(d).firefly.inp (generated)

001084714.b3lyp_6-31g(d).smash.inp (generated)

001084714.b3lyp_6-31g(d).nwchem.inp (generated) 001084714.b3lyp_6-31g(d).log.xz 001084714.mol 001084714.PUBCHEM 001084714.mol (via Jmol)
001084715.b3lyp_6-31g(d).inp

001084715.b3lyp_6-31g(d).qchem.inp (generated)

001084715.b3lyp_6-31g(d).gjf (generated)

001084715.b3lyp_6-31g(d).firefly.inp (generated)

001084715.b3lyp_6-31g(d).smash.inp (generated)

001084715.b3lyp_6-31g(d).nwchem.inp (generated) 001084715.b3lyp_6-31g(d).log.xz 001084715.mol 001084715.PUBCHEM 001084715.mol (via Jmol)
001084790.b3lyp_6-31g(d).inp

001084790.b3lyp_6-31g(d).qchem.inp (generated)

001084790.b3lyp_6-31g(d).gjf (generated)

001084790.b3lyp_6-31g(d).firefly.inp (generated)

001084790.b3lyp_6-31g(d).smash.inp (generated)

001084790.b3lyp_6-31g(d).nwchem.inp (generated) 001084790.b3lyp_6-31g(d).log.xz 001084790.mol 001084790.PUBCHEM 001084790.mol (via Jmol)
001084804.b3lyp_6-31g(d).inp

001084804.b3lyp_6-31g(d).qchem.inp (generated)

001084804.b3lyp_6-31g(d).gjf (generated)

001084804.b3lyp_6-31g(d).firefly.inp (generated)

001084804.b3lyp_6-31g(d).smash.inp (generated)

001084804.b3lyp_6-31g(d).nwchem.inp (generated) 001084804.b3lyp_6-31g(d).log.xz 001084804.td-b3lyp_6-31g+(d).inp 001084804.td-b3lyp_6-31g+(d).log.xz

001084804.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084804.td-b3lyp_6-31+g(d).gjf (generated)

001084804.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084804.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084804.mol 001084804.PUBCHEM 001084804.mol (via Jmol)
001084805.b3lyp_6-31g(d).inp

001084805.b3lyp_6-31g(d).qchem.inp (generated)

001084805.b3lyp_6-31g(d).gjf (generated)

001084805.b3lyp_6-31g(d).firefly.inp (generated)

001084805.b3lyp_6-31g(d).smash.inp (generated)

001084805.b3lyp_6-31g(d).nwchem.inp (generated) 001084805.b3lyp_6-31g(d).log.xz 001084805.mol 001084805.PUBCHEM 001084805.mol (via Jmol)
001084809.b3lyp_6-31g(d).inp

001084809.b3lyp_6-31g(d).qchem.inp (generated)

001084809.b3lyp_6-31g(d).gjf (generated)

001084809.b3lyp_6-31g(d).firefly.inp (generated)

001084809.b3lyp_6-31g(d).smash.inp (generated)

001084809.b3lyp_6-31g(d).nwchem.inp (generated) 001084809.b3lyp_6-31g(d).log.xz 001084809.td-b3lyp_6-31g+(d).inp 001084809.td-b3lyp_6-31g+(d).log.xz

001084809.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084809.td-b3lyp_6-31+g(d).gjf (generated)

001084809.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084809.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084809.mol 001084809.PUBCHEM 001084809.mol (via Jmol)
001084810.b3lyp_6-31g(d).inp

001084810.b3lyp_6-31g(d).qchem.inp (generated)

001084810.b3lyp_6-31g(d).gjf (generated)

001084810.b3lyp_6-31g(d).firefly.inp (generated)

001084810.b3lyp_6-31g(d).smash.inp (generated)

001084810.b3lyp_6-31g(d).nwchem.inp (generated) 001084810.b3lyp_6-31g(d).log.xz 001084810.td-b3lyp_6-31g+(d).inp 001084810.td-b3lyp_6-31g+(d).log.xz

001084810.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084810.td-b3lyp_6-31+g(d).gjf (generated)

001084810.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084810.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084810.mol 001084810.PUBCHEM 001084810.mol (via Jmol)
001084819.b3lyp_6-31g(d).inp

001084819.b3lyp_6-31g(d).qchem.inp (generated)

001084819.b3lyp_6-31g(d).gjf (generated)

001084819.b3lyp_6-31g(d).firefly.inp (generated)

001084819.b3lyp_6-31g(d).smash.inp (generated)

001084819.b3lyp_6-31g(d).nwchem.inp (generated) 001084819.b3lyp_6-31g(d).log.xz 001084819.td-b3lyp_6-31g+(d).inp 001084819.td-b3lyp_6-31g+(d).log.xz

001084819.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084819.td-b3lyp_6-31+g(d).gjf (generated)

001084819.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084819.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084819.mol 001084819.PUBCHEM 001084819.mol (via Jmol)
001084844.b3lyp_6-31g(d).inp

001084844.b3lyp_6-31g(d).qchem.inp (generated)

001084844.b3lyp_6-31g(d).gjf (generated)

001084844.b3lyp_6-31g(d).firefly.inp (generated)

001084844.b3lyp_6-31g(d).smash.inp (generated)

001084844.b3lyp_6-31g(d).nwchem.inp (generated) 001084844.b3lyp_6-31g(d).log.xz 001084844.td-b3lyp_6-31g+(d).inp 001084844.td-b3lyp_6-31g+(d).log.xz

001084844.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084844.td-b3lyp_6-31+g(d).gjf (generated)

001084844.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084844.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084844.mol 001084844.PUBCHEM 001084844.mol (via Jmol)
001084850.b3lyp_6-31g(d).inp

001084850.b3lyp_6-31g(d).qchem.inp (generated)

001084850.b3lyp_6-31g(d).gjf (generated)

001084850.b3lyp_6-31g(d).firefly.inp (generated)

001084850.b3lyp_6-31g(d).smash.inp (generated)

001084850.b3lyp_6-31g(d).nwchem.inp (generated) 001084850.b3lyp_6-31g(d).log.xz 001084850.td-b3lyp_6-31g+(d).inp 001084850.td-b3lyp_6-31g+(d).log.xz

001084850.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084850.td-b3lyp_6-31+g(d).gjf (generated)

001084850.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084850.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084850.mol 001084850.PUBCHEM 001084850.mol (via Jmol)
001084856.b3lyp_6-31g(d).inp

001084856.b3lyp_6-31g(d).qchem.inp (generated)

001084856.b3lyp_6-31g(d).gjf (generated)

001084856.b3lyp_6-31g(d).firefly.inp (generated)

001084856.b3lyp_6-31g(d).smash.inp (generated)

001084856.b3lyp_6-31g(d).nwchem.inp (generated) 001084856.b3lyp_6-31g(d).log.xz 001084856.td-b3lyp_6-31g+(d).inp 001084856.td-b3lyp_6-31g+(d).log.xz

001084856.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084856.td-b3lyp_6-31+g(d).gjf (generated)

001084856.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084856.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084856.mol 001084856.PUBCHEM 001084856.mol (via Jmol)
001084874.b3lyp_6-31g(d).inp

001084874.b3lyp_6-31g(d).qchem.inp (generated)

001084874.b3lyp_6-31g(d).gjf (generated)

001084874.b3lyp_6-31g(d).firefly.inp (generated)

001084874.b3lyp_6-31g(d).smash.inp (generated)

001084874.b3lyp_6-31g(d).nwchem.inp (generated) 001084874.b3lyp_6-31g(d).log.xz 001084874.td-b3lyp_6-31g+(d).inp 001084874.td-b3lyp_6-31g+(d).log.xz

001084874.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084874.td-b3lyp_6-31+g(d).gjf (generated)

001084874.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084874.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084874.mol 001084874.PUBCHEM 001084874.mol (via Jmol)
001084875.b3lyp_6-31g(d).inp

001084875.b3lyp_6-31g(d).qchem.inp (generated)

001084875.b3lyp_6-31g(d).gjf (generated)

001084875.b3lyp_6-31g(d).firefly.inp (generated)

001084875.b3lyp_6-31g(d).smash.inp (generated)

001084875.b3lyp_6-31g(d).nwchem.inp (generated) 001084875.b3lyp_6-31g(d).log.xz 001084875.td-b3lyp_6-31g+(d).inp 001084875.td-b3lyp_6-31g+(d).log.xz

001084875.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084875.td-b3lyp_6-31+g(d).gjf (generated)

001084875.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084875.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084875.mol 001084875.PUBCHEM 001084875.mol (via Jmol)
001084917.b3lyp_6-31g(d).inp

001084917.b3lyp_6-31g(d).qchem.inp (generated)

001084917.b3lyp_6-31g(d).gjf (generated)

001084917.b3lyp_6-31g(d).firefly.inp (generated)

001084917.b3lyp_6-31g(d).smash.inp (generated)

001084917.b3lyp_6-31g(d).nwchem.inp (generated) 001084917.b3lyp_6-31g(d).log.xz 001084917.td-b3lyp_6-31g+(d).inp 001084917.td-b3lyp_6-31g+(d).log.xz

001084917.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084917.td-b3lyp_6-31+g(d).gjf (generated)

001084917.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084917.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084917.mol 001084917.PUBCHEM 001084917.mol (via Jmol)
001084918.b3lyp_6-31g(d).inp

001084918.b3lyp_6-31g(d).qchem.inp (generated)

001084918.b3lyp_6-31g(d).gjf (generated)

001084918.b3lyp_6-31g(d).firefly.inp (generated)

001084918.b3lyp_6-31g(d).smash.inp (generated)

001084918.b3lyp_6-31g(d).nwchem.inp (generated) 001084918.b3lyp_6-31g(d).log.xz 001084918.td-b3lyp_6-31g+(d).inp 001084918.td-b3lyp_6-31g+(d).log.xz

001084918.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084918.td-b3lyp_6-31+g(d).gjf (generated)

001084918.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084918.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084918.mol 001084918.PUBCHEM 001084918.mol (via Jmol)
001084919.b3lyp_6-31g(d).inp

001084919.b3lyp_6-31g(d).qchem.inp (generated)

001084919.b3lyp_6-31g(d).gjf (generated)

001084919.b3lyp_6-31g(d).firefly.inp (generated)

001084919.b3lyp_6-31g(d).smash.inp (generated)

001084919.b3lyp_6-31g(d).nwchem.inp (generated) 001084919.b3lyp_6-31g(d).log.xz 001084919.td-b3lyp_6-31g+(d).inp 001084919.td-b3lyp_6-31g+(d).log.xz

001084919.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084919.td-b3lyp_6-31+g(d).gjf (generated)

001084919.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084919.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084919.mol 001084919.PUBCHEM 001084919.mol (via Jmol)
001084920.b3lyp_6-31g(d).inp

001084920.b3lyp_6-31g(d).qchem.inp (generated)

001084920.b3lyp_6-31g(d).gjf (generated)

001084920.b3lyp_6-31g(d).firefly.inp (generated)

001084920.b3lyp_6-31g(d).smash.inp (generated)

001084920.b3lyp_6-31g(d).nwchem.inp (generated) 001084920.b3lyp_6-31g(d).log.xz 001084920.td-b3lyp_6-31g+(d).inp 001084920.td-b3lyp_6-31g+(d).log.xz

001084920.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084920.td-b3lyp_6-31+g(d).gjf (generated)

001084920.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084920.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084920.mol 001084920.PUBCHEM 001084920.mol (via Jmol)
001084922.b3lyp_6-31g(d).inp

001084922.b3lyp_6-31g(d).qchem.inp (generated)

001084922.b3lyp_6-31g(d).gjf (generated)

001084922.b3lyp_6-31g(d).firefly.inp (generated)

001084922.b3lyp_6-31g(d).smash.inp (generated)

001084922.b3lyp_6-31g(d).nwchem.inp (generated) 001084922.b3lyp_6-31g(d).log.xz 001084922.td-b3lyp_6-31g+(d).inp 001084922.td-b3lyp_6-31g+(d).log.xz

001084922.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084922.td-b3lyp_6-31+g(d).gjf (generated)

001084922.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084922.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084922.mol 001084922.PUBCHEM 001084922.mol (via Jmol)
001084923.b3lyp_6-31g(d).inp

001084923.b3lyp_6-31g(d).qchem.inp (generated)

001084923.b3lyp_6-31g(d).gjf (generated)

001084923.b3lyp_6-31g(d).firefly.inp (generated)

001084923.b3lyp_6-31g(d).smash.inp (generated)

001084923.b3lyp_6-31g(d).nwchem.inp (generated) 001084923.b3lyp_6-31g(d).log.xz 001084923.td-b3lyp_6-31g+(d).inp 001084923.td-b3lyp_6-31g+(d).log.xz

001084923.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084923.td-b3lyp_6-31+g(d).gjf (generated)

001084923.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084923.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084923.mol 001084923.PUBCHEM 001084923.mol (via Jmol)
001084924.b3lyp_6-31g(d).inp

001084924.b3lyp_6-31g(d).qchem.inp (generated)

001084924.b3lyp_6-31g(d).gjf (generated)

001084924.b3lyp_6-31g(d).firefly.inp (generated)

001084924.b3lyp_6-31g(d).smash.inp (generated)

001084924.b3lyp_6-31g(d).nwchem.inp (generated) 001084924.b3lyp_6-31g(d).log.xz 001084924.td-b3lyp_6-31g+(d).inp 001084924.td-b3lyp_6-31g+(d).log.xz

001084924.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084924.td-b3lyp_6-31+g(d).gjf (generated)

001084924.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084924.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084924.mol 001084924.PUBCHEM 001084924.mol (via Jmol)
001084925.b3lyp_6-31g(d).inp

001084925.b3lyp_6-31g(d).qchem.inp (generated)

001084925.b3lyp_6-31g(d).gjf (generated)

001084925.b3lyp_6-31g(d).firefly.inp (generated)

001084925.b3lyp_6-31g(d).smash.inp (generated)

001084925.b3lyp_6-31g(d).nwchem.inp (generated) 001084925.b3lyp_6-31g(d).log.xz 001084925.td-b3lyp_6-31g+(d).inp 001084925.td-b3lyp_6-31g+(d).log.xz

001084925.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084925.td-b3lyp_6-31+g(d).gjf (generated)

001084925.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084925.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084925.mol 001084925.PUBCHEM 001084925.mol (via Jmol)
001084926.b3lyp_6-31g(d).inp

001084926.b3lyp_6-31g(d).qchem.inp (generated)

001084926.b3lyp_6-31g(d).gjf (generated)

001084926.b3lyp_6-31g(d).firefly.inp (generated)

001084926.b3lyp_6-31g(d).smash.inp (generated)

001084926.b3lyp_6-31g(d).nwchem.inp (generated) 001084926.b3lyp_6-31g(d).log.xz 001084926.td-b3lyp_6-31g+(d).inp 001084926.td-b3lyp_6-31g+(d).log.xz

001084926.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084926.td-b3lyp_6-31+g(d).gjf (generated)

001084926.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084926.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084926.mol 001084926.PUBCHEM 001084926.mol (via Jmol)
001084927.b3lyp_6-31g(d).inp

001084927.b3lyp_6-31g(d).qchem.inp (generated)

001084927.b3lyp_6-31g(d).gjf (generated)

001084927.b3lyp_6-31g(d).firefly.inp (generated)

001084927.b3lyp_6-31g(d).smash.inp (generated)

001084927.b3lyp_6-31g(d).nwchem.inp (generated) 001084927.b3lyp_6-31g(d).log.xz 001084927.td-b3lyp_6-31g+(d).inp 001084927.td-b3lyp_6-31g+(d).log.xz

001084927.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084927.td-b3lyp_6-31+g(d).gjf (generated)

001084927.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084927.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084927.mol 001084927.PUBCHEM 001084927.mol (via Jmol)
001084928.b3lyp_6-31g(d).inp

001084928.b3lyp_6-31g(d).qchem.inp (generated)

001084928.b3lyp_6-31g(d).gjf (generated)

001084928.b3lyp_6-31g(d).firefly.inp (generated)

001084928.b3lyp_6-31g(d).smash.inp (generated)

001084928.b3lyp_6-31g(d).nwchem.inp (generated) 001084928.b3lyp_6-31g(d).log.xz 001084928.td-b3lyp_6-31g+(d).inp 001084928.td-b3lyp_6-31g+(d).log.xz

001084928.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084928.td-b3lyp_6-31+g(d).gjf (generated)

001084928.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084928.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084928.mol 001084928.PUBCHEM 001084928.mol (via Jmol)
001084929.b3lyp_6-31g(d).inp

001084929.b3lyp_6-31g(d).qchem.inp (generated)

001084929.b3lyp_6-31g(d).gjf (generated)

001084929.b3lyp_6-31g(d).firefly.inp (generated)

001084929.b3lyp_6-31g(d).smash.inp (generated)

001084929.b3lyp_6-31g(d).nwchem.inp (generated) 001084929.b3lyp_6-31g(d).log.xz 001084929.td-b3lyp_6-31g+(d).inp 001084929.td-b3lyp_6-31g+(d).log.xz

001084929.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084929.td-b3lyp_6-31+g(d).gjf (generated)

001084929.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084929.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084929.mol 001084929.PUBCHEM 001084929.mol (via Jmol)
001084930.b3lyp_6-31g(d).inp

001084930.b3lyp_6-31g(d).qchem.inp (generated)

001084930.b3lyp_6-31g(d).gjf (generated)

001084930.b3lyp_6-31g(d).firefly.inp (generated)

001084930.b3lyp_6-31g(d).smash.inp (generated)

001084930.b3lyp_6-31g(d).nwchem.inp (generated) 001084930.b3lyp_6-31g(d).log.xz 001084930.td-b3lyp_6-31g+(d).inp 001084930.td-b3lyp_6-31g+(d).log.xz

001084930.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084930.td-b3lyp_6-31+g(d).gjf (generated)

001084930.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084930.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084930.mol 001084930.PUBCHEM 001084930.mol (via Jmol)
001084932.b3lyp_6-31g(d).inp

001084932.b3lyp_6-31g(d).qchem.inp (generated)

001084932.b3lyp_6-31g(d).gjf (generated)

001084932.b3lyp_6-31g(d).firefly.inp (generated)

001084932.b3lyp_6-31g(d).smash.inp (generated)

001084932.b3lyp_6-31g(d).nwchem.inp (generated) 001084932.b3lyp_6-31g(d).log.xz 001084932.mol 001084932.PUBCHEM 001084932.mol (via Jmol)
001084995.b3lyp_6-31g(d).inp

001084995.b3lyp_6-31g(d).qchem.inp (generated)

001084995.b3lyp_6-31g(d).gjf (generated)

001084995.b3lyp_6-31g(d).firefly.inp (generated)

001084995.b3lyp_6-31g(d).smash.inp (generated)

001084995.b3lyp_6-31g(d).nwchem.inp (generated) 001084995.b3lyp_6-31g(d).log.xz 001084995.td-b3lyp_6-31g+(d).inp 001084995.td-b3lyp_6-31g+(d).log.xz

001084995.td-b3lyp_6-31+g(d).qchem.inp (generated)

001084995.td-b3lyp_6-31+g(d).gjf (generated)

001084995.td-b3lyp_6-31+g(d).firefly.inp (generated)

001084995.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001084995.mol 001084995.PUBCHEM 001084995.mol (via Jmol)
001084996.b3lyp_6-31g(d).inp

001084996.b3lyp_6-31g(d).qchem.inp (generated)

001084996.b3lyp_6-31g(d).gjf (generated)

001084996.b3lyp_6-31g(d).firefly.inp (generated)

001084996.b3lyp_6-31g(d).smash.inp (generated)

001084996.b3lyp_6-31g(d).nwchem.inp (generated) 001084996.b3lyp_6-31g(d).log.xz 001084996.mol 001084996.PUBCHEM 001084996.mol (via Jmol)
001085019.b3lyp_6-31g(d).inp

001085019.b3lyp_6-31g(d).qchem.inp (generated)

001085019.b3lyp_6-31g(d).gjf (generated)

001085019.b3lyp_6-31g(d).firefly.inp (generated)

001085019.b3lyp_6-31g(d).smash.inp (generated)

001085019.b3lyp_6-31g(d).nwchem.inp (generated) 001085019.b3lyp_6-31g(d).log.xz 001085019.td-b3lyp_6-31g+(d).inp 001085019.td-b3lyp_6-31g+(d).log.xz

001085019.td-b3lyp_6-31+g(d).qchem.inp (generated)

001085019.td-b3lyp_6-31+g(d).gjf (generated)

001085019.td-b3lyp_6-31+g(d).firefly.inp (generated)

001085019.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001085019.mol 001085019.PUBCHEM 001085019.mol (via Jmol)
001085020.b3lyp_6-31g(d).inp

001085020.b3lyp_6-31g(d).qchem.inp (generated)

001085020.b3lyp_6-31g(d).gjf (generated)

001085020.b3lyp_6-31g(d).firefly.inp (generated)

001085020.b3lyp_6-31g(d).smash.inp (generated)

001085020.b3lyp_6-31g(d).nwchem.inp (generated) 001085020.b3lyp_6-31g(d).log.xz 001085020.td-b3lyp_6-31g+(d).inp 001085020.td-b3lyp_6-31g+(d).log.xz

001085020.td-b3lyp_6-31+g(d).qchem.inp (generated)

001085020.td-b3lyp_6-31+g(d).gjf (generated)

001085020.td-b3lyp_6-31+g(d).firefly.inp (generated)

001085020.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001085020.mol 001085020.PUBCHEM 001085020.mol (via Jmol)
001085023.b3lyp_6-31g(d).inp

001085023.b3lyp_6-31g(d).qchem.inp (generated)

001085023.b3lyp_6-31g(d).gjf (generated)

001085023.b3lyp_6-31g(d).firefly.inp (generated)

001085023.b3lyp_6-31g(d).smash.inp (generated)

001085023.b3lyp_6-31g(d).nwchem.inp (generated) 001085023.b3lyp_6-31g(d).log.xz 001085023.td-b3lyp_6-31g+(d).inp 001085023.td-b3lyp_6-31g+(d).log.xz

001085023.td-b3lyp_6-31+g(d).qchem.inp (generated)

001085023.td-b3lyp_6-31+g(d).gjf (generated)

001085023.td-b3lyp_6-31+g(d).firefly.inp (generated)

001085023.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001085023.mol 001085023.PUBCHEM 001085023.mol (via Jmol)
001085136.b3lyp_6-31g(d).inp

001085136.b3lyp_6-31g(d).qchem.inp (generated)

001085136.b3lyp_6-31g(d).gjf (generated)

001085136.b3lyp_6-31g(d).firefly.inp (generated)

001085136.b3lyp_6-31g(d).smash.inp (generated)

001085136.b3lyp_6-31g(d).nwchem.inp (generated) 001085136.b3lyp_6-31g(d).log.xz 001085136.td-b3lyp_6-31g+(d).inp 001085136.td-b3lyp_6-31g+(d).log.xz

001085136.td-b3lyp_6-31+g(d).qchem.inp (generated)

001085136.td-b3lyp_6-31+g(d).gjf (generated)

001085136.td-b3lyp_6-31+g(d).firefly.inp (generated)

001085136.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001085136.mol 001085136.PUBCHEM 001085136.mol (via Jmol)
001085137.b3lyp_6-31g(d).inp

001085137.b3lyp_6-31g(d).qchem.inp (generated)

001085137.b3lyp_6-31g(d).gjf (generated)

001085137.b3lyp_6-31g(d).firefly.inp (generated)

001085137.b3lyp_6-31g(d).smash.inp (generated)

001085137.b3lyp_6-31g(d).nwchem.inp (generated) 001085137.b3lyp_6-31g(d).log.xz 001085137.td-b3lyp_6-31g+(d).inp 001085137.td-b3lyp_6-31g+(d).log.xz

001085137.td-b3lyp_6-31+g(d).qchem.inp (generated)

001085137.td-b3lyp_6-31+g(d).gjf (generated)

001085137.td-b3lyp_6-31+g(d).firefly.inp (generated)

001085137.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001085137.mol 001085137.PUBCHEM 001085137.mol (via Jmol)
001085144.b3lyp_6-31g(d).inp

001085144.b3lyp_6-31g(d).qchem.inp (generated)

001085144.b3lyp_6-31g(d).gjf (generated)

001085144.b3lyp_6-31g(d).firefly.inp (generated)

001085144.b3lyp_6-31g(d).smash.inp (generated)

001085144.b3lyp_6-31g(d).nwchem.inp (generated) 001085144.b3lyp_6-31g(d).log.xz 001085144.td-b3lyp_6-31g+(d).inp 001085144.td-b3lyp_6-31g+(d).log.xz

001085144.td-b3lyp_6-31+g(d).qchem.inp (generated)

001085144.td-b3lyp_6-31+g(d).gjf (generated)

001085144.td-b3lyp_6-31+g(d).firefly.inp (generated)

001085144.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001085144.mol 001085144.PUBCHEM 001085144.mol (via Jmol)
001085153.b3lyp_6-31g(d).inp

001085153.b3lyp_6-31g(d).qchem.inp (generated)

001085153.b3lyp_6-31g(d).gjf (generated)

001085153.b3lyp_6-31g(d).firefly.inp (generated)

001085153.b3lyp_6-31g(d).smash.inp (generated)

001085153.b3lyp_6-31g(d).nwchem.inp (generated) 001085153.b3lyp_6-31g(d).log.xz 001085153.mol 001085153.PUBCHEM 001085153.mol (via Jmol)
001085154.b3lyp_6-31g(d).inp

001085154.b3lyp_6-31g(d).qchem.inp (generated)

001085154.b3lyp_6-31g(d).gjf (generated)

001085154.b3lyp_6-31g(d).firefly.inp (generated)

001085154.b3lyp_6-31g(d).smash.inp (generated)

001085154.b3lyp_6-31g(d).nwchem.inp (generated) 001085154.b3lyp_6-31g(d).log.xz 001085154.mol 001085154.PUBCHEM 001085154.mol (via Jmol)
001085172.b3lyp_6-31g(d).inp

001085172.b3lyp_6-31g(d).qchem.inp (generated)

001085172.b3lyp_6-31g(d).gjf (generated)

001085172.b3lyp_6-31g(d).firefly.inp (generated)

001085172.b3lyp_6-31g(d).smash.inp (generated)

001085172.b3lyp_6-31g(d).nwchem.inp (generated) 001085172.b3lyp_6-31g(d).log.xz 001085172.mol 001085172.PUBCHEM 001085172.mol (via Jmol)
001085173.b3lyp_6-31g(d).inp

001085173.b3lyp_6-31g(d).qchem.inp (generated)

001085173.b3lyp_6-31g(d).gjf (generated)

001085173.b3lyp_6-31g(d).firefly.inp (generated)

001085173.b3lyp_6-31g(d).smash.inp (generated)

001085173.b3lyp_6-31g(d).nwchem.inp (generated) 001085173.b3lyp_6-31g(d).log.xz 001085173.mol 001085173.PUBCHEM 001085173.mol (via Jmol)
001085174.b3lyp_6-31g(d).inp

001085174.b3lyp_6-31g(d).qchem.inp (generated)

001085174.b3lyp_6-31g(d).gjf (generated)

001085174.b3lyp_6-31g(d).firefly.inp (generated)

001085174.b3lyp_6-31g(d).smash.inp (generated)

001085174.b3lyp_6-31g(d).nwchem.inp (generated) 001085174.b3lyp_6-31g(d).log.xz 001085174.td-b3lyp_6-31g+(d).inp 001085174.td-b3lyp_6-31g+(d).log.xz

001085174.td-b3lyp_6-31+g(d).qchem.inp (generated)

001085174.td-b3lyp_6-31+g(d).gjf (generated)

001085174.td-b3lyp_6-31+g(d).firefly.inp (generated)

001085174.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001085174.mol 001085174.PUBCHEM 001085174.mol (via Jmol)
001085177.b3lyp_6-31g(d).inp

001085177.b3lyp_6-31g(d).qchem.inp (generated)

001085177.b3lyp_6-31g(d).gjf (generated)

001085177.b3lyp_6-31g(d).firefly.inp (generated)

001085177.b3lyp_6-31g(d).smash.inp (generated)

001085177.b3lyp_6-31g(d).nwchem.inp (generated) 001085177.b3lyp_6-31g(d).log.xz 001085177.mol 001085177.PUBCHEM 001085177.mol (via Jmol)
001085190.b3lyp_6-31g(d).inp

001085190.b3lyp_6-31g(d).qchem.inp (generated)

001085190.b3lyp_6-31g(d).gjf (generated)

001085190.b3lyp_6-31g(d).firefly.inp (generated)

001085190.b3lyp_6-31g(d).smash.inp (generated)

001085190.b3lyp_6-31g(d).nwchem.inp (generated) 001085190.b3lyp_6-31g(d).log.xz 001085190.mol 001085190.PUBCHEM 001085190.mol (via Jmol)
001085196.b3lyp_6-31g(d).inp

001085196.b3lyp_6-31g(d).qchem.inp (generated)

001085196.b3lyp_6-31g(d).gjf (generated)

001085196.b3lyp_6-31g(d).firefly.inp (generated)

001085196.b3lyp_6-31g(d).smash.inp (generated)

001085196.b3lyp_6-31g(d).nwchem.inp (generated) 001085196.b3lyp_6-31g(d).log.xz 001085196.td-b3lyp_6-31g+(d).inp 001085196.td-b3lyp_6-31g+(d).log.xz

001085196.td-b3lyp_6-31+g(d).qchem.inp (generated)

001085196.td-b3lyp_6-31+g(d).gjf (generated)

001085196.td-b3lyp_6-31+g(d).firefly.inp (generated)

001085196.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001085196.mol 001085196.PUBCHEM 001085196.mol (via Jmol)
001085200.b3lyp_6-31g(d).inp

001085200.b3lyp_6-31g(d).qchem.inp (generated)

001085200.b3lyp_6-31g(d).gjf (generated)

001085200.b3lyp_6-31g(d).firefly.inp (generated)

001085200.b3lyp_6-31g(d).smash.inp (generated)

001085200.b3lyp_6-31g(d).nwchem.inp (generated) 001085200.b3lyp_6-31g(d).log.xz 001085200.mol 001085200.PUBCHEM 001085200.mol (via Jmol)
001085207.b3lyp_6-31g(d).inp

001085207.b3lyp_6-31g(d).qchem.inp (generated)

001085207.b3lyp_6-31g(d).gjf (generated)

001085207.b3lyp_6-31g(d).firefly.inp (generated)

001085207.b3lyp_6-31g(d).smash.inp (generated)

001085207.b3lyp_6-31g(d).nwchem.inp (generated) 001085207.b3lyp_6-31g(d).log.xz 001085207.td-b3lyp_6-31g+(d).inp 001085207.td-b3lyp_6-31g+(d).log.xz

001085207.td-b3lyp_6-31+g(d).qchem.inp (generated)

001085207.td-b3lyp_6-31+g(d).gjf (generated)

001085207.td-b3lyp_6-31+g(d).firefly.inp (generated)

001085207.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001085207.mol 001085207.PUBCHEM 001085207.mol (via Jmol)
001085208.b3lyp_6-31g(d).inp

001085208.b3lyp_6-31g(d).qchem.inp (generated)

001085208.b3lyp_6-31g(d).gjf (generated)

001085208.b3lyp_6-31g(d).firefly.inp (generated)

001085208.b3lyp_6-31g(d).smash.inp (generated)

001085208.b3lyp_6-31g(d).nwchem.inp (generated) 001085208.b3lyp_6-31g(d).log.xz 001085208.td-b3lyp_6-31g+(d).inp 001085208.td-b3lyp_6-31g+(d).log.xz

001085208.td-b3lyp_6-31+g(d).qchem.inp (generated)

001085208.td-b3lyp_6-31+g(d).gjf (generated)

001085208.td-b3lyp_6-31+g(d).firefly.inp (generated)

001085208.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001085208.mol 001085208.PUBCHEM 001085208.mol (via Jmol)
001085209.b3lyp_6-31g(d).inp

001085209.b3lyp_6-31g(d).qchem.inp (generated)

001085209.b3lyp_6-31g(d).gjf (generated)

001085209.b3lyp_6-31g(d).firefly.inp (generated)

001085209.b3lyp_6-31g(d).smash.inp (generated)

001085209.b3lyp_6-31g(d).nwchem.inp (generated) 001085209.b3lyp_6-31g(d).log.xz 001085209.td-b3lyp_6-31g+(d).inp 001085209.td-b3lyp_6-31g+(d).log.xz

001085209.td-b3lyp_6-31+g(d).qchem.inp (generated)

001085209.td-b3lyp_6-31+g(d).gjf (generated)

001085209.td-b3lyp_6-31+g(d).firefly.inp (generated)

001085209.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001085209.mol 001085209.PUBCHEM 001085209.mol (via Jmol)
001085210.b3lyp_6-31g(d).inp

001085210.b3lyp_6-31g(d).qchem.inp (generated)

001085210.b3lyp_6-31g(d).gjf (generated)

001085210.b3lyp_6-31g(d).firefly.inp (generated)

001085210.b3lyp_6-31g(d).smash.inp (generated)

001085210.b3lyp_6-31g(d).nwchem.inp (generated) 001085210.b3lyp_6-31g(d).log.xz 001085210.td-b3lyp_6-31g+(d).inp 001085210.td-b3lyp_6-31g+(d).log.xz

001085210.td-b3lyp_6-31+g(d).qchem.inp (generated)

001085210.td-b3lyp_6-31+g(d).gjf (generated)

001085210.td-b3lyp_6-31+g(d).firefly.inp (generated)

001085210.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001085210.mol 001085210.PUBCHEM 001085210.mol (via Jmol)
001085213.b3lyp_6-31g(d).inp

001085213.b3lyp_6-31g(d).qchem.inp (generated)

001085213.b3lyp_6-31g(d).gjf (generated)

001085213.b3lyp_6-31g(d).firefly.inp (generated)

001085213.b3lyp_6-31g(d).smash.inp (generated)

001085213.b3lyp_6-31g(d).nwchem.inp (generated) 001085213.b3lyp_6-31g(d).log.xz 001085213.td-b3lyp_6-31g+(d).inp 001085213.td-b3lyp_6-31g+(d).log.xz

001085213.td-b3lyp_6-31+g(d).qchem.inp (generated)

001085213.td-b3lyp_6-31+g(d).gjf (generated)

001085213.td-b3lyp_6-31+g(d).firefly.inp (generated)

001085213.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001085213.mol 001085213.PUBCHEM 001085213.mol (via Jmol)
001085214.b3lyp_6-31g(d).inp

001085214.b3lyp_6-31g(d).qchem.inp (generated)

001085214.b3lyp_6-31g(d).gjf (generated)

001085214.b3lyp_6-31g(d).firefly.inp (generated)

001085214.b3lyp_6-31g(d).smash.inp (generated)

001085214.b3lyp_6-31g(d).nwchem.inp (generated) 001085214.b3lyp_6-31g(d).log.xz 001085214.td-b3lyp_6-31g+(d).inp 001085214.td-b3lyp_6-31g+(d).log.xz

001085214.td-b3lyp_6-31+g(d).qchem.inp (generated)

001085214.td-b3lyp_6-31+g(d).gjf (generated)

001085214.td-b3lyp_6-31+g(d).firefly.inp (generated)

001085214.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001085214.mol 001085214.PUBCHEM 001085214.mol (via Jmol)
001085215.b3lyp_6-31g(d).inp

001085215.b3lyp_6-31g(d).qchem.inp (generated)

001085215.b3lyp_6-31g(d).gjf (generated)

001085215.b3lyp_6-31g(d).firefly.inp (generated)

001085215.b3lyp_6-31g(d).smash.inp (generated)

001085215.b3lyp_6-31g(d).nwchem.inp (generated) 001085215.b3lyp_6-31g(d).log.xz 001085215.td-b3lyp_6-31g+(d).inp 001085215.td-b3lyp_6-31g+(d).log.xz

001085215.td-b3lyp_6-31+g(d).qchem.inp (generated)

001085215.td-b3lyp_6-31+g(d).gjf (generated)

001085215.td-b3lyp_6-31+g(d).firefly.inp (generated)

001085215.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001085215.mol 001085215.PUBCHEM 001085215.mol (via Jmol)
001085489.b3lyp_6-31g(d).inp

001085489.b3lyp_6-31g(d).qchem.inp (generated)

001085489.b3lyp_6-31g(d).gjf (generated)

001085489.b3lyp_6-31g(d).firefly.inp (generated)

001085489.b3lyp_6-31g(d).smash.inp (generated)

001085489.b3lyp_6-31g(d).nwchem.inp (generated) 001085489.b3lyp_6-31g(d).log.xz 001085489.td-b3lyp_6-31g+(d).inp 001085489.td-b3lyp_6-31g+(d).log.xz

001085489.td-b3lyp_6-31+g(d).qchem.inp (generated)

001085489.td-b3lyp_6-31+g(d).gjf (generated)

001085489.td-b3lyp_6-31+g(d).firefly.inp (generated)

001085489.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001085489.mol 001085489.PUBCHEM 001085489.mol (via Jmol)
001085715.b3lyp_6-31g(d).inp

001085715.b3lyp_6-31g(d).qchem.inp (generated)

001085715.b3lyp_6-31g(d).gjf (generated)

001085715.b3lyp_6-31g(d).firefly.inp (generated)

001085715.b3lyp_6-31g(d).smash.inp (generated)

001085715.b3lyp_6-31g(d).nwchem.inp (generated) 001085715.b3lyp_6-31g(d).log.xz 001085715.td-b3lyp_6-31g+(d).inp 001085715.td-b3lyp_6-31g+(d).log.xz

001085715.td-b3lyp_6-31+g(d).qchem.inp (generated)

001085715.td-b3lyp_6-31+g(d).gjf (generated)

001085715.td-b3lyp_6-31+g(d).firefly.inp (generated)

001085715.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001085715.mol 001085715.PUBCHEM 001085715.mol (via Jmol)
001085716.b3lyp_6-31g(d).inp

001085716.b3lyp_6-31g(d).qchem.inp (generated)

001085716.b3lyp_6-31g(d).gjf (generated)

001085716.b3lyp_6-31g(d).firefly.inp (generated)

001085716.b3lyp_6-31g(d).smash.inp (generated)

001085716.b3lyp_6-31g(d).nwchem.inp (generated) 001085716.b3lyp_6-31g(d).log.xz 001085716.td-b3lyp_6-31g+(d).inp 001085716.td-b3lyp_6-31g+(d).log.xz

001085716.td-b3lyp_6-31+g(d).qchem.inp (generated)

001085716.td-b3lyp_6-31+g(d).gjf (generated)

001085716.td-b3lyp_6-31+g(d).firefly.inp (generated)

001085716.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001085716.mol 001085716.PUBCHEM 001085716.mol (via Jmol)
001085886.b3lyp_6-31g(d).inp

001085886.b3lyp_6-31g(d).qchem.inp (generated)

001085886.b3lyp_6-31g(d).gjf (generated)

001085886.b3lyp_6-31g(d).firefly.inp (generated)

001085886.b3lyp_6-31g(d).smash.inp (generated)

001085886.b3lyp_6-31g(d).nwchem.inp (generated) 001085886.b3lyp_6-31g(d).log.xz 001085886.td-b3lyp_6-31g+(d).inp 001085886.td-b3lyp_6-31g+(d).log.xz

001085886.td-b3lyp_6-31+g(d).qchem.inp (generated)

001085886.td-b3lyp_6-31+g(d).gjf (generated)

001085886.td-b3lyp_6-31+g(d).firefly.inp (generated)

001085886.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001085886.mol 001085886.PUBCHEM 001085886.mol (via Jmol)
001085887.b3lyp_6-31g(d).inp

001085887.b3lyp_6-31g(d).qchem.inp (generated)

001085887.b3lyp_6-31g(d).gjf (generated)

001085887.b3lyp_6-31g(d).firefly.inp (generated)

001085887.b3lyp_6-31g(d).smash.inp (generated)

001085887.b3lyp_6-31g(d).nwchem.inp (generated) 001085887.b3lyp_6-31g(d).log.xz 001085887.td-b3lyp_6-31g+(d).inp 001085887.td-b3lyp_6-31g+(d).log.xz

001085887.td-b3lyp_6-31+g(d).qchem.inp (generated)

001085887.td-b3lyp_6-31+g(d).gjf (generated)

001085887.td-b3lyp_6-31+g(d).firefly.inp (generated)

001085887.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001085887.mol 001085887.PUBCHEM 001085887.mol (via Jmol)
001085977.b3lyp_6-31g(d).inp

001085977.b3lyp_6-31g(d).qchem.inp (generated)

001085977.b3lyp_6-31g(d).gjf (generated)

001085977.b3lyp_6-31g(d).firefly.inp (generated)

001085977.b3lyp_6-31g(d).smash.inp (generated)

001085977.b3lyp_6-31g(d).nwchem.inp (generated) 001085977.b3lyp_6-31g(d).log.xz 001085977.td-b3lyp_6-31g+(d).inp 001085977.td-b3lyp_6-31g+(d).log.xz

001085977.td-b3lyp_6-31+g(d).qchem.inp (generated)

001085977.td-b3lyp_6-31+g(d).gjf (generated)

001085977.td-b3lyp_6-31+g(d).firefly.inp (generated)

001085977.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001085977.mol 001085977.PUBCHEM 001085977.mol (via Jmol)
001086035.b3lyp_6-31g(d).inp

001086035.b3lyp_6-31g(d).qchem.inp (generated)

001086035.b3lyp_6-31g(d).gjf (generated)

001086035.b3lyp_6-31g(d).firefly.inp (generated)

001086035.b3lyp_6-31g(d).smash.inp (generated)

001086035.b3lyp_6-31g(d).nwchem.inp (generated) 001086035.b3lyp_6-31g(d).log.xz 001086035.td-b3lyp_6-31g+(d).inp 001086035.td-b3lyp_6-31g+(d).log.xz

001086035.td-b3lyp_6-31+g(d).qchem.inp (generated)

001086035.td-b3lyp_6-31+g(d).gjf (generated)

001086035.td-b3lyp_6-31+g(d).firefly.inp (generated)

001086035.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001086035.mol 001086035.PUBCHEM 001086035.mol (via Jmol)
001086326.b3lyp_6-31g(d).inp

001086326.b3lyp_6-31g(d).qchem.inp (generated)

001086326.b3lyp_6-31g(d).gjf (generated)

001086326.b3lyp_6-31g(d).firefly.inp (generated)

001086326.b3lyp_6-31g(d).smash.inp (generated)

001086326.b3lyp_6-31g(d).nwchem.inp (generated) 001086326.b3lyp_6-31g(d).log.xz 001086326.mol 001086326.PUBCHEM 001086326.mol (via Jmol)
001086563.b3lyp_6-31g(d).inp

001086563.b3lyp_6-31g(d).qchem.inp (generated)

001086563.b3lyp_6-31g(d).gjf (generated)

001086563.b3lyp_6-31g(d).firefly.inp (generated)

001086563.b3lyp_6-31g(d).smash.inp (generated)

001086563.b3lyp_6-31g(d).nwchem.inp (generated) 001086563.b3lyp_6-31g(d).log.xz 001086563.td-b3lyp_6-31g+(d).inp 001086563.td-b3lyp_6-31g+(d).log.xz

001086563.td-b3lyp_6-31+g(d).qchem.inp (generated)

001086563.td-b3lyp_6-31+g(d).gjf (generated)

001086563.td-b3lyp_6-31+g(d).firefly.inp (generated)

001086563.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001086563.mol 001086563.PUBCHEM 001086563.mol (via Jmol)
001086599.b3lyp_6-31g(d).inp

001086599.b3lyp_6-31g(d).qchem.inp (generated)

001086599.b3lyp_6-31g(d).gjf (generated)

001086599.b3lyp_6-31g(d).firefly.inp (generated)

001086599.b3lyp_6-31g(d).smash.inp (generated)

001086599.b3lyp_6-31g(d).nwchem.inp (generated) 001086599.b3lyp_6-31g(d).log.xz 001086599.td-b3lyp_6-31g+(d).inp 001086599.td-b3lyp_6-31g+(d).log.xz

001086599.td-b3lyp_6-31+g(d).qchem.inp (generated)

001086599.td-b3lyp_6-31+g(d).gjf (generated)

001086599.td-b3lyp_6-31+g(d).firefly.inp (generated)

001086599.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001086599.mol 001086599.PUBCHEM 001086599.mol (via Jmol)
001086601.b3lyp_6-31g(d).inp

001086601.b3lyp_6-31g(d).qchem.inp (generated)

001086601.b3lyp_6-31g(d).gjf (generated)

001086601.b3lyp_6-31g(d).firefly.inp (generated)

001086601.b3lyp_6-31g(d).smash.inp (generated)

001086601.b3lyp_6-31g(d).nwchem.inp (generated) 001086601.b3lyp_6-31g(d).log.xz 001086601.mol 001086601.PUBCHEM 001086601.mol (via Jmol)
001086602.b3lyp_6-31g(d).inp

001086602.b3lyp_6-31g(d).qchem.inp (generated)

001086602.b3lyp_6-31g(d).gjf (generated)

001086602.b3lyp_6-31g(d).firefly.inp (generated)

001086602.b3lyp_6-31g(d).smash.inp (generated)

001086602.b3lyp_6-31g(d).nwchem.inp (generated) 001086602.b3lyp_6-31g(d).log.xz 001086602.td-b3lyp_6-31g+(d).inp 001086602.td-b3lyp_6-31g+(d).log.xz

001086602.td-b3lyp_6-31+g(d).qchem.inp (generated)

001086602.td-b3lyp_6-31+g(d).gjf (generated)

001086602.td-b3lyp_6-31+g(d).firefly.inp (generated)

001086602.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001086602.mol 001086602.PUBCHEM 001086602.mol (via Jmol)
001086629.b3lyp_6-31g(d).inp

001086629.b3lyp_6-31g(d).qchem.inp (generated)

001086629.b3lyp_6-31g(d).gjf (generated)

001086629.b3lyp_6-31g(d).firefly.inp (generated)

001086629.b3lyp_6-31g(d).smash.inp (generated)

001086629.b3lyp_6-31g(d).nwchem.inp (generated) 001086629.b3lyp_6-31g(d).log.xz 001086629.td-b3lyp_6-31g+(d).inp 001086629.td-b3lyp_6-31g+(d).log.xz

001086629.td-b3lyp_6-31+g(d).qchem.inp (generated)

001086629.td-b3lyp_6-31+g(d).gjf (generated)

001086629.td-b3lyp_6-31+g(d).firefly.inp (generated)

001086629.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001086629.mol 001086629.PUBCHEM 001086629.mol (via Jmol)
001086690.b3lyp_6-31g(d).inp

001086690.b3lyp_6-31g(d).qchem.inp (generated)

001086690.b3lyp_6-31g(d).gjf (generated)

001086690.b3lyp_6-31g(d).firefly.inp (generated)

001086690.b3lyp_6-31g(d).smash.inp (generated)

001086690.b3lyp_6-31g(d).nwchem.inp (generated) 001086690.b3lyp_6-31g(d).log.xz 001086690.td-b3lyp_6-31g+(d).inp 001086690.td-b3lyp_6-31g+(d).log.xz

001086690.td-b3lyp_6-31+g(d).qchem.inp (generated)

001086690.td-b3lyp_6-31+g(d).gjf (generated)

001086690.td-b3lyp_6-31+g(d).firefly.inp (generated)

001086690.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001086690.mol 001086690.PUBCHEM 001086690.mol (via Jmol)
001086691.b3lyp_6-31g(d).inp

001086691.b3lyp_6-31g(d).qchem.inp (generated)

001086691.b3lyp_6-31g(d).gjf (generated)

001086691.b3lyp_6-31g(d).firefly.inp (generated)

001086691.b3lyp_6-31g(d).smash.inp (generated)

001086691.b3lyp_6-31g(d).nwchem.inp (generated) 001086691.b3lyp_6-31g(d).log.xz 001086691.td-b3lyp_6-31g+(d).inp 001086691.td-b3lyp_6-31g+(d).log.xz

001086691.td-b3lyp_6-31+g(d).qchem.inp (generated)

001086691.td-b3lyp_6-31+g(d).gjf (generated)

001086691.td-b3lyp_6-31+g(d).firefly.inp (generated)

001086691.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001086691.mol 001086691.PUBCHEM 001086691.mol (via Jmol)
001086692.b3lyp_6-31g(d).inp

001086692.b3lyp_6-31g(d).qchem.inp (generated)

001086692.b3lyp_6-31g(d).gjf (generated)

001086692.b3lyp_6-31g(d).firefly.inp (generated)

001086692.b3lyp_6-31g(d).smash.inp (generated)

001086692.b3lyp_6-31g(d).nwchem.inp (generated) 001086692.b3lyp_6-31g(d).log.xz 001086692.td-b3lyp_6-31g+(d).inp 001086692.td-b3lyp_6-31g+(d).log.xz

001086692.td-b3lyp_6-31+g(d).qchem.inp (generated)

001086692.td-b3lyp_6-31+g(d).gjf (generated)

001086692.td-b3lyp_6-31+g(d).firefly.inp (generated)

001086692.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001086692.mol 001086692.PUBCHEM 001086692.mol (via Jmol)
001086693.b3lyp_6-31g(d).inp

001086693.b3lyp_6-31g(d).qchem.inp (generated)

001086693.b3lyp_6-31g(d).gjf (generated)

001086693.b3lyp_6-31g(d).firefly.inp (generated)

001086693.b3lyp_6-31g(d).smash.inp (generated)

001086693.b3lyp_6-31g(d).nwchem.inp (generated) 001086693.b3lyp_6-31g(d).log.xz 001086693.td-b3lyp_6-31g+(d).inp 001086693.td-b3lyp_6-31g+(d).log.xz

001086693.td-b3lyp_6-31+g(d).qchem.inp (generated)

001086693.td-b3lyp_6-31+g(d).gjf (generated)

001086693.td-b3lyp_6-31+g(d).firefly.inp (generated)

001086693.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001086693.mol 001086693.PUBCHEM 001086693.mol (via Jmol)
001086736.b3lyp_6-31g(d).inp

001086736.b3lyp_6-31g(d).qchem.inp (generated)

001086736.b3lyp_6-31g(d).gjf (generated)

001086736.b3lyp_6-31g(d).firefly.inp (generated)

001086736.b3lyp_6-31g(d).smash.inp (generated)

001086736.b3lyp_6-31g(d).nwchem.inp (generated) 001086736.b3lyp_6-31g(d).log.xz 001086736.mol 001086736.PUBCHEM 001086736.mol (via Jmol)
001086737.b3lyp_6-31g(d).inp

001086737.b3lyp_6-31g(d).qchem.inp (generated)

001086737.b3lyp_6-31g(d).gjf (generated)

001086737.b3lyp_6-31g(d).firefly.inp (generated)

001086737.b3lyp_6-31g(d).smash.inp (generated)

001086737.b3lyp_6-31g(d).nwchem.inp (generated) 001086737.b3lyp_6-31g(d).log.xz 001086737.td-b3lyp_6-31g+(d).inp 001086737.td-b3lyp_6-31g+(d).log.xz

001086737.td-b3lyp_6-31+g(d).qchem.inp (generated)

001086737.td-b3lyp_6-31+g(d).gjf (generated)

001086737.td-b3lyp_6-31+g(d).firefly.inp (generated)

001086737.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001086737.mol 001086737.PUBCHEM 001086737.mol (via Jmol)
001086751.b3lyp_6-31g(d).inp

001086751.b3lyp_6-31g(d).qchem.inp (generated)

001086751.b3lyp_6-31g(d).gjf (generated)

001086751.b3lyp_6-31g(d).firefly.inp (generated)

001086751.b3lyp_6-31g(d).smash.inp (generated)

001086751.b3lyp_6-31g(d).nwchem.inp (generated) 001086751.b3lyp_6-31g(d).log.xz 001086751.td-b3lyp_6-31g+(d).inp 001086751.td-b3lyp_6-31g+(d).log.xz

001086751.td-b3lyp_6-31+g(d).qchem.inp (generated)

001086751.td-b3lyp_6-31+g(d).gjf (generated)

001086751.td-b3lyp_6-31+g(d).firefly.inp (generated)

001086751.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001086751.mol 001086751.PUBCHEM 001086751.mol (via Jmol)
001086789.b3lyp_6-31g(d).inp

001086789.b3lyp_6-31g(d).qchem.inp (generated)

001086789.b3lyp_6-31g(d).gjf (generated)

001086789.b3lyp_6-31g(d).firefly.inp (generated)

001086789.b3lyp_6-31g(d).smash.inp (generated)

001086789.b3lyp_6-31g(d).nwchem.inp (generated) 001086789.b3lyp_6-31g(d).log.xz 001086789.td-b3lyp_6-31g+(d).inp 001086789.td-b3lyp_6-31g+(d).log.xz

001086789.td-b3lyp_6-31+g(d).qchem.inp (generated)

001086789.td-b3lyp_6-31+g(d).gjf (generated)

001086789.td-b3lyp_6-31+g(d).firefly.inp (generated)

001086789.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001086789.mol 001086789.PUBCHEM 001086789.mol (via Jmol)
001086790.b3lyp_6-31g(d).inp

001086790.b3lyp_6-31g(d).qchem.inp (generated)

001086790.b3lyp_6-31g(d).gjf (generated)

001086790.b3lyp_6-31g(d).firefly.inp (generated)

001086790.b3lyp_6-31g(d).smash.inp (generated)

001086790.b3lyp_6-31g(d).nwchem.inp (generated) 001086790.b3lyp_6-31g(d).log.xz 001086790.td-b3lyp_6-31g+(d).inp 001086790.td-b3lyp_6-31g+(d).log.xz

001086790.td-b3lyp_6-31+g(d).qchem.inp (generated)

001086790.td-b3lyp_6-31+g(d).gjf (generated)

001086790.td-b3lyp_6-31+g(d).firefly.inp (generated)

001086790.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001086790.mol 001086790.PUBCHEM 001086790.mol (via Jmol)
001086793.b3lyp_6-31g(d).inp

001086793.b3lyp_6-31g(d).qchem.inp (generated)

001086793.b3lyp_6-31g(d).gjf (generated)

001086793.b3lyp_6-31g(d).firefly.inp (generated)

001086793.b3lyp_6-31g(d).smash.inp (generated)

001086793.b3lyp_6-31g(d).nwchem.inp (generated) 001086793.b3lyp_6-31g(d).log.xz 001086793.mol 001086793.PUBCHEM 001086793.mol (via Jmol)
001086794.b3lyp_6-31g(d).inp

001086794.b3lyp_6-31g(d).qchem.inp (generated)

001086794.b3lyp_6-31g(d).gjf (generated)

001086794.b3lyp_6-31g(d).firefly.inp (generated)

001086794.b3lyp_6-31g(d).smash.inp (generated)

001086794.b3lyp_6-31g(d).nwchem.inp (generated) 001086794.b3lyp_6-31g(d).log.xz 001086794.mol 001086794.PUBCHEM 001086794.mol (via Jmol)
001086795.b3lyp_6-31g(d).inp

001086795.b3lyp_6-31g(d).qchem.inp (generated)

001086795.b3lyp_6-31g(d).gjf (generated)

001086795.b3lyp_6-31g(d).firefly.inp (generated)

001086795.b3lyp_6-31g(d).smash.inp (generated)

001086795.b3lyp_6-31g(d).nwchem.inp (generated) 001086795.b3lyp_6-31g(d).log.xz 001086795.mol 001086795.PUBCHEM 001086795.mol (via Jmol)
001086796.b3lyp_6-31g(d).inp

001086796.b3lyp_6-31g(d).qchem.inp (generated)

001086796.b3lyp_6-31g(d).gjf (generated)

001086796.b3lyp_6-31g(d).firefly.inp (generated)

001086796.b3lyp_6-31g(d).smash.inp (generated)

001086796.b3lyp_6-31g(d).nwchem.inp (generated) 001086796.b3lyp_6-31g(d).log.xz 001086796.mol 001086796.PUBCHEM 001086796.mol (via Jmol)
001086799.b3lyp_6-31g(d).inp

001086799.b3lyp_6-31g(d).qchem.inp (generated)

001086799.b3lyp_6-31g(d).gjf (generated)

001086799.b3lyp_6-31g(d).firefly.inp (generated)

001086799.b3lyp_6-31g(d).smash.inp (generated)

001086799.b3lyp_6-31g(d).nwchem.inp (generated) 001086799.b3lyp_6-31g(d).log.xz 001086799.td-b3lyp_6-31g+(d).inp 001086799.td-b3lyp_6-31g+(d).log.xz

001086799.td-b3lyp_6-31+g(d).qchem.inp (generated)

001086799.td-b3lyp_6-31+g(d).gjf (generated)

001086799.td-b3lyp_6-31+g(d).firefly.inp (generated)

001086799.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001086799.mol 001086799.PUBCHEM 001086799.mol (via Jmol)
001086800.b3lyp_6-31g(d).inp

001086800.b3lyp_6-31g(d).qchem.inp (generated)

001086800.b3lyp_6-31g(d).gjf (generated)

001086800.b3lyp_6-31g(d).firefly.inp (generated)

001086800.b3lyp_6-31g(d).smash.inp (generated)

001086800.b3lyp_6-31g(d).nwchem.inp (generated) 001086800.b3lyp_6-31g(d).log.xz 001086800.td-b3lyp_6-31g+(d).inp 001086800.td-b3lyp_6-31g+(d).log.xz

001086800.td-b3lyp_6-31+g(d).qchem.inp (generated)

001086800.td-b3lyp_6-31+g(d).gjf (generated)

001086800.td-b3lyp_6-31+g(d).firefly.inp (generated)

001086800.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001086800.mol 001086800.PUBCHEM 001086800.mol (via Jmol)
001086808.b3lyp_6-31g(d).inp

001086808.b3lyp_6-31g(d).qchem.inp (generated)

001086808.b3lyp_6-31g(d).gjf (generated)

001086808.b3lyp_6-31g(d).firefly.inp (generated)

001086808.b3lyp_6-31g(d).smash.inp (generated)

001086808.b3lyp_6-31g(d).nwchem.inp (generated) 001086808.b3lyp_6-31g(d).log.xz 001086808.td-b3lyp_6-31g+(d).inp 001086808.td-b3lyp_6-31g+(d).log.xz

001086808.td-b3lyp_6-31+g(d).qchem.inp (generated)

001086808.td-b3lyp_6-31+g(d).gjf (generated)

001086808.td-b3lyp_6-31+g(d).firefly.inp (generated)

001086808.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001086808.mol 001086808.PUBCHEM 001086808.mol (via Jmol)
001086809.b3lyp_6-31g(d).inp

001086809.b3lyp_6-31g(d).qchem.inp (generated)

001086809.b3lyp_6-31g(d).gjf (generated)

001086809.b3lyp_6-31g(d).firefly.inp (generated)

001086809.b3lyp_6-31g(d).smash.inp (generated)

001086809.b3lyp_6-31g(d).nwchem.inp (generated) 001086809.b3lyp_6-31g(d).log.xz 001086809.td-b3lyp_6-31g+(d).inp 001086809.td-b3lyp_6-31g+(d).log.xz

001086809.td-b3lyp_6-31+g(d).qchem.inp (generated)

001086809.td-b3lyp_6-31+g(d).gjf (generated)

001086809.td-b3lyp_6-31+g(d).firefly.inp (generated)

001086809.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001086809.mol 001086809.PUBCHEM 001086809.mol (via Jmol)
001086832.b3lyp_6-31g(d).inp

001086832.b3lyp_6-31g(d).qchem.inp (generated)

001086832.b3lyp_6-31g(d).gjf (generated)

001086832.b3lyp_6-31g(d).firefly.inp (generated)

001086832.b3lyp_6-31g(d).smash.inp (generated)

001086832.b3lyp_6-31g(d).nwchem.inp (generated) 001086832.b3lyp_6-31g(d).log.xz 001086832.td-b3lyp_6-31g+(d).inp 001086832.td-b3lyp_6-31g+(d).log.xz

001086832.td-b3lyp_6-31+g(d).qchem.inp (generated)

001086832.td-b3lyp_6-31+g(d).gjf (generated)

001086832.td-b3lyp_6-31+g(d).firefly.inp (generated)

001086832.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001086832.mol 001086832.PUBCHEM 001086832.mol (via Jmol)
001086833.b3lyp_6-31g(d).inp

001086833.b3lyp_6-31g(d).qchem.inp (generated)

001086833.b3lyp_6-31g(d).gjf (generated)

001086833.b3lyp_6-31g(d).firefly.inp (generated)

001086833.b3lyp_6-31g(d).smash.inp (generated)

001086833.b3lyp_6-31g(d).nwchem.inp (generated) 001086833.b3lyp_6-31g(d).log.xz 001086833.td-b3lyp_6-31g+(d).inp 001086833.td-b3lyp_6-31g+(d).log.xz

001086833.td-b3lyp_6-31+g(d).qchem.inp (generated)

001086833.td-b3lyp_6-31+g(d).gjf (generated)

001086833.td-b3lyp_6-31+g(d).firefly.inp (generated)

001086833.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001086833.mol 001086833.PUBCHEM 001086833.mol (via Jmol)
001086838.b3lyp_6-31g(d).inp

001086838.b3lyp_6-31g(d).qchem.inp (generated)

001086838.b3lyp_6-31g(d).gjf (generated)

001086838.b3lyp_6-31g(d).firefly.inp (generated)

001086838.b3lyp_6-31g(d).smash.inp (generated)

001086838.b3lyp_6-31g(d).nwchem.inp (generated) 001086838.b3lyp_6-31g(d).log.xz 001086838.td-b3lyp_6-31g+(d).inp 001086838.td-b3lyp_6-31g+(d).log.xz

001086838.td-b3lyp_6-31+g(d).qchem.inp (generated)

001086838.td-b3lyp_6-31+g(d).gjf (generated)

001086838.td-b3lyp_6-31+g(d).firefly.inp (generated)

001086838.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001086838.mol 001086838.PUBCHEM 001086838.mol (via Jmol)
001086839.b3lyp_6-31g(d).inp

001086839.b3lyp_6-31g(d).qchem.inp (generated)

001086839.b3lyp_6-31g(d).gjf (generated)

001086839.b3lyp_6-31g(d).firefly.inp (generated)

001086839.b3lyp_6-31g(d).smash.inp (generated)

001086839.b3lyp_6-31g(d).nwchem.inp (generated) 001086839.b3lyp_6-31g(d).log.xz 001086839.td-b3lyp_6-31g+(d).inp 001086839.td-b3lyp_6-31g+(d).log.xz

001086839.td-b3lyp_6-31+g(d).qchem.inp (generated)

001086839.td-b3lyp_6-31+g(d).gjf (generated)

001086839.td-b3lyp_6-31+g(d).firefly.inp (generated)

001086839.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001086839.mol 001086839.PUBCHEM 001086839.mol (via Jmol)
001086842.b3lyp_6-31g(d).inp

001086842.b3lyp_6-31g(d).qchem.inp (generated)

001086842.b3lyp_6-31g(d).gjf (generated)

001086842.b3lyp_6-31g(d).firefly.inp (generated)

001086842.b3lyp_6-31g(d).smash.inp (generated)

001086842.b3lyp_6-31g(d).nwchem.inp (generated) 001086842.b3lyp_6-31g(d).log.xz 001086842.td-b3lyp_6-31g+(d).inp 001086842.td-b3lyp_6-31g+(d).log.xz

001086842.td-b3lyp_6-31+g(d).qchem.inp (generated)

001086842.td-b3lyp_6-31+g(d).gjf (generated)

001086842.td-b3lyp_6-31+g(d).firefly.inp (generated)

001086842.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001086842.mol 001086842.PUBCHEM 001086842.mol (via Jmol)
001086843.b3lyp_6-31g(d).inp

001086843.b3lyp_6-31g(d).qchem.inp (generated)

001086843.b3lyp_6-31g(d).gjf (generated)

001086843.b3lyp_6-31g(d).firefly.inp (generated)

001086843.b3lyp_6-31g(d).smash.inp (generated)

001086843.b3lyp_6-31g(d).nwchem.inp (generated) 001086843.b3lyp_6-31g(d).log.xz 001086843.td-b3lyp_6-31g+(d).inp 001086843.td-b3lyp_6-31g+(d).log.xz

001086843.td-b3lyp_6-31+g(d).qchem.inp (generated)

001086843.td-b3lyp_6-31+g(d).gjf (generated)

001086843.td-b3lyp_6-31+g(d).firefly.inp (generated)

001086843.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001086843.mol 001086843.PUBCHEM 001086843.mol (via Jmol)
001086879.b3lyp_6-31g(d).inp

001086879.b3lyp_6-31g(d).qchem.inp (generated)

001086879.b3lyp_6-31g(d).gjf (generated)

001086879.b3lyp_6-31g(d).firefly.inp (generated)

001086879.b3lyp_6-31g(d).smash.inp (generated)

001086879.b3lyp_6-31g(d).nwchem.inp (generated) 001086879.b3lyp_6-31g(d).log.xz 001086879.td-b3lyp_6-31g+(d).inp 001086879.td-b3lyp_6-31g+(d).log.xz

001086879.td-b3lyp_6-31+g(d).qchem.inp (generated)

001086879.td-b3lyp_6-31+g(d).gjf (generated)

001086879.td-b3lyp_6-31+g(d).firefly.inp (generated)

001086879.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001086879.mol 001086879.PUBCHEM 001086879.mol (via Jmol)
001086969.b3lyp_6-31g(d).inp

001086969.b3lyp_6-31g(d).qchem.inp (generated)

001086969.b3lyp_6-31g(d).gjf (generated)

001086969.b3lyp_6-31g(d).firefly.inp (generated)

001086969.b3lyp_6-31g(d).smash.inp (generated)

001086969.b3lyp_6-31g(d).nwchem.inp (generated) 001086969.b3lyp_6-31g(d).log.xz 001086969.td-b3lyp_6-31g+(d).inp 001086969.td-b3lyp_6-31g+(d).log.xz

001086969.td-b3lyp_6-31+g(d).qchem.inp (generated)

001086969.td-b3lyp_6-31+g(d).gjf (generated)

001086969.td-b3lyp_6-31+g(d).firefly.inp (generated)

001086969.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001086969.mol 001086969.PUBCHEM 001086969.mol (via Jmol)
001087014.b3lyp_6-31g(d).inp

001087014.b3lyp_6-31g(d).qchem.inp (generated)

001087014.b3lyp_6-31g(d).gjf (generated)

001087014.b3lyp_6-31g(d).firefly.inp (generated)

001087014.b3lyp_6-31g(d).smash.inp (generated)

001087014.b3lyp_6-31g(d).nwchem.inp (generated) 001087014.b3lyp_6-31g(d).log.xz 001087014.td-b3lyp_6-31g+(d).inp 001087014.td-b3lyp_6-31g+(d).log.xz

001087014.td-b3lyp_6-31+g(d).qchem.inp (generated)

001087014.td-b3lyp_6-31+g(d).gjf (generated)

001087014.td-b3lyp_6-31+g(d).firefly.inp (generated)

001087014.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001087014.mol 001087014.PUBCHEM 001087014.mol (via Jmol)
001087060.b3lyp_6-31g(d).inp

001087060.b3lyp_6-31g(d).qchem.inp (generated)

001087060.b3lyp_6-31g(d).gjf (generated)

001087060.b3lyp_6-31g(d).firefly.inp (generated)

001087060.b3lyp_6-31g(d).smash.inp (generated)

001087060.b3lyp_6-31g(d).nwchem.inp (generated) 001087060.b3lyp_6-31g(d).log.xz 001087060.td-b3lyp_6-31g+(d).inp 001087060.td-b3lyp_6-31g+(d).log.xz

001087060.td-b3lyp_6-31+g(d).qchem.inp (generated)

001087060.td-b3lyp_6-31+g(d).gjf (generated)

001087060.td-b3lyp_6-31+g(d).firefly.inp (generated)

001087060.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001087060.mol 001087060.PUBCHEM 001087060.mol (via Jmol)
001087156.b3lyp_6-31g(d).inp

001087156.b3lyp_6-31g(d).qchem.inp (generated)

001087156.b3lyp_6-31g(d).gjf (generated)

001087156.b3lyp_6-31g(d).firefly.inp (generated)

001087156.b3lyp_6-31g(d).smash.inp (generated)

001087156.b3lyp_6-31g(d).nwchem.inp (generated) 001087156.b3lyp_6-31g(d).log.xz 001087156.td-b3lyp_6-31g+(d).inp 001087156.td-b3lyp_6-31g+(d).log.xz

001087156.td-b3lyp_6-31+g(d).qchem.inp (generated)

001087156.td-b3lyp_6-31+g(d).gjf (generated)

001087156.td-b3lyp_6-31+g(d).firefly.inp (generated)

001087156.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001087156.mol 001087156.PUBCHEM 001087156.mol (via Jmol)
001087207.b3lyp_6-31g(d).inp

001087207.b3lyp_6-31g(d).qchem.inp (generated)

001087207.b3lyp_6-31g(d).gjf (generated)

001087207.b3lyp_6-31g(d).firefly.inp (generated)

001087207.b3lyp_6-31g(d).smash.inp (generated)

001087207.b3lyp_6-31g(d).nwchem.inp (generated) 001087207.b3lyp_6-31g(d).log.xz 001087207.td-b3lyp_6-31g+(d).inp 001087207.td-b3lyp_6-31g+(d).log.xz

001087207.td-b3lyp_6-31+g(d).qchem.inp (generated)

001087207.td-b3lyp_6-31+g(d).gjf (generated)

001087207.td-b3lyp_6-31+g(d).firefly.inp (generated)

001087207.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001087207.mol 001087207.PUBCHEM 001087207.mol (via Jmol)
001087208.b3lyp_6-31g(d).inp

001087208.b3lyp_6-31g(d).qchem.inp (generated)

001087208.b3lyp_6-31g(d).gjf (generated)

001087208.b3lyp_6-31g(d).firefly.inp (generated)

001087208.b3lyp_6-31g(d).smash.inp (generated)

001087208.b3lyp_6-31g(d).nwchem.inp (generated) 001087208.b3lyp_6-31g(d).log.xz 001087208.td-b3lyp_6-31g+(d).inp 001087208.td-b3lyp_6-31g+(d).log.xz

001087208.td-b3lyp_6-31+g(d).qchem.inp (generated)

001087208.td-b3lyp_6-31+g(d).gjf (generated)

001087208.td-b3lyp_6-31+g(d).firefly.inp (generated)

001087208.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001087208.mol 001087208.PUBCHEM 001087208.mol (via Jmol)
001087305.b3lyp_6-31g(d).inp

001087305.b3lyp_6-31g(d).qchem.inp (generated)

001087305.b3lyp_6-31g(d).gjf (generated)

001087305.b3lyp_6-31g(d).firefly.inp (generated)

001087305.b3lyp_6-31g(d).smash.inp (generated)

001087305.b3lyp_6-31g(d).nwchem.inp (generated) 001087305.b3lyp_6-31g(d).log.xz 001087305.td-b3lyp_6-31g+(d).inp 001087305.td-b3lyp_6-31g+(d).log.xz

001087305.td-b3lyp_6-31+g(d).qchem.inp (generated)

001087305.td-b3lyp_6-31+g(d).gjf (generated)

001087305.td-b3lyp_6-31+g(d).firefly.inp (generated)

001087305.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001087305.mol 001087305.PUBCHEM 001087305.mol (via Jmol)
001087306.b3lyp_6-31g(d).inp

001087306.b3lyp_6-31g(d).qchem.inp (generated)

001087306.b3lyp_6-31g(d).gjf (generated)

001087306.b3lyp_6-31g(d).firefly.inp (generated)

001087306.b3lyp_6-31g(d).smash.inp (generated)

001087306.b3lyp_6-31g(d).nwchem.inp (generated) 001087306.b3lyp_6-31g(d).log.xz 001087306.td-b3lyp_6-31g+(d).inp 001087306.td-b3lyp_6-31g+(d).log.xz

001087306.td-b3lyp_6-31+g(d).qchem.inp (generated)

001087306.td-b3lyp_6-31+g(d).gjf (generated)

001087306.td-b3lyp_6-31+g(d).firefly.inp (generated)

001087306.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001087306.mol 001087306.PUBCHEM 001087306.mol (via Jmol)
001087548.b3lyp_6-31g(d).inp

001087548.b3lyp_6-31g(d).qchem.inp (generated)

001087548.b3lyp_6-31g(d).gjf (generated)

001087548.b3lyp_6-31g(d).firefly.inp (generated)

001087548.b3lyp_6-31g(d).smash.inp (generated)

001087548.b3lyp_6-31g(d).nwchem.inp (generated) 001087548.b3lyp_6-31g(d).log.xz 001087548.td-b3lyp_6-31g+(d).inp 001087548.td-b3lyp_6-31g+(d).log.xz

001087548.td-b3lyp_6-31+g(d).qchem.inp (generated)

001087548.td-b3lyp_6-31+g(d).gjf (generated)

001087548.td-b3lyp_6-31+g(d).firefly.inp (generated)

001087548.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001087548.mol 001087548.PUBCHEM 001087548.mol (via Jmol)
001087801.b3lyp_6-31g(d).inp

001087801.b3lyp_6-31g(d).qchem.inp (generated)

001087801.b3lyp_6-31g(d).gjf (generated)

001087801.b3lyp_6-31g(d).firefly.inp (generated)

001087801.b3lyp_6-31g(d).smash.inp (generated)

001087801.b3lyp_6-31g(d).nwchem.inp (generated) 001087801.b3lyp_6-31g(d).log.xz 001087801.mol 001087801.PUBCHEM 001087801.mol (via Jmol)
001087836.b3lyp_6-31g(d).inp

001087836.b3lyp_6-31g(d).qchem.inp (generated)

001087836.b3lyp_6-31g(d).gjf (generated)

001087836.b3lyp_6-31g(d).firefly.inp (generated)

001087836.b3lyp_6-31g(d).smash.inp (generated)

001087836.b3lyp_6-31g(d).nwchem.inp (generated) 001087836.b3lyp_6-31g(d).log.xz 001087836.td-b3lyp_6-31g+(d).inp 001087836.td-b3lyp_6-31g+(d).log.xz

001087836.td-b3lyp_6-31+g(d).qchem.inp (generated)

001087836.td-b3lyp_6-31+g(d).gjf (generated)

001087836.td-b3lyp_6-31+g(d).firefly.inp (generated)

001087836.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001087836.mol 001087836.PUBCHEM 001087836.mol (via Jmol)
001087839.b3lyp_6-31g(d).inp

001087839.b3lyp_6-31g(d).qchem.inp (generated)

001087839.b3lyp_6-31g(d).gjf (generated)

001087839.b3lyp_6-31g(d).firefly.inp (generated)

001087839.b3lyp_6-31g(d).smash.inp (generated)

001087839.b3lyp_6-31g(d).nwchem.inp (generated) 001087839.b3lyp_6-31g(d).log.xz 001087839.td-b3lyp_6-31g+(d).inp 001087839.td-b3lyp_6-31g+(d).log.xz

001087839.td-b3lyp_6-31+g(d).qchem.inp (generated)

001087839.td-b3lyp_6-31+g(d).gjf (generated)

001087839.td-b3lyp_6-31+g(d).firefly.inp (generated)

001087839.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001087839.mol 001087839.PUBCHEM 001087839.mol (via Jmol)
001087842.b3lyp_6-31g(d).inp

001087842.b3lyp_6-31g(d).qchem.inp (generated)

001087842.b3lyp_6-31g(d).gjf (generated)

001087842.b3lyp_6-31g(d).firefly.inp (generated)

001087842.b3lyp_6-31g(d).smash.inp (generated)

001087842.b3lyp_6-31g(d).nwchem.inp (generated) 001087842.b3lyp_6-31g(d).log.xz 001087842.td-b3lyp_6-31g+(d).inp 001087842.td-b3lyp_6-31g+(d).log.xz

001087842.td-b3lyp_6-31+g(d).qchem.inp (generated)

001087842.td-b3lyp_6-31+g(d).gjf (generated)

001087842.td-b3lyp_6-31+g(d).firefly.inp (generated)

001087842.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001087842.mol 001087842.PUBCHEM 001087842.mol (via Jmol)
001088127.b3lyp_6-31g(d).inp

001088127.b3lyp_6-31g(d).qchem.inp (generated)

001088127.b3lyp_6-31g(d).gjf (generated)

001088127.b3lyp_6-31g(d).firefly.inp (generated)

001088127.b3lyp_6-31g(d).smash.inp (generated)

001088127.b3lyp_6-31g(d).nwchem.inp (generated) 001088127.b3lyp_6-31g(d).log.xz 001088127.td-b3lyp_6-31g+(d).inp 001088127.td-b3lyp_6-31g+(d).log.xz

001088127.td-b3lyp_6-31+g(d).qchem.inp (generated)

001088127.td-b3lyp_6-31+g(d).gjf (generated)

001088127.td-b3lyp_6-31+g(d).firefly.inp (generated)

001088127.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001088127.mol 001088127.PUBCHEM 001088127.mol (via Jmol)
001088162.b3lyp_6-31g(d).inp

001088162.b3lyp_6-31g(d).qchem.inp (generated)

001088162.b3lyp_6-31g(d).gjf (generated)

001088162.b3lyp_6-31g(d).firefly.inp (generated)

001088162.b3lyp_6-31g(d).smash.inp (generated)

001088162.b3lyp_6-31g(d).nwchem.inp (generated) 001088162.b3lyp_6-31g(d).log.xz 001088162.mol 001088162.PUBCHEM 001088162.mol (via Jmol)
001088304.b3lyp_6-31g(d).inp

001088304.b3lyp_6-31g(d).qchem.inp (generated)

001088304.b3lyp_6-31g(d).gjf (generated)

001088304.b3lyp_6-31g(d).firefly.inp (generated)

001088304.b3lyp_6-31g(d).smash.inp (generated)

001088304.b3lyp_6-31g(d).nwchem.inp (generated) 001088304.b3lyp_6-31g(d).log.xz 001088304.td-b3lyp_6-31g+(d).inp 001088304.td-b3lyp_6-31g+(d).log.xz

001088304.td-b3lyp_6-31+g(d).qchem.inp (generated)

001088304.td-b3lyp_6-31+g(d).gjf (generated)

001088304.td-b3lyp_6-31+g(d).firefly.inp (generated)

001088304.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001088304.mol 001088304.PUBCHEM 001088304.mol (via Jmol)
001088345.b3lyp_6-31g(d).inp

001088345.b3lyp_6-31g(d).qchem.inp (generated)

001088345.b3lyp_6-31g(d).gjf (generated)

001088345.b3lyp_6-31g(d).firefly.inp (generated)

001088345.b3lyp_6-31g(d).smash.inp (generated)

001088345.b3lyp_6-31g(d).nwchem.inp (generated) 001088345.b3lyp_6-31g(d).log.xz 001088345.td-b3lyp_6-31g+(d).inp 001088345.td-b3lyp_6-31g+(d).log.xz

001088345.td-b3lyp_6-31+g(d).qchem.inp (generated)

001088345.td-b3lyp_6-31+g(d).gjf (generated)

001088345.td-b3lyp_6-31+g(d).firefly.inp (generated)

001088345.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001088345.mol 001088345.PUBCHEM 001088345.mol (via Jmol)
001088426.b3lyp_6-31g(d).inp

001088426.b3lyp_6-31g(d).qchem.inp (generated)

001088426.b3lyp_6-31g(d).gjf (generated)

001088426.b3lyp_6-31g(d).firefly.inp (generated)

001088426.b3lyp_6-31g(d).smash.inp (generated)

001088426.b3lyp_6-31g(d).nwchem.inp (generated) 001088426.b3lyp_6-31g(d).log.xz 001088426.mol 001088426.PUBCHEM 001088426.mol (via Jmol)
001088430.b3lyp_6-31g(d).inp

001088430.b3lyp_6-31g(d).qchem.inp (generated)

001088430.b3lyp_6-31g(d).gjf (generated)

001088430.b3lyp_6-31g(d).firefly.inp (generated)

001088430.b3lyp_6-31g(d).smash.inp (generated)

001088430.b3lyp_6-31g(d).nwchem.inp (generated) 001088430.b3lyp_6-31g(d).log.xz 001088430.td-b3lyp_6-31g+(d).inp 001088430.td-b3lyp_6-31g+(d).log.xz

001088430.td-b3lyp_6-31+g(d).qchem.inp (generated)

001088430.td-b3lyp_6-31+g(d).gjf (generated)

001088430.td-b3lyp_6-31+g(d).firefly.inp (generated)

001088430.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001088430.mol 001088430.PUBCHEM 001088430.mol (via Jmol)
001088442.b3lyp_6-31g(d).inp

001088442.b3lyp_6-31g(d).qchem.inp (generated)

001088442.b3lyp_6-31g(d).gjf (generated)

001088442.b3lyp_6-31g(d).firefly.inp (generated)

001088442.b3lyp_6-31g(d).smash.inp (generated)

001088442.b3lyp_6-31g(d).nwchem.inp (generated) 001088442.b3lyp_6-31g(d).log.xz 001088442.mol 001088442.PUBCHEM 001088442.mol (via Jmol)
001088443.b3lyp_6-31g(d).inp

001088443.b3lyp_6-31g(d).qchem.inp (generated)

001088443.b3lyp_6-31g(d).gjf (generated)

001088443.b3lyp_6-31g(d).firefly.inp (generated)

001088443.b3lyp_6-31g(d).smash.inp (generated)

001088443.b3lyp_6-31g(d).nwchem.inp (generated) 001088443.b3lyp_6-31g(d).log.xz 001088443.td-b3lyp_6-31g+(d).inp 001088443.td-b3lyp_6-31g+(d).log.xz

001088443.td-b3lyp_6-31+g(d).qchem.inp (generated)

001088443.td-b3lyp_6-31+g(d).gjf (generated)

001088443.td-b3lyp_6-31+g(d).firefly.inp (generated)

001088443.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001088443.mol 001088443.PUBCHEM 001088443.mol (via Jmol)
001088478.b3lyp_6-31g(d).inp

001088478.b3lyp_6-31g(d).qchem.inp (generated)

001088478.b3lyp_6-31g(d).gjf (generated)

001088478.b3lyp_6-31g(d).firefly.inp (generated)

001088478.b3lyp_6-31g(d).smash.inp (generated)

001088478.b3lyp_6-31g(d).nwchem.inp (generated) 001088478.b3lyp_6-31g(d).log.xz 001088478.td-b3lyp_6-31g+(d).inp 001088478.td-b3lyp_6-31g+(d).log.xz

001088478.td-b3lyp_6-31+g(d).qchem.inp (generated)

001088478.td-b3lyp_6-31+g(d).gjf (generated)

001088478.td-b3lyp_6-31+g(d).firefly.inp (generated)

001088478.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001088478.mol 001088478.PUBCHEM 001088478.mol (via Jmol)
001088480.b3lyp_6-31g(d).inp

001088480.b3lyp_6-31g(d).qchem.inp (generated)

001088480.b3lyp_6-31g(d).gjf (generated)

001088480.b3lyp_6-31g(d).firefly.inp (generated)

001088480.b3lyp_6-31g(d).smash.inp (generated)

001088480.b3lyp_6-31g(d).nwchem.inp (generated) 001088480.b3lyp_6-31g(d).log.xz 001088480.td-b3lyp_6-31g+(d).inp 001088480.td-b3lyp_6-31g+(d).log.xz

001088480.td-b3lyp_6-31+g(d).qchem.inp (generated)

001088480.td-b3lyp_6-31+g(d).gjf (generated)

001088480.td-b3lyp_6-31+g(d).firefly.inp (generated)

001088480.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001088480.mol 001088480.PUBCHEM 001088480.mol (via Jmol)
001088516.b3lyp_6-31g(d).inp

001088516.b3lyp_6-31g(d).qchem.inp (generated)

001088516.b3lyp_6-31g(d).gjf (generated)

001088516.b3lyp_6-31g(d).firefly.inp (generated)

001088516.b3lyp_6-31g(d).smash.inp (generated)

001088516.b3lyp_6-31g(d).nwchem.inp (generated) 001088516.b3lyp_6-31g(d).log.xz 001088516.td-b3lyp_6-31g+(d).inp 001088516.td-b3lyp_6-31g+(d).log.xz

001088516.td-b3lyp_6-31+g(d).qchem.inp (generated)

001088516.td-b3lyp_6-31+g(d).gjf (generated)

001088516.td-b3lyp_6-31+g(d).firefly.inp (generated)

001088516.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001088516.mol 001088516.PUBCHEM 001088516.mol (via Jmol)
001088519.b3lyp_6-31g(d).inp

001088519.b3lyp_6-31g(d).qchem.inp (generated)

001088519.b3lyp_6-31g(d).gjf (generated)

001088519.b3lyp_6-31g(d).firefly.inp (generated)

001088519.b3lyp_6-31g(d).smash.inp (generated)

001088519.b3lyp_6-31g(d).nwchem.inp (generated) 001088519.b3lyp_6-31g(d).log.xz 001088519.td-b3lyp_6-31g+(d).inp 001088519.td-b3lyp_6-31g+(d).log.xz

001088519.td-b3lyp_6-31+g(d).qchem.inp (generated)

001088519.td-b3lyp_6-31+g(d).gjf (generated)

001088519.td-b3lyp_6-31+g(d).firefly.inp (generated)

001088519.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001088519.mol 001088519.PUBCHEM 001088519.mol (via Jmol)
001088520.b3lyp_6-31g(d).inp

001088520.b3lyp_6-31g(d).qchem.inp (generated)

001088520.b3lyp_6-31g(d).gjf (generated)

001088520.b3lyp_6-31g(d).firefly.inp (generated)

001088520.b3lyp_6-31g(d).smash.inp (generated)

001088520.b3lyp_6-31g(d).nwchem.inp (generated) 001088520.b3lyp_6-31g(d).log.xz 001088520.td-b3lyp_6-31g+(d).inp 001088520.td-b3lyp_6-31g+(d).log.xz

001088520.td-b3lyp_6-31+g(d).qchem.inp (generated)

001088520.td-b3lyp_6-31+g(d).gjf (generated)

001088520.td-b3lyp_6-31+g(d).firefly.inp (generated)

001088520.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001088520.mol 001088520.PUBCHEM 001088520.mol (via Jmol)
001088541.b3lyp_6-31g(d).inp

001088541.b3lyp_6-31g(d).qchem.inp (generated)

001088541.b3lyp_6-31g(d).gjf (generated)

001088541.b3lyp_6-31g(d).firefly.inp (generated)

001088541.b3lyp_6-31g(d).smash.inp (generated)

001088541.b3lyp_6-31g(d).nwchem.inp (generated) 001088541.b3lyp_6-31g(d).log.xz 001088541.td-b3lyp_6-31g+(d).inp 001088541.td-b3lyp_6-31g+(d).log.xz

001088541.td-b3lyp_6-31+g(d).qchem.inp (generated)

001088541.td-b3lyp_6-31+g(d).gjf (generated)

001088541.td-b3lyp_6-31+g(d).firefly.inp (generated)

001088541.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001088541.mol 001088541.PUBCHEM 001088541.mol (via Jmol)
001088707.b3lyp_6-31g(d).inp

001088707.b3lyp_6-31g(d).qchem.inp (generated)

001088707.b3lyp_6-31g(d).gjf (generated)

001088707.b3lyp_6-31g(d).firefly.inp (generated)

001088707.b3lyp_6-31g(d).smash.inp (generated)

001088707.b3lyp_6-31g(d).nwchem.inp (generated) 001088707.b3lyp_6-31g(d).log.xz 001088707.td-b3lyp_6-31g+(d).inp 001088707.td-b3lyp_6-31g+(d).log.xz

001088707.td-b3lyp_6-31+g(d).qchem.inp (generated)

001088707.td-b3lyp_6-31+g(d).gjf (generated)

001088707.td-b3lyp_6-31+g(d).firefly.inp (generated)

001088707.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001088707.mol 001088707.PUBCHEM 001088707.mol (via Jmol)
001088873.b3lyp_6-31g(d).inp

001088873.b3lyp_6-31g(d).qchem.inp (generated)

001088873.b3lyp_6-31g(d).gjf (generated)

001088873.b3lyp_6-31g(d).firefly.inp (generated)

001088873.b3lyp_6-31g(d).smash.inp (generated)

001088873.b3lyp_6-31g(d).nwchem.inp (generated) 001088873.b3lyp_6-31g(d).log.xz 001088873.td-b3lyp_6-31g+(d).inp 001088873.td-b3lyp_6-31g+(d).log.xz

001088873.td-b3lyp_6-31+g(d).qchem.inp (generated)

001088873.td-b3lyp_6-31+g(d).gjf (generated)

001088873.td-b3lyp_6-31+g(d).firefly.inp (generated)

001088873.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001088873.mol 001088873.PUBCHEM 001088873.mol (via Jmol)
001088925.b3lyp_6-31g(d).inp

001088925.b3lyp_6-31g(d).qchem.inp (generated)

001088925.b3lyp_6-31g(d).gjf (generated)

001088925.b3lyp_6-31g(d).firefly.inp (generated)

001088925.b3lyp_6-31g(d).smash.inp (generated)

001088925.b3lyp_6-31g(d).nwchem.inp (generated) 001088925.b3lyp_6-31g(d).log.xz 001088925.td-b3lyp_6-31g+(d).inp 001088925.td-b3lyp_6-31g+(d).log.xz

001088925.td-b3lyp_6-31+g(d).qchem.inp (generated)

001088925.td-b3lyp_6-31+g(d).gjf (generated)

001088925.td-b3lyp_6-31+g(d).firefly.inp (generated)

001088925.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001088925.mol 001088925.PUBCHEM 001088925.mol (via Jmol)
001089015.b3lyp_6-31g(d).inp

001089015.b3lyp_6-31g(d).qchem.inp (generated)

001089015.b3lyp_6-31g(d).gjf (generated)

001089015.b3lyp_6-31g(d).firefly.inp (generated)

001089015.b3lyp_6-31g(d).smash.inp (generated)

001089015.b3lyp_6-31g(d).nwchem.inp (generated) 001089015.b3lyp_6-31g(d).log.xz 001089015.td-b3lyp_6-31g+(d).inp 001089015.td-b3lyp_6-31g+(d).log.xz

001089015.td-b3lyp_6-31+g(d).qchem.inp (generated)

001089015.td-b3lyp_6-31+g(d).gjf (generated)

001089015.td-b3lyp_6-31+g(d).firefly.inp (generated)

001089015.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001089015.mol 001089015.PUBCHEM 001089015.mol (via Jmol)
001089051.b3lyp_6-31g(d).inp

001089051.b3lyp_6-31g(d).qchem.inp (generated)

001089051.b3lyp_6-31g(d).gjf (generated)

001089051.b3lyp_6-31g(d).firefly.inp (generated)

001089051.b3lyp_6-31g(d).smash.inp (generated)

001089051.b3lyp_6-31g(d).nwchem.inp (generated) 001089051.b3lyp_6-31g(d).log.xz 001089051.td-b3lyp_6-31g+(d).inp 001089051.td-b3lyp_6-31g+(d).log.xz

001089051.td-b3lyp_6-31+g(d).qchem.inp (generated)

001089051.td-b3lyp_6-31+g(d).gjf (generated)

001089051.td-b3lyp_6-31+g(d).firefly.inp (generated)

001089051.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001089051.mol 001089051.PUBCHEM 001089051.mol (via Jmol)
001089052.b3lyp_6-31g(d).inp

001089052.b3lyp_6-31g(d).qchem.inp (generated)

001089052.b3lyp_6-31g(d).gjf (generated)

001089052.b3lyp_6-31g(d).firefly.inp (generated)

001089052.b3lyp_6-31g(d).smash.inp (generated)

001089052.b3lyp_6-31g(d).nwchem.inp (generated) 001089052.b3lyp_6-31g(d).log.xz 001089052.mol 001089052.PUBCHEM 001089052.mol (via Jmol)
001089053.b3lyp_6-31g(d).inp

001089053.b3lyp_6-31g(d).qchem.inp (generated)

001089053.b3lyp_6-31g(d).gjf (generated)

001089053.b3lyp_6-31g(d).firefly.inp (generated)

001089053.b3lyp_6-31g(d).smash.inp (generated)

001089053.b3lyp_6-31g(d).nwchem.inp (generated) 001089053.b3lyp_6-31g(d).log.xz 001089053.td-b3lyp_6-31g+(d).inp 001089053.td-b3lyp_6-31g+(d).log.xz

001089053.td-b3lyp_6-31+g(d).qchem.inp (generated)

001089053.td-b3lyp_6-31+g(d).gjf (generated)

001089053.td-b3lyp_6-31+g(d).firefly.inp (generated)

001089053.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001089053.mol 001089053.PUBCHEM 001089053.mol (via Jmol)
001089058.b3lyp_6-31g(d).inp

001089058.b3lyp_6-31g(d).qchem.inp (generated)

001089058.b3lyp_6-31g(d).gjf (generated)

001089058.b3lyp_6-31g(d).firefly.inp (generated)

001089058.b3lyp_6-31g(d).smash.inp (generated)

001089058.b3lyp_6-31g(d).nwchem.inp (generated) 001089058.b3lyp_6-31g(d).log.xz 001089058.mol 001089058.PUBCHEM 001089058.mol (via Jmol)
001089067.b3lyp_6-31g(d).inp

001089067.b3lyp_6-31g(d).qchem.inp (generated)

001089067.b3lyp_6-31g(d).gjf (generated)

001089067.b3lyp_6-31g(d).firefly.inp (generated)

001089067.b3lyp_6-31g(d).smash.inp (generated)

001089067.b3lyp_6-31g(d).nwchem.inp (generated) 001089067.b3lyp_6-31g(d).log.xz 001089067.td-b3lyp_6-31g+(d).inp 001089067.td-b3lyp_6-31g+(d).log.xz

001089067.td-b3lyp_6-31+g(d).qchem.inp (generated)

001089067.td-b3lyp_6-31+g(d).gjf (generated)

001089067.td-b3lyp_6-31+g(d).firefly.inp (generated)

001089067.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001089067.mol 001089067.PUBCHEM 001089067.mol (via Jmol)
001089162.b3lyp_6-31g(d).inp

001089162.b3lyp_6-31g(d).qchem.inp (generated)

001089162.b3lyp_6-31g(d).gjf (generated)

001089162.b3lyp_6-31g(d).firefly.inp (generated)

001089162.b3lyp_6-31g(d).smash.inp (generated)

001089162.b3lyp_6-31g(d).nwchem.inp (generated) 001089162.b3lyp_6-31g(d).log.xz 001089162.td-b3lyp_6-31g+(d).inp 001089162.td-b3lyp_6-31g+(d).log.xz

001089162.td-b3lyp_6-31+g(d).qchem.inp (generated)

001089162.td-b3lyp_6-31+g(d).gjf (generated)

001089162.td-b3lyp_6-31+g(d).firefly.inp (generated)

001089162.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001089162.mol 001089162.PUBCHEM 001089162.mol (via Jmol)
001089169.b3lyp_6-31g(d).inp

001089169.b3lyp_6-31g(d).qchem.inp (generated)

001089169.b3lyp_6-31g(d).gjf (generated)

001089169.b3lyp_6-31g(d).firefly.inp (generated)

001089169.b3lyp_6-31g(d).smash.inp (generated)

001089169.b3lyp_6-31g(d).nwchem.inp (generated) 001089169.b3lyp_6-31g(d).log.xz 001089169.td-b3lyp_6-31g+(d).inp 001089169.td-b3lyp_6-31g+(d).log.xz

001089169.td-b3lyp_6-31+g(d).qchem.inp (generated)

001089169.td-b3lyp_6-31+g(d).gjf (generated)

001089169.td-b3lyp_6-31+g(d).firefly.inp (generated)

001089169.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001089169.mol 001089169.PUBCHEM 001089169.mol (via Jmol)
001089184.b3lyp_6-31g(d).inp

001089184.b3lyp_6-31g(d).qchem.inp (generated)

001089184.b3lyp_6-31g(d).gjf (generated)

001089184.b3lyp_6-31g(d).firefly.inp (generated)

001089184.b3lyp_6-31g(d).smash.inp (generated)

001089184.b3lyp_6-31g(d).nwchem.inp (generated) 001089184.b3lyp_6-31g(d).log.xz 001089184.td-b3lyp_6-31g+(d).inp 001089184.td-b3lyp_6-31g+(d).log.xz

001089184.td-b3lyp_6-31+g(d).qchem.inp (generated)

001089184.td-b3lyp_6-31+g(d).gjf (generated)

001089184.td-b3lyp_6-31+g(d).firefly.inp (generated)

001089184.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001089184.mol 001089184.PUBCHEM 001089184.mol (via Jmol)
001089185.b3lyp_6-31g(d).inp

001089185.b3lyp_6-31g(d).qchem.inp (generated)

001089185.b3lyp_6-31g(d).gjf (generated)

001089185.b3lyp_6-31g(d).firefly.inp (generated)

001089185.b3lyp_6-31g(d).smash.inp (generated)

001089185.b3lyp_6-31g(d).nwchem.inp (generated) 001089185.b3lyp_6-31g(d).log.xz 001089185.td-b3lyp_6-31g+(d).inp 001089185.td-b3lyp_6-31g+(d).log.xz

001089185.td-b3lyp_6-31+g(d).qchem.inp (generated)

001089185.td-b3lyp_6-31+g(d).gjf (generated)

001089185.td-b3lyp_6-31+g(d).firefly.inp (generated)

001089185.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001089185.mol 001089185.PUBCHEM 001089185.mol (via Jmol)
001089239.b3lyp_6-31g(d).inp

001089239.b3lyp_6-31g(d).qchem.inp (generated)

001089239.b3lyp_6-31g(d).gjf (generated)

001089239.b3lyp_6-31g(d).firefly.inp (generated)

001089239.b3lyp_6-31g(d).smash.inp (generated)

001089239.b3lyp_6-31g(d).nwchem.inp (generated) 001089239.b3lyp_6-31g(d).log.xz 001089239.mol 001089239.PUBCHEM 001089239.mol (via Jmol)
001089241.b3lyp_6-31g(d).inp

001089241.b3lyp_6-31g(d).qchem.inp (generated)

001089241.b3lyp_6-31g(d).gjf (generated)

001089241.b3lyp_6-31g(d).firefly.inp (generated)

001089241.b3lyp_6-31g(d).smash.inp (generated)

001089241.b3lyp_6-31g(d).nwchem.inp (generated) 001089241.b3lyp_6-31g(d).log.xz 001089241.td-b3lyp_6-31g+(d).inp 001089241.td-b3lyp_6-31g+(d).log.xz

001089241.td-b3lyp_6-31+g(d).qchem.inp (generated)

001089241.td-b3lyp_6-31+g(d).gjf (generated)

001089241.td-b3lyp_6-31+g(d).firefly.inp (generated)

001089241.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001089241.mol 001089241.PUBCHEM 001089241.mol (via Jmol)
001089242.b3lyp_6-31g(d).inp

001089242.b3lyp_6-31g(d).qchem.inp (generated)

001089242.b3lyp_6-31g(d).gjf (generated)

001089242.b3lyp_6-31g(d).firefly.inp (generated)

001089242.b3lyp_6-31g(d).smash.inp (generated)

001089242.b3lyp_6-31g(d).nwchem.inp (generated) 001089242.b3lyp_6-31g(d).log.xz 001089242.td-b3lyp_6-31g+(d).inp 001089242.td-b3lyp_6-31g+(d).log.xz

001089242.td-b3lyp_6-31+g(d).qchem.inp (generated)

001089242.td-b3lyp_6-31+g(d).gjf (generated)

001089242.td-b3lyp_6-31+g(d).firefly.inp (generated)

001089242.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001089242.mol 001089242.PUBCHEM 001089242.mol (via Jmol)
001089243.b3lyp_6-31g(d).inp

001089243.b3lyp_6-31g(d).qchem.inp (generated)

001089243.b3lyp_6-31g(d).gjf (generated)

001089243.b3lyp_6-31g(d).firefly.inp (generated)

001089243.b3lyp_6-31g(d).smash.inp (generated)

001089243.b3lyp_6-31g(d).nwchem.inp (generated) 001089243.b3lyp_6-31g(d).log.xz 001089243.td-b3lyp_6-31g+(d).inp 001089243.td-b3lyp_6-31g+(d).log.xz

001089243.td-b3lyp_6-31+g(d).qchem.inp (generated)

001089243.td-b3lyp_6-31+g(d).gjf (generated)

001089243.td-b3lyp_6-31+g(d).firefly.inp (generated)

001089243.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001089243.mol 001089243.PUBCHEM 001089243.mol (via Jmol)
001089285.b3lyp_6-31g(d).inp

001089285.b3lyp_6-31g(d).qchem.inp (generated)

001089285.b3lyp_6-31g(d).gjf (generated)

001089285.b3lyp_6-31g(d).firefly.inp (generated)

001089285.b3lyp_6-31g(d).smash.inp (generated)

001089285.b3lyp_6-31g(d).nwchem.inp (generated) 001089285.b3lyp_6-31g(d).log.xz 001089285.mol 001089285.PUBCHEM 001089285.mol (via Jmol)
001089640.b3lyp_6-31g(d).inp

001089640.b3lyp_6-31g(d).qchem.inp (generated)

001089640.b3lyp_6-31g(d).gjf (generated)

001089640.b3lyp_6-31g(d).firefly.inp (generated)

001089640.b3lyp_6-31g(d).smash.inp (generated)

001089640.b3lyp_6-31g(d).nwchem.inp (generated) 001089640.b3lyp_6-31g(d).log.xz 001089640.td-b3lyp_6-31g+(d).inp 001089640.td-b3lyp_6-31g+(d).log.xz

001089640.td-b3lyp_6-31+g(d).qchem.inp (generated)

001089640.td-b3lyp_6-31+g(d).gjf (generated)

001089640.td-b3lyp_6-31+g(d).firefly.inp (generated)

001089640.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001089640.mol 001089640.PUBCHEM 001089640.mol (via Jmol)
001090017.b3lyp_6-31g(d).inp

001090017.b3lyp_6-31g(d).qchem.inp (generated)

001090017.b3lyp_6-31g(d).gjf (generated)

001090017.b3lyp_6-31g(d).firefly.inp (generated)

001090017.b3lyp_6-31g(d).smash.inp (generated)

001090017.b3lyp_6-31g(d).nwchem.inp (generated) 001090017.b3lyp_6-31g(d).log.xz 001090017.td-b3lyp_6-31g+(d).inp 001090017.td-b3lyp_6-31g+(d).log.xz

001090017.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090017.td-b3lyp_6-31+g(d).gjf (generated)

001090017.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090017.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090017.mol 001090017.PUBCHEM 001090017.mol (via Jmol)
001090018.b3lyp_6-31g(d).inp

001090018.b3lyp_6-31g(d).qchem.inp (generated)

001090018.b3lyp_6-31g(d).gjf (generated)

001090018.b3lyp_6-31g(d).firefly.inp (generated)

001090018.b3lyp_6-31g(d).smash.inp (generated)

001090018.b3lyp_6-31g(d).nwchem.inp (generated) 001090018.b3lyp_6-31g(d).log.xz 001090018.td-b3lyp_6-31g+(d).inp 001090018.td-b3lyp_6-31g+(d).log.xz

001090018.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090018.td-b3lyp_6-31+g(d).gjf (generated)

001090018.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090018.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090018.mol 001090018.PUBCHEM 001090018.mol (via Jmol)
001090064.b3lyp_6-31g(d).inp

001090064.b3lyp_6-31g(d).qchem.inp (generated)

001090064.b3lyp_6-31g(d).gjf (generated)

001090064.b3lyp_6-31g(d).firefly.inp (generated)

001090064.b3lyp_6-31g(d).smash.inp (generated)

001090064.b3lyp_6-31g(d).nwchem.inp (generated) 001090064.b3lyp_6-31g(d).log.xz 001090064.td-b3lyp_6-31g+(d).inp 001090064.td-b3lyp_6-31g+(d).log.xz

001090064.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090064.td-b3lyp_6-31+g(d).gjf (generated)

001090064.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090064.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090064.mol 001090064.PUBCHEM 001090064.mol (via Jmol)
001090150.b3lyp_6-31g(d).inp

001090150.b3lyp_6-31g(d).qchem.inp (generated)

001090150.b3lyp_6-31g(d).gjf (generated)

001090150.b3lyp_6-31g(d).firefly.inp (generated)

001090150.b3lyp_6-31g(d).smash.inp (generated)

001090150.b3lyp_6-31g(d).nwchem.inp (generated) 001090150.b3lyp_6-31g(d).log.xz 001090150.td-b3lyp_6-31g+(d).inp 001090150.td-b3lyp_6-31g+(d).log.xz

001090150.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090150.td-b3lyp_6-31+g(d).gjf (generated)

001090150.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090150.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090150.mol 001090150.PUBCHEM 001090150.mol (via Jmol)
001090300.b3lyp_6-31g(d).inp

001090300.b3lyp_6-31g(d).qchem.inp (generated)

001090300.b3lyp_6-31g(d).gjf (generated)

001090300.b3lyp_6-31g(d).firefly.inp (generated)

001090300.b3lyp_6-31g(d).smash.inp (generated)

001090300.b3lyp_6-31g(d).nwchem.inp (generated) 001090300.b3lyp_6-31g(d).log.xz 001090300.td-b3lyp_6-31g+(d).inp 001090300.td-b3lyp_6-31g+(d).log.xz

001090300.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090300.td-b3lyp_6-31+g(d).gjf (generated)

001090300.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090300.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090300.mol 001090300.PUBCHEM 001090300.mol (via Jmol)
001090301.b3lyp_6-31g(d).inp

001090301.b3lyp_6-31g(d).qchem.inp (generated)

001090301.b3lyp_6-31g(d).gjf (generated)

001090301.b3lyp_6-31g(d).firefly.inp (generated)

001090301.b3lyp_6-31g(d).smash.inp (generated)

001090301.b3lyp_6-31g(d).nwchem.inp (generated) 001090301.b3lyp_6-31g(d).log.xz 001090301.td-b3lyp_6-31g+(d).inp 001090301.td-b3lyp_6-31g+(d).log.xz

001090301.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090301.td-b3lyp_6-31+g(d).gjf (generated)

001090301.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090301.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090301.mol 001090301.PUBCHEM 001090301.mol (via Jmol)
001090317.b3lyp_6-31g(d).inp

001090317.b3lyp_6-31g(d).qchem.inp (generated)

001090317.b3lyp_6-31g(d).gjf (generated)

001090317.b3lyp_6-31g(d).firefly.inp (generated)

001090317.b3lyp_6-31g(d).smash.inp (generated)

001090317.b3lyp_6-31g(d).nwchem.inp (generated) 001090317.b3lyp_6-31g(d).log.xz 001090317.mol 001090317.PUBCHEM 001090317.mol (via Jmol)
001090322.b3lyp_6-31g(d).inp

001090322.b3lyp_6-31g(d).qchem.inp (generated)

001090322.b3lyp_6-31g(d).gjf (generated)

001090322.b3lyp_6-31g(d).firefly.inp (generated)

001090322.b3lyp_6-31g(d).smash.inp (generated)

001090322.b3lyp_6-31g(d).nwchem.inp (generated) 001090322.b3lyp_6-31g(d).log.xz 001090322.mol 001090322.PUBCHEM 001090322.mol (via Jmol)
001090324.b3lyp_6-31g(d).inp

001090324.b3lyp_6-31g(d).qchem.inp (generated)

001090324.b3lyp_6-31g(d).gjf (generated)

001090324.b3lyp_6-31g(d).firefly.inp (generated)

001090324.b3lyp_6-31g(d).smash.inp (generated)

001090324.b3lyp_6-31g(d).nwchem.inp (generated) 001090324.b3lyp_6-31g(d).log.xz 001090324.td-b3lyp_6-31g+(d).inp 001090324.td-b3lyp_6-31g+(d).log.xz

001090324.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090324.td-b3lyp_6-31+g(d).gjf (generated)

001090324.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090324.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090324.mol 001090324.PUBCHEM 001090324.mol (via Jmol)
001090325.b3lyp_6-31g(d).inp

001090325.b3lyp_6-31g(d).qchem.inp (generated)

001090325.b3lyp_6-31g(d).gjf (generated)

001090325.b3lyp_6-31g(d).firefly.inp (generated)

001090325.b3lyp_6-31g(d).smash.inp (generated)

001090325.b3lyp_6-31g(d).nwchem.inp (generated) 001090325.b3lyp_6-31g(d).log.xz 001090325.td-b3lyp_6-31g+(d).inp 001090325.td-b3lyp_6-31g+(d).log.xz

001090325.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090325.td-b3lyp_6-31+g(d).gjf (generated)

001090325.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090325.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090325.mol 001090325.PUBCHEM 001090325.mol (via Jmol)
001090341.b3lyp_6-31g(d).inp

001090341.b3lyp_6-31g(d).qchem.inp (generated)

001090341.b3lyp_6-31g(d).gjf (generated)

001090341.b3lyp_6-31g(d).firefly.inp (generated)

001090341.b3lyp_6-31g(d).smash.inp (generated)

001090341.b3lyp_6-31g(d).nwchem.inp (generated) 001090341.b3lyp_6-31g(d).log.xz 001090341.td-b3lyp_6-31g+(d).inp 001090341.td-b3lyp_6-31g+(d).log.xz

001090341.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090341.td-b3lyp_6-31+g(d).gjf (generated)

001090341.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090341.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090341.mol 001090341.PUBCHEM 001090341.mol (via Jmol)
001090391.b3lyp_6-31g(d).inp

001090391.b3lyp_6-31g(d).qchem.inp (generated)

001090391.b3lyp_6-31g(d).gjf (generated)

001090391.b3lyp_6-31g(d).firefly.inp (generated)

001090391.b3lyp_6-31g(d).smash.inp (generated)

001090391.b3lyp_6-31g(d).nwchem.inp (generated) 001090391.b3lyp_6-31g(d).log.xz 001090391.td-b3lyp_6-31g+(d).inp 001090391.td-b3lyp_6-31g+(d).log.xz

001090391.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090391.td-b3lyp_6-31+g(d).gjf (generated)

001090391.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090391.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090391.mol 001090391.PUBCHEM 001090391.mol (via Jmol)
001090481.b3lyp_6-31g(d).inp

001090481.b3lyp_6-31g(d).qchem.inp (generated)

001090481.b3lyp_6-31g(d).gjf (generated)

001090481.b3lyp_6-31g(d).firefly.inp (generated)

001090481.b3lyp_6-31g(d).smash.inp (generated)

001090481.b3lyp_6-31g(d).nwchem.inp (generated) 001090481.b3lyp_6-31g(d).log.xz 001090481.td-b3lyp_6-31g+(d).inp 001090481.td-b3lyp_6-31g+(d).log.xz

001090481.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090481.td-b3lyp_6-31+g(d).gjf (generated)

001090481.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090481.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090481.mol 001090481.PUBCHEM 001090481.mol (via Jmol)
001090485.b3lyp_6-31g(d).inp

001090485.b3lyp_6-31g(d).qchem.inp (generated)

001090485.b3lyp_6-31g(d).gjf (generated)

001090485.b3lyp_6-31g(d).firefly.inp (generated)

001090485.b3lyp_6-31g(d).smash.inp (generated)

001090485.b3lyp_6-31g(d).nwchem.inp (generated) 001090485.b3lyp_6-31g(d).log.xz 001090485.mol 001090485.PUBCHEM 001090485.mol (via Jmol)
001090523.b3lyp_6-31g(d).inp

001090523.b3lyp_6-31g(d).qchem.inp (generated)

001090523.b3lyp_6-31g(d).gjf (generated)

001090523.b3lyp_6-31g(d).firefly.inp (generated)

001090523.b3lyp_6-31g(d).smash.inp (generated)

001090523.b3lyp_6-31g(d).nwchem.inp (generated) 001090523.b3lyp_6-31g(d).log.xz 001090523.mol 001090523.PUBCHEM 001090523.mol (via Jmol)
001090524.b3lyp_6-31g(d).inp

001090524.b3lyp_6-31g(d).qchem.inp (generated)

001090524.b3lyp_6-31g(d).gjf (generated)

001090524.b3lyp_6-31g(d).firefly.inp (generated)

001090524.b3lyp_6-31g(d).smash.inp (generated)

001090524.b3lyp_6-31g(d).nwchem.inp (generated) 001090524.b3lyp_6-31g(d).log.xz 001090524.mol 001090524.PUBCHEM 001090524.mol (via Jmol)
001090527.b3lyp_6-31g(d).inp

001090527.b3lyp_6-31g(d).qchem.inp (generated)

001090527.b3lyp_6-31g(d).gjf (generated)

001090527.b3lyp_6-31g(d).firefly.inp (generated)

001090527.b3lyp_6-31g(d).smash.inp (generated)

001090527.b3lyp_6-31g(d).nwchem.inp (generated) 001090527.b3lyp_6-31g(d).log.xz 001090527.td-b3lyp_6-31g+(d).inp 001090527.td-b3lyp_6-31g+(d).log.xz

001090527.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090527.td-b3lyp_6-31+g(d).gjf (generated)

001090527.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090527.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090527.mol 001090527.PUBCHEM 001090527.mol (via Jmol)
001090528.b3lyp_6-31g(d).inp

001090528.b3lyp_6-31g(d).qchem.inp (generated)

001090528.b3lyp_6-31g(d).gjf (generated)

001090528.b3lyp_6-31g(d).firefly.inp (generated)

001090528.b3lyp_6-31g(d).smash.inp (generated)

001090528.b3lyp_6-31g(d).nwchem.inp (generated) 001090528.b3lyp_6-31g(d).log.xz 001090528.mol 001090528.PUBCHEM 001090528.mol (via Jmol)
001090530.b3lyp_6-31g(d).inp

001090530.b3lyp_6-31g(d).qchem.inp (generated)

001090530.b3lyp_6-31g(d).gjf (generated)

001090530.b3lyp_6-31g(d).firefly.inp (generated)

001090530.b3lyp_6-31g(d).smash.inp (generated)

001090530.b3lyp_6-31g(d).nwchem.inp (generated) 001090530.b3lyp_6-31g(d).log.xz 001090530.td-b3lyp_6-31g+(d).inp 001090530.td-b3lyp_6-31g+(d).log.xz

001090530.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090530.td-b3lyp_6-31+g(d).gjf (generated)

001090530.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090530.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090530.mol 001090530.PUBCHEM 001090530.mol (via Jmol)
001090535.b3lyp_6-31g(d).inp

001090535.b3lyp_6-31g(d).qchem.inp (generated)

001090535.b3lyp_6-31g(d).gjf (generated)

001090535.b3lyp_6-31g(d).firefly.inp (generated)

001090535.b3lyp_6-31g(d).smash.inp (generated)

001090535.b3lyp_6-31g(d).nwchem.inp (generated) 001090535.b3lyp_6-31g(d).log.xz 001090535.mol 001090535.PUBCHEM 001090535.mol (via Jmol)
001090538.b3lyp_6-31g(d).inp

001090538.b3lyp_6-31g(d).qchem.inp (generated)

001090538.b3lyp_6-31g(d).gjf (generated)

001090538.b3lyp_6-31g(d).firefly.inp (generated)

001090538.b3lyp_6-31g(d).smash.inp (generated)

001090538.b3lyp_6-31g(d).nwchem.inp (generated) 001090538.b3lyp_6-31g(d).log.xz 001090538.td-b3lyp_6-31g+(d).inp 001090538.td-b3lyp_6-31g+(d).log.xz

001090538.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090538.td-b3lyp_6-31+g(d).gjf (generated)

001090538.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090538.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090538.mol 001090538.PUBCHEM 001090538.mol (via Jmol)
001090539.b3lyp_6-31g(d).inp

001090539.b3lyp_6-31g(d).qchem.inp (generated)

001090539.b3lyp_6-31g(d).gjf (generated)

001090539.b3lyp_6-31g(d).firefly.inp (generated)

001090539.b3lyp_6-31g(d).smash.inp (generated)

001090539.b3lyp_6-31g(d).nwchem.inp (generated) 001090539.b3lyp_6-31g(d).log.xz 001090539.td-b3lyp_6-31g+(d).inp 001090539.td-b3lyp_6-31g+(d).log.xz

001090539.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090539.td-b3lyp_6-31+g(d).gjf (generated)

001090539.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090539.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090539.mol 001090539.PUBCHEM 001090539.mol (via Jmol)
001090540.b3lyp_6-31g(d).inp

001090540.b3lyp_6-31g(d).qchem.inp (generated)

001090540.b3lyp_6-31g(d).gjf (generated)

001090540.b3lyp_6-31g(d).firefly.inp (generated)

001090540.b3lyp_6-31g(d).smash.inp (generated)

001090540.b3lyp_6-31g(d).nwchem.inp (generated) 001090540.b3lyp_6-31g(d).log.xz 001090540.mol 001090540.PUBCHEM 001090540.mol (via Jmol)
001090541.b3lyp_6-31g(d).inp

001090541.b3lyp_6-31g(d).qchem.inp (generated)

001090541.b3lyp_6-31g(d).gjf (generated)

001090541.b3lyp_6-31g(d).firefly.inp (generated)

001090541.b3lyp_6-31g(d).smash.inp (generated)

001090541.b3lyp_6-31g(d).nwchem.inp (generated) 001090541.b3lyp_6-31g(d).log.xz 001090541.td-b3lyp_6-31g+(d).inp 001090541.td-b3lyp_6-31g+(d).log.xz

001090541.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090541.td-b3lyp_6-31+g(d).gjf (generated)

001090541.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090541.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090541.mol 001090541.PUBCHEM 001090541.mol (via Jmol)
001090542.b3lyp_6-31g(d).inp

001090542.b3lyp_6-31g(d).qchem.inp (generated)

001090542.b3lyp_6-31g(d).gjf (generated)

001090542.b3lyp_6-31g(d).firefly.inp (generated)

001090542.b3lyp_6-31g(d).smash.inp (generated)

001090542.b3lyp_6-31g(d).nwchem.inp (generated) 001090542.b3lyp_6-31g(d).log.xz 001090542.td-b3lyp_6-31g+(d).inp 001090542.td-b3lyp_6-31g+(d).log.xz

001090542.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090542.td-b3lyp_6-31+g(d).gjf (generated)

001090542.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090542.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090542.mol 001090542.PUBCHEM 001090542.mol (via Jmol)
001090547.b3lyp_6-31g(d).inp

001090547.b3lyp_6-31g(d).qchem.inp (generated)

001090547.b3lyp_6-31g(d).gjf (generated)

001090547.b3lyp_6-31g(d).firefly.inp (generated)

001090547.b3lyp_6-31g(d).smash.inp (generated)

001090547.b3lyp_6-31g(d).nwchem.inp (generated) 001090547.b3lyp_6-31g(d).log.xz 001090547.td-b3lyp_6-31g+(d).inp 001090547.td-b3lyp_6-31g+(d).log.xz

001090547.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090547.td-b3lyp_6-31+g(d).gjf (generated)

001090547.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090547.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090547.mol 001090547.PUBCHEM 001090547.mol (via Jmol)
001090549.b3lyp_6-31g(d).inp

001090549.b3lyp_6-31g(d).qchem.inp (generated)

001090549.b3lyp_6-31g(d).gjf (generated)

001090549.b3lyp_6-31g(d).firefly.inp (generated)

001090549.b3lyp_6-31g(d).smash.inp (generated)

001090549.b3lyp_6-31g(d).nwchem.inp (generated) 001090549.b3lyp_6-31g(d).log.xz 001090549.mol 001090549.PUBCHEM 001090549.mol (via Jmol)
001090550.b3lyp_6-31g(d).inp

001090550.b3lyp_6-31g(d).qchem.inp (generated)

001090550.b3lyp_6-31g(d).gjf (generated)

001090550.b3lyp_6-31g(d).firefly.inp (generated)

001090550.b3lyp_6-31g(d).smash.inp (generated)

001090550.b3lyp_6-31g(d).nwchem.inp (generated) 001090550.b3lyp_6-31g(d).log.xz 001090550.td-b3lyp_6-31g+(d).inp 001090550.td-b3lyp_6-31g+(d).log.xz

001090550.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090550.td-b3lyp_6-31+g(d).gjf (generated)

001090550.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090550.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090550.mol 001090550.PUBCHEM 001090550.mol (via Jmol)
001090551.b3lyp_6-31g(d).inp

001090551.b3lyp_6-31g(d).qchem.inp (generated)

001090551.b3lyp_6-31g(d).gjf (generated)

001090551.b3lyp_6-31g(d).firefly.inp (generated)

001090551.b3lyp_6-31g(d).smash.inp (generated)

001090551.b3lyp_6-31g(d).nwchem.inp (generated) 001090551.b3lyp_6-31g(d).log.xz 001090551.td-b3lyp_6-31g+(d).inp 001090551.td-b3lyp_6-31g+(d).log.xz

001090551.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090551.td-b3lyp_6-31+g(d).gjf (generated)

001090551.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090551.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090551.mol 001090551.PUBCHEM 001090551.mol (via Jmol)
001090558.b3lyp_6-31g(d).inp

001090558.b3lyp_6-31g(d).qchem.inp (generated)

001090558.b3lyp_6-31g(d).gjf (generated)

001090558.b3lyp_6-31g(d).firefly.inp (generated)

001090558.b3lyp_6-31g(d).smash.inp (generated)

001090558.b3lyp_6-31g(d).nwchem.inp (generated) 001090558.b3lyp_6-31g(d).log.xz 001090558.td-b3lyp_6-31g+(d).inp 001090558.td-b3lyp_6-31g+(d).log.xz

001090558.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090558.td-b3lyp_6-31+g(d).gjf (generated)

001090558.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090558.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090558.mol 001090558.PUBCHEM 001090558.mol (via Jmol)
001090559.b3lyp_6-31g(d).inp

001090559.b3lyp_6-31g(d).qchem.inp (generated)

001090559.b3lyp_6-31g(d).gjf (generated)

001090559.b3lyp_6-31g(d).firefly.inp (generated)

001090559.b3lyp_6-31g(d).smash.inp (generated)

001090559.b3lyp_6-31g(d).nwchem.inp (generated) 001090559.b3lyp_6-31g(d).log.xz 001090559.td-b3lyp_6-31g+(d).inp 001090559.td-b3lyp_6-31g+(d).log.xz

001090559.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090559.td-b3lyp_6-31+g(d).gjf (generated)

001090559.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090559.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090559.mol 001090559.PUBCHEM 001090559.mol (via Jmol)
001090580.b3lyp_6-31g(d).inp

001090580.b3lyp_6-31g(d).qchem.inp (generated)

001090580.b3lyp_6-31g(d).gjf (generated)

001090580.b3lyp_6-31g(d).firefly.inp (generated)

001090580.b3lyp_6-31g(d).smash.inp (generated)

001090580.b3lyp_6-31g(d).nwchem.inp (generated) 001090580.b3lyp_6-31g(d).log.xz 001090580.mol 001090580.PUBCHEM 001090580.mol (via Jmol)
001090627.b3lyp_6-31g(d).inp

001090627.b3lyp_6-31g(d).qchem.inp (generated)

001090627.b3lyp_6-31g(d).gjf (generated)

001090627.b3lyp_6-31g(d).firefly.inp (generated)

001090627.b3lyp_6-31g(d).smash.inp (generated)

001090627.b3lyp_6-31g(d).nwchem.inp (generated) 001090627.b3lyp_6-31g(d).log.xz 001090627.mol 001090627.PUBCHEM 001090627.mol (via Jmol)
001090705.b3lyp_6-31g(d).inp

001090705.b3lyp_6-31g(d).qchem.inp (generated)

001090705.b3lyp_6-31g(d).gjf (generated)

001090705.b3lyp_6-31g(d).firefly.inp (generated)

001090705.b3lyp_6-31g(d).smash.inp (generated)

001090705.b3lyp_6-31g(d).nwchem.inp (generated) 001090705.b3lyp_6-31g(d).log.xz 001090705.td-b3lyp_6-31g+(d).inp 001090705.td-b3lyp_6-31g+(d).log.xz

001090705.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090705.td-b3lyp_6-31+g(d).gjf (generated)

001090705.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090705.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090705.mol 001090705.PUBCHEM 001090705.mol (via Jmol)
001090706.b3lyp_6-31g(d).inp

001090706.b3lyp_6-31g(d).qchem.inp (generated)

001090706.b3lyp_6-31g(d).gjf (generated)

001090706.b3lyp_6-31g(d).firefly.inp (generated)

001090706.b3lyp_6-31g(d).smash.inp (generated)

001090706.b3lyp_6-31g(d).nwchem.inp (generated) 001090706.b3lyp_6-31g(d).log.xz 001090706.td-b3lyp_6-31g+(d).inp 001090706.td-b3lyp_6-31g+(d).log.xz

001090706.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090706.td-b3lyp_6-31+g(d).gjf (generated)

001090706.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090706.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090706.mol 001090706.PUBCHEM 001090706.mol (via Jmol)
001090742.b3lyp_6-31g(d).inp

001090742.b3lyp_6-31g(d).qchem.inp (generated)

001090742.b3lyp_6-31g(d).gjf (generated)

001090742.b3lyp_6-31g(d).firefly.inp (generated)

001090742.b3lyp_6-31g(d).smash.inp (generated)

001090742.b3lyp_6-31g(d).nwchem.inp (generated) 001090742.b3lyp_6-31g(d).log.xz 001090742.mol 001090742.PUBCHEM 001090742.mol (via Jmol)
001090743.b3lyp_6-31g(d).inp

001090743.b3lyp_6-31g(d).qchem.inp (generated)

001090743.b3lyp_6-31g(d).gjf (generated)

001090743.b3lyp_6-31g(d).firefly.inp (generated)

001090743.b3lyp_6-31g(d).smash.inp (generated)

001090743.b3lyp_6-31g(d).nwchem.inp (generated) 001090743.b3lyp_6-31g(d).log.xz 001090743.td-b3lyp_6-31g+(d).inp 001090743.td-b3lyp_6-31g+(d).log.xz

001090743.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090743.td-b3lyp_6-31+g(d).gjf (generated)

001090743.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090743.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090743.mol 001090743.PUBCHEM 001090743.mol (via Jmol)
001090744.b3lyp_6-31g(d).inp

001090744.b3lyp_6-31g(d).qchem.inp (generated)

001090744.b3lyp_6-31g(d).gjf (generated)

001090744.b3lyp_6-31g(d).firefly.inp (generated)

001090744.b3lyp_6-31g(d).smash.inp (generated)

001090744.b3lyp_6-31g(d).nwchem.inp (generated) 001090744.b3lyp_6-31g(d).log.xz 001090744.td-b3lyp_6-31g+(d).inp 001090744.td-b3lyp_6-31g+(d).log.xz

001090744.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090744.td-b3lyp_6-31+g(d).gjf (generated)

001090744.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090744.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090744.mol 001090744.PUBCHEM 001090744.mol (via Jmol)
001090747.b3lyp_6-31g(d).inp

001090747.b3lyp_6-31g(d).qchem.inp (generated)

001090747.b3lyp_6-31g(d).gjf (generated)

001090747.b3lyp_6-31g(d).firefly.inp (generated)

001090747.b3lyp_6-31g(d).smash.inp (generated)

001090747.b3lyp_6-31g(d).nwchem.inp (generated) 001090747.b3lyp_6-31g(d).log.xz 001090747.td-b3lyp_6-31g+(d).inp 001090747.td-b3lyp_6-31g+(d).log.xz

001090747.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090747.td-b3lyp_6-31+g(d).gjf (generated)

001090747.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090747.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090747.mol 001090747.PUBCHEM 001090747.mol (via Jmol)
001090933.b3lyp_6-31g(d).inp

001090933.b3lyp_6-31g(d).qchem.inp (generated)

001090933.b3lyp_6-31g(d).gjf (generated)

001090933.b3lyp_6-31g(d).firefly.inp (generated)

001090933.b3lyp_6-31g(d).smash.inp (generated)

001090933.b3lyp_6-31g(d).nwchem.inp (generated) 001090933.b3lyp_6-31g(d).log.xz 001090933.td-b3lyp_6-31g+(d).inp 001090933.td-b3lyp_6-31g+(d).log.xz

001090933.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090933.td-b3lyp_6-31+g(d).gjf (generated)

001090933.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090933.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090933.mol 001090933.PUBCHEM 001090933.mol (via Jmol)
001090977.b3lyp_6-31g(d).inp

001090977.b3lyp_6-31g(d).qchem.inp (generated)

001090977.b3lyp_6-31g(d).gjf (generated)

001090977.b3lyp_6-31g(d).firefly.inp (generated)

001090977.b3lyp_6-31g(d).smash.inp (generated)

001090977.b3lyp_6-31g(d).nwchem.inp (generated) 001090977.b3lyp_6-31g(d).log.xz 001090977.mol 001090977.PUBCHEM 001090977.mol (via Jmol)
001090978.b3lyp_6-31g(d).inp

001090978.b3lyp_6-31g(d).qchem.inp (generated)

001090978.b3lyp_6-31g(d).gjf (generated)

001090978.b3lyp_6-31g(d).firefly.inp (generated)

001090978.b3lyp_6-31g(d).smash.inp (generated)

001090978.b3lyp_6-31g(d).nwchem.inp (generated) 001090978.b3lyp_6-31g(d).log.xz 001090978.mol 001090978.PUBCHEM 001090978.mol (via Jmol)
001090979.b3lyp_6-31g(d).inp

001090979.b3lyp_6-31g(d).qchem.inp (generated)

001090979.b3lyp_6-31g(d).gjf (generated)

001090979.b3lyp_6-31g(d).firefly.inp (generated)

001090979.b3lyp_6-31g(d).smash.inp (generated)

001090979.b3lyp_6-31g(d).nwchem.inp (generated) 001090979.b3lyp_6-31g(d).log.xz 001090979.mol 001090979.PUBCHEM 001090979.mol (via Jmol)
001090981.b3lyp_6-31g(d).inp

001090981.b3lyp_6-31g(d).qchem.inp (generated)

001090981.b3lyp_6-31g(d).gjf (generated)

001090981.b3lyp_6-31g(d).firefly.inp (generated)

001090981.b3lyp_6-31g(d).smash.inp (generated)

001090981.b3lyp_6-31g(d).nwchem.inp (generated) 001090981.b3lyp_6-31g(d).log.xz 001090981.td-b3lyp_6-31g+(d).inp 001090981.td-b3lyp_6-31g+(d).log.xz

001090981.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090981.td-b3lyp_6-31+g(d).gjf (generated)

001090981.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090981.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090981.mol 001090981.PUBCHEM 001090981.mol (via Jmol)
001090982.b3lyp_6-31g(d).inp

001090982.b3lyp_6-31g(d).qchem.inp (generated)

001090982.b3lyp_6-31g(d).gjf (generated)

001090982.b3lyp_6-31g(d).firefly.inp (generated)

001090982.b3lyp_6-31g(d).smash.inp (generated)

001090982.b3lyp_6-31g(d).nwchem.inp (generated) 001090982.b3lyp_6-31g(d).log.xz 001090982.td-b3lyp_6-31g+(d).inp 001090982.td-b3lyp_6-31g+(d).log.xz

001090982.td-b3lyp_6-31+g(d).qchem.inp (generated)

001090982.td-b3lyp_6-31+g(d).gjf (generated)

001090982.td-b3lyp_6-31+g(d).firefly.inp (generated)

001090982.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001090982.mol 001090982.PUBCHEM 001090982.mol (via Jmol)
001091048.b3lyp_6-31g(d).inp

001091048.b3lyp_6-31g(d).qchem.inp (generated)

001091048.b3lyp_6-31g(d).gjf (generated)

001091048.b3lyp_6-31g(d).firefly.inp (generated)

001091048.b3lyp_6-31g(d).smash.inp (generated)

001091048.b3lyp_6-31g(d).nwchem.inp (generated) 001091048.b3lyp_6-31g(d).log.xz 001091048.mol 001091048.PUBCHEM 001091048.mol (via Jmol)
001091051.b3lyp_6-31g(d).inp

001091051.b3lyp_6-31g(d).qchem.inp (generated)

001091051.b3lyp_6-31g(d).gjf (generated)

001091051.b3lyp_6-31g(d).firefly.inp (generated)

001091051.b3lyp_6-31g(d).smash.inp (generated)

001091051.b3lyp_6-31g(d).nwchem.inp (generated) 001091051.b3lyp_6-31g(d).log.xz 001091051.td-b3lyp_6-31g+(d).inp 001091051.td-b3lyp_6-31g+(d).log.xz

001091051.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091051.td-b3lyp_6-31+g(d).gjf (generated)

001091051.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091051.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091051.mol 001091051.PUBCHEM 001091051.mol (via Jmol)
001091052.b3lyp_6-31g(d).inp

001091052.b3lyp_6-31g(d).qchem.inp (generated)

001091052.b3lyp_6-31g(d).gjf (generated)

001091052.b3lyp_6-31g(d).firefly.inp (generated)

001091052.b3lyp_6-31g(d).smash.inp (generated)

001091052.b3lyp_6-31g(d).nwchem.inp (generated) 001091052.b3lyp_6-31g(d).log.xz 001091052.td-b3lyp_6-31g+(d).inp 001091052.td-b3lyp_6-31g+(d).log.xz

001091052.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091052.td-b3lyp_6-31+g(d).gjf (generated)

001091052.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091052.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091052.mol 001091052.PUBCHEM 001091052.mol (via Jmol)
001091053.b3lyp_6-31g(d).inp

001091053.b3lyp_6-31g(d).qchem.inp (generated)

001091053.b3lyp_6-31g(d).gjf (generated)

001091053.b3lyp_6-31g(d).firefly.inp (generated)

001091053.b3lyp_6-31g(d).smash.inp (generated)

001091053.b3lyp_6-31g(d).nwchem.inp (generated) 001091053.b3lyp_6-31g(d).log.xz 001091053.td-b3lyp_6-31g+(d).inp 001091053.td-b3lyp_6-31g+(d).log.xz

001091053.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091053.td-b3lyp_6-31+g(d).gjf (generated)

001091053.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091053.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091053.mol 001091053.PUBCHEM 001091053.mol (via Jmol)
001091054.b3lyp_6-31g(d).inp

001091054.b3lyp_6-31g(d).qchem.inp (generated)

001091054.b3lyp_6-31g(d).gjf (generated)

001091054.b3lyp_6-31g(d).firefly.inp (generated)

001091054.b3lyp_6-31g(d).smash.inp (generated)

001091054.b3lyp_6-31g(d).nwchem.inp (generated) 001091054.b3lyp_6-31g(d).log.xz 001091054.td-b3lyp_6-31g+(d).inp 001091054.td-b3lyp_6-31g+(d).log.xz

001091054.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091054.td-b3lyp_6-31+g(d).gjf (generated)

001091054.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091054.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091054.mol 001091054.PUBCHEM 001091054.mol (via Jmol)
001091055.b3lyp_6-31g(d).inp

001091055.b3lyp_6-31g(d).qchem.inp (generated)

001091055.b3lyp_6-31g(d).gjf (generated)

001091055.b3lyp_6-31g(d).firefly.inp (generated)

001091055.b3lyp_6-31g(d).smash.inp (generated)

001091055.b3lyp_6-31g(d).nwchem.inp (generated) 001091055.b3lyp_6-31g(d).log.xz 001091055.td-b3lyp_6-31g+(d).inp 001091055.td-b3lyp_6-31g+(d).log.xz

001091055.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091055.td-b3lyp_6-31+g(d).gjf (generated)

001091055.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091055.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091055.mol 001091055.PUBCHEM 001091055.mol (via Jmol)
001091057.b3lyp_6-31g(d).inp

001091057.b3lyp_6-31g(d).qchem.inp (generated)

001091057.b3lyp_6-31g(d).gjf (generated)

001091057.b3lyp_6-31g(d).firefly.inp (generated)

001091057.b3lyp_6-31g(d).smash.inp (generated)

001091057.b3lyp_6-31g(d).nwchem.inp (generated) 001091057.b3lyp_6-31g(d).log.xz 001091057.mol 001091057.PUBCHEM 001091057.mol (via Jmol)
001091058.b3lyp_6-31g(d).inp

001091058.b3lyp_6-31g(d).qchem.inp (generated)

001091058.b3lyp_6-31g(d).gjf (generated)

001091058.b3lyp_6-31g(d).firefly.inp (generated)

001091058.b3lyp_6-31g(d).smash.inp (generated)

001091058.b3lyp_6-31g(d).nwchem.inp (generated) 001091058.b3lyp_6-31g(d).log.xz 001091058.mol 001091058.PUBCHEM 001091058.mol (via Jmol)
001091059.b3lyp_6-31g(d).inp

001091059.b3lyp_6-31g(d).qchem.inp (generated)

001091059.b3lyp_6-31g(d).gjf (generated)

001091059.b3lyp_6-31g(d).firefly.inp (generated)

001091059.b3lyp_6-31g(d).smash.inp (generated)

001091059.b3lyp_6-31g(d).nwchem.inp (generated) 001091059.b3lyp_6-31g(d).log.xz 001091059.mol 001091059.PUBCHEM 001091059.mol (via Jmol)
001091060.b3lyp_6-31g(d).inp

001091060.b3lyp_6-31g(d).qchem.inp (generated)

001091060.b3lyp_6-31g(d).gjf (generated)

001091060.b3lyp_6-31g(d).firefly.inp (generated)

001091060.b3lyp_6-31g(d).smash.inp (generated)

001091060.b3lyp_6-31g(d).nwchem.inp (generated) 001091060.b3lyp_6-31g(d).log.xz 001091060.mol 001091060.PUBCHEM 001091060.mol (via Jmol)
001091061.b3lyp_6-31g(d).inp

001091061.b3lyp_6-31g(d).qchem.inp (generated)

001091061.b3lyp_6-31g(d).gjf (generated)

001091061.b3lyp_6-31g(d).firefly.inp (generated)

001091061.b3lyp_6-31g(d).smash.inp (generated)

001091061.b3lyp_6-31g(d).nwchem.inp (generated) 001091061.b3lyp_6-31g(d).log.xz 001091061.mol 001091061.PUBCHEM 001091061.mol (via Jmol)
001091062.b3lyp_6-31g(d).inp

001091062.b3lyp_6-31g(d).qchem.inp (generated)

001091062.b3lyp_6-31g(d).gjf (generated)

001091062.b3lyp_6-31g(d).firefly.inp (generated)

001091062.b3lyp_6-31g(d).smash.inp (generated)

001091062.b3lyp_6-31g(d).nwchem.inp (generated) 001091062.b3lyp_6-31g(d).log.xz 001091062.mol 001091062.PUBCHEM 001091062.mol (via Jmol)
001091063.b3lyp_6-31g(d).inp

001091063.b3lyp_6-31g(d).qchem.inp (generated)

001091063.b3lyp_6-31g(d).gjf (generated)

001091063.b3lyp_6-31g(d).firefly.inp (generated)

001091063.b3lyp_6-31g(d).smash.inp (generated)

001091063.b3lyp_6-31g(d).nwchem.inp (generated) 001091063.b3lyp_6-31g(d).log.xz 001091063.mol 001091063.PUBCHEM 001091063.mol (via Jmol)
001091064.b3lyp_6-31g(d).inp

001091064.b3lyp_6-31g(d).qchem.inp (generated)

001091064.b3lyp_6-31g(d).gjf (generated)

001091064.b3lyp_6-31g(d).firefly.inp (generated)

001091064.b3lyp_6-31g(d).smash.inp (generated)

001091064.b3lyp_6-31g(d).nwchem.inp (generated) 001091064.b3lyp_6-31g(d).log.xz 001091064.td-b3lyp_6-31g+(d).inp 001091064.td-b3lyp_6-31g+(d).log.xz

001091064.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091064.td-b3lyp_6-31+g(d).gjf (generated)

001091064.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091064.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091064.mol 001091064.PUBCHEM 001091064.mol (via Jmol)
001091076.b3lyp_6-31g(d).inp

001091076.b3lyp_6-31g(d).qchem.inp (generated)

001091076.b3lyp_6-31g(d).gjf (generated)

001091076.b3lyp_6-31g(d).firefly.inp (generated)

001091076.b3lyp_6-31g(d).smash.inp (generated)

001091076.b3lyp_6-31g(d).nwchem.inp (generated) 001091076.b3lyp_6-31g(d).log.xz 001091076.td-b3lyp_6-31g+(d).inp 001091076.td-b3lyp_6-31g+(d).log.xz

001091076.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091076.td-b3lyp_6-31+g(d).gjf (generated)

001091076.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091076.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091076.mol 001091076.PUBCHEM 001091076.mol (via Jmol)
001091379.b3lyp_6-31g(d).inp

001091379.b3lyp_6-31g(d).qchem.inp (generated)

001091379.b3lyp_6-31g(d).gjf (generated)

001091379.b3lyp_6-31g(d).firefly.inp (generated)

001091379.b3lyp_6-31g(d).smash.inp (generated)

001091379.b3lyp_6-31g(d).nwchem.inp (generated) 001091379.b3lyp_6-31g(d).log.xz 001091379.td-b3lyp_6-31g+(d).inp 001091379.td-b3lyp_6-31g+(d).log.xz

001091379.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091379.td-b3lyp_6-31+g(d).gjf (generated)

001091379.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091379.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091379.mol 001091379.PUBCHEM 001091379.mol (via Jmol)
001091380.b3lyp_6-31g(d).inp

001091380.b3lyp_6-31g(d).qchem.inp (generated)

001091380.b3lyp_6-31g(d).gjf (generated)

001091380.b3lyp_6-31g(d).firefly.inp (generated)

001091380.b3lyp_6-31g(d).smash.inp (generated)

001091380.b3lyp_6-31g(d).nwchem.inp (generated) 001091380.b3lyp_6-31g(d).log.xz 001091380.td-b3lyp_6-31g+(d).inp 001091380.td-b3lyp_6-31g+(d).log.xz

001091380.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091380.td-b3lyp_6-31+g(d).gjf (generated)

001091380.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091380.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091380.mol 001091380.PUBCHEM 001091380.mol (via Jmol)
001091381.b3lyp_6-31g(d).inp

001091381.b3lyp_6-31g(d).qchem.inp (generated)

001091381.b3lyp_6-31g(d).gjf (generated)

001091381.b3lyp_6-31g(d).firefly.inp (generated)

001091381.b3lyp_6-31g(d).smash.inp (generated)

001091381.b3lyp_6-31g(d).nwchem.inp (generated) 001091381.b3lyp_6-31g(d).log.xz 001091381.td-b3lyp_6-31g+(d).inp 001091381.td-b3lyp_6-31g+(d).log.xz

001091381.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091381.td-b3lyp_6-31+g(d).gjf (generated)

001091381.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091381.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091381.mol 001091381.PUBCHEM 001091381.mol (via Jmol)
001091382.b3lyp_6-31g(d).inp

001091382.b3lyp_6-31g(d).qchem.inp (generated)

001091382.b3lyp_6-31g(d).gjf (generated)

001091382.b3lyp_6-31g(d).firefly.inp (generated)

001091382.b3lyp_6-31g(d).smash.inp (generated)

001091382.b3lyp_6-31g(d).nwchem.inp (generated) 001091382.b3lyp_6-31g(d).log.xz 001091382.td-b3lyp_6-31g+(d).inp 001091382.td-b3lyp_6-31g+(d).log.xz

001091382.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091382.td-b3lyp_6-31+g(d).gjf (generated)

001091382.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091382.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091382.mol 001091382.PUBCHEM 001091382.mol (via Jmol)
001091383.b3lyp_6-31g(d).inp

001091383.b3lyp_6-31g(d).qchem.inp (generated)

001091383.b3lyp_6-31g(d).gjf (generated)

001091383.b3lyp_6-31g(d).firefly.inp (generated)

001091383.b3lyp_6-31g(d).smash.inp (generated)

001091383.b3lyp_6-31g(d).nwchem.inp (generated) 001091383.b3lyp_6-31g(d).log.xz 001091383.td-b3lyp_6-31g+(d).inp 001091383.td-b3lyp_6-31g+(d).log.xz

001091383.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091383.td-b3lyp_6-31+g(d).gjf (generated)

001091383.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091383.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091383.mol 001091383.PUBCHEM 001091383.mol (via Jmol)
001091388.b3lyp_6-31g(d).inp

001091388.b3lyp_6-31g(d).qchem.inp (generated)

001091388.b3lyp_6-31g(d).gjf (generated)

001091388.b3lyp_6-31g(d).firefly.inp (generated)

001091388.b3lyp_6-31g(d).smash.inp (generated)

001091388.b3lyp_6-31g(d).nwchem.inp (generated) 001091388.b3lyp_6-31g(d).log.xz 001091388.mol 001091388.PUBCHEM 001091388.mol (via Jmol)
001091545.b3lyp_6-31g(d).inp

001091545.b3lyp_6-31g(d).qchem.inp (generated)

001091545.b3lyp_6-31g(d).gjf (generated)

001091545.b3lyp_6-31g(d).firefly.inp (generated)

001091545.b3lyp_6-31g(d).smash.inp (generated)

001091545.b3lyp_6-31g(d).nwchem.inp (generated) 001091545.b3lyp_6-31g(d).log.xz 001091545.td-b3lyp_6-31g+(d).inp 001091545.td-b3lyp_6-31g+(d).log.xz

001091545.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091545.td-b3lyp_6-31+g(d).gjf (generated)

001091545.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091545.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091545.mol 001091545.PUBCHEM 001091545.mol (via Jmol)
001091546.b3lyp_6-31g(d).inp

001091546.b3lyp_6-31g(d).qchem.inp (generated)

001091546.b3lyp_6-31g(d).gjf (generated)

001091546.b3lyp_6-31g(d).firefly.inp (generated)

001091546.b3lyp_6-31g(d).smash.inp (generated)

001091546.b3lyp_6-31g(d).nwchem.inp (generated) 001091546.b3lyp_6-31g(d).log.xz 001091546.td-b3lyp_6-31g+(d).inp 001091546.td-b3lyp_6-31g+(d).log.xz

001091546.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091546.td-b3lyp_6-31+g(d).gjf (generated)

001091546.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091546.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091546.mol 001091546.PUBCHEM 001091546.mol (via Jmol)
001091684.b3lyp_6-31g(d).inp

001091684.b3lyp_6-31g(d).qchem.inp (generated)

001091684.b3lyp_6-31g(d).gjf (generated)

001091684.b3lyp_6-31g(d).firefly.inp (generated)

001091684.b3lyp_6-31g(d).smash.inp (generated)

001091684.b3lyp_6-31g(d).nwchem.inp (generated) 001091684.b3lyp_6-31g(d).log.xz 001091684.td-b3lyp_6-31g+(d).inp 001091684.td-b3lyp_6-31g+(d).log.xz

001091684.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091684.td-b3lyp_6-31+g(d).gjf (generated)

001091684.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091684.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091684.mol 001091684.PUBCHEM 001091684.mol (via Jmol)
001091687.b3lyp_6-31g(d).inp

001091687.b3lyp_6-31g(d).qchem.inp (generated)

001091687.b3lyp_6-31g(d).gjf (generated)

001091687.b3lyp_6-31g(d).firefly.inp (generated)

001091687.b3lyp_6-31g(d).smash.inp (generated)

001091687.b3lyp_6-31g(d).nwchem.inp (generated) 001091687.b3lyp_6-31g(d).log.xz 001091687.td-b3lyp_6-31g+(d).inp 001091687.td-b3lyp_6-31g+(d).log.xz

001091687.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091687.td-b3lyp_6-31+g(d).gjf (generated)

001091687.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091687.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091687.mol 001091687.PUBCHEM 001091687.mol (via Jmol)
001091696.b3lyp_6-31g(d).inp

001091696.b3lyp_6-31g(d).qchem.inp (generated)

001091696.b3lyp_6-31g(d).gjf (generated)

001091696.b3lyp_6-31g(d).firefly.inp (generated)

001091696.b3lyp_6-31g(d).smash.inp (generated)

001091696.b3lyp_6-31g(d).nwchem.inp (generated) 001091696.b3lyp_6-31g(d).log.xz 001091696.td-b3lyp_6-31g+(d).inp 001091696.td-b3lyp_6-31g+(d).log.xz

001091696.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091696.td-b3lyp_6-31+g(d).gjf (generated)

001091696.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091696.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091696.mol 001091696.PUBCHEM 001091696.mol (via Jmol)
001091710.b3lyp_6-31g(d).inp

001091710.b3lyp_6-31g(d).qchem.inp (generated)

001091710.b3lyp_6-31g(d).gjf (generated)

001091710.b3lyp_6-31g(d).firefly.inp (generated)

001091710.b3lyp_6-31g(d).smash.inp (generated)

001091710.b3lyp_6-31g(d).nwchem.inp (generated) 001091710.b3lyp_6-31g(d).log.xz 001091710.td-b3lyp_6-31g+(d).inp 001091710.td-b3lyp_6-31g+(d).log.xz

001091710.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091710.td-b3lyp_6-31+g(d).gjf (generated)

001091710.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091710.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091710.mol 001091710.PUBCHEM 001091710.mol (via Jmol)
001091711.b3lyp_6-31g(d).inp

001091711.b3lyp_6-31g(d).qchem.inp (generated)

001091711.b3lyp_6-31g(d).gjf (generated)

001091711.b3lyp_6-31g(d).firefly.inp (generated)

001091711.b3lyp_6-31g(d).smash.inp (generated)

001091711.b3lyp_6-31g(d).nwchem.inp (generated) 001091711.b3lyp_6-31g(d).log.xz 001091711.td-b3lyp_6-31g+(d).inp 001091711.td-b3lyp_6-31g+(d).log.xz

001091711.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091711.td-b3lyp_6-31+g(d).gjf (generated)

001091711.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091711.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091711.mol 001091711.PUBCHEM 001091711.mol (via Jmol)
001091712.b3lyp_6-31g(d).inp

001091712.b3lyp_6-31g(d).qchem.inp (generated)

001091712.b3lyp_6-31g(d).gjf (generated)

001091712.b3lyp_6-31g(d).firefly.inp (generated)

001091712.b3lyp_6-31g(d).smash.inp (generated)

001091712.b3lyp_6-31g(d).nwchem.inp (generated) 001091712.b3lyp_6-31g(d).log.xz 001091712.td-b3lyp_6-31g+(d).inp 001091712.td-b3lyp_6-31g+(d).log.xz

001091712.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091712.td-b3lyp_6-31+g(d).gjf (generated)

001091712.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091712.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091712.mol 001091712.PUBCHEM 001091712.mol (via Jmol)
001091713.b3lyp_6-31g(d).inp

001091713.b3lyp_6-31g(d).qchem.inp (generated)

001091713.b3lyp_6-31g(d).gjf (generated)

001091713.b3lyp_6-31g(d).firefly.inp (generated)

001091713.b3lyp_6-31g(d).smash.inp (generated)

001091713.b3lyp_6-31g(d).nwchem.inp (generated) 001091713.b3lyp_6-31g(d).log.xz 001091713.td-b3lyp_6-31g+(d).inp 001091713.td-b3lyp_6-31g+(d).log.xz

001091713.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091713.td-b3lyp_6-31+g(d).gjf (generated)

001091713.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091713.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091713.mol 001091713.PUBCHEM 001091713.mol (via Jmol)
001091736.b3lyp_6-31g(d).inp

001091736.b3lyp_6-31g(d).qchem.inp (generated)

001091736.b3lyp_6-31g(d).gjf (generated)

001091736.b3lyp_6-31g(d).firefly.inp (generated)

001091736.b3lyp_6-31g(d).smash.inp (generated)

001091736.b3lyp_6-31g(d).nwchem.inp (generated) 001091736.b3lyp_6-31g(d).log.xz 001091736.td-b3lyp_6-31g+(d).inp 001091736.td-b3lyp_6-31g+(d).log.xz

001091736.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091736.td-b3lyp_6-31+g(d).gjf (generated)

001091736.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091736.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091736.mol 001091736.PUBCHEM 001091736.mol (via Jmol)
001091738.b3lyp_6-31g(d).inp

001091738.b3lyp_6-31g(d).qchem.inp (generated)

001091738.b3lyp_6-31g(d).gjf (generated)

001091738.b3lyp_6-31g(d).firefly.inp (generated)

001091738.b3lyp_6-31g(d).smash.inp (generated)

001091738.b3lyp_6-31g(d).nwchem.inp (generated) 001091738.b3lyp_6-31g(d).log.xz 001091738.td-b3lyp_6-31g+(d).inp 001091738.td-b3lyp_6-31g+(d).log.xz

001091738.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091738.td-b3lyp_6-31+g(d).gjf (generated)

001091738.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091738.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091738.mol 001091738.PUBCHEM 001091738.mol (via Jmol)
001091739.b3lyp_6-31g(d).inp

001091739.b3lyp_6-31g(d).qchem.inp (generated)

001091739.b3lyp_6-31g(d).gjf (generated)

001091739.b3lyp_6-31g(d).firefly.inp (generated)

001091739.b3lyp_6-31g(d).smash.inp (generated)

001091739.b3lyp_6-31g(d).nwchem.inp (generated) 001091739.b3lyp_6-31g(d).log.xz 001091739.td-b3lyp_6-31g+(d).inp 001091739.td-b3lyp_6-31g+(d).log.xz

001091739.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091739.td-b3lyp_6-31+g(d).gjf (generated)

001091739.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091739.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091739.mol 001091739.PUBCHEM 001091739.mol (via Jmol)
001091846.b3lyp_6-31g(d).inp

001091846.b3lyp_6-31g(d).qchem.inp (generated)

001091846.b3lyp_6-31g(d).gjf (generated)

001091846.b3lyp_6-31g(d).firefly.inp (generated)

001091846.b3lyp_6-31g(d).smash.inp (generated)

001091846.b3lyp_6-31g(d).nwchem.inp (generated) 001091846.b3lyp_6-31g(d).log.xz 001091846.td-b3lyp_6-31g+(d).inp 001091846.td-b3lyp_6-31g+(d).log.xz

001091846.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091846.td-b3lyp_6-31+g(d).gjf (generated)

001091846.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091846.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091846.mol 001091846.PUBCHEM 001091846.mol (via Jmol)
001091847.b3lyp_6-31g(d).inp

001091847.b3lyp_6-31g(d).qchem.inp (generated)

001091847.b3lyp_6-31g(d).gjf (generated)

001091847.b3lyp_6-31g(d).firefly.inp (generated)

001091847.b3lyp_6-31g(d).smash.inp (generated)

001091847.b3lyp_6-31g(d).nwchem.inp (generated) 001091847.b3lyp_6-31g(d).log.xz 001091847.mol 001091847.PUBCHEM 001091847.mol (via Jmol)
001091852.b3lyp_6-31g(d).inp

001091852.b3lyp_6-31g(d).qchem.inp (generated)

001091852.b3lyp_6-31g(d).gjf (generated)

001091852.b3lyp_6-31g(d).firefly.inp (generated)

001091852.b3lyp_6-31g(d).smash.inp (generated)

001091852.b3lyp_6-31g(d).nwchem.inp (generated) 001091852.b3lyp_6-31g(d).log.xz 001091852.td-b3lyp_6-31g+(d).inp 001091852.td-b3lyp_6-31g+(d).log.xz

001091852.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091852.td-b3lyp_6-31+g(d).gjf (generated)

001091852.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091852.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091852.mol 001091852.PUBCHEM 001091852.mol (via Jmol)
001091856.b3lyp_6-31g(d).inp

001091856.b3lyp_6-31g(d).qchem.inp (generated)

001091856.b3lyp_6-31g(d).gjf (generated)

001091856.b3lyp_6-31g(d).firefly.inp (generated)

001091856.b3lyp_6-31g(d).smash.inp (generated)

001091856.b3lyp_6-31g(d).nwchem.inp (generated) 001091856.b3lyp_6-31g(d).log.xz 001091856.td-b3lyp_6-31g+(d).inp 001091856.td-b3lyp_6-31g+(d).log.xz

001091856.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091856.td-b3lyp_6-31+g(d).gjf (generated)

001091856.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091856.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091856.mol 001091856.PUBCHEM 001091856.mol (via Jmol)
001091860.b3lyp_6-31g(d).inp

001091860.b3lyp_6-31g(d).qchem.inp (generated)

001091860.b3lyp_6-31g(d).gjf (generated)

001091860.b3lyp_6-31g(d).firefly.inp (generated)

001091860.b3lyp_6-31g(d).smash.inp (generated)

001091860.b3lyp_6-31g(d).nwchem.inp (generated) 001091860.b3lyp_6-31g(d).log.xz 001091860.td-b3lyp_6-31g+(d).inp 001091860.td-b3lyp_6-31g+(d).log.xz

001091860.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091860.td-b3lyp_6-31+g(d).gjf (generated)

001091860.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091860.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091860.mol 001091860.PUBCHEM 001091860.mol (via Jmol)
001091922.b3lyp_6-31g(d).inp

001091922.b3lyp_6-31g(d).qchem.inp (generated)

001091922.b3lyp_6-31g(d).gjf (generated)

001091922.b3lyp_6-31g(d).firefly.inp (generated)

001091922.b3lyp_6-31g(d).smash.inp (generated)

001091922.b3lyp_6-31g(d).nwchem.inp (generated) 001091922.b3lyp_6-31g(d).log.xz 001091922.td-b3lyp_6-31g+(d).inp 001091922.td-b3lyp_6-31g+(d).log.xz

001091922.td-b3lyp_6-31+g(d).qchem.inp (generated)

001091922.td-b3lyp_6-31+g(d).gjf (generated)

001091922.td-b3lyp_6-31+g(d).firefly.inp (generated)

001091922.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001091922.mol 001091922.PUBCHEM 001091922.mol (via Jmol)
001092113.b3lyp_6-31g(d).inp

001092113.b3lyp_6-31g(d).qchem.inp (generated)

001092113.b3lyp_6-31g(d).gjf (generated)

001092113.b3lyp_6-31g(d).firefly.inp (generated)

001092113.b3lyp_6-31g(d).smash.inp (generated)

001092113.b3lyp_6-31g(d).nwchem.inp (generated) 001092113.b3lyp_6-31g(d).log.xz 001092113.td-b3lyp_6-31g+(d).inp 001092113.td-b3lyp_6-31g+(d).log.xz

001092113.td-b3lyp_6-31+g(d).qchem.inp (generated)

001092113.td-b3lyp_6-31+g(d).gjf (generated)

001092113.td-b3lyp_6-31+g(d).firefly.inp (generated)

001092113.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001092113.mol 001092113.PUBCHEM 001092113.mol (via Jmol)
001092114.b3lyp_6-31g(d).inp

001092114.b3lyp_6-31g(d).qchem.inp (generated)

001092114.b3lyp_6-31g(d).gjf (generated)

001092114.b3lyp_6-31g(d).firefly.inp (generated)

001092114.b3lyp_6-31g(d).smash.inp (generated)

001092114.b3lyp_6-31g(d).nwchem.inp (generated) 001092114.b3lyp_6-31g(d).log.xz 001092114.mol 001092114.PUBCHEM 001092114.mol (via Jmol)
001092115.b3lyp_6-31g(d).inp

001092115.b3lyp_6-31g(d).qchem.inp (generated)

001092115.b3lyp_6-31g(d).gjf (generated)

001092115.b3lyp_6-31g(d).firefly.inp (generated)

001092115.b3lyp_6-31g(d).smash.inp (generated)

001092115.b3lyp_6-31g(d).nwchem.inp (generated) 001092115.b3lyp_6-31g(d).log.xz 001092115.mol 001092115.PUBCHEM 001092115.mol (via Jmol)
001092116.b3lyp_6-31g(d).inp

001092116.b3lyp_6-31g(d).qchem.inp (generated)

001092116.b3lyp_6-31g(d).gjf (generated)

001092116.b3lyp_6-31g(d).firefly.inp (generated)

001092116.b3lyp_6-31g(d).smash.inp (generated)

001092116.b3lyp_6-31g(d).nwchem.inp (generated) 001092116.b3lyp_6-31g(d).log.xz 001092116.mol 001092116.PUBCHEM 001092116.mol (via Jmol)
001092117.b3lyp_6-31g(d).inp

001092117.b3lyp_6-31g(d).qchem.inp (generated)

001092117.b3lyp_6-31g(d).gjf (generated)

001092117.b3lyp_6-31g(d).firefly.inp (generated)

001092117.b3lyp_6-31g(d).smash.inp (generated)

001092117.b3lyp_6-31g(d).nwchem.inp (generated) 001092117.b3lyp_6-31g(d).log.xz 001092117.td-b3lyp_6-31g+(d).inp 001092117.td-b3lyp_6-31g+(d).log.xz

001092117.td-b3lyp_6-31+g(d).qchem.inp (generated)

001092117.td-b3lyp_6-31+g(d).gjf (generated)

001092117.td-b3lyp_6-31+g(d).firefly.inp (generated)

001092117.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001092117.mol 001092117.PUBCHEM 001092117.mol (via Jmol)
001092118.b3lyp_6-31g(d).inp

001092118.b3lyp_6-31g(d).qchem.inp (generated)

001092118.b3lyp_6-31g(d).gjf (generated)

001092118.b3lyp_6-31g(d).firefly.inp (generated)

001092118.b3lyp_6-31g(d).smash.inp (generated)

001092118.b3lyp_6-31g(d).nwchem.inp (generated) 001092118.b3lyp_6-31g(d).log.xz 001092118.td-b3lyp_6-31g+(d).inp 001092118.td-b3lyp_6-31g+(d).log.xz

001092118.td-b3lyp_6-31+g(d).qchem.inp (generated)

001092118.td-b3lyp_6-31+g(d).gjf (generated)

001092118.td-b3lyp_6-31+g(d).firefly.inp (generated)

001092118.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001092118.mol 001092118.PUBCHEM 001092118.mol (via Jmol)
001092119.b3lyp_6-31g(d).inp

001092119.b3lyp_6-31g(d).qchem.inp (generated)

001092119.b3lyp_6-31g(d).gjf (generated)

001092119.b3lyp_6-31g(d).firefly.inp (generated)

001092119.b3lyp_6-31g(d).smash.inp (generated)

001092119.b3lyp_6-31g(d).nwchem.inp (generated) 001092119.b3lyp_6-31g(d).log.xz 001092119.td-b3lyp_6-31g+(d).inp 001092119.td-b3lyp_6-31g+(d).log.xz

001092119.td-b3lyp_6-31+g(d).qchem.inp (generated)

001092119.td-b3lyp_6-31+g(d).gjf (generated)

001092119.td-b3lyp_6-31+g(d).firefly.inp (generated)

001092119.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001092119.mol 001092119.PUBCHEM 001092119.mol (via Jmol)
001092120.b3lyp_6-31g(d).inp

001092120.b3lyp_6-31g(d).qchem.inp (generated)

001092120.b3lyp_6-31g(d).gjf (generated)

001092120.b3lyp_6-31g(d).firefly.inp (generated)

001092120.b3lyp_6-31g(d).smash.inp (generated)

001092120.b3lyp_6-31g(d).nwchem.inp (generated) 001092120.b3lyp_6-31g(d).log.xz 001092120.td-b3lyp_6-31g+(d).inp 001092120.td-b3lyp_6-31g+(d).log.xz

001092120.td-b3lyp_6-31+g(d).qchem.inp (generated)

001092120.td-b3lyp_6-31+g(d).gjf (generated)

001092120.td-b3lyp_6-31+g(d).firefly.inp (generated)

001092120.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001092120.mol 001092120.PUBCHEM 001092120.mol (via Jmol)
001092459.b3lyp_6-31g(d).inp

001092459.b3lyp_6-31g(d).qchem.inp (generated)

001092459.b3lyp_6-31g(d).gjf (generated)

001092459.b3lyp_6-31g(d).firefly.inp (generated)

001092459.b3lyp_6-31g(d).smash.inp (generated)

001092459.b3lyp_6-31g(d).nwchem.inp (generated) 001092459.b3lyp_6-31g(d).log.xz 001092459.td-b3lyp_6-31g+(d).inp 001092459.td-b3lyp_6-31g+(d).log.xz

001092459.td-b3lyp_6-31+g(d).qchem.inp (generated)

001092459.td-b3lyp_6-31+g(d).gjf (generated)

001092459.td-b3lyp_6-31+g(d).firefly.inp (generated)

001092459.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001092459.mol 001092459.PUBCHEM 001092459.mol (via Jmol)
001092638.b3lyp_6-31g(d).inp

001092638.b3lyp_6-31g(d).qchem.inp (generated)

001092638.b3lyp_6-31g(d).gjf (generated)

001092638.b3lyp_6-31g(d).firefly.inp (generated)

001092638.b3lyp_6-31g(d).smash.inp (generated)

001092638.b3lyp_6-31g(d).nwchem.inp (generated) 001092638.b3lyp_6-31g(d).log.xz 001092638.td-b3lyp_6-31g+(d).inp 001092638.td-b3lyp_6-31g+(d).log.xz

001092638.td-b3lyp_6-31+g(d).qchem.inp (generated)

001092638.td-b3lyp_6-31+g(d).gjf (generated)

001092638.td-b3lyp_6-31+g(d).firefly.inp (generated)

001092638.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001092638.mol 001092638.PUBCHEM 001092638.mol (via Jmol)
001092652.b3lyp_6-31g(d).inp

001092652.b3lyp_6-31g(d).qchem.inp (generated)

001092652.b3lyp_6-31g(d).gjf (generated)

001092652.b3lyp_6-31g(d).firefly.inp (generated)

001092652.b3lyp_6-31g(d).smash.inp (generated)

001092652.b3lyp_6-31g(d).nwchem.inp (generated) 001092652.b3lyp_6-31g(d).log.xz 001092652.mol 001092652.PUBCHEM 001092652.mol (via Jmol)
001092671.b3lyp_6-31g(d).inp

001092671.b3lyp_6-31g(d).qchem.inp (generated)

001092671.b3lyp_6-31g(d).gjf (generated)

001092671.b3lyp_6-31g(d).firefly.inp (generated)

001092671.b3lyp_6-31g(d).smash.inp (generated)

001092671.b3lyp_6-31g(d).nwchem.inp (generated) 001092671.b3lyp_6-31g(d).log.xz 001092671.td-b3lyp_6-31g+(d).inp 001092671.td-b3lyp_6-31g+(d).log.xz

001092671.td-b3lyp_6-31+g(d).qchem.inp (generated)

001092671.td-b3lyp_6-31+g(d).gjf (generated)

001092671.td-b3lyp_6-31+g(d).firefly.inp (generated)

001092671.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001092671.mol 001092671.PUBCHEM 001092671.mol (via Jmol)
001092672.b3lyp_6-31g(d).inp

001092672.b3lyp_6-31g(d).qchem.inp (generated)

001092672.b3lyp_6-31g(d).gjf (generated)

001092672.b3lyp_6-31g(d).firefly.inp (generated)

001092672.b3lyp_6-31g(d).smash.inp (generated)

001092672.b3lyp_6-31g(d).nwchem.inp (generated) 001092672.b3lyp_6-31g(d).log.xz 001092672.td-b3lyp_6-31g+(d).inp 001092672.td-b3lyp_6-31g+(d).log.xz

001092672.td-b3lyp_6-31+g(d).qchem.inp (generated)

001092672.td-b3lyp_6-31+g(d).gjf (generated)

001092672.td-b3lyp_6-31+g(d).firefly.inp (generated)

001092672.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001092672.mol 001092672.PUBCHEM 001092672.mol (via Jmol)
001092674.b3lyp_6-31g(d).inp

001092674.b3lyp_6-31g(d).qchem.inp (generated)

001092674.b3lyp_6-31g(d).gjf (generated)

001092674.b3lyp_6-31g(d).firefly.inp (generated)

001092674.b3lyp_6-31g(d).smash.inp (generated)

001092674.b3lyp_6-31g(d).nwchem.inp (generated) 001092674.b3lyp_6-31g(d).log.xz 001092674.td-b3lyp_6-31g+(d).inp 001092674.td-b3lyp_6-31g+(d).log.xz

001092674.td-b3lyp_6-31+g(d).qchem.inp (generated)

001092674.td-b3lyp_6-31+g(d).gjf (generated)

001092674.td-b3lyp_6-31+g(d).firefly.inp (generated)

001092674.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001092674.mol 001092674.PUBCHEM 001092674.mol (via Jmol)
001092686.b3lyp_6-31g(d).inp

001092686.b3lyp_6-31g(d).qchem.inp (generated)

001092686.b3lyp_6-31g(d).gjf (generated)

001092686.b3lyp_6-31g(d).firefly.inp (generated)

001092686.b3lyp_6-31g(d).smash.inp (generated)

001092686.b3lyp_6-31g(d).nwchem.inp (generated) 001092686.b3lyp_6-31g(d).log.xz 001092686.mol 001092686.PUBCHEM 001092686.mol (via Jmol)
001092687.b3lyp_6-31g(d).inp

001092687.b3lyp_6-31g(d).qchem.inp (generated)

001092687.b3lyp_6-31g(d).gjf (generated)

001092687.b3lyp_6-31g(d).firefly.inp (generated)

001092687.b3lyp_6-31g(d).smash.inp (generated)

001092687.b3lyp_6-31g(d).nwchem.inp (generated) 001092687.b3lyp_6-31g(d).log.xz 001092687.td-b3lyp_6-31g+(d).inp 001092687.td-b3lyp_6-31g+(d).log.xz

001092687.td-b3lyp_6-31+g(d).qchem.inp (generated)

001092687.td-b3lyp_6-31+g(d).gjf (generated)

001092687.td-b3lyp_6-31+g(d).firefly.inp (generated)

001092687.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001092687.mol 001092687.PUBCHEM 001092687.mol (via Jmol)
001092772.b3lyp_6-31g(d).inp

001092772.b3lyp_6-31g(d).qchem.inp (generated)

001092772.b3lyp_6-31g(d).gjf (generated)

001092772.b3lyp_6-31g(d).firefly.inp (generated)

001092772.b3lyp_6-31g(d).smash.inp (generated)

001092772.b3lyp_6-31g(d).nwchem.inp (generated) 001092772.b3lyp_6-31g(d).log.xz 001092772.td-b3lyp_6-31g+(d).inp 001092772.td-b3lyp_6-31g+(d).log.xz

001092772.td-b3lyp_6-31+g(d).qchem.inp (generated)

001092772.td-b3lyp_6-31+g(d).gjf (generated)

001092772.td-b3lyp_6-31+g(d).firefly.inp (generated)

001092772.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001092772.mol 001092772.PUBCHEM 001092772.mol (via Jmol)
001092781.b3lyp_6-31g(d).inp

001092781.b3lyp_6-31g(d).qchem.inp (generated)

001092781.b3lyp_6-31g(d).gjf (generated)

001092781.b3lyp_6-31g(d).firefly.inp (generated)

001092781.b3lyp_6-31g(d).smash.inp (generated)

001092781.b3lyp_6-31g(d).nwchem.inp (generated) 001092781.b3lyp_6-31g(d).log.xz 001092781.td-b3lyp_6-31g+(d).inp 001092781.td-b3lyp_6-31g+(d).log.xz

001092781.td-b3lyp_6-31+g(d).qchem.inp (generated)

001092781.td-b3lyp_6-31+g(d).gjf (generated)

001092781.td-b3lyp_6-31+g(d).firefly.inp (generated)

001092781.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001092781.mol 001092781.PUBCHEM 001092781.mol (via Jmol)
001092971.b3lyp_6-31g(d).inp

001092971.b3lyp_6-31g(d).qchem.inp (generated)

001092971.b3lyp_6-31g(d).gjf (generated)

001092971.b3lyp_6-31g(d).firefly.inp (generated)

001092971.b3lyp_6-31g(d).smash.inp (generated)

001092971.b3lyp_6-31g(d).nwchem.inp (generated) 001092971.b3lyp_6-31g(d).log.xz 001092971.td-b3lyp_6-31g+(d).inp 001092971.td-b3lyp_6-31g+(d).log.xz

001092971.td-b3lyp_6-31+g(d).qchem.inp (generated)

001092971.td-b3lyp_6-31+g(d).gjf (generated)

001092971.td-b3lyp_6-31+g(d).firefly.inp (generated)

001092971.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001092971.mol 001092971.PUBCHEM 001092971.mol (via Jmol)
001092972.b3lyp_6-31g(d).inp

001092972.b3lyp_6-31g(d).qchem.inp (generated)

001092972.b3lyp_6-31g(d).gjf (generated)

001092972.b3lyp_6-31g(d).firefly.inp (generated)

001092972.b3lyp_6-31g(d).smash.inp (generated)

001092972.b3lyp_6-31g(d).nwchem.inp (generated) 001092972.b3lyp_6-31g(d).log.xz 001092972.td-b3lyp_6-31g+(d).inp 001092972.td-b3lyp_6-31g+(d).log.xz

001092972.td-b3lyp_6-31+g(d).qchem.inp (generated)

001092972.td-b3lyp_6-31+g(d).gjf (generated)

001092972.td-b3lyp_6-31+g(d).firefly.inp (generated)

001092972.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001092972.mol 001092972.PUBCHEM 001092972.mol (via Jmol)
001092975.b3lyp_6-31g(d).inp

001092975.b3lyp_6-31g(d).qchem.inp (generated)

001092975.b3lyp_6-31g(d).gjf (generated)

001092975.b3lyp_6-31g(d).firefly.inp (generated)

001092975.b3lyp_6-31g(d).smash.inp (generated)

001092975.b3lyp_6-31g(d).nwchem.inp (generated) 001092975.b3lyp_6-31g(d).log.xz 001092975.mol 001092975.PUBCHEM 001092975.mol (via Jmol)
001092976.b3lyp_6-31g(d).inp

001092976.b3lyp_6-31g(d).qchem.inp (generated)

001092976.b3lyp_6-31g(d).gjf (generated)

001092976.b3lyp_6-31g(d).firefly.inp (generated)

001092976.b3lyp_6-31g(d).smash.inp (generated)

001092976.b3lyp_6-31g(d).nwchem.inp (generated) 001092976.b3lyp_6-31g(d).log.xz 001092976.td-b3lyp_6-31g+(d).inp 001092976.td-b3lyp_6-31g+(d).log.xz

001092976.td-b3lyp_6-31+g(d).qchem.inp (generated)

001092976.td-b3lyp_6-31+g(d).gjf (generated)

001092976.td-b3lyp_6-31+g(d).firefly.inp (generated)

001092976.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001092976.mol 001092976.PUBCHEM 001092976.mol (via Jmol)
001092997.b3lyp_6-31g(d).inp

001092997.b3lyp_6-31g(d).qchem.inp (generated)

001092997.b3lyp_6-31g(d).gjf (generated)

001092997.b3lyp_6-31g(d).firefly.inp (generated)

001092997.b3lyp_6-31g(d).smash.inp (generated)

001092997.b3lyp_6-31g(d).nwchem.inp (generated) 001092997.b3lyp_6-31g(d).log.xz 001092997.mol 001092997.PUBCHEM 001092997.mol (via Jmol)
001093118.b3lyp_6-31g(d).inp

001093118.b3lyp_6-31g(d).qchem.inp (generated)

001093118.b3lyp_6-31g(d).gjf (generated)

001093118.b3lyp_6-31g(d).firefly.inp (generated)

001093118.b3lyp_6-31g(d).smash.inp (generated)

001093118.b3lyp_6-31g(d).nwchem.inp (generated) 001093118.b3lyp_6-31g(d).log.xz 001093118.td-b3lyp_6-31g+(d).inp 001093118.td-b3lyp_6-31g+(d).log.xz

001093118.td-b3lyp_6-31+g(d).qchem.inp (generated)

001093118.td-b3lyp_6-31+g(d).gjf (generated)

001093118.td-b3lyp_6-31+g(d).firefly.inp (generated)

001093118.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001093118.mol 001093118.PUBCHEM 001093118.mol (via Jmol)
001093119.b3lyp_6-31g(d).inp

001093119.b3lyp_6-31g(d).qchem.inp (generated)

001093119.b3lyp_6-31g(d).gjf (generated)

001093119.b3lyp_6-31g(d).firefly.inp (generated)

001093119.b3lyp_6-31g(d).smash.inp (generated)

001093119.b3lyp_6-31g(d).nwchem.inp (generated) 001093119.b3lyp_6-31g(d).log.xz 001093119.td-b3lyp_6-31g+(d).inp 001093119.td-b3lyp_6-31g+(d).log.xz

001093119.td-b3lyp_6-31+g(d).qchem.inp (generated)

001093119.td-b3lyp_6-31+g(d).gjf (generated)

001093119.td-b3lyp_6-31+g(d).firefly.inp (generated)

001093119.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001093119.mol 001093119.PUBCHEM 001093119.mol (via Jmol)
001093221.b3lyp_6-31g(d).inp

001093221.b3lyp_6-31g(d).qchem.inp (generated)

001093221.b3lyp_6-31g(d).gjf (generated)

001093221.b3lyp_6-31g(d).firefly.inp (generated)

001093221.b3lyp_6-31g(d).smash.inp (generated)

001093221.b3lyp_6-31g(d).nwchem.inp (generated) 001093221.b3lyp_6-31g(d).log.xz 001093221.td-b3lyp_6-31g+(d).inp 001093221.td-b3lyp_6-31g+(d).log.xz

001093221.td-b3lyp_6-31+g(d).qchem.inp (generated)

001093221.td-b3lyp_6-31+g(d).gjf (generated)

001093221.td-b3lyp_6-31+g(d).firefly.inp (generated)

001093221.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001093221.mol 001093221.PUBCHEM 001093221.mol (via Jmol)
001093222.b3lyp_6-31g(d).inp

001093222.b3lyp_6-31g(d).qchem.inp (generated)

001093222.b3lyp_6-31g(d).gjf (generated)

001093222.b3lyp_6-31g(d).firefly.inp (generated)

001093222.b3lyp_6-31g(d).smash.inp (generated)

001093222.b3lyp_6-31g(d).nwchem.inp (generated) 001093222.b3lyp_6-31g(d).log.xz 001093222.mol 001093222.PUBCHEM 001093222.mol (via Jmol)
001093248.b3lyp_6-31g(d).inp

001093248.b3lyp_6-31g(d).qchem.inp (generated)

001093248.b3lyp_6-31g(d).gjf (generated)

001093248.b3lyp_6-31g(d).firefly.inp (generated)

001093248.b3lyp_6-31g(d).smash.inp (generated)

001093248.b3lyp_6-31g(d).nwchem.inp (generated) 001093248.b3lyp_6-31g(d).log.xz 001093248.td-b3lyp_6-31g+(d).inp 001093248.td-b3lyp_6-31g+(d).log.xz

001093248.td-b3lyp_6-31+g(d).qchem.inp (generated)

001093248.td-b3lyp_6-31+g(d).gjf (generated)

001093248.td-b3lyp_6-31+g(d).firefly.inp (generated)

001093248.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001093248.mol 001093248.PUBCHEM 001093248.mol (via Jmol)
001093249.b3lyp_6-31g(d).inp

001093249.b3lyp_6-31g(d).qchem.inp (generated)

001093249.b3lyp_6-31g(d).gjf (generated)

001093249.b3lyp_6-31g(d).firefly.inp (generated)

001093249.b3lyp_6-31g(d).smash.inp (generated)

001093249.b3lyp_6-31g(d).nwchem.inp (generated) 001093249.b3lyp_6-31g(d).log.xz 001093249.td-b3lyp_6-31g+(d).inp 001093249.td-b3lyp_6-31g+(d).log.xz

001093249.td-b3lyp_6-31+g(d).qchem.inp (generated)

001093249.td-b3lyp_6-31+g(d).gjf (generated)

001093249.td-b3lyp_6-31+g(d).firefly.inp (generated)

001093249.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001093249.mol 001093249.PUBCHEM 001093249.mol (via Jmol)
001093250.b3lyp_6-31g(d).inp

001093250.b3lyp_6-31g(d).qchem.inp (generated)

001093250.b3lyp_6-31g(d).gjf (generated)

001093250.b3lyp_6-31g(d).firefly.inp (generated)

001093250.b3lyp_6-31g(d).smash.inp (generated)

001093250.b3lyp_6-31g(d).nwchem.inp (generated) 001093250.b3lyp_6-31g(d).log.xz 001093250.td-b3lyp_6-31g+(d).inp 001093250.td-b3lyp_6-31g+(d).log.xz

001093250.td-b3lyp_6-31+g(d).qchem.inp (generated)

001093250.td-b3lyp_6-31+g(d).gjf (generated)

001093250.td-b3lyp_6-31+g(d).firefly.inp (generated)

001093250.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001093250.mol 001093250.PUBCHEM 001093250.mol (via Jmol)
001093280.b3lyp_6-31g(d).inp

001093280.b3lyp_6-31g(d).qchem.inp (generated)

001093280.b3lyp_6-31g(d).gjf (generated)

001093280.b3lyp_6-31g(d).firefly.inp (generated)

001093280.b3lyp_6-31g(d).smash.inp (generated)

001093280.b3lyp_6-31g(d).nwchem.inp (generated) 001093280.b3lyp_6-31g(d).log.xz 001093280.td-b3lyp_6-31g+(d).inp 001093280.td-b3lyp_6-31g+(d).log.xz

001093280.td-b3lyp_6-31+g(d).qchem.inp (generated)

001093280.td-b3lyp_6-31+g(d).gjf (generated)

001093280.td-b3lyp_6-31+g(d).firefly.inp (generated)

001093280.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001093280.mol 001093280.PUBCHEM 001093280.mol (via Jmol)
001093281.b3lyp_6-31g(d).inp

001093281.b3lyp_6-31g(d).qchem.inp (generated)

001093281.b3lyp_6-31g(d).gjf (generated)

001093281.b3lyp_6-31g(d).firefly.inp (generated)

001093281.b3lyp_6-31g(d).smash.inp (generated)

001093281.b3lyp_6-31g(d).nwchem.inp (generated) 001093281.b3lyp_6-31g(d).log.xz 001093281.td-b3lyp_6-31g+(d).inp 001093281.td-b3lyp_6-31g+(d).log.xz

001093281.td-b3lyp_6-31+g(d).qchem.inp (generated)

001093281.td-b3lyp_6-31+g(d).gjf (generated)

001093281.td-b3lyp_6-31+g(d).firefly.inp (generated)

001093281.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001093281.mol 001093281.PUBCHEM 001093281.mol (via Jmol)
001093282.b3lyp_6-31g(d).inp

001093282.b3lyp_6-31g(d).qchem.inp (generated)

001093282.b3lyp_6-31g(d).gjf (generated)

001093282.b3lyp_6-31g(d).firefly.inp (generated)

001093282.b3lyp_6-31g(d).smash.inp (generated)

001093282.b3lyp_6-31g(d).nwchem.inp (generated) 001093282.b3lyp_6-31g(d).log.xz 001093282.td-b3lyp_6-31g+(d).inp 001093282.td-b3lyp_6-31g+(d).log.xz

001093282.td-b3lyp_6-31+g(d).qchem.inp (generated)

001093282.td-b3lyp_6-31+g(d).gjf (generated)

001093282.td-b3lyp_6-31+g(d).firefly.inp (generated)

001093282.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001093282.mol 001093282.PUBCHEM 001093282.mol (via Jmol)
001093283.b3lyp_6-31g(d).inp

001093283.b3lyp_6-31g(d).qchem.inp (generated)

001093283.b3lyp_6-31g(d).gjf (generated)

001093283.b3lyp_6-31g(d).firefly.inp (generated)

001093283.b3lyp_6-31g(d).smash.inp (generated)

001093283.b3lyp_6-31g(d).nwchem.inp (generated) 001093283.b3lyp_6-31g(d).log.xz 001093283.td-b3lyp_6-31g+(d).inp 001093283.td-b3lyp_6-31g+(d).log.xz

001093283.td-b3lyp_6-31+g(d).qchem.inp (generated)

001093283.td-b3lyp_6-31+g(d).gjf (generated)

001093283.td-b3lyp_6-31+g(d).firefly.inp (generated)

001093283.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001093283.mol 001093283.PUBCHEM 001093283.mol (via Jmol)
001093284.b3lyp_6-31g(d).inp

001093284.b3lyp_6-31g(d).qchem.inp (generated)

001093284.b3lyp_6-31g(d).gjf (generated)

001093284.b3lyp_6-31g(d).firefly.inp (generated)

001093284.b3lyp_6-31g(d).smash.inp (generated)

001093284.b3lyp_6-31g(d).nwchem.inp (generated) 001093284.b3lyp_6-31g(d).log.xz 001093284.td-b3lyp_6-31g+(d).inp 001093284.td-b3lyp_6-31g+(d).log.xz

001093284.td-b3lyp_6-31+g(d).qchem.inp (generated)

001093284.td-b3lyp_6-31+g(d).gjf (generated)

001093284.td-b3lyp_6-31+g(d).firefly.inp (generated)

001093284.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001093284.mol 001093284.PUBCHEM 001093284.mol (via Jmol)
001093285.b3lyp_6-31g(d).inp

001093285.b3lyp_6-31g(d).qchem.inp (generated)

001093285.b3lyp_6-31g(d).gjf (generated)

001093285.b3lyp_6-31g(d).firefly.inp (generated)

001093285.b3lyp_6-31g(d).smash.inp (generated)

001093285.b3lyp_6-31g(d).nwchem.inp (generated) 001093285.b3lyp_6-31g(d).log.xz 001093285.td-b3lyp_6-31g+(d).inp 001093285.td-b3lyp_6-31g+(d).log.xz

001093285.td-b3lyp_6-31+g(d).qchem.inp (generated)

001093285.td-b3lyp_6-31+g(d).gjf (generated)

001093285.td-b3lyp_6-31+g(d).firefly.inp (generated)

001093285.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001093285.mol 001093285.PUBCHEM 001093285.mol (via Jmol)
001093313.b3lyp_6-31g(d).inp

001093313.b3lyp_6-31g(d).qchem.inp (generated)

001093313.b3lyp_6-31g(d).gjf (generated)

001093313.b3lyp_6-31g(d).firefly.inp (generated)

001093313.b3lyp_6-31g(d).smash.inp (generated)

001093313.b3lyp_6-31g(d).nwchem.inp (generated) 001093313.b3lyp_6-31g(d).log.xz 001093313.mol 001093313.PUBCHEM 001093313.mol (via Jmol)
001093314.b3lyp_6-31g(d).inp

001093314.b3lyp_6-31g(d).qchem.inp (generated)

001093314.b3lyp_6-31g(d).gjf (generated)

001093314.b3lyp_6-31g(d).firefly.inp (generated)

001093314.b3lyp_6-31g(d).smash.inp (generated)

001093314.b3lyp_6-31g(d).nwchem.inp (generated) 001093314.b3lyp_6-31g(d).log.xz 001093314.mol 001093314.PUBCHEM 001093314.mol (via Jmol)
001093316.b3lyp_6-31g(d).inp

001093316.b3lyp_6-31g(d).qchem.inp (generated)

001093316.b3lyp_6-31g(d).gjf (generated)

001093316.b3lyp_6-31g(d).firefly.inp (generated)

001093316.b3lyp_6-31g(d).smash.inp (generated)

001093316.b3lyp_6-31g(d).nwchem.inp (generated) 001093316.b3lyp_6-31g(d).log.xz 001093316.mol 001093316.PUBCHEM 001093316.mol (via Jmol)
001093401.b3lyp_6-31g(d).inp

001093401.b3lyp_6-31g(d).qchem.inp (generated)

001093401.b3lyp_6-31g(d).gjf (generated)

001093401.b3lyp_6-31g(d).firefly.inp (generated)

001093401.b3lyp_6-31g(d).smash.inp (generated)

001093401.b3lyp_6-31g(d).nwchem.inp (generated) 001093401.b3lyp_6-31g(d).log.xz 001093401.mol 001093401.PUBCHEM 001093401.mol (via Jmol)
001093415.b3lyp_6-31g(d).inp

001093415.b3lyp_6-31g(d).qchem.inp (generated)

001093415.b3lyp_6-31g(d).gjf (generated)

001093415.b3lyp_6-31g(d).firefly.inp (generated)

001093415.b3lyp_6-31g(d).smash.inp (generated)

001093415.b3lyp_6-31g(d).nwchem.inp (generated) 001093415.b3lyp_6-31g(d).log.xz 001093415.td-b3lyp_6-31g+(d).inp 001093415.td-b3lyp_6-31g+(d).log.xz

001093415.td-b3lyp_6-31+g(d).qchem.inp (generated)

001093415.td-b3lyp_6-31+g(d).gjf (generated)

001093415.td-b3lyp_6-31+g(d).firefly.inp (generated)

001093415.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001093415.mol 001093415.PUBCHEM 001093415.mol (via Jmol)
001093416.b3lyp_6-31g(d).inp

001093416.b3lyp_6-31g(d).qchem.inp (generated)

001093416.b3lyp_6-31g(d).gjf (generated)

001093416.b3lyp_6-31g(d).firefly.inp (generated)

001093416.b3lyp_6-31g(d).smash.inp (generated)

001093416.b3lyp_6-31g(d).nwchem.inp (generated) 001093416.b3lyp_6-31g(d).log.xz 001093416.td-b3lyp_6-31g+(d).inp 001093416.td-b3lyp_6-31g+(d).log.xz

001093416.td-b3lyp_6-31+g(d).qchem.inp (generated)

001093416.td-b3lyp_6-31+g(d).gjf (generated)

001093416.td-b3lyp_6-31+g(d).firefly.inp (generated)

001093416.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001093416.mol 001093416.PUBCHEM 001093416.mol (via Jmol)
001093417.b3lyp_6-31g(d).inp

001093417.b3lyp_6-31g(d).qchem.inp (generated)

001093417.b3lyp_6-31g(d).gjf (generated)

001093417.b3lyp_6-31g(d).firefly.inp (generated)

001093417.b3lyp_6-31g(d).smash.inp (generated)

001093417.b3lyp_6-31g(d).nwchem.inp (generated) 001093417.b3lyp_6-31g(d).log.xz 001093417.mol 001093417.PUBCHEM 001093417.mol (via Jmol)
001093418.b3lyp_6-31g(d).inp

001093418.b3lyp_6-31g(d).qchem.inp (generated)

001093418.b3lyp_6-31g(d).gjf (generated)

001093418.b3lyp_6-31g(d).firefly.inp (generated)

001093418.b3lyp_6-31g(d).smash.inp (generated)

001093418.b3lyp_6-31g(d).nwchem.inp (generated) 001093418.b3lyp_6-31g(d).log.xz 001093418.td-b3lyp_6-31g+(d).inp 001093418.td-b3lyp_6-31g+(d).log.xz

001093418.td-b3lyp_6-31+g(d).qchem.inp (generated)

001093418.td-b3lyp_6-31+g(d).gjf (generated)

001093418.td-b3lyp_6-31+g(d).firefly.inp (generated)

001093418.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001093418.mol 001093418.PUBCHEM 001093418.mol (via Jmol)
001094131.b3lyp_6-31g(d).inp

001094131.b3lyp_6-31g(d).qchem.inp (generated)

001094131.b3lyp_6-31g(d).gjf (generated)

001094131.b3lyp_6-31g(d).firefly.inp (generated)

001094131.b3lyp_6-31g(d).smash.inp (generated)

001094131.b3lyp_6-31g(d).nwchem.inp (generated) 001094131.b3lyp_6-31g(d).log.xz 001094131.td-b3lyp_6-31g+(d).inp 001094131.td-b3lyp_6-31g+(d).log.xz

001094131.td-b3lyp_6-31+g(d).qchem.inp (generated)

001094131.td-b3lyp_6-31+g(d).gjf (generated)

001094131.td-b3lyp_6-31+g(d).firefly.inp (generated)

001094131.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001094131.mol 001094131.PUBCHEM 001094131.mol (via Jmol)
001094132.b3lyp_6-31g(d).inp

001094132.b3lyp_6-31g(d).qchem.inp (generated)

001094132.b3lyp_6-31g(d).gjf (generated)

001094132.b3lyp_6-31g(d).firefly.inp (generated)

001094132.b3lyp_6-31g(d).smash.inp (generated)

001094132.b3lyp_6-31g(d).nwchem.inp (generated) 001094132.b3lyp_6-31g(d).log.xz 001094132.td-b3lyp_6-31g+(d).inp 001094132.td-b3lyp_6-31g+(d).log.xz

001094132.td-b3lyp_6-31+g(d).qchem.inp (generated)

001094132.td-b3lyp_6-31+g(d).gjf (generated)

001094132.td-b3lyp_6-31+g(d).firefly.inp (generated)

001094132.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001094132.mol 001094132.PUBCHEM 001094132.mol (via Jmol)
001094292.b3lyp_6-31g(d).inp

001094292.b3lyp_6-31g(d).qchem.inp (generated)

001094292.b3lyp_6-31g(d).gjf (generated)

001094292.b3lyp_6-31g(d).firefly.inp (generated)

001094292.b3lyp_6-31g(d).smash.inp (generated)

001094292.b3lyp_6-31g(d).nwchem.inp (generated) 001094292.b3lyp_6-31g(d).log.xz 001094292.td-b3lyp_6-31g+(d).inp 001094292.td-b3lyp_6-31g+(d).log.xz

001094292.td-b3lyp_6-31+g(d).qchem.inp (generated)

001094292.td-b3lyp_6-31+g(d).gjf (generated)

001094292.td-b3lyp_6-31+g(d).firefly.inp (generated)

001094292.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001094292.mol 001094292.PUBCHEM 001094292.mol (via Jmol)
001094318.b3lyp_6-31g(d).inp

001094318.b3lyp_6-31g(d).qchem.inp (generated)

001094318.b3lyp_6-31g(d).gjf (generated)

001094318.b3lyp_6-31g(d).firefly.inp (generated)

001094318.b3lyp_6-31g(d).smash.inp (generated)

001094318.b3lyp_6-31g(d).nwchem.inp (generated) 001094318.b3lyp_6-31g(d).log.xz 001094318.td-b3lyp_6-31g+(d).inp 001094318.td-b3lyp_6-31g+(d).log.xz

001094318.td-b3lyp_6-31+g(d).qchem.inp (generated)

001094318.td-b3lyp_6-31+g(d).gjf (generated)

001094318.td-b3lyp_6-31+g(d).firefly.inp (generated)

001094318.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001094318.mol 001094318.PUBCHEM 001094318.mol (via Jmol)
001094836.b3lyp_6-31g(d).inp

001094836.b3lyp_6-31g(d).qchem.inp (generated)

001094836.b3lyp_6-31g(d).gjf (generated)

001094836.b3lyp_6-31g(d).firefly.inp (generated)

001094836.b3lyp_6-31g(d).smash.inp (generated)

001094836.b3lyp_6-31g(d).nwchem.inp (generated) 001094836.b3lyp_6-31g(d).log.xz 001094836.td-b3lyp_6-31g+(d).inp 001094836.td-b3lyp_6-31g+(d).log.xz

001094836.td-b3lyp_6-31+g(d).qchem.inp (generated)

001094836.td-b3lyp_6-31+g(d).gjf (generated)

001094836.td-b3lyp_6-31+g(d).firefly.inp (generated)

001094836.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001094836.mol 001094836.PUBCHEM 001094836.mol (via Jmol)
001094837.b3lyp_6-31g(d).inp

001094837.b3lyp_6-31g(d).qchem.inp (generated)

001094837.b3lyp_6-31g(d).gjf (generated)

001094837.b3lyp_6-31g(d).firefly.inp (generated)

001094837.b3lyp_6-31g(d).smash.inp (generated)

001094837.b3lyp_6-31g(d).nwchem.inp (generated) 001094837.b3lyp_6-31g(d).log.xz 001094837.td-b3lyp_6-31g+(d).inp 001094837.td-b3lyp_6-31g+(d).log.xz

001094837.td-b3lyp_6-31+g(d).qchem.inp (generated)

001094837.td-b3lyp_6-31+g(d).gjf (generated)

001094837.td-b3lyp_6-31+g(d).firefly.inp (generated)

001094837.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001094837.mol 001094837.PUBCHEM 001094837.mol (via Jmol)
001094840.b3lyp_6-31g(d).inp

001094840.b3lyp_6-31g(d).qchem.inp (generated)

001094840.b3lyp_6-31g(d).gjf (generated)

001094840.b3lyp_6-31g(d).firefly.inp (generated)

001094840.b3lyp_6-31g(d).smash.inp (generated)

001094840.b3lyp_6-31g(d).nwchem.inp (generated) 001094840.b3lyp_6-31g(d).log.xz 001094840.td-b3lyp_6-31g+(d).inp 001094840.td-b3lyp_6-31g+(d).log.xz

001094840.td-b3lyp_6-31+g(d).qchem.inp (generated)

001094840.td-b3lyp_6-31+g(d).gjf (generated)

001094840.td-b3lyp_6-31+g(d).firefly.inp (generated)

001094840.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001094840.mol 001094840.PUBCHEM 001094840.mol (via Jmol)
001094841.b3lyp_6-31g(d).inp

001094841.b3lyp_6-31g(d).qchem.inp (generated)

001094841.b3lyp_6-31g(d).gjf (generated)

001094841.b3lyp_6-31g(d).firefly.inp (generated)

001094841.b3lyp_6-31g(d).smash.inp (generated)

001094841.b3lyp_6-31g(d).nwchem.inp (generated) 001094841.b3lyp_6-31g(d).log.xz 001094841.td-b3lyp_6-31g+(d).inp 001094841.td-b3lyp_6-31g+(d).log.xz

001094841.td-b3lyp_6-31+g(d).qchem.inp (generated)

001094841.td-b3lyp_6-31+g(d).gjf (generated)

001094841.td-b3lyp_6-31+g(d).firefly.inp (generated)

001094841.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001094841.mol 001094841.PUBCHEM 001094841.mol (via Jmol)
001094842.b3lyp_6-31g(d).inp

001094842.b3lyp_6-31g(d).qchem.inp (generated)

001094842.b3lyp_6-31g(d).gjf (generated)

001094842.b3lyp_6-31g(d).firefly.inp (generated)

001094842.b3lyp_6-31g(d).smash.inp (generated)

001094842.b3lyp_6-31g(d).nwchem.inp (generated) 001094842.b3lyp_6-31g(d).log.xz 001094842.td-b3lyp_6-31g+(d).inp 001094842.td-b3lyp_6-31g+(d).log.xz

001094842.td-b3lyp_6-31+g(d).qchem.inp (generated)

001094842.td-b3lyp_6-31+g(d).gjf (generated)

001094842.td-b3lyp_6-31+g(d).firefly.inp (generated)

001094842.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001094842.mol 001094842.PUBCHEM 001094842.mol (via Jmol)
001094966.b3lyp_6-31g(d).inp

001094966.b3lyp_6-31g(d).qchem.inp (generated)

001094966.b3lyp_6-31g(d).gjf (generated)

001094966.b3lyp_6-31g(d).firefly.inp (generated)

001094966.b3lyp_6-31g(d).smash.inp (generated)

001094966.b3lyp_6-31g(d).nwchem.inp (generated) 001094966.b3lyp_6-31g(d).log.xz 001094966.td-b3lyp_6-31g+(d).inp 001094966.td-b3lyp_6-31g+(d).log.xz

001094966.td-b3lyp_6-31+g(d).qchem.inp (generated)

001094966.td-b3lyp_6-31+g(d).gjf (generated)

001094966.td-b3lyp_6-31+g(d).firefly.inp (generated)

001094966.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001094966.mol 001094966.PUBCHEM 001094966.mol (via Jmol)
001095015.b3lyp_6-31g(d).inp

001095015.b3lyp_6-31g(d).qchem.inp (generated)

001095015.b3lyp_6-31g(d).gjf (generated)

001095015.b3lyp_6-31g(d).firefly.inp (generated)

001095015.b3lyp_6-31g(d).smash.inp (generated)

001095015.b3lyp_6-31g(d).nwchem.inp (generated) 001095015.b3lyp_6-31g(d).log.xz 001095015.td-b3lyp_6-31g+(d).inp 001095015.td-b3lyp_6-31g+(d).log.xz

001095015.td-b3lyp_6-31+g(d).qchem.inp (generated)

001095015.td-b3lyp_6-31+g(d).gjf (generated)

001095015.td-b3lyp_6-31+g(d).firefly.inp (generated)

001095015.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001095015.mol 001095015.PUBCHEM 001095015.mol (via Jmol)
001095027.b3lyp_6-31g(d).inp

001095027.b3lyp_6-31g(d).qchem.inp (generated)

001095027.b3lyp_6-31g(d).gjf (generated)

001095027.b3lyp_6-31g(d).firefly.inp (generated)

001095027.b3lyp_6-31g(d).smash.inp (generated)

001095027.b3lyp_6-31g(d).nwchem.inp (generated) 001095027.b3lyp_6-31g(d).log.xz 001095027.mol 001095027.PUBCHEM 001095027.mol (via Jmol)
001095028.b3lyp_6-31g(d).inp

001095028.b3lyp_6-31g(d).qchem.inp (generated)

001095028.b3lyp_6-31g(d).gjf (generated)

001095028.b3lyp_6-31g(d).firefly.inp (generated)

001095028.b3lyp_6-31g(d).smash.inp (generated)

001095028.b3lyp_6-31g(d).nwchem.inp (generated) 001095028.b3lyp_6-31g(d).log.xz 001095028.td-b3lyp_6-31g+(d).inp 001095028.td-b3lyp_6-31g+(d).log.xz

001095028.td-b3lyp_6-31+g(d).qchem.inp (generated)

001095028.td-b3lyp_6-31+g(d).gjf (generated)

001095028.td-b3lyp_6-31+g(d).firefly.inp (generated)

001095028.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001095028.mol 001095028.PUBCHEM 001095028.mol (via Jmol)
001095029.b3lyp_6-31g(d).inp

001095029.b3lyp_6-31g(d).qchem.inp (generated)

001095029.b3lyp_6-31g(d).gjf (generated)

001095029.b3lyp_6-31g(d).firefly.inp (generated)

001095029.b3lyp_6-31g(d).smash.inp (generated)

001095029.b3lyp_6-31g(d).nwchem.inp (generated) 001095029.b3lyp_6-31g(d).log.xz 001095029.td-b3lyp_6-31g+(d).inp 001095029.td-b3lyp_6-31g+(d).log.xz

001095029.td-b3lyp_6-31+g(d).qchem.inp (generated)

001095029.td-b3lyp_6-31+g(d).gjf (generated)

001095029.td-b3lyp_6-31+g(d).firefly.inp (generated)

001095029.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001095029.mol 001095029.PUBCHEM 001095029.mol (via Jmol)
001095922.b3lyp_6-31g(d).inp

001095922.b3lyp_6-31g(d).qchem.inp (generated)

001095922.b3lyp_6-31g(d).gjf (generated)

001095922.b3lyp_6-31g(d).firefly.inp (generated)

001095922.b3lyp_6-31g(d).smash.inp (generated)

001095922.b3lyp_6-31g(d).nwchem.inp (generated) 001095922.b3lyp_6-31g(d).log.xz 001095922.td-b3lyp_6-31g+(d).inp 001095922.td-b3lyp_6-31g+(d).log.xz

001095922.td-b3lyp_6-31+g(d).qchem.inp (generated)

001095922.td-b3lyp_6-31+g(d).gjf (generated)

001095922.td-b3lyp_6-31+g(d).firefly.inp (generated)

001095922.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001095922.mol 001095922.PUBCHEM 001095922.mol (via Jmol)
001095923.b3lyp_6-31g(d).inp

001095923.b3lyp_6-31g(d).qchem.inp (generated)

001095923.b3lyp_6-31g(d).gjf (generated)

001095923.b3lyp_6-31g(d).firefly.inp (generated)

001095923.b3lyp_6-31g(d).smash.inp (generated)

001095923.b3lyp_6-31g(d).nwchem.inp (generated) 001095923.b3lyp_6-31g(d).log.xz 001095923.td-b3lyp_6-31g+(d).inp 001095923.td-b3lyp_6-31g+(d).log.xz

001095923.td-b3lyp_6-31+g(d).qchem.inp (generated)

001095923.td-b3lyp_6-31+g(d).gjf (generated)

001095923.td-b3lyp_6-31+g(d).firefly.inp (generated)

001095923.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001095923.mol 001095923.PUBCHEM 001095923.mol (via Jmol)
001096081.b3lyp_6-31g(d).inp

001096081.b3lyp_6-31g(d).qchem.inp (generated)

001096081.b3lyp_6-31g(d).gjf (generated)

001096081.b3lyp_6-31g(d).firefly.inp (generated)

001096081.b3lyp_6-31g(d).smash.inp (generated)

001096081.b3lyp_6-31g(d).nwchem.inp (generated) 001096081.b3lyp_6-31g(d).log.xz 001096081.td-b3lyp_6-31g+(d).inp 001096081.td-b3lyp_6-31g+(d).log.xz

001096081.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096081.td-b3lyp_6-31+g(d).gjf (generated)

001096081.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096081.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096081.mol 001096081.PUBCHEM 001096081.mol (via Jmol)
001096254.b3lyp_6-31g(d).inp

001096254.b3lyp_6-31g(d).qchem.inp (generated)

001096254.b3lyp_6-31g(d).gjf (generated)

001096254.b3lyp_6-31g(d).firefly.inp (generated)

001096254.b3lyp_6-31g(d).smash.inp (generated)

001096254.b3lyp_6-31g(d).nwchem.inp (generated) 001096254.b3lyp_6-31g(d).log.xz 001096254.mol 001096254.PUBCHEM 001096254.mol (via Jmol)
001096255.b3lyp_6-31g(d).inp

001096255.b3lyp_6-31g(d).qchem.inp (generated)

001096255.b3lyp_6-31g(d).gjf (generated)

001096255.b3lyp_6-31g(d).firefly.inp (generated)

001096255.b3lyp_6-31g(d).smash.inp (generated)

001096255.b3lyp_6-31g(d).nwchem.inp (generated) 001096255.b3lyp_6-31g(d).log.xz 001096255.mol 001096255.PUBCHEM 001096255.mol (via Jmol)
001096256.b3lyp_6-31g(d).inp

001096256.b3lyp_6-31g(d).qchem.inp (generated)

001096256.b3lyp_6-31g(d).gjf (generated)

001096256.b3lyp_6-31g(d).firefly.inp (generated)

001096256.b3lyp_6-31g(d).smash.inp (generated)

001096256.b3lyp_6-31g(d).nwchem.inp (generated) 001096256.b3lyp_6-31g(d).log.xz 001096256.td-b3lyp_6-31g+(d).inp 001096256.td-b3lyp_6-31g+(d).log.xz

001096256.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096256.td-b3lyp_6-31+g(d).gjf (generated)

001096256.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096256.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096256.mol 001096256.PUBCHEM 001096256.mol (via Jmol)
001096293.b3lyp_6-31g(d).inp

001096293.b3lyp_6-31g(d).qchem.inp (generated)

001096293.b3lyp_6-31g(d).gjf (generated)

001096293.b3lyp_6-31g(d).firefly.inp (generated)

001096293.b3lyp_6-31g(d).smash.inp (generated)

001096293.b3lyp_6-31g(d).nwchem.inp (generated) 001096293.b3lyp_6-31g(d).log.xz 001096293.td-b3lyp_6-31g+(d).inp 001096293.td-b3lyp_6-31g+(d).log.xz

001096293.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096293.td-b3lyp_6-31+g(d).gjf (generated)

001096293.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096293.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096293.mol 001096293.PUBCHEM 001096293.mol (via Jmol)
001096336.b3lyp_6-31g(d).inp

001096336.b3lyp_6-31g(d).qchem.inp (generated)

001096336.b3lyp_6-31g(d).gjf (generated)

001096336.b3lyp_6-31g(d).firefly.inp (generated)

001096336.b3lyp_6-31g(d).smash.inp (generated)

001096336.b3lyp_6-31g(d).nwchem.inp (generated) 001096336.b3lyp_6-31g(d).log.xz 001096336.td-b3lyp_6-31g+(d).inp 001096336.td-b3lyp_6-31g+(d).log.xz

001096336.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096336.td-b3lyp_6-31+g(d).gjf (generated)

001096336.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096336.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096336.mol 001096336.PUBCHEM 001096336.mol (via Jmol)
001096337.b3lyp_6-31g(d).inp

001096337.b3lyp_6-31g(d).qchem.inp (generated)

001096337.b3lyp_6-31g(d).gjf (generated)

001096337.b3lyp_6-31g(d).firefly.inp (generated)

001096337.b3lyp_6-31g(d).smash.inp (generated)

001096337.b3lyp_6-31g(d).nwchem.inp (generated) 001096337.b3lyp_6-31g(d).log.xz 001096337.td-b3lyp_6-31g+(d).inp 001096337.td-b3lyp_6-31g+(d).log.xz

001096337.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096337.td-b3lyp_6-31+g(d).gjf (generated)

001096337.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096337.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096337.mol 001096337.PUBCHEM 001096337.mol (via Jmol)
001096338.b3lyp_6-31g(d).inp

001096338.b3lyp_6-31g(d).qchem.inp (generated)

001096338.b3lyp_6-31g(d).gjf (generated)

001096338.b3lyp_6-31g(d).firefly.inp (generated)

001096338.b3lyp_6-31g(d).smash.inp (generated)

001096338.b3lyp_6-31g(d).nwchem.inp (generated) 001096338.b3lyp_6-31g(d).log.xz 001096338.td-b3lyp_6-31g+(d).inp 001096338.td-b3lyp_6-31g+(d).log.xz

001096338.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096338.td-b3lyp_6-31+g(d).gjf (generated)

001096338.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096338.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096338.mol 001096338.PUBCHEM 001096338.mol (via Jmol)
001096339.b3lyp_6-31g(d).inp

001096339.b3lyp_6-31g(d).qchem.inp (generated)

001096339.b3lyp_6-31g(d).gjf (generated)

001096339.b3lyp_6-31g(d).firefly.inp (generated)

001096339.b3lyp_6-31g(d).smash.inp (generated)

001096339.b3lyp_6-31g(d).nwchem.inp (generated) 001096339.b3lyp_6-31g(d).log.xz 001096339.td-b3lyp_6-31g+(d).inp 001096339.td-b3lyp_6-31g+(d).log.xz

001096339.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096339.td-b3lyp_6-31+g(d).gjf (generated)

001096339.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096339.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096339.mol 001096339.PUBCHEM 001096339.mol (via Jmol)
001096340.b3lyp_6-31g(d).inp

001096340.b3lyp_6-31g(d).qchem.inp (generated)

001096340.b3lyp_6-31g(d).gjf (generated)

001096340.b3lyp_6-31g(d).firefly.inp (generated)

001096340.b3lyp_6-31g(d).smash.inp (generated)

001096340.b3lyp_6-31g(d).nwchem.inp (generated) 001096340.b3lyp_6-31g(d).log.xz 001096340.td-b3lyp_6-31g+(d).inp 001096340.td-b3lyp_6-31g+(d).log.xz

001096340.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096340.td-b3lyp_6-31+g(d).gjf (generated)

001096340.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096340.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096340.mol 001096340.PUBCHEM 001096340.mol (via Jmol)
001096341.b3lyp_6-31g(d).inp

001096341.b3lyp_6-31g(d).qchem.inp (generated)

001096341.b3lyp_6-31g(d).gjf (generated)

001096341.b3lyp_6-31g(d).firefly.inp (generated)

001096341.b3lyp_6-31g(d).smash.inp (generated)

001096341.b3lyp_6-31g(d).nwchem.inp (generated) 001096341.b3lyp_6-31g(d).log.xz 001096341.td-b3lyp_6-31g+(d).inp 001096341.td-b3lyp_6-31g+(d).log.xz

001096341.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096341.td-b3lyp_6-31+g(d).gjf (generated)

001096341.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096341.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096341.mol 001096341.PUBCHEM 001096341.mol (via Jmol)
001096342.b3lyp_6-31g(d).inp

001096342.b3lyp_6-31g(d).qchem.inp (generated)

001096342.b3lyp_6-31g(d).gjf (generated)

001096342.b3lyp_6-31g(d).firefly.inp (generated)

001096342.b3lyp_6-31g(d).smash.inp (generated)

001096342.b3lyp_6-31g(d).nwchem.inp (generated) 001096342.b3lyp_6-31g(d).log.xz 001096342.td-b3lyp_6-31g+(d).inp 001096342.td-b3lyp_6-31g+(d).log.xz

001096342.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096342.td-b3lyp_6-31+g(d).gjf (generated)

001096342.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096342.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096342.mol 001096342.PUBCHEM 001096342.mol (via Jmol)
001096348.b3lyp_6-31g(d).inp

001096348.b3lyp_6-31g(d).qchem.inp (generated)

001096348.b3lyp_6-31g(d).gjf (generated)

001096348.b3lyp_6-31g(d).firefly.inp (generated)

001096348.b3lyp_6-31g(d).smash.inp (generated)

001096348.b3lyp_6-31g(d).nwchem.inp (generated) 001096348.b3lyp_6-31g(d).log.xz 001096348.mol 001096348.PUBCHEM 001096348.mol (via Jmol)
001096353.b3lyp_6-31g(d).inp

001096353.b3lyp_6-31g(d).qchem.inp (generated)

001096353.b3lyp_6-31g(d).gjf (generated)

001096353.b3lyp_6-31g(d).firefly.inp (generated)

001096353.b3lyp_6-31g(d).smash.inp (generated)

001096353.b3lyp_6-31g(d).nwchem.inp (generated) 001096353.b3lyp_6-31g(d).log.xz 001096353.td-b3lyp_6-31g+(d).inp 001096353.td-b3lyp_6-31g+(d).log.xz

001096353.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096353.td-b3lyp_6-31+g(d).gjf (generated)

001096353.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096353.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096353.mol 001096353.PUBCHEM 001096353.mol (via Jmol)
001096357.b3lyp_6-31g(d).inp

001096357.b3lyp_6-31g(d).qchem.inp (generated)

001096357.b3lyp_6-31g(d).gjf (generated)

001096357.b3lyp_6-31g(d).firefly.inp (generated)

001096357.b3lyp_6-31g(d).smash.inp (generated)

001096357.b3lyp_6-31g(d).nwchem.inp (generated) 001096357.b3lyp_6-31g(d).log.xz 001096357.td-b3lyp_6-31g+(d).inp 001096357.td-b3lyp_6-31g+(d).log.xz

001096357.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096357.td-b3lyp_6-31+g(d).gjf (generated)

001096357.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096357.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096357.mol 001096357.PUBCHEM 001096357.mol (via Jmol)
001096361.b3lyp_6-31g(d).inp

001096361.b3lyp_6-31g(d).qchem.inp (generated)

001096361.b3lyp_6-31g(d).gjf (generated)

001096361.b3lyp_6-31g(d).firefly.inp (generated)

001096361.b3lyp_6-31g(d).smash.inp (generated)

001096361.b3lyp_6-31g(d).nwchem.inp (generated) 001096361.b3lyp_6-31g(d).log.xz 001096361.td-b3lyp_6-31g+(d).inp 001096361.td-b3lyp_6-31g+(d).log.xz

001096361.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096361.td-b3lyp_6-31+g(d).gjf (generated)

001096361.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096361.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096361.mol 001096361.PUBCHEM 001096361.mol (via Jmol)
001096362.b3lyp_6-31g(d).inp

001096362.b3lyp_6-31g(d).qchem.inp (generated)

001096362.b3lyp_6-31g(d).gjf (generated)

001096362.b3lyp_6-31g(d).firefly.inp (generated)

001096362.b3lyp_6-31g(d).smash.inp (generated)

001096362.b3lyp_6-31g(d).nwchem.inp (generated) 001096362.b3lyp_6-31g(d).log.xz 001096362.mol 001096362.PUBCHEM 001096362.mol (via Jmol)
001096363.b3lyp_6-31g(d).inp

001096363.b3lyp_6-31g(d).qchem.inp (generated)

001096363.b3lyp_6-31g(d).gjf (generated)

001096363.b3lyp_6-31g(d).firefly.inp (generated)

001096363.b3lyp_6-31g(d).smash.inp (generated)

001096363.b3lyp_6-31g(d).nwchem.inp (generated) 001096363.b3lyp_6-31g(d).log.xz 001096363.mol 001096363.PUBCHEM 001096363.mol (via Jmol)
001096364.b3lyp_6-31g(d).inp

001096364.b3lyp_6-31g(d).qchem.inp (generated)

001096364.b3lyp_6-31g(d).gjf (generated)

001096364.b3lyp_6-31g(d).firefly.inp (generated)

001096364.b3lyp_6-31g(d).smash.inp (generated)

001096364.b3lyp_6-31g(d).nwchem.inp (generated) 001096364.b3lyp_6-31g(d).log.xz 001096364.td-b3lyp_6-31g+(d).inp 001096364.td-b3lyp_6-31g+(d).log.xz

001096364.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096364.td-b3lyp_6-31+g(d).gjf (generated)

001096364.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096364.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096364.mol 001096364.PUBCHEM 001096364.mol (via Jmol)
001096365.b3lyp_6-31g(d).inp

001096365.b3lyp_6-31g(d).qchem.inp (generated)

001096365.b3lyp_6-31g(d).gjf (generated)

001096365.b3lyp_6-31g(d).firefly.inp (generated)

001096365.b3lyp_6-31g(d).smash.inp (generated)

001096365.b3lyp_6-31g(d).nwchem.inp (generated) 001096365.b3lyp_6-31g(d).log.xz 001096365.td-b3lyp_6-31g+(d).inp 001096365.td-b3lyp_6-31g+(d).log.xz

001096365.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096365.td-b3lyp_6-31+g(d).gjf (generated)

001096365.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096365.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096365.mol 001096365.PUBCHEM 001096365.mol (via Jmol)
001096370.b3lyp_6-31g(d).inp

001096370.b3lyp_6-31g(d).qchem.inp (generated)

001096370.b3lyp_6-31g(d).gjf (generated)

001096370.b3lyp_6-31g(d).firefly.inp (generated)

001096370.b3lyp_6-31g(d).smash.inp (generated)

001096370.b3lyp_6-31g(d).nwchem.inp (generated) 001096370.b3lyp_6-31g(d).log.xz 001096370.mol 001096370.PUBCHEM 001096370.mol (via Jmol)
001096371.b3lyp_6-31g(d).inp

001096371.b3lyp_6-31g(d).qchem.inp (generated)

001096371.b3lyp_6-31g(d).gjf (generated)

001096371.b3lyp_6-31g(d).firefly.inp (generated)

001096371.b3lyp_6-31g(d).smash.inp (generated)

001096371.b3lyp_6-31g(d).nwchem.inp (generated) 001096371.b3lyp_6-31g(d).log.xz 001096371.mol 001096371.PUBCHEM 001096371.mol (via Jmol)
001096372.b3lyp_6-31g(d).inp

001096372.b3lyp_6-31g(d).qchem.inp (generated)

001096372.b3lyp_6-31g(d).gjf (generated)

001096372.b3lyp_6-31g(d).firefly.inp (generated)

001096372.b3lyp_6-31g(d).smash.inp (generated)

001096372.b3lyp_6-31g(d).nwchem.inp (generated) 001096372.b3lyp_6-31g(d).log.xz 001096372.td-b3lyp_6-31g+(d).inp 001096372.td-b3lyp_6-31g+(d).log.xz

001096372.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096372.td-b3lyp_6-31+g(d).gjf (generated)

001096372.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096372.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096372.mol 001096372.PUBCHEM 001096372.mol (via Jmol)
001096373.b3lyp_6-31g(d).inp

001096373.b3lyp_6-31g(d).qchem.inp (generated)

001096373.b3lyp_6-31g(d).gjf (generated)

001096373.b3lyp_6-31g(d).firefly.inp (generated)

001096373.b3lyp_6-31g(d).smash.inp (generated)

001096373.b3lyp_6-31g(d).nwchem.inp (generated) 001096373.b3lyp_6-31g(d).log.xz 001096373.td-b3lyp_6-31g+(d).inp 001096373.td-b3lyp_6-31g+(d).log.xz

001096373.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096373.td-b3lyp_6-31+g(d).gjf (generated)

001096373.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096373.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096373.mol 001096373.PUBCHEM 001096373.mol (via Jmol)
001096374.b3lyp_6-31g(d).inp

001096374.b3lyp_6-31g(d).qchem.inp (generated)

001096374.b3lyp_6-31g(d).gjf (generated)

001096374.b3lyp_6-31g(d).firefly.inp (generated)

001096374.b3lyp_6-31g(d).smash.inp (generated)

001096374.b3lyp_6-31g(d).nwchem.inp (generated) 001096374.b3lyp_6-31g(d).log.xz 001096374.td-b3lyp_6-31g+(d).inp 001096374.td-b3lyp_6-31g+(d).log.xz

001096374.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096374.td-b3lyp_6-31+g(d).gjf (generated)

001096374.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096374.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096374.mol 001096374.PUBCHEM 001096374.mol (via Jmol)
001096385.b3lyp_6-31g(d).inp

001096385.b3lyp_6-31g(d).qchem.inp (generated)

001096385.b3lyp_6-31g(d).gjf (generated)

001096385.b3lyp_6-31g(d).firefly.inp (generated)

001096385.b3lyp_6-31g(d).smash.inp (generated)

001096385.b3lyp_6-31g(d).nwchem.inp (generated) 001096385.b3lyp_6-31g(d).log.xz 001096385.td-b3lyp_6-31g+(d).inp 001096385.td-b3lyp_6-31g+(d).log.xz

001096385.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096385.td-b3lyp_6-31+g(d).gjf (generated)

001096385.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096385.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096385.mol 001096385.PUBCHEM 001096385.mol (via Jmol)
001096386.b3lyp_6-31g(d).inp

001096386.b3lyp_6-31g(d).qchem.inp (generated)

001096386.b3lyp_6-31g(d).gjf (generated)

001096386.b3lyp_6-31g(d).firefly.inp (generated)

001096386.b3lyp_6-31g(d).smash.inp (generated)

001096386.b3lyp_6-31g(d).nwchem.inp (generated) 001096386.b3lyp_6-31g(d).log.xz 001096386.td-b3lyp_6-31g+(d).inp 001096386.td-b3lyp_6-31g+(d).log.xz

001096386.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096386.td-b3lyp_6-31+g(d).gjf (generated)

001096386.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096386.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096386.mol 001096386.PUBCHEM 001096386.mol (via Jmol)
001096387.b3lyp_6-31g(d).inp

001096387.b3lyp_6-31g(d).qchem.inp (generated)

001096387.b3lyp_6-31g(d).gjf (generated)

001096387.b3lyp_6-31g(d).firefly.inp (generated)

001096387.b3lyp_6-31g(d).smash.inp (generated)

001096387.b3lyp_6-31g(d).nwchem.inp (generated) 001096387.b3lyp_6-31g(d).log.xz 001096387.td-b3lyp_6-31g+(d).inp 001096387.td-b3lyp_6-31g+(d).log.xz

001096387.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096387.td-b3lyp_6-31+g(d).gjf (generated)

001096387.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096387.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096387.mol 001096387.PUBCHEM 001096387.mol (via Jmol)
001096388.b3lyp_6-31g(d).inp

001096388.b3lyp_6-31g(d).qchem.inp (generated)

001096388.b3lyp_6-31g(d).gjf (generated)

001096388.b3lyp_6-31g(d).firefly.inp (generated)

001096388.b3lyp_6-31g(d).smash.inp (generated)

001096388.b3lyp_6-31g(d).nwchem.inp (generated) 001096388.b3lyp_6-31g(d).log.xz 001096388.td-b3lyp_6-31g+(d).inp 001096388.td-b3lyp_6-31g+(d).log.xz

001096388.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096388.td-b3lyp_6-31+g(d).gjf (generated)

001096388.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096388.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096388.mol 001096388.PUBCHEM 001096388.mol (via Jmol)
001096389.b3lyp_6-31g(d).inp

001096389.b3lyp_6-31g(d).qchem.inp (generated)

001096389.b3lyp_6-31g(d).gjf (generated)

001096389.b3lyp_6-31g(d).firefly.inp (generated)

001096389.b3lyp_6-31g(d).smash.inp (generated)

001096389.b3lyp_6-31g(d).nwchem.inp (generated) 001096389.b3lyp_6-31g(d).log.xz 001096389.td-b3lyp_6-31g+(d).inp 001096389.td-b3lyp_6-31g+(d).log.xz

001096389.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096389.td-b3lyp_6-31+g(d).gjf (generated)

001096389.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096389.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096389.mol 001096389.PUBCHEM 001096389.mol (via Jmol)
001096390.b3lyp_6-31g(d).inp

001096390.b3lyp_6-31g(d).qchem.inp (generated)

001096390.b3lyp_6-31g(d).gjf (generated)

001096390.b3lyp_6-31g(d).firefly.inp (generated)

001096390.b3lyp_6-31g(d).smash.inp (generated)

001096390.b3lyp_6-31g(d).nwchem.inp (generated) 001096390.b3lyp_6-31g(d).log.xz 001096390.td-b3lyp_6-31g+(d).inp 001096390.td-b3lyp_6-31g+(d).log.xz

001096390.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096390.td-b3lyp_6-31+g(d).gjf (generated)

001096390.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096390.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096390.mol 001096390.PUBCHEM 001096390.mol (via Jmol)
001096392.b3lyp_6-31g(d).inp

001096392.b3lyp_6-31g(d).qchem.inp (generated)

001096392.b3lyp_6-31g(d).gjf (generated)

001096392.b3lyp_6-31g(d).firefly.inp (generated)

001096392.b3lyp_6-31g(d).smash.inp (generated)

001096392.b3lyp_6-31g(d).nwchem.inp (generated) 001096392.b3lyp_6-31g(d).log.xz 001096392.td-b3lyp_6-31g+(d).inp 001096392.td-b3lyp_6-31g+(d).log.xz

001096392.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096392.td-b3lyp_6-31+g(d).gjf (generated)

001096392.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096392.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096392.mol 001096392.PUBCHEM 001096392.mol (via Jmol)
001096393.b3lyp_6-31g(d).inp

001096393.b3lyp_6-31g(d).qchem.inp (generated)

001096393.b3lyp_6-31g(d).gjf (generated)

001096393.b3lyp_6-31g(d).firefly.inp (generated)

001096393.b3lyp_6-31g(d).smash.inp (generated)

001096393.b3lyp_6-31g(d).nwchem.inp (generated) 001096393.b3lyp_6-31g(d).log.xz 001096393.mol 001096393.PUBCHEM 001096393.mol (via Jmol)
001096394.b3lyp_6-31g(d).inp

001096394.b3lyp_6-31g(d).qchem.inp (generated)

001096394.b3lyp_6-31g(d).gjf (generated)

001096394.b3lyp_6-31g(d).firefly.inp (generated)

001096394.b3lyp_6-31g(d).smash.inp (generated)

001096394.b3lyp_6-31g(d).nwchem.inp (generated) 001096394.b3lyp_6-31g(d).log.xz 001096394.mol 001096394.PUBCHEM 001096394.mol (via Jmol)
001096395.b3lyp_6-31g(d).inp

001096395.b3lyp_6-31g(d).qchem.inp (generated)

001096395.b3lyp_6-31g(d).gjf (generated)

001096395.b3lyp_6-31g(d).firefly.inp (generated)

001096395.b3lyp_6-31g(d).smash.inp (generated)

001096395.b3lyp_6-31g(d).nwchem.inp (generated) 001096395.b3lyp_6-31g(d).log.xz 001096395.td-b3lyp_6-31g+(d).inp 001096395.td-b3lyp_6-31g+(d).log.xz

001096395.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096395.td-b3lyp_6-31+g(d).gjf (generated)

001096395.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096395.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096395.mol 001096395.PUBCHEM 001096395.mol (via Jmol)
001096397.b3lyp_6-31g(d).inp

001096397.b3lyp_6-31g(d).qchem.inp (generated)

001096397.b3lyp_6-31g(d).gjf (generated)

001096397.b3lyp_6-31g(d).firefly.inp (generated)

001096397.b3lyp_6-31g(d).smash.inp (generated)

001096397.b3lyp_6-31g(d).nwchem.inp (generated) 001096397.b3lyp_6-31g(d).log.xz 001096397.mol 001096397.PUBCHEM 001096397.mol (via Jmol)
001096398.b3lyp_6-31g(d).inp

001096398.b3lyp_6-31g(d).qchem.inp (generated)

001096398.b3lyp_6-31g(d).gjf (generated)

001096398.b3lyp_6-31g(d).firefly.inp (generated)

001096398.b3lyp_6-31g(d).smash.inp (generated)

001096398.b3lyp_6-31g(d).nwchem.inp (generated) 001096398.b3lyp_6-31g(d).log.xz 001096398.mol 001096398.PUBCHEM 001096398.mol (via Jmol)
001096400.b3lyp_6-31g(d).inp

001096400.b3lyp_6-31g(d).qchem.inp (generated)

001096400.b3lyp_6-31g(d).gjf (generated)

001096400.b3lyp_6-31g(d).firefly.inp (generated)

001096400.b3lyp_6-31g(d).smash.inp (generated)

001096400.b3lyp_6-31g(d).nwchem.inp (generated) 001096400.b3lyp_6-31g(d).log.xz 001096400.mol 001096400.PUBCHEM 001096400.mol (via Jmol)
001096401.b3lyp_6-31g(d).inp

001096401.b3lyp_6-31g(d).qchem.inp (generated)

001096401.b3lyp_6-31g(d).gjf (generated)

001096401.b3lyp_6-31g(d).firefly.inp (generated)

001096401.b3lyp_6-31g(d).smash.inp (generated)

001096401.b3lyp_6-31g(d).nwchem.inp (generated) 001096401.b3lyp_6-31g(d).log.xz 001096401.td-b3lyp_6-31g+(d).inp 001096401.td-b3lyp_6-31g+(d).log.xz

001096401.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096401.td-b3lyp_6-31+g(d).gjf (generated)

001096401.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096401.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096401.mol 001096401.PUBCHEM 001096401.mol (via Jmol)
001096402.b3lyp_6-31g(d).inp

001096402.b3lyp_6-31g(d).qchem.inp (generated)

001096402.b3lyp_6-31g(d).gjf (generated)

001096402.b3lyp_6-31g(d).firefly.inp (generated)

001096402.b3lyp_6-31g(d).smash.inp (generated)

001096402.b3lyp_6-31g(d).nwchem.inp (generated) 001096402.b3lyp_6-31g(d).log.xz 001096402.td-b3lyp_6-31g+(d).inp 001096402.td-b3lyp_6-31g+(d).log.xz

001096402.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096402.td-b3lyp_6-31+g(d).gjf (generated)

001096402.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096402.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096402.mol 001096402.PUBCHEM 001096402.mol (via Jmol)
001096403.b3lyp_6-31g(d).inp

001096403.b3lyp_6-31g(d).qchem.inp (generated)

001096403.b3lyp_6-31g(d).gjf (generated)

001096403.b3lyp_6-31g(d).firefly.inp (generated)

001096403.b3lyp_6-31g(d).smash.inp (generated)

001096403.b3lyp_6-31g(d).nwchem.inp (generated) 001096403.b3lyp_6-31g(d).log.xz 001096403.td-b3lyp_6-31g+(d).inp 001096403.td-b3lyp_6-31g+(d).log.xz

001096403.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096403.td-b3lyp_6-31+g(d).gjf (generated)

001096403.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096403.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096403.mol 001096403.PUBCHEM 001096403.mol (via Jmol)
001096404.b3lyp_6-31g(d).inp

001096404.b3lyp_6-31g(d).qchem.inp (generated)

001096404.b3lyp_6-31g(d).gjf (generated)

001096404.b3lyp_6-31g(d).firefly.inp (generated)

001096404.b3lyp_6-31g(d).smash.inp (generated)

001096404.b3lyp_6-31g(d).nwchem.inp (generated) 001096404.b3lyp_6-31g(d).log.xz 001096404.td-b3lyp_6-31g+(d).inp 001096404.td-b3lyp_6-31g+(d).log.xz

001096404.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096404.td-b3lyp_6-31+g(d).gjf (generated)

001096404.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096404.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096404.mol 001096404.PUBCHEM 001096404.mol (via Jmol)
001096405.b3lyp_6-31g(d).inp

001096405.b3lyp_6-31g(d).qchem.inp (generated)

001096405.b3lyp_6-31g(d).gjf (generated)

001096405.b3lyp_6-31g(d).firefly.inp (generated)

001096405.b3lyp_6-31g(d).smash.inp (generated)

001096405.b3lyp_6-31g(d).nwchem.inp (generated) 001096405.b3lyp_6-31g(d).log.xz 001096405.td-b3lyp_6-31g+(d).inp 001096405.td-b3lyp_6-31g+(d).log.xz

001096405.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096405.td-b3lyp_6-31+g(d).gjf (generated)

001096405.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096405.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096405.mol 001096405.PUBCHEM 001096405.mol (via Jmol)
001096406.b3lyp_6-31g(d).inp

001096406.b3lyp_6-31g(d).qchem.inp (generated)

001096406.b3lyp_6-31g(d).gjf (generated)

001096406.b3lyp_6-31g(d).firefly.inp (generated)

001096406.b3lyp_6-31g(d).smash.inp (generated)

001096406.b3lyp_6-31g(d).nwchem.inp (generated) 001096406.b3lyp_6-31g(d).log.xz 001096406.td-b3lyp_6-31g+(d).inp 001096406.td-b3lyp_6-31g+(d).log.xz

001096406.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096406.td-b3lyp_6-31+g(d).gjf (generated)

001096406.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096406.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096406.mol 001096406.PUBCHEM 001096406.mol (via Jmol)
001096408.b3lyp_6-31g(d).inp

001096408.b3lyp_6-31g(d).qchem.inp (generated)

001096408.b3lyp_6-31g(d).gjf (generated)

001096408.b3lyp_6-31g(d).firefly.inp (generated)

001096408.b3lyp_6-31g(d).smash.inp (generated)

001096408.b3lyp_6-31g(d).nwchem.inp (generated) 001096408.b3lyp_6-31g(d).log.xz 001096408.td-b3lyp_6-31g+(d).inp 001096408.td-b3lyp_6-31g+(d).log.xz

001096408.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096408.td-b3lyp_6-31+g(d).gjf (generated)

001096408.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096408.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096408.mol 001096408.PUBCHEM 001096408.mol (via Jmol)
001096409.b3lyp_6-31g(d).inp

001096409.b3lyp_6-31g(d).qchem.inp (generated)

001096409.b3lyp_6-31g(d).gjf (generated)

001096409.b3lyp_6-31g(d).firefly.inp (generated)

001096409.b3lyp_6-31g(d).smash.inp (generated)

001096409.b3lyp_6-31g(d).nwchem.inp (generated) 001096409.b3lyp_6-31g(d).log.xz 001096409.td-b3lyp_6-31g+(d).inp 001096409.td-b3lyp_6-31g+(d).log.xz

001096409.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096409.td-b3lyp_6-31+g(d).gjf (generated)

001096409.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096409.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096409.mol 001096409.PUBCHEM 001096409.mol (via Jmol)
001096447.b3lyp_6-31g(d).inp

001096447.b3lyp_6-31g(d).qchem.inp (generated)

001096447.b3lyp_6-31g(d).gjf (generated)

001096447.b3lyp_6-31g(d).firefly.inp (generated)

001096447.b3lyp_6-31g(d).smash.inp (generated)

001096447.b3lyp_6-31g(d).nwchem.inp (generated) 001096447.b3lyp_6-31g(d).log.xz 001096447.mol 001096447.PUBCHEM 001096447.mol (via Jmol)
001096449.b3lyp_6-31g(d).inp

001096449.b3lyp_6-31g(d).qchem.inp (generated)

001096449.b3lyp_6-31g(d).gjf (generated)

001096449.b3lyp_6-31g(d).firefly.inp (generated)

001096449.b3lyp_6-31g(d).smash.inp (generated)

001096449.b3lyp_6-31g(d).nwchem.inp (generated) 001096449.b3lyp_6-31g(d).log.xz 001096449.td-b3lyp_6-31g+(d).inp 001096449.td-b3lyp_6-31g+(d).log.xz

001096449.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096449.td-b3lyp_6-31+g(d).gjf (generated)

001096449.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096449.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096449.mol 001096449.PUBCHEM 001096449.mol (via Jmol)
001096564.b3lyp_6-31g(d).inp

001096564.b3lyp_6-31g(d).qchem.inp (generated)

001096564.b3lyp_6-31g(d).gjf (generated)

001096564.b3lyp_6-31g(d).firefly.inp (generated)

001096564.b3lyp_6-31g(d).smash.inp (generated)

001096564.b3lyp_6-31g(d).nwchem.inp (generated) 001096564.b3lyp_6-31g(d).log.xz 001096564.mol 001096564.PUBCHEM 001096564.mol (via Jmol)
001096859.b3lyp_6-31g(d).inp

001096859.b3lyp_6-31g(d).qchem.inp (generated)

001096859.b3lyp_6-31g(d).gjf (generated)

001096859.b3lyp_6-31g(d).firefly.inp (generated)

001096859.b3lyp_6-31g(d).smash.inp (generated)

001096859.b3lyp_6-31g(d).nwchem.inp (generated) 001096859.b3lyp_6-31g(d).log.xz 001096859.td-b3lyp_6-31g+(d).inp 001096859.td-b3lyp_6-31g+(d).log.xz

001096859.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096859.td-b3lyp_6-31+g(d).gjf (generated)

001096859.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096859.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096859.mol 001096859.PUBCHEM 001096859.mol (via Jmol)
001096878.b3lyp_6-31g(d).inp

001096878.b3lyp_6-31g(d).qchem.inp (generated)

001096878.b3lyp_6-31g(d).gjf (generated)

001096878.b3lyp_6-31g(d).firefly.inp (generated)

001096878.b3lyp_6-31g(d).smash.inp (generated)

001096878.b3lyp_6-31g(d).nwchem.inp (generated) 001096878.b3lyp_6-31g(d).log.xz 001096878.td-b3lyp_6-31g+(d).inp 001096878.td-b3lyp_6-31g+(d).log.xz

001096878.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096878.td-b3lyp_6-31+g(d).gjf (generated)

001096878.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096878.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096878.mol 001096878.PUBCHEM 001096878.mol (via Jmol)
001096879.b3lyp_6-31g(d).inp

001096879.b3lyp_6-31g(d).qchem.inp (generated)

001096879.b3lyp_6-31g(d).gjf (generated)

001096879.b3lyp_6-31g(d).firefly.inp (generated)

001096879.b3lyp_6-31g(d).smash.inp (generated)

001096879.b3lyp_6-31g(d).nwchem.inp (generated) 001096879.b3lyp_6-31g(d).log.xz 001096879.td-b3lyp_6-31g+(d).inp 001096879.td-b3lyp_6-31g+(d).log.xz

001096879.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096879.td-b3lyp_6-31+g(d).gjf (generated)

001096879.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096879.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096879.mol 001096879.PUBCHEM 001096879.mol (via Jmol)
001096882.b3lyp_6-31g(d).inp

001096882.b3lyp_6-31g(d).qchem.inp (generated)

001096882.b3lyp_6-31g(d).gjf (generated)

001096882.b3lyp_6-31g(d).firefly.inp (generated)

001096882.b3lyp_6-31g(d).smash.inp (generated)

001096882.b3lyp_6-31g(d).nwchem.inp (generated) 001096882.b3lyp_6-31g(d).log.xz 001096882.td-b3lyp_6-31g+(d).inp 001096882.td-b3lyp_6-31g+(d).log.xz

001096882.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096882.td-b3lyp_6-31+g(d).gjf (generated)

001096882.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096882.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096882.mol 001096882.PUBCHEM 001096882.mol (via Jmol)
001096883.b3lyp_6-31g(d).inp

001096883.b3lyp_6-31g(d).qchem.inp (generated)

001096883.b3lyp_6-31g(d).gjf (generated)

001096883.b3lyp_6-31g(d).firefly.inp (generated)

001096883.b3lyp_6-31g(d).smash.inp (generated)

001096883.b3lyp_6-31g(d).nwchem.inp (generated) 001096883.b3lyp_6-31g(d).log.xz 001096883.td-b3lyp_6-31g+(d).inp 001096883.td-b3lyp_6-31g+(d).log.xz

001096883.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096883.td-b3lyp_6-31+g(d).gjf (generated)

001096883.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096883.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096883.mol 001096883.PUBCHEM 001096883.mol (via Jmol)
001096898.b3lyp_6-31g(d).inp

001096898.b3lyp_6-31g(d).qchem.inp (generated)

001096898.b3lyp_6-31g(d).gjf (generated)

001096898.b3lyp_6-31g(d).firefly.inp (generated)

001096898.b3lyp_6-31g(d).smash.inp (generated)

001096898.b3lyp_6-31g(d).nwchem.inp (generated) 001096898.b3lyp_6-31g(d).log.xz 001096898.td-b3lyp_6-31g+(d).inp 001096898.td-b3lyp_6-31g+(d).log.xz

001096898.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096898.td-b3lyp_6-31+g(d).gjf (generated)

001096898.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096898.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096898.mol 001096898.PUBCHEM 001096898.mol (via Jmol)
001096899.b3lyp_6-31g(d).inp

001096899.b3lyp_6-31g(d).qchem.inp (generated)

001096899.b3lyp_6-31g(d).gjf (generated)

001096899.b3lyp_6-31g(d).firefly.inp (generated)

001096899.b3lyp_6-31g(d).smash.inp (generated)

001096899.b3lyp_6-31g(d).nwchem.inp (generated) 001096899.b3lyp_6-31g(d).log.xz 001096899.td-b3lyp_6-31g+(d).inp 001096899.td-b3lyp_6-31g+(d).log.xz

001096899.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096899.td-b3lyp_6-31+g(d).gjf (generated)

001096899.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096899.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096899.mol 001096899.PUBCHEM 001096899.mol (via Jmol)
001096900.b3lyp_6-31g(d).inp

001096900.b3lyp_6-31g(d).qchem.inp (generated)

001096900.b3lyp_6-31g(d).gjf (generated)

001096900.b3lyp_6-31g(d).firefly.inp (generated)

001096900.b3lyp_6-31g(d).smash.inp (generated)

001096900.b3lyp_6-31g(d).nwchem.inp (generated) 001096900.b3lyp_6-31g(d).log.xz 001096900.td-b3lyp_6-31g+(d).inp 001096900.td-b3lyp_6-31g+(d).log.xz

001096900.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096900.td-b3lyp_6-31+g(d).gjf (generated)

001096900.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096900.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096900.mol 001096900.PUBCHEM 001096900.mol (via Jmol)
001096901.b3lyp_6-31g(d).inp

001096901.b3lyp_6-31g(d).qchem.inp (generated)

001096901.b3lyp_6-31g(d).gjf (generated)

001096901.b3lyp_6-31g(d).firefly.inp (generated)

001096901.b3lyp_6-31g(d).smash.inp (generated)

001096901.b3lyp_6-31g(d).nwchem.inp (generated) 001096901.b3lyp_6-31g(d).log.xz 001096901.td-b3lyp_6-31g+(d).inp 001096901.td-b3lyp_6-31g+(d).log.xz

001096901.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096901.td-b3lyp_6-31+g(d).gjf (generated)

001096901.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096901.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096901.mol 001096901.PUBCHEM 001096901.mol (via Jmol)
001096902.b3lyp_6-31g(d).inp

001096902.b3lyp_6-31g(d).qchem.inp (generated)

001096902.b3lyp_6-31g(d).gjf (generated)

001096902.b3lyp_6-31g(d).firefly.inp (generated)

001096902.b3lyp_6-31g(d).smash.inp (generated)

001096902.b3lyp_6-31g(d).nwchem.inp (generated) 001096902.b3lyp_6-31g(d).log.xz 001096902.td-b3lyp_6-31g+(d).inp 001096902.td-b3lyp_6-31g+(d).log.xz

001096902.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096902.td-b3lyp_6-31+g(d).gjf (generated)

001096902.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096902.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096902.mol 001096902.PUBCHEM 001096902.mol (via Jmol)
001096903.b3lyp_6-31g(d).inp

001096903.b3lyp_6-31g(d).qchem.inp (generated)

001096903.b3lyp_6-31g(d).gjf (generated)

001096903.b3lyp_6-31g(d).firefly.inp (generated)

001096903.b3lyp_6-31g(d).smash.inp (generated)

001096903.b3lyp_6-31g(d).nwchem.inp (generated) 001096903.b3lyp_6-31g(d).log.xz 001096903.td-b3lyp_6-31g+(d).inp 001096903.td-b3lyp_6-31g+(d).log.xz

001096903.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096903.td-b3lyp_6-31+g(d).gjf (generated)

001096903.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096903.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096903.mol 001096903.PUBCHEM 001096903.mol (via Jmol)
001096904.b3lyp_6-31g(d).inp

001096904.b3lyp_6-31g(d).qchem.inp (generated)

001096904.b3lyp_6-31g(d).gjf (generated)

001096904.b3lyp_6-31g(d).firefly.inp (generated)

001096904.b3lyp_6-31g(d).smash.inp (generated)

001096904.b3lyp_6-31g(d).nwchem.inp (generated) 001096904.b3lyp_6-31g(d).log.xz 001096904.td-b3lyp_6-31g+(d).inp 001096904.td-b3lyp_6-31g+(d).log.xz

001096904.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096904.td-b3lyp_6-31+g(d).gjf (generated)

001096904.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096904.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096904.mol 001096904.PUBCHEM 001096904.mol (via Jmol)
001096905.b3lyp_6-31g(d).inp

001096905.b3lyp_6-31g(d).qchem.inp (generated)

001096905.b3lyp_6-31g(d).gjf (generated)

001096905.b3lyp_6-31g(d).firefly.inp (generated)

001096905.b3lyp_6-31g(d).smash.inp (generated)

001096905.b3lyp_6-31g(d).nwchem.inp (generated) 001096905.b3lyp_6-31g(d).log.xz 001096905.td-b3lyp_6-31g+(d).inp 001096905.td-b3lyp_6-31g+(d).log.xz

001096905.td-b3lyp_6-31+g(d).qchem.inp (generated)

001096905.td-b3lyp_6-31+g(d).gjf (generated)

001096905.td-b3lyp_6-31+g(d).firefly.inp (generated)

001096905.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001096905.mol 001096905.PUBCHEM 001096905.mol (via Jmol)
001097224.b3lyp_6-31g(d).inp

001097224.b3lyp_6-31g(d).qchem.inp (generated)

001097224.b3lyp_6-31g(d).gjf (generated)

001097224.b3lyp_6-31g(d).firefly.inp (generated)

001097224.b3lyp_6-31g(d).smash.inp (generated)

001097224.b3lyp_6-31g(d).nwchem.inp (generated) 001097224.b3lyp_6-31g(d).log.xz 001097224.td-b3lyp_6-31g+(d).inp 001097224.td-b3lyp_6-31g+(d).log.xz

001097224.td-b3lyp_6-31+g(d).qchem.inp (generated)

001097224.td-b3lyp_6-31+g(d).gjf (generated)

001097224.td-b3lyp_6-31+g(d).firefly.inp (generated)

001097224.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001097224.mol 001097224.PUBCHEM 001097224.mol (via Jmol)
001097225.b3lyp_6-31g(d).inp

001097225.b3lyp_6-31g(d).qchem.inp (generated)

001097225.b3lyp_6-31g(d).gjf (generated)

001097225.b3lyp_6-31g(d).firefly.inp (generated)

001097225.b3lyp_6-31g(d).smash.inp (generated)

001097225.b3lyp_6-31g(d).nwchem.inp (generated) 001097225.b3lyp_6-31g(d).log.xz 001097225.td-b3lyp_6-31g+(d).inp 001097225.td-b3lyp_6-31g+(d).log.xz

001097225.td-b3lyp_6-31+g(d).qchem.inp (generated)

001097225.td-b3lyp_6-31+g(d).gjf (generated)

001097225.td-b3lyp_6-31+g(d).firefly.inp (generated)

001097225.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001097225.mol 001097225.PUBCHEM 001097225.mol (via Jmol)
001097534.b3lyp_6-31g(d).inp

001097534.b3lyp_6-31g(d).qchem.inp (generated)

001097534.b3lyp_6-31g(d).gjf (generated)

001097534.b3lyp_6-31g(d).firefly.inp (generated)

001097534.b3lyp_6-31g(d).smash.inp (generated)

001097534.b3lyp_6-31g(d).nwchem.inp (generated) 001097534.b3lyp_6-31g(d).log.xz 001097534.td-b3lyp_6-31g+(d).inp 001097534.td-b3lyp_6-31g+(d).log.xz

001097534.td-b3lyp_6-31+g(d).qchem.inp (generated)

001097534.td-b3lyp_6-31+g(d).gjf (generated)

001097534.td-b3lyp_6-31+g(d).firefly.inp (generated)

001097534.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001097534.mol 001097534.PUBCHEM 001097534.mol (via Jmol)
001097797.b3lyp_6-31g(d).inp

001097797.b3lyp_6-31g(d).qchem.inp (generated)

001097797.b3lyp_6-31g(d).gjf (generated)

001097797.b3lyp_6-31g(d).firefly.inp (generated)

001097797.b3lyp_6-31g(d).smash.inp (generated)

001097797.b3lyp_6-31g(d).nwchem.inp (generated) 001097797.b3lyp_6-31g(d).log.xz 001097797.td-b3lyp_6-31g+(d).inp 001097797.td-b3lyp_6-31g+(d).log.xz

001097797.td-b3lyp_6-31+g(d).qchem.inp (generated)

001097797.td-b3lyp_6-31+g(d).gjf (generated)

001097797.td-b3lyp_6-31+g(d).firefly.inp (generated)

001097797.td-b3lyp_6-31+g(d).nwchem.inp (generated) 001097797.mol 001097797.PUBCHEM 001097797.mol (via Jmol)
001097803.b3lyp_6-31g(d).inp

001097803.b3lyp_6-31g(d).qchem.inp (generated)

001097803.b3lyp_6-31g(d).gjf (generated)

001097803.b3lyp_6-31g(d).firefly.inp (generated)

001097803.b3lyp_6-31g(d).smash.inp (generated)

001097803.b3lyp_6-31g(d).nwchem.inp (generated) 001097803.b3lyp_6-31g(d).log.xz 001097803.mol 001097803.PUBCHEM 001097803.mol (via Jmol)
001098423.b3lyp_6-31g(d).inp

001098423.b3lyp_6-31g(d).qchem.inp (generated)