Index of

Last updated : Thu Jun 22 02:29:55 JST 2017
Total : 400 (296) in this page
047025088.b3lyp_6-31g(d).inp

047025088.b3lyp_6-31g(d).qchem.inp (generated)

047025088.b3lyp_6-31g(d).gjf (generated)

047025088.b3lyp_6-31g(d).firefly.inp (generated)

047025088.b3lyp_6-31g(d).smash.inp (generated)

047025088.b3lyp_6-31g(d).nwchem.inp (generated) 047025088.b3lyp_6-31g(d).log.xz 047025088.td-b3lyp_6-31g+(d).inp 047025088.td-b3lyp_6-31g+(d).log.xz

047025088.td-b3lyp_6-31+g(d).qchem.inp (generated)

047025088.td-b3lyp_6-31+g(d).gjf (generated)

047025088.td-b3lyp_6-31+g(d).firefly.inp (generated)

047025088.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047025088.mol 047025088.PUBCHEM 047025088.mol (via Jmol)
047025095.b3lyp_6-31g(d).inp

047025095.b3lyp_6-31g(d).qchem.inp (generated)

047025095.b3lyp_6-31g(d).gjf (generated)

047025095.b3lyp_6-31g(d).firefly.inp (generated)

047025095.b3lyp_6-31g(d).smash.inp (generated)

047025095.b3lyp_6-31g(d).nwchem.inp (generated) 047025095.b3lyp_6-31g(d).log.xz 047025095.td-b3lyp_6-31g+(d).inp 047025095.td-b3lyp_6-31g+(d).log.xz

047025095.td-b3lyp_6-31+g(d).qchem.inp (generated)

047025095.td-b3lyp_6-31+g(d).gjf (generated)

047025095.td-b3lyp_6-31+g(d).firefly.inp (generated)

047025095.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047025095.mol 047025095.PUBCHEM 047025095.mol (via Jmol)
047025096.b3lyp_6-31g(d).inp

047025096.b3lyp_6-31g(d).qchem.inp (generated)

047025096.b3lyp_6-31g(d).gjf (generated)

047025096.b3lyp_6-31g(d).firefly.inp (generated)

047025096.b3lyp_6-31g(d).smash.inp (generated)

047025096.b3lyp_6-31g(d).nwchem.inp (generated) 047025096.b3lyp_6-31g(d).log.xz 047025096.mol 047025096.PUBCHEM 047025096.mol (via Jmol)
047025119.b3lyp_6-31g(d).inp

047025119.b3lyp_6-31g(d).qchem.inp (generated)

047025119.b3lyp_6-31g(d).gjf (generated)

047025119.b3lyp_6-31g(d).firefly.inp (generated)

047025119.b3lyp_6-31g(d).smash.inp (generated)

047025119.b3lyp_6-31g(d).nwchem.inp (generated) 047025119.b3lyp_6-31g(d).log.xz 047025119.td-b3lyp_6-31g+(d).inp 047025119.td-b3lyp_6-31g+(d).log.xz

047025119.td-b3lyp_6-31+g(d).qchem.inp (generated)

047025119.td-b3lyp_6-31+g(d).gjf (generated)

047025119.td-b3lyp_6-31+g(d).firefly.inp (generated)

047025119.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047025119.mol 047025119.PUBCHEM 047025119.mol (via Jmol)
047025248.b3lyp_6-31g(d).inp

047025248.b3lyp_6-31g(d).qchem.inp (generated)

047025248.b3lyp_6-31g(d).gjf (generated)

047025248.b3lyp_6-31g(d).firefly.inp (generated)

047025248.b3lyp_6-31g(d).smash.inp (generated)

047025248.b3lyp_6-31g(d).nwchem.inp (generated) 047025248.b3lyp_6-31g(d).log.xz 047025248.td-b3lyp_6-31g+(d).inp 047025248.td-b3lyp_6-31g+(d).log.xz

047025248.td-b3lyp_6-31+g(d).qchem.inp (generated)

047025248.td-b3lyp_6-31+g(d).gjf (generated)

047025248.td-b3lyp_6-31+g(d).firefly.inp (generated)

047025248.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047025248.mol 047025248.PUBCHEM 047025248.mol (via Jmol)
047025307.b3lyp_6-31g(d).inp

047025307.b3lyp_6-31g(d).qchem.inp (generated)

047025307.b3lyp_6-31g(d).gjf (generated)

047025307.b3lyp_6-31g(d).firefly.inp (generated)

047025307.b3lyp_6-31g(d).smash.inp (generated)

047025307.b3lyp_6-31g(d).nwchem.inp (generated) 047025307.b3lyp_6-31g(d).log.xz 047025307.td-b3lyp_6-31g+(d).inp 047025307.td-b3lyp_6-31g+(d).log.xz

047025307.td-b3lyp_6-31+g(d).qchem.inp (generated)

047025307.td-b3lyp_6-31+g(d).gjf (generated)

047025307.td-b3lyp_6-31+g(d).firefly.inp (generated)

047025307.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047025307.mol 047025307.PUBCHEM 047025307.mol (via Jmol)
047025435.b3lyp_6-31g(d).inp

047025435.b3lyp_6-31g(d).qchem.inp (generated)

047025435.b3lyp_6-31g(d).gjf (generated)

047025435.b3lyp_6-31g(d).firefly.inp (generated)

047025435.b3lyp_6-31g(d).smash.inp (generated)

047025435.b3lyp_6-31g(d).nwchem.inp (generated) 047025435.b3lyp_6-31g(d).log.xz 047025435.td-b3lyp_6-31g+(d).inp 047025435.td-b3lyp_6-31g+(d).log.xz

047025435.td-b3lyp_6-31+g(d).qchem.inp (generated)

047025435.td-b3lyp_6-31+g(d).gjf (generated)

047025435.td-b3lyp_6-31+g(d).firefly.inp (generated)

047025435.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047025435.mol 047025435.PUBCHEM 047025435.mol (via Jmol)
047025437.b3lyp_6-31g(d).inp

047025437.b3lyp_6-31g(d).qchem.inp (generated)

047025437.b3lyp_6-31g(d).gjf (generated)

047025437.b3lyp_6-31g(d).firefly.inp (generated)

047025437.b3lyp_6-31g(d).smash.inp (generated)

047025437.b3lyp_6-31g(d).nwchem.inp (generated) 047025437.b3lyp_6-31g(d).log.xz 047025437.td-b3lyp_6-31g+(d).inp 047025437.td-b3lyp_6-31g+(d).log.xz

047025437.td-b3lyp_6-31+g(d).qchem.inp (generated)

047025437.td-b3lyp_6-31+g(d).gjf (generated)

047025437.td-b3lyp_6-31+g(d).firefly.inp (generated)

047025437.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047025437.mol 047025437.PUBCHEM 047025437.mol (via Jmol)
047025523.b3lyp_6-31g(d).inp

047025523.b3lyp_6-31g(d).qchem.inp (generated)

047025523.b3lyp_6-31g(d).gjf (generated)

047025523.b3lyp_6-31g(d).firefly.inp (generated)

047025523.b3lyp_6-31g(d).smash.inp (generated)

047025523.b3lyp_6-31g(d).nwchem.inp (generated) 047025523.b3lyp_6-31g(d).log.xz 047025523.mol 047025523.PUBCHEM 047025523.mol (via Jmol)
047025568.b3lyp_6-31g(d).inp

047025568.b3lyp_6-31g(d).qchem.inp (generated)

047025568.b3lyp_6-31g(d).gjf (generated)

047025568.b3lyp_6-31g(d).firefly.inp (generated)

047025568.b3lyp_6-31g(d).smash.inp (generated)

047025568.b3lyp_6-31g(d).nwchem.inp (generated) 047025568.b3lyp_6-31g(d).log.xz 047025568.td-b3lyp_6-31g+(d).inp 047025568.td-b3lyp_6-31g+(d).log.xz

047025568.td-b3lyp_6-31+g(d).qchem.inp (generated)

047025568.td-b3lyp_6-31+g(d).gjf (generated)

047025568.td-b3lyp_6-31+g(d).firefly.inp (generated)

047025568.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047025568.mol 047025568.PUBCHEM 047025568.mol (via Jmol)
047025674.b3lyp_6-31g(d).inp

047025674.b3lyp_6-31g(d).qchem.inp (generated)

047025674.b3lyp_6-31g(d).gjf (generated)

047025674.b3lyp_6-31g(d).firefly.inp (generated)

047025674.b3lyp_6-31g(d).smash.inp (generated)

047025674.b3lyp_6-31g(d).nwchem.inp (generated) 047025674.b3lyp_6-31g(d).log.xz 047025674.td-b3lyp_6-31g+(d).inp 047025674.td-b3lyp_6-31g+(d).log.xz

047025674.td-b3lyp_6-31+g(d).qchem.inp (generated)

047025674.td-b3lyp_6-31+g(d).gjf (generated)

047025674.td-b3lyp_6-31+g(d).firefly.inp (generated)

047025674.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047025674.mol 047025674.PUBCHEM 047025674.mol (via Jmol)
047025680.b3lyp_6-31g(d).inp

047025680.b3lyp_6-31g(d).qchem.inp (generated)

047025680.b3lyp_6-31g(d).gjf (generated)

047025680.b3lyp_6-31g(d).firefly.inp (generated)

047025680.b3lyp_6-31g(d).smash.inp (generated)

047025680.b3lyp_6-31g(d).nwchem.inp (generated) 047025680.b3lyp_6-31g(d).log.xz 047025680.td-b3lyp_6-31g+(d).inp 047025680.td-b3lyp_6-31g+(d).log.xz

047025680.td-b3lyp_6-31+g(d).qchem.inp (generated)

047025680.td-b3lyp_6-31+g(d).gjf (generated)

047025680.td-b3lyp_6-31+g(d).firefly.inp (generated)

047025680.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047025680.mol 047025680.PUBCHEM 047025680.mol (via Jmol)
047025862.b3lyp_6-31g(d).inp

047025862.b3lyp_6-31g(d).qchem.inp (generated)

047025862.b3lyp_6-31g(d).gjf (generated)

047025862.b3lyp_6-31g(d).firefly.inp (generated)

047025862.b3lyp_6-31g(d).smash.inp (generated)

047025862.b3lyp_6-31g(d).nwchem.inp (generated) 047025862.b3lyp_6-31g(d).log.xz 047025862.td-b3lyp_6-31g+(d).inp 047025862.td-b3lyp_6-31g+(d).log.xz

047025862.td-b3lyp_6-31+g(d).qchem.inp (generated)

047025862.td-b3lyp_6-31+g(d).gjf (generated)

047025862.td-b3lyp_6-31+g(d).firefly.inp (generated)

047025862.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047025862.mol 047025862.PUBCHEM 047025862.mol (via Jmol)
047025865.b3lyp_6-31g(d).inp

047025865.b3lyp_6-31g(d).qchem.inp (generated)

047025865.b3lyp_6-31g(d).gjf (generated)

047025865.b3lyp_6-31g(d).firefly.inp (generated)

047025865.b3lyp_6-31g(d).smash.inp (generated)

047025865.b3lyp_6-31g(d).nwchem.inp (generated) 047025865.b3lyp_6-31g(d).log.xz 047025865.td-b3lyp_6-31g+(d).inp 047025865.td-b3lyp_6-31g+(d).log.xz

047025865.td-b3lyp_6-31+g(d).qchem.inp (generated)

047025865.td-b3lyp_6-31+g(d).gjf (generated)

047025865.td-b3lyp_6-31+g(d).firefly.inp (generated)

047025865.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047025865.mol 047025865.PUBCHEM 047025865.mol (via Jmol)
047025977.b3lyp_6-31g(d).inp

047025977.b3lyp_6-31g(d).qchem.inp (generated)

047025977.b3lyp_6-31g(d).gjf (generated)

047025977.b3lyp_6-31g(d).firefly.inp (generated)

047025977.b3lyp_6-31g(d).smash.inp (generated)

047025977.b3lyp_6-31g(d).nwchem.inp (generated) 047025977.b3lyp_6-31g(d).log.xz 047025977.mol 047025977.PUBCHEM 047025977.mol (via Jmol)
047025978.b3lyp_6-31g(d).inp

047025978.b3lyp_6-31g(d).qchem.inp (generated)

047025978.b3lyp_6-31g(d).gjf (generated)

047025978.b3lyp_6-31g(d).firefly.inp (generated)

047025978.b3lyp_6-31g(d).smash.inp (generated)

047025978.b3lyp_6-31g(d).nwchem.inp (generated) 047025978.b3lyp_6-31g(d).log.xz 047025978.mol 047025978.PUBCHEM 047025978.mol (via Jmol)
047025979.b3lyp_6-31g(d).inp

047025979.b3lyp_6-31g(d).qchem.inp (generated)

047025979.b3lyp_6-31g(d).gjf (generated)

047025979.b3lyp_6-31g(d).firefly.inp (generated)

047025979.b3lyp_6-31g(d).smash.inp (generated)

047025979.b3lyp_6-31g(d).nwchem.inp (generated) 047025979.b3lyp_6-31g(d).log.xz 047025979.mol 047025979.PUBCHEM 047025979.mol (via Jmol)
047025981.b3lyp_6-31g(d).inp

047025981.b3lyp_6-31g(d).qchem.inp (generated)

047025981.b3lyp_6-31g(d).gjf (generated)

047025981.b3lyp_6-31g(d).firefly.inp (generated)

047025981.b3lyp_6-31g(d).smash.inp (generated)

047025981.b3lyp_6-31g(d).nwchem.inp (generated) 047025981.b3lyp_6-31g(d).log.xz 047025981.td-b3lyp_6-31g+(d).inp 047025981.td-b3lyp_6-31g+(d).log.xz

047025981.td-b3lyp_6-31+g(d).qchem.inp (generated)

047025981.td-b3lyp_6-31+g(d).gjf (generated)

047025981.td-b3lyp_6-31+g(d).firefly.inp (generated)

047025981.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047025981.mol 047025981.PUBCHEM 047025981.mol (via Jmol)
047025986.b3lyp_6-31g(d).inp

047025986.b3lyp_6-31g(d).qchem.inp (generated)

047025986.b3lyp_6-31g(d).gjf (generated)

047025986.b3lyp_6-31g(d).firefly.inp (generated)

047025986.b3lyp_6-31g(d).smash.inp (generated)

047025986.b3lyp_6-31g(d).nwchem.inp (generated) 047025986.b3lyp_6-31g(d).log.xz 047025986.td-b3lyp_6-31g+(d).inp 047025986.td-b3lyp_6-31g+(d).log.xz

047025986.td-b3lyp_6-31+g(d).qchem.inp (generated)

047025986.td-b3lyp_6-31+g(d).gjf (generated)

047025986.td-b3lyp_6-31+g(d).firefly.inp (generated)

047025986.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047025986.mol 047025986.PUBCHEM 047025986.mol (via Jmol)
047025988.b3lyp_6-31g(d).inp

047025988.b3lyp_6-31g(d).qchem.inp (generated)

047025988.b3lyp_6-31g(d).gjf (generated)

047025988.b3lyp_6-31g(d).firefly.inp (generated)

047025988.b3lyp_6-31g(d).smash.inp (generated)

047025988.b3lyp_6-31g(d).nwchem.inp (generated) 047025988.b3lyp_6-31g(d).log.xz 047025988.td-b3lyp_6-31g+(d).inp 047025988.td-b3lyp_6-31g+(d).log.xz

047025988.td-b3lyp_6-31+g(d).qchem.inp (generated)

047025988.td-b3lyp_6-31+g(d).gjf (generated)

047025988.td-b3lyp_6-31+g(d).firefly.inp (generated)

047025988.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047025988.mol 047025988.PUBCHEM 047025988.mol (via Jmol)
047025989.b3lyp_6-31g(d).inp

047025989.b3lyp_6-31g(d).qchem.inp (generated)

047025989.b3lyp_6-31g(d).gjf (generated)

047025989.b3lyp_6-31g(d).firefly.inp (generated)

047025989.b3lyp_6-31g(d).smash.inp (generated)

047025989.b3lyp_6-31g(d).nwchem.inp (generated) 047025989.b3lyp_6-31g(d).log.xz 047025989.td-b3lyp_6-31g+(d).inp 047025989.td-b3lyp_6-31g+(d).log.xz

047025989.td-b3lyp_6-31+g(d).qchem.inp (generated)

047025989.td-b3lyp_6-31+g(d).gjf (generated)

047025989.td-b3lyp_6-31+g(d).firefly.inp (generated)

047025989.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047025989.mol 047025989.PUBCHEM 047025989.mol (via Jmol)
047025991.b3lyp_6-31g(d).inp

047025991.b3lyp_6-31g(d).qchem.inp (generated)

047025991.b3lyp_6-31g(d).gjf (generated)

047025991.b3lyp_6-31g(d).firefly.inp (generated)

047025991.b3lyp_6-31g(d).smash.inp (generated)

047025991.b3lyp_6-31g(d).nwchem.inp (generated) 047025991.b3lyp_6-31g(d).log.xz 047025991.td-b3lyp_6-31g+(d).inp 047025991.td-b3lyp_6-31g+(d).log.xz

047025991.td-b3lyp_6-31+g(d).qchem.inp (generated)

047025991.td-b3lyp_6-31+g(d).gjf (generated)

047025991.td-b3lyp_6-31+g(d).firefly.inp (generated)

047025991.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047025991.mol 047025991.PUBCHEM 047025991.mol (via Jmol)
047025993.b3lyp_6-31g(d).inp

047025993.b3lyp_6-31g(d).qchem.inp (generated)

047025993.b3lyp_6-31g(d).gjf (generated)

047025993.b3lyp_6-31g(d).firefly.inp (generated)

047025993.b3lyp_6-31g(d).smash.inp (generated)

047025993.b3lyp_6-31g(d).nwchem.inp (generated) 047025993.b3lyp_6-31g(d).log.xz 047025993.td-b3lyp_6-31g+(d).inp 047025993.td-b3lyp_6-31g+(d).log.xz

047025993.td-b3lyp_6-31+g(d).qchem.inp (generated)

047025993.td-b3lyp_6-31+g(d).gjf (generated)

047025993.td-b3lyp_6-31+g(d).firefly.inp (generated)

047025993.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047025993.mol 047025993.PUBCHEM 047025993.mol (via Jmol)
047025995.b3lyp_6-31g(d).inp

047025995.b3lyp_6-31g(d).qchem.inp (generated)

047025995.b3lyp_6-31g(d).gjf (generated)

047025995.b3lyp_6-31g(d).firefly.inp (generated)

047025995.b3lyp_6-31g(d).smash.inp (generated)

047025995.b3lyp_6-31g(d).nwchem.inp (generated) 047025995.b3lyp_6-31g(d).log.xz 047025995.td-b3lyp_6-31g+(d).inp 047025995.td-b3lyp_6-31g+(d).log.xz

047025995.td-b3lyp_6-31+g(d).qchem.inp (generated)

047025995.td-b3lyp_6-31+g(d).gjf (generated)

047025995.td-b3lyp_6-31+g(d).firefly.inp (generated)

047025995.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047025995.mol 047025995.PUBCHEM 047025995.mol (via Jmol)
047025997.b3lyp_6-31g(d).inp

047025997.b3lyp_6-31g(d).qchem.inp (generated)

047025997.b3lyp_6-31g(d).gjf (generated)

047025997.b3lyp_6-31g(d).firefly.inp (generated)

047025997.b3lyp_6-31g(d).smash.inp (generated)

047025997.b3lyp_6-31g(d).nwchem.inp (generated) 047025997.b3lyp_6-31g(d).log.xz 047025997.mol 047025997.PUBCHEM 047025997.mol (via Jmol)
047025999.b3lyp_6-31g(d).inp

047025999.b3lyp_6-31g(d).qchem.inp (generated)

047025999.b3lyp_6-31g(d).gjf (generated)

047025999.b3lyp_6-31g(d).firefly.inp (generated)

047025999.b3lyp_6-31g(d).smash.inp (generated)

047025999.b3lyp_6-31g(d).nwchem.inp (generated) 047025999.b3lyp_6-31g(d).log.xz 047025999.td-b3lyp_6-31g+(d).inp 047025999.td-b3lyp_6-31g+(d).log.xz

047025999.td-b3lyp_6-31+g(d).qchem.inp (generated)

047025999.td-b3lyp_6-31+g(d).gjf (generated)

047025999.td-b3lyp_6-31+g(d).firefly.inp (generated)

047025999.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047025999.mol 047025999.PUBCHEM 047025999.mol (via Jmol)
047026000.b3lyp_6-31g(d).inp

047026000.b3lyp_6-31g(d).qchem.inp (generated)

047026000.b3lyp_6-31g(d).gjf (generated)

047026000.b3lyp_6-31g(d).firefly.inp (generated)

047026000.b3lyp_6-31g(d).smash.inp (generated)

047026000.b3lyp_6-31g(d).nwchem.inp (generated) 047026000.b3lyp_6-31g(d).log.xz 047026000.mol 047026000.PUBCHEM 047026000.mol (via Jmol)
047026001.b3lyp_6-31g(d).inp

047026001.b3lyp_6-31g(d).qchem.inp (generated)

047026001.b3lyp_6-31g(d).gjf (generated)

047026001.b3lyp_6-31g(d).firefly.inp (generated)

047026001.b3lyp_6-31g(d).smash.inp (generated)

047026001.b3lyp_6-31g(d).nwchem.inp (generated) 047026001.b3lyp_6-31g(d).log.xz 047026001.td-b3lyp_6-31g+(d).inp 047026001.td-b3lyp_6-31g+(d).log.xz

047026001.td-b3lyp_6-31+g(d).qchem.inp (generated)

047026001.td-b3lyp_6-31+g(d).gjf (generated)

047026001.td-b3lyp_6-31+g(d).firefly.inp (generated)

047026001.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047026001.mol 047026001.PUBCHEM 047026001.mol (via Jmol)
047026053.b3lyp_6-31g(d).inp

047026053.b3lyp_6-31g(d).qchem.inp (generated)

047026053.b3lyp_6-31g(d).gjf (generated)

047026053.b3lyp_6-31g(d).firefly.inp (generated)

047026053.b3lyp_6-31g(d).smash.inp (generated)

047026053.b3lyp_6-31g(d).nwchem.inp (generated) 047026053.b3lyp_6-31g(d).log.xz 047026053.td-b3lyp_6-31g+(d).inp 047026053.td-b3lyp_6-31g+(d).log.xz

047026053.td-b3lyp_6-31+g(d).qchem.inp (generated)

047026053.td-b3lyp_6-31+g(d).gjf (generated)

047026053.td-b3lyp_6-31+g(d).firefly.inp (generated)

047026053.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047026053.mol 047026053.PUBCHEM 047026053.mol (via Jmol)
047026065.b3lyp_6-31g(d).inp

047026065.b3lyp_6-31g(d).qchem.inp (generated)

047026065.b3lyp_6-31g(d).gjf (generated)

047026065.b3lyp_6-31g(d).firefly.inp (generated)

047026065.b3lyp_6-31g(d).smash.inp (generated)

047026065.b3lyp_6-31g(d).nwchem.inp (generated) 047026065.b3lyp_6-31g(d).log.xz 047026065.td-b3lyp_6-31g+(d).inp 047026065.td-b3lyp_6-31g+(d).log.xz

047026065.td-b3lyp_6-31+g(d).qchem.inp (generated)

047026065.td-b3lyp_6-31+g(d).gjf (generated)

047026065.td-b3lyp_6-31+g(d).firefly.inp (generated)

047026065.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047026065.mol 047026065.PUBCHEM 047026065.mol (via Jmol)
047026070.b3lyp_6-31g(d).inp

047026070.b3lyp_6-31g(d).qchem.inp (generated)

047026070.b3lyp_6-31g(d).gjf (generated)

047026070.b3lyp_6-31g(d).firefly.inp (generated)

047026070.b3lyp_6-31g(d).smash.inp (generated)

047026070.b3lyp_6-31g(d).nwchem.inp (generated) 047026070.b3lyp_6-31g(d).log.xz 047026070.mol 047026070.PUBCHEM 047026070.mol (via Jmol)
047026072.b3lyp_6-31g(d).inp

047026072.b3lyp_6-31g(d).qchem.inp (generated)

047026072.b3lyp_6-31g(d).gjf (generated)

047026072.b3lyp_6-31g(d).firefly.inp (generated)

047026072.b3lyp_6-31g(d).smash.inp (generated)

047026072.b3lyp_6-31g(d).nwchem.inp (generated) 047026072.b3lyp_6-31g(d).log.xz 047026072.td-b3lyp_6-31g+(d).inp 047026072.td-b3lyp_6-31g+(d).log.xz

047026072.td-b3lyp_6-31+g(d).qchem.inp (generated)

047026072.td-b3lyp_6-31+g(d).gjf (generated)

047026072.td-b3lyp_6-31+g(d).firefly.inp (generated)

047026072.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047026072.mol 047026072.PUBCHEM 047026072.mol (via Jmol)
047026077.b3lyp_6-31g(d).inp

047026077.b3lyp_6-31g(d).qchem.inp (generated)

047026077.b3lyp_6-31g(d).gjf (generated)

047026077.b3lyp_6-31g(d).firefly.inp (generated)

047026077.b3lyp_6-31g(d).smash.inp (generated)

047026077.b3lyp_6-31g(d).nwchem.inp (generated) 047026077.b3lyp_6-31g(d).log.xz 047026077.mol 047026077.PUBCHEM 047026077.mol (via Jmol)
047026160.b3lyp_6-31g(d).inp

047026160.b3lyp_6-31g(d).qchem.inp (generated)

047026160.b3lyp_6-31g(d).gjf (generated)

047026160.b3lyp_6-31g(d).firefly.inp (generated)

047026160.b3lyp_6-31g(d).smash.inp (generated)

047026160.b3lyp_6-31g(d).nwchem.inp (generated) 047026160.b3lyp_6-31g(d).log.xz 047026160.mol 047026160.PUBCHEM 047026160.mol (via Jmol)
047026166.b3lyp_6-31g(d).inp

047026166.b3lyp_6-31g(d).qchem.inp (generated)

047026166.b3lyp_6-31g(d).gjf (generated)

047026166.b3lyp_6-31g(d).firefly.inp (generated)

047026166.b3lyp_6-31g(d).smash.inp (generated)

047026166.b3lyp_6-31g(d).nwchem.inp (generated) 047026166.b3lyp_6-31g(d).log.xz 047026166.mol 047026166.PUBCHEM 047026166.mol (via Jmol)
047026171.b3lyp_6-31g(d).inp

047026171.b3lyp_6-31g(d).qchem.inp (generated)

047026171.b3lyp_6-31g(d).gjf (generated)

047026171.b3lyp_6-31g(d).firefly.inp (generated)

047026171.b3lyp_6-31g(d).smash.inp (generated)

047026171.b3lyp_6-31g(d).nwchem.inp (generated) 047026171.b3lyp_6-31g(d).log.xz 047026171.td-b3lyp_6-31g+(d).inp 047026171.td-b3lyp_6-31g+(d).log.xz

047026171.td-b3lyp_6-31+g(d).qchem.inp (generated)

047026171.td-b3lyp_6-31+g(d).gjf (generated)

047026171.td-b3lyp_6-31+g(d).firefly.inp (generated)

047026171.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047026171.mol 047026171.PUBCHEM 047026171.mol (via Jmol)
047026224.b3lyp_6-31g(d).inp

047026224.b3lyp_6-31g(d).qchem.inp (generated)

047026224.b3lyp_6-31g(d).gjf (generated)

047026224.b3lyp_6-31g(d).firefly.inp (generated)

047026224.b3lyp_6-31g(d).smash.inp (generated)

047026224.b3lyp_6-31g(d).nwchem.inp (generated) 047026224.b3lyp_6-31g(d).log.xz 047026224.mol 047026224.PUBCHEM 047026224.mol (via Jmol)
047026265.b3lyp_6-31g(d).inp

047026265.b3lyp_6-31g(d).qchem.inp (generated)

047026265.b3lyp_6-31g(d).gjf (generated)

047026265.b3lyp_6-31g(d).firefly.inp (generated)

047026265.b3lyp_6-31g(d).smash.inp (generated)

047026265.b3lyp_6-31g(d).nwchem.inp (generated) 047026265.b3lyp_6-31g(d).log.xz 047026265.mol 047026265.PUBCHEM 047026265.mol (via Jmol)
047026414.b3lyp_6-31g(d).inp

047026414.b3lyp_6-31g(d).qchem.inp (generated)

047026414.b3lyp_6-31g(d).gjf (generated)

047026414.b3lyp_6-31g(d).firefly.inp (generated)

047026414.b3lyp_6-31g(d).smash.inp (generated)

047026414.b3lyp_6-31g(d).nwchem.inp (generated) 047026414.b3lyp_6-31g(d).log.xz 047026414.td-b3lyp_6-31g+(d).inp 047026414.td-b3lyp_6-31g+(d).log.xz

047026414.td-b3lyp_6-31+g(d).qchem.inp (generated)

047026414.td-b3lyp_6-31+g(d).gjf (generated)

047026414.td-b3lyp_6-31+g(d).firefly.inp (generated)

047026414.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047026414.mol 047026414.PUBCHEM 047026414.mol (via Jmol)
047026462.b3lyp_6-31g(d).inp

047026462.b3lyp_6-31g(d).qchem.inp (generated)

047026462.b3lyp_6-31g(d).gjf (generated)

047026462.b3lyp_6-31g(d).firefly.inp (generated)

047026462.b3lyp_6-31g(d).smash.inp (generated)

047026462.b3lyp_6-31g(d).nwchem.inp (generated) 047026462.b3lyp_6-31g(d).log.xz 047026462.td-b3lyp_6-31g+(d).inp 047026462.td-b3lyp_6-31g+(d).log.xz

047026462.td-b3lyp_6-31+g(d).qchem.inp (generated)

047026462.td-b3lyp_6-31+g(d).gjf (generated)

047026462.td-b3lyp_6-31+g(d).firefly.inp (generated)

047026462.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047026462.mol 047026462.PUBCHEM 047026462.mol (via Jmol)
047026476.b3lyp_6-31g(d).inp

047026476.b3lyp_6-31g(d).qchem.inp (generated)

047026476.b3lyp_6-31g(d).gjf (generated)

047026476.b3lyp_6-31g(d).firefly.inp (generated)

047026476.b3lyp_6-31g(d).smash.inp (generated)

047026476.b3lyp_6-31g(d).nwchem.inp (generated) 047026476.b3lyp_6-31g(d).log.xz 047026476.td-b3lyp_6-31g+(d).inp 047026476.td-b3lyp_6-31g+(d).log.xz

047026476.td-b3lyp_6-31+g(d).qchem.inp (generated)

047026476.td-b3lyp_6-31+g(d).gjf (generated)

047026476.td-b3lyp_6-31+g(d).firefly.inp (generated)

047026476.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047026476.mol 047026476.PUBCHEM 047026476.mol (via Jmol)
047026535.b3lyp_6-31g(d).inp

047026535.b3lyp_6-31g(d).qchem.inp (generated)

047026535.b3lyp_6-31g(d).gjf (generated)

047026535.b3lyp_6-31g(d).firefly.inp (generated)

047026535.b3lyp_6-31g(d).smash.inp (generated)

047026535.b3lyp_6-31g(d).nwchem.inp (generated) 047026535.b3lyp_6-31g(d).log.xz 047026535.td-b3lyp_6-31g+(d).inp 047026535.td-b3lyp_6-31g+(d).log.xz

047026535.td-b3lyp_6-31+g(d).qchem.inp (generated)

047026535.td-b3lyp_6-31+g(d).gjf (generated)

047026535.td-b3lyp_6-31+g(d).firefly.inp (generated)

047026535.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047026535.mol 047026535.PUBCHEM 047026535.mol (via Jmol)
047026631.b3lyp_6-31g(d).inp

047026631.b3lyp_6-31g(d).qchem.inp (generated)

047026631.b3lyp_6-31g(d).gjf (generated)

047026631.b3lyp_6-31g(d).firefly.inp (generated)

047026631.b3lyp_6-31g(d).smash.inp (generated)

047026631.b3lyp_6-31g(d).nwchem.inp (generated) 047026631.b3lyp_6-31g(d).log.xz 047026631.td-b3lyp_6-31g+(d).inp 047026631.td-b3lyp_6-31g+(d).log.xz

047026631.td-b3lyp_6-31+g(d).qchem.inp (generated)

047026631.td-b3lyp_6-31+g(d).gjf (generated)

047026631.td-b3lyp_6-31+g(d).firefly.inp (generated)

047026631.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047026631.mol 047026631.PUBCHEM 047026631.mol (via Jmol)
047026750.b3lyp_6-31g(d).inp

047026750.b3lyp_6-31g(d).qchem.inp (generated)

047026750.b3lyp_6-31g(d).gjf (generated)

047026750.b3lyp_6-31g(d).firefly.inp (generated)

047026750.b3lyp_6-31g(d).smash.inp (generated)

047026750.b3lyp_6-31g(d).nwchem.inp (generated) 047026750.b3lyp_6-31g(d).log.xz 047026750.td-b3lyp_6-31g+(d).inp 047026750.td-b3lyp_6-31g+(d).log.xz

047026750.td-b3lyp_6-31+g(d).qchem.inp (generated)

047026750.td-b3lyp_6-31+g(d).gjf (generated)

047026750.td-b3lyp_6-31+g(d).firefly.inp (generated)

047026750.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047026750.mol 047026750.PUBCHEM 047026750.mol (via Jmol)
047026751.b3lyp_6-31g(d).inp

047026751.b3lyp_6-31g(d).qchem.inp (generated)

047026751.b3lyp_6-31g(d).gjf (generated)

047026751.b3lyp_6-31g(d).firefly.inp (generated)

047026751.b3lyp_6-31g(d).smash.inp (generated)

047026751.b3lyp_6-31g(d).nwchem.inp (generated) 047026751.b3lyp_6-31g(d).log.xz 047026751.mol 047026751.PUBCHEM 047026751.mol (via Jmol)
047026762.b3lyp_6-31g(d).inp

047026762.b3lyp_6-31g(d).qchem.inp (generated)

047026762.b3lyp_6-31g(d).gjf (generated)

047026762.b3lyp_6-31g(d).firefly.inp (generated)

047026762.b3lyp_6-31g(d).smash.inp (generated)

047026762.b3lyp_6-31g(d).nwchem.inp (generated) 047026762.b3lyp_6-31g(d).log.xz 047026762.td-b3lyp_6-31g+(d).inp 047026762.td-b3lyp_6-31g+(d).log.xz

047026762.td-b3lyp_6-31+g(d).qchem.inp (generated)

047026762.td-b3lyp_6-31+g(d).gjf (generated)

047026762.td-b3lyp_6-31+g(d).firefly.inp (generated)

047026762.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047026762.mol 047026762.PUBCHEM 047026762.mol (via Jmol)
047026824.b3lyp_6-31g(d).inp

047026824.b3lyp_6-31g(d).qchem.inp (generated)

047026824.b3lyp_6-31g(d).gjf (generated)

047026824.b3lyp_6-31g(d).firefly.inp (generated)

047026824.b3lyp_6-31g(d).smash.inp (generated)

047026824.b3lyp_6-31g(d).nwchem.inp (generated) 047026824.b3lyp_6-31g(d).log.xz 047026824.td-b3lyp_6-31g+(d).inp 047026824.td-b3lyp_6-31g+(d).log.xz

047026824.td-b3lyp_6-31+g(d).qchem.inp (generated)

047026824.td-b3lyp_6-31+g(d).gjf (generated)

047026824.td-b3lyp_6-31+g(d).firefly.inp (generated)

047026824.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047026824.mol 047026824.PUBCHEM 047026824.mol (via Jmol)
047026827.b3lyp_6-31g(d).inp

047026827.b3lyp_6-31g(d).qchem.inp (generated)

047026827.b3lyp_6-31g(d).gjf (generated)

047026827.b3lyp_6-31g(d).firefly.inp (generated)

047026827.b3lyp_6-31g(d).smash.inp (generated)

047026827.b3lyp_6-31g(d).nwchem.inp (generated) 047026827.b3lyp_6-31g(d).log.xz 047026827.td-b3lyp_6-31g+(d).inp 047026827.td-b3lyp_6-31g+(d).log.xz

047026827.td-b3lyp_6-31+g(d).qchem.inp (generated)

047026827.td-b3lyp_6-31+g(d).gjf (generated)

047026827.td-b3lyp_6-31+g(d).firefly.inp (generated)

047026827.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047026827.mol 047026827.PUBCHEM 047026827.mol (via Jmol)
047026967.b3lyp_6-31g(d).inp

047026967.b3lyp_6-31g(d).qchem.inp (generated)

047026967.b3lyp_6-31g(d).gjf (generated)

047026967.b3lyp_6-31g(d).firefly.inp (generated)

047026967.b3lyp_6-31g(d).smash.inp (generated)

047026967.b3lyp_6-31g(d).nwchem.inp (generated) 047026967.b3lyp_6-31g(d).log.xz 047026967.td-b3lyp_6-31g+(d).inp 047026967.td-b3lyp_6-31g+(d).log.xz

047026967.td-b3lyp_6-31+g(d).qchem.inp (generated)

047026967.td-b3lyp_6-31+g(d).gjf (generated)

047026967.td-b3lyp_6-31+g(d).firefly.inp (generated)

047026967.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047026967.mol 047026967.PUBCHEM 047026967.mol (via Jmol)
047027025.b3lyp_6-31g(d).inp

047027025.b3lyp_6-31g(d).qchem.inp (generated)

047027025.b3lyp_6-31g(d).gjf (generated)

047027025.b3lyp_6-31g(d).firefly.inp (generated)

047027025.b3lyp_6-31g(d).smash.inp (generated)

047027025.b3lyp_6-31g(d).nwchem.inp (generated) 047027025.b3lyp_6-31g(d).log.xz 047027025.td-b3lyp_6-31g+(d).inp 047027025.td-b3lyp_6-31g+(d).log.xz

047027025.td-b3lyp_6-31+g(d).qchem.inp (generated)

047027025.td-b3lyp_6-31+g(d).gjf (generated)

047027025.td-b3lyp_6-31+g(d).firefly.inp (generated)

047027025.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047027025.mol 047027025.PUBCHEM 047027025.mol (via Jmol)
047027335.b3lyp_6-31g(d).inp

047027335.b3lyp_6-31g(d).qchem.inp (generated)

047027335.b3lyp_6-31g(d).gjf (generated)

047027335.b3lyp_6-31g(d).firefly.inp (generated)

047027335.b3lyp_6-31g(d).smash.inp (generated)

047027335.b3lyp_6-31g(d).nwchem.inp (generated) 047027335.b3lyp_6-31g(d).log.xz 047027335.td-b3lyp_6-31g+(d).inp 047027335.td-b3lyp_6-31g+(d).log.xz

047027335.td-b3lyp_6-31+g(d).qchem.inp (generated)

047027335.td-b3lyp_6-31+g(d).gjf (generated)

047027335.td-b3lyp_6-31+g(d).firefly.inp (generated)

047027335.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047027335.mol 047027335.PUBCHEM 047027335.mol (via Jmol)
047027337.b3lyp_6-31g(d).inp

047027337.b3lyp_6-31g(d).qchem.inp (generated)

047027337.b3lyp_6-31g(d).gjf (generated)

047027337.b3lyp_6-31g(d).firefly.inp (generated)

047027337.b3lyp_6-31g(d).smash.inp (generated)

047027337.b3lyp_6-31g(d).nwchem.inp (generated) 047027337.b3lyp_6-31g(d).log.xz 047027337.td-b3lyp_6-31g+(d).inp 047027337.td-b3lyp_6-31g+(d).log.xz

047027337.td-b3lyp_6-31+g(d).qchem.inp (generated)

047027337.td-b3lyp_6-31+g(d).gjf (generated)

047027337.td-b3lyp_6-31+g(d).firefly.inp (generated)

047027337.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047027337.mol 047027337.PUBCHEM 047027337.mol (via Jmol)
047027339.b3lyp_6-31g(d).inp

047027339.b3lyp_6-31g(d).qchem.inp (generated)

047027339.b3lyp_6-31g(d).gjf (generated)

047027339.b3lyp_6-31g(d).firefly.inp (generated)

047027339.b3lyp_6-31g(d).smash.inp (generated)

047027339.b3lyp_6-31g(d).nwchem.inp (generated) 047027339.b3lyp_6-31g(d).log.xz 047027339.td-b3lyp_6-31g+(d).inp 047027339.td-b3lyp_6-31g+(d).log.xz

047027339.td-b3lyp_6-31+g(d).qchem.inp (generated)

047027339.td-b3lyp_6-31+g(d).gjf (generated)

047027339.td-b3lyp_6-31+g(d).firefly.inp (generated)

047027339.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047027339.mol 047027339.PUBCHEM 047027339.mol (via Jmol)
047027342.b3lyp_6-31g(d).inp

047027342.b3lyp_6-31g(d).qchem.inp (generated)

047027342.b3lyp_6-31g(d).gjf (generated)

047027342.b3lyp_6-31g(d).firefly.inp (generated)

047027342.b3lyp_6-31g(d).smash.inp (generated)

047027342.b3lyp_6-31g(d).nwchem.inp (generated) 047027342.b3lyp_6-31g(d).log.xz 047027342.td-b3lyp_6-31g+(d).inp 047027342.td-b3lyp_6-31g+(d).log.xz

047027342.td-b3lyp_6-31+g(d).qchem.inp (generated)

047027342.td-b3lyp_6-31+g(d).gjf (generated)

047027342.td-b3lyp_6-31+g(d).firefly.inp (generated)

047027342.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047027342.mol 047027342.PUBCHEM 047027342.mol (via Jmol)
047027539.b3lyp_6-31g(d).inp

047027539.b3lyp_6-31g(d).qchem.inp (generated)

047027539.b3lyp_6-31g(d).gjf (generated)

047027539.b3lyp_6-31g(d).firefly.inp (generated)

047027539.b3lyp_6-31g(d).smash.inp (generated)

047027539.b3lyp_6-31g(d).nwchem.inp (generated) 047027539.b3lyp_6-31g(d).log.xz 047027539.td-b3lyp_6-31g+(d).inp 047027539.td-b3lyp_6-31g+(d).log.xz

047027539.td-b3lyp_6-31+g(d).qchem.inp (generated)

047027539.td-b3lyp_6-31+g(d).gjf (generated)

047027539.td-b3lyp_6-31+g(d).firefly.inp (generated)

047027539.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047027539.mol 047027539.PUBCHEM 047027539.mol (via Jmol)
047027585.b3lyp_6-31g(d).inp

047027585.b3lyp_6-31g(d).qchem.inp (generated)

047027585.b3lyp_6-31g(d).gjf (generated)

047027585.b3lyp_6-31g(d).firefly.inp (generated)

047027585.b3lyp_6-31g(d).smash.inp (generated)

047027585.b3lyp_6-31g(d).nwchem.inp (generated) 047027585.b3lyp_6-31g(d).log.xz 047027585.td-b3lyp_6-31g+(d).inp 047027585.td-b3lyp_6-31g+(d).log.xz

047027585.td-b3lyp_6-31+g(d).qchem.inp (generated)

047027585.td-b3lyp_6-31+g(d).gjf (generated)

047027585.td-b3lyp_6-31+g(d).firefly.inp (generated)

047027585.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047027585.mol 047027585.PUBCHEM 047027585.mol (via Jmol)
047027597.b3lyp_6-31g(d).inp

047027597.b3lyp_6-31g(d).qchem.inp (generated)

047027597.b3lyp_6-31g(d).gjf (generated)

047027597.b3lyp_6-31g(d).firefly.inp (generated)

047027597.b3lyp_6-31g(d).smash.inp (generated)

047027597.b3lyp_6-31g(d).nwchem.inp (generated) 047027597.b3lyp_6-31g(d).log.xz 047027597.td-b3lyp_6-31g+(d).inp 047027597.td-b3lyp_6-31g+(d).log.xz

047027597.td-b3lyp_6-31+g(d).qchem.inp (generated)

047027597.td-b3lyp_6-31+g(d).gjf (generated)

047027597.td-b3lyp_6-31+g(d).firefly.inp (generated)

047027597.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047027597.mol 047027597.PUBCHEM 047027597.mol (via Jmol)
047027615.b3lyp_6-31g(d).inp

047027615.b3lyp_6-31g(d).qchem.inp (generated)

047027615.b3lyp_6-31g(d).gjf (generated)

047027615.b3lyp_6-31g(d).firefly.inp (generated)

047027615.b3lyp_6-31g(d).smash.inp (generated)

047027615.b3lyp_6-31g(d).nwchem.inp (generated) 047027615.b3lyp_6-31g(d).log.xz 047027615.td-b3lyp_6-31g+(d).inp 047027615.td-b3lyp_6-31g+(d).log.xz

047027615.td-b3lyp_6-31+g(d).qchem.inp (generated)

047027615.td-b3lyp_6-31+g(d).gjf (generated)

047027615.td-b3lyp_6-31+g(d).firefly.inp (generated)

047027615.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047027615.mol 047027615.PUBCHEM 047027615.mol (via Jmol)
047027848.b3lyp_6-31g(d).inp

047027848.b3lyp_6-31g(d).qchem.inp (generated)

047027848.b3lyp_6-31g(d).gjf (generated)

047027848.b3lyp_6-31g(d).firefly.inp (generated)

047027848.b3lyp_6-31g(d).smash.inp (generated)

047027848.b3lyp_6-31g(d).nwchem.inp (generated) 047027848.b3lyp_6-31g(d).log.xz 047027848.td-b3lyp_6-31g+(d).inp 047027848.td-b3lyp_6-31g+(d).log.xz

047027848.td-b3lyp_6-31+g(d).qchem.inp (generated)

047027848.td-b3lyp_6-31+g(d).gjf (generated)

047027848.td-b3lyp_6-31+g(d).firefly.inp (generated)

047027848.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047027848.mol 047027848.PUBCHEM 047027848.mol (via Jmol)
047027880.b3lyp_6-31g(d).inp

047027880.b3lyp_6-31g(d).qchem.inp (generated)

047027880.b3lyp_6-31g(d).gjf (generated)

047027880.b3lyp_6-31g(d).firefly.inp (generated)

047027880.b3lyp_6-31g(d).smash.inp (generated)

047027880.b3lyp_6-31g(d).nwchem.inp (generated) 047027880.b3lyp_6-31g(d).log.xz 047027880.mol 047027880.PUBCHEM 047027880.mol (via Jmol)
047027881.b3lyp_6-31g(d).inp

047027881.b3lyp_6-31g(d).qchem.inp (generated)

047027881.b3lyp_6-31g(d).gjf (generated)

047027881.b3lyp_6-31g(d).firefly.inp (generated)

047027881.b3lyp_6-31g(d).smash.inp (generated)

047027881.b3lyp_6-31g(d).nwchem.inp (generated) 047027881.b3lyp_6-31g(d).log.xz 047027881.mol 047027881.PUBCHEM 047027881.mol (via Jmol)
047027883.b3lyp_6-31g(d).inp

047027883.b3lyp_6-31g(d).qchem.inp (generated)

047027883.b3lyp_6-31g(d).gjf (generated)

047027883.b3lyp_6-31g(d).firefly.inp (generated)

047027883.b3lyp_6-31g(d).smash.inp (generated)

047027883.b3lyp_6-31g(d).nwchem.inp (generated) 047027883.b3lyp_6-31g(d).log.xz 047027883.mol 047027883.PUBCHEM 047027883.mol (via Jmol)
047027888.b3lyp_6-31g(d).inp

047027888.b3lyp_6-31g(d).qchem.inp (generated)

047027888.b3lyp_6-31g(d).gjf (generated)

047027888.b3lyp_6-31g(d).firefly.inp (generated)

047027888.b3lyp_6-31g(d).smash.inp (generated)

047027888.b3lyp_6-31g(d).nwchem.inp (generated) 047027888.b3lyp_6-31g(d).log.xz 047027888.td-b3lyp_6-31g+(d).inp 047027888.td-b3lyp_6-31g+(d).log.xz

047027888.td-b3lyp_6-31+g(d).qchem.inp (generated)

047027888.td-b3lyp_6-31+g(d).gjf (generated)

047027888.td-b3lyp_6-31+g(d).firefly.inp (generated)

047027888.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047027888.mol 047027888.PUBCHEM 047027888.mol (via Jmol)
047027889.b3lyp_6-31g(d).inp

047027889.b3lyp_6-31g(d).qchem.inp (generated)

047027889.b3lyp_6-31g(d).gjf (generated)

047027889.b3lyp_6-31g(d).firefly.inp (generated)

047027889.b3lyp_6-31g(d).smash.inp (generated)

047027889.b3lyp_6-31g(d).nwchem.inp (generated) 047027889.b3lyp_6-31g(d).log.xz 047027889.mol 047027889.PUBCHEM 047027889.mol (via Jmol)
047027937.b3lyp_6-31g(d).inp

047027937.b3lyp_6-31g(d).qchem.inp (generated)

047027937.b3lyp_6-31g(d).gjf (generated)

047027937.b3lyp_6-31g(d).firefly.inp (generated)

047027937.b3lyp_6-31g(d).smash.inp (generated)

047027937.b3lyp_6-31g(d).nwchem.inp (generated) 047027937.b3lyp_6-31g(d).log.xz 047027937.mol 047027937.PUBCHEM 047027937.mol (via Jmol)
047027965.b3lyp_6-31g(d).inp

047027965.b3lyp_6-31g(d).qchem.inp (generated)

047027965.b3lyp_6-31g(d).gjf (generated)

047027965.b3lyp_6-31g(d).firefly.inp (generated)

047027965.b3lyp_6-31g(d).smash.inp (generated)

047027965.b3lyp_6-31g(d).nwchem.inp (generated) 047027965.b3lyp_6-31g(d).log.xz 047027965.mol 047027965.PUBCHEM 047027965.mol (via Jmol)
047028014.b3lyp_6-31g(d).inp

047028014.b3lyp_6-31g(d).qchem.inp (generated)

047028014.b3lyp_6-31g(d).gjf (generated)

047028014.b3lyp_6-31g(d).firefly.inp (generated)

047028014.b3lyp_6-31g(d).smash.inp (generated)

047028014.b3lyp_6-31g(d).nwchem.inp (generated) 047028014.b3lyp_6-31g(d).log.xz 047028014.td-b3lyp_6-31g+(d).inp 047028014.td-b3lyp_6-31g+(d).log.xz

047028014.td-b3lyp_6-31+g(d).qchem.inp (generated)

047028014.td-b3lyp_6-31+g(d).gjf (generated)

047028014.td-b3lyp_6-31+g(d).firefly.inp (generated)

047028014.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047028014.mol 047028014.PUBCHEM 047028014.mol (via Jmol)
047028121.b3lyp_6-31g(d).inp

047028121.b3lyp_6-31g(d).qchem.inp (generated)

047028121.b3lyp_6-31g(d).gjf (generated)

047028121.b3lyp_6-31g(d).firefly.inp (generated)

047028121.b3lyp_6-31g(d).smash.inp (generated)

047028121.b3lyp_6-31g(d).nwchem.inp (generated) 047028121.b3lyp_6-31g(d).log.xz 047028121.td-b3lyp_6-31g+(d).inp 047028121.td-b3lyp_6-31g+(d).log.xz

047028121.td-b3lyp_6-31+g(d).qchem.inp (generated)

047028121.td-b3lyp_6-31+g(d).gjf (generated)

047028121.td-b3lyp_6-31+g(d).firefly.inp (generated)

047028121.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047028121.mol 047028121.PUBCHEM 047028121.mol (via Jmol)
047028186.b3lyp_6-31g(d).inp

047028186.b3lyp_6-31g(d).qchem.inp (generated)

047028186.b3lyp_6-31g(d).gjf (generated)

047028186.b3lyp_6-31g(d).firefly.inp (generated)

047028186.b3lyp_6-31g(d).smash.inp (generated)

047028186.b3lyp_6-31g(d).nwchem.inp (generated) 047028186.b3lyp_6-31g(d).log.xz 047028186.mol 047028186.PUBCHEM 047028186.mol (via Jmol)
047028272.b3lyp_6-31g(d).inp

047028272.b3lyp_6-31g(d).qchem.inp (generated)

047028272.b3lyp_6-31g(d).gjf (generated)

047028272.b3lyp_6-31g(d).firefly.inp (generated)

047028272.b3lyp_6-31g(d).smash.inp (generated)

047028272.b3lyp_6-31g(d).nwchem.inp (generated) 047028272.b3lyp_6-31g(d).log.xz 047028272.td-b3lyp_6-31g+(d).inp 047028272.td-b3lyp_6-31g+(d).log.xz

047028272.td-b3lyp_6-31+g(d).qchem.inp (generated)

047028272.td-b3lyp_6-31+g(d).gjf (generated)

047028272.td-b3lyp_6-31+g(d).firefly.inp (generated)

047028272.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047028272.mol 047028272.PUBCHEM 047028272.mol (via Jmol)
047028316.b3lyp_6-31g(d).inp

047028316.b3lyp_6-31g(d).qchem.inp (generated)

047028316.b3lyp_6-31g(d).gjf (generated)

047028316.b3lyp_6-31g(d).firefly.inp (generated)

047028316.b3lyp_6-31g(d).smash.inp (generated)

047028316.b3lyp_6-31g(d).nwchem.inp (generated) 047028316.b3lyp_6-31g(d).log.xz 047028316.mol 047028316.PUBCHEM 047028316.mol (via Jmol)
047028334.b3lyp_6-31g(d).inp

047028334.b3lyp_6-31g(d).qchem.inp (generated)

047028334.b3lyp_6-31g(d).gjf (generated)

047028334.b3lyp_6-31g(d).firefly.inp (generated)

047028334.b3lyp_6-31g(d).smash.inp (generated)

047028334.b3lyp_6-31g(d).nwchem.inp (generated) 047028334.b3lyp_6-31g(d).log.xz 047028334.mol 047028334.PUBCHEM 047028334.mol (via Jmol)
047028339.b3lyp_6-31g(d).inp

047028339.b3lyp_6-31g(d).qchem.inp (generated)

047028339.b3lyp_6-31g(d).gjf (generated)

047028339.b3lyp_6-31g(d).firefly.inp (generated)

047028339.b3lyp_6-31g(d).smash.inp (generated)

047028339.b3lyp_6-31g(d).nwchem.inp (generated) 047028339.b3lyp_6-31g(d).log.xz 047028339.td-b3lyp_6-31g+(d).inp 047028339.td-b3lyp_6-31g+(d).log.xz

047028339.td-b3lyp_6-31+g(d).qchem.inp (generated)

047028339.td-b3lyp_6-31+g(d).gjf (generated)

047028339.td-b3lyp_6-31+g(d).firefly.inp (generated)

047028339.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047028339.mol 047028339.PUBCHEM 047028339.mol (via Jmol)
047028357.b3lyp_6-31g(d).inp

047028357.b3lyp_6-31g(d).qchem.inp (generated)

047028357.b3lyp_6-31g(d).gjf (generated)

047028357.b3lyp_6-31g(d).firefly.inp (generated)

047028357.b3lyp_6-31g(d).smash.inp (generated)

047028357.b3lyp_6-31g(d).nwchem.inp (generated) 047028357.b3lyp_6-31g(d).log.xz 047028357.td-b3lyp_6-31g+(d).inp 047028357.td-b3lyp_6-31g+(d).log.xz

047028357.td-b3lyp_6-31+g(d).qchem.inp (generated)

047028357.td-b3lyp_6-31+g(d).gjf (generated)

047028357.td-b3lyp_6-31+g(d).firefly.inp (generated)

047028357.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047028357.mol 047028357.PUBCHEM 047028357.mol (via Jmol)
047028363.b3lyp_6-31g(d).inp

047028363.b3lyp_6-31g(d).qchem.inp (generated)

047028363.b3lyp_6-31g(d).gjf (generated)

047028363.b3lyp_6-31g(d).firefly.inp (generated)

047028363.b3lyp_6-31g(d).smash.inp (generated)

047028363.b3lyp_6-31g(d).nwchem.inp (generated) 047028363.b3lyp_6-31g(d).log.xz 047028363.td-b3lyp_6-31g+(d).inp 047028363.td-b3lyp_6-31g+(d).log.xz

047028363.td-b3lyp_6-31+g(d).qchem.inp (generated)

047028363.td-b3lyp_6-31+g(d).gjf (generated)

047028363.td-b3lyp_6-31+g(d).firefly.inp (generated)

047028363.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047028363.mol 047028363.PUBCHEM 047028363.mol (via Jmol)
047028369.b3lyp_6-31g(d).inp

047028369.b3lyp_6-31g(d).qchem.inp (generated)

047028369.b3lyp_6-31g(d).gjf (generated)

047028369.b3lyp_6-31g(d).firefly.inp (generated)

047028369.b3lyp_6-31g(d).smash.inp (generated)

047028369.b3lyp_6-31g(d).nwchem.inp (generated) 047028369.b3lyp_6-31g(d).log.xz 047028369.td-b3lyp_6-31g+(d).inp 047028369.td-b3lyp_6-31g+(d).log.xz

047028369.td-b3lyp_6-31+g(d).qchem.inp (generated)

047028369.td-b3lyp_6-31+g(d).gjf (generated)

047028369.td-b3lyp_6-31+g(d).firefly.inp (generated)

047028369.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047028369.mol 047028369.PUBCHEM 047028369.mol (via Jmol)
047028372.b3lyp_6-31g(d).inp

047028372.b3lyp_6-31g(d).qchem.inp (generated)

047028372.b3lyp_6-31g(d).gjf (generated)

047028372.b3lyp_6-31g(d).firefly.inp (generated)

047028372.b3lyp_6-31g(d).smash.inp (generated)

047028372.b3lyp_6-31g(d).nwchem.inp (generated) 047028372.b3lyp_6-31g(d).log.xz 047028372.mol 047028372.PUBCHEM 047028372.mol (via Jmol)
047028433.b3lyp_6-31g(d).inp

047028433.b3lyp_6-31g(d).qchem.inp (generated)

047028433.b3lyp_6-31g(d).gjf (generated)

047028433.b3lyp_6-31g(d).firefly.inp (generated)

047028433.b3lyp_6-31g(d).smash.inp (generated)

047028433.b3lyp_6-31g(d).nwchem.inp (generated) 047028433.b3lyp_6-31g(d).log.xz 047028433.td-b3lyp_6-31g+(d).inp 047028433.td-b3lyp_6-31g+(d).log.xz

047028433.td-b3lyp_6-31+g(d).qchem.inp (generated)

047028433.td-b3lyp_6-31+g(d).gjf (generated)

047028433.td-b3lyp_6-31+g(d).firefly.inp (generated)

047028433.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047028433.mol 047028433.PUBCHEM 047028433.mol (via Jmol)
047028462.b3lyp_6-31g(d).inp

047028462.b3lyp_6-31g(d).qchem.inp (generated)

047028462.b3lyp_6-31g(d).gjf (generated)

047028462.b3lyp_6-31g(d).firefly.inp (generated)

047028462.b3lyp_6-31g(d).smash.inp (generated)

047028462.b3lyp_6-31g(d).nwchem.inp (generated) 047028462.b3lyp_6-31g(d).log.xz 047028462.td-b3lyp_6-31g+(d).inp 047028462.td-b3lyp_6-31g+(d).log.xz

047028462.td-b3lyp_6-31+g(d).qchem.inp (generated)

047028462.td-b3lyp_6-31+g(d).gjf (generated)

047028462.td-b3lyp_6-31+g(d).firefly.inp (generated)

047028462.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047028462.mol 047028462.PUBCHEM 047028462.mol (via Jmol)
047028490.b3lyp_6-31g(d).inp

047028490.b3lyp_6-31g(d).qchem.inp (generated)

047028490.b3lyp_6-31g(d).gjf (generated)

047028490.b3lyp_6-31g(d).firefly.inp (generated)

047028490.b3lyp_6-31g(d).smash.inp (generated)

047028490.b3lyp_6-31g(d).nwchem.inp (generated) 047028490.b3lyp_6-31g(d).log.xz 047028490.td-b3lyp_6-31g+(d).inp 047028490.td-b3lyp_6-31g+(d).log.xz

047028490.td-b3lyp_6-31+g(d).qchem.inp (generated)

047028490.td-b3lyp_6-31+g(d).gjf (generated)

047028490.td-b3lyp_6-31+g(d).firefly.inp (generated)

047028490.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047028490.mol 047028490.PUBCHEM 047028490.mol (via Jmol)
047028541.b3lyp_6-31g(d).inp

047028541.b3lyp_6-31g(d).qchem.inp (generated)

047028541.b3lyp_6-31g(d).gjf (generated)

047028541.b3lyp_6-31g(d).firefly.inp (generated)

047028541.b3lyp_6-31g(d).smash.inp (generated)

047028541.b3lyp_6-31g(d).nwchem.inp (generated) 047028541.b3lyp_6-31g(d).log.xz 047028541.mol 047028541.PUBCHEM 047028541.mol (via Jmol)
047028544.b3lyp_6-31g(d).inp

047028544.b3lyp_6-31g(d).qchem.inp (generated)

047028544.b3lyp_6-31g(d).gjf (generated)

047028544.b3lyp_6-31g(d).firefly.inp (generated)

047028544.b3lyp_6-31g(d).smash.inp (generated)

047028544.b3lyp_6-31g(d).nwchem.inp (generated) 047028544.b3lyp_6-31g(d).log.xz 047028544.td-b3lyp_6-31g+(d).inp 047028544.td-b3lyp_6-31g+(d).log.xz

047028544.td-b3lyp_6-31+g(d).qchem.inp (generated)

047028544.td-b3lyp_6-31+g(d).gjf (generated)

047028544.td-b3lyp_6-31+g(d).firefly.inp (generated)

047028544.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047028544.mol 047028544.PUBCHEM 047028544.mol (via Jmol)
047028560.b3lyp_6-31g(d).inp

047028560.b3lyp_6-31g(d).qchem.inp (generated)

047028560.b3lyp_6-31g(d).gjf (generated)

047028560.b3lyp_6-31g(d).firefly.inp (generated)

047028560.b3lyp_6-31g(d).smash.inp (generated)

047028560.b3lyp_6-31g(d).nwchem.inp (generated) 047028560.b3lyp_6-31g(d).log.xz 047028560.td-b3lyp_6-31g+(d).inp 047028560.td-b3lyp_6-31g+(d).log.xz

047028560.td-b3lyp_6-31+g(d).qchem.inp (generated)

047028560.td-b3lyp_6-31+g(d).gjf (generated)

047028560.td-b3lyp_6-31+g(d).firefly.inp (generated)

047028560.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047028560.mol 047028560.PUBCHEM 047028560.mol (via Jmol)
047028749.b3lyp_6-31g(d).inp

047028749.b3lyp_6-31g(d).qchem.inp (generated)

047028749.b3lyp_6-31g(d).gjf (generated)

047028749.b3lyp_6-31g(d).firefly.inp (generated)

047028749.b3lyp_6-31g(d).smash.inp (generated)

047028749.b3lyp_6-31g(d).nwchem.inp (generated) 047028749.b3lyp_6-31g(d).log.xz 047028749.td-b3lyp_6-31g+(d).inp 047028749.td-b3lyp_6-31g+(d).log.xz

047028749.td-b3lyp_6-31+g(d).qchem.inp (generated)

047028749.td-b3lyp_6-31+g(d).gjf (generated)

047028749.td-b3lyp_6-31+g(d).firefly.inp (generated)

047028749.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047028749.mol 047028749.PUBCHEM 047028749.mol (via Jmol)
047028761.b3lyp_6-31g(d).inp

047028761.b3lyp_6-31g(d).qchem.inp (generated)

047028761.b3lyp_6-31g(d).gjf (generated)

047028761.b3lyp_6-31g(d).firefly.inp (generated)

047028761.b3lyp_6-31g(d).smash.inp (generated)

047028761.b3lyp_6-31g(d).nwchem.inp (generated) 047028761.b3lyp_6-31g(d).log.xz 047028761.td-b3lyp_6-31g+(d).inp 047028761.td-b3lyp_6-31g+(d).log.xz

047028761.td-b3lyp_6-31+g(d).qchem.inp (generated)

047028761.td-b3lyp_6-31+g(d).gjf (generated)

047028761.td-b3lyp_6-31+g(d).firefly.inp (generated)

047028761.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047028761.mol 047028761.PUBCHEM 047028761.mol (via Jmol)
047028764.b3lyp_6-31g(d).inp

047028764.b3lyp_6-31g(d).qchem.inp (generated)

047028764.b3lyp_6-31g(d).gjf (generated)

047028764.b3lyp_6-31g(d).firefly.inp (generated)

047028764.b3lyp_6-31g(d).smash.inp (generated)

047028764.b3lyp_6-31g(d).nwchem.inp (generated) 047028764.b3lyp_6-31g(d).log.xz 047028764.mol 047028764.PUBCHEM 047028764.mol (via Jmol)
047028774.b3lyp_6-31g(d).inp

047028774.b3lyp_6-31g(d).qchem.inp (generated)

047028774.b3lyp_6-31g(d).gjf (generated)

047028774.b3lyp_6-31g(d).firefly.inp (generated)

047028774.b3lyp_6-31g(d).smash.inp (generated)

047028774.b3lyp_6-31g(d).nwchem.inp (generated) 047028774.b3lyp_6-31g(d).log.xz 047028774.td-b3lyp_6-31g+(d).inp 047028774.td-b3lyp_6-31g+(d).log.xz

047028774.td-b3lyp_6-31+g(d).qchem.inp (generated)

047028774.td-b3lyp_6-31+g(d).gjf (generated)

047028774.td-b3lyp_6-31+g(d).firefly.inp (generated)

047028774.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047028774.mol 047028774.PUBCHEM 047028774.mol (via Jmol)
047028775.b3lyp_6-31g(d).inp

047028775.b3lyp_6-31g(d).qchem.inp (generated)

047028775.b3lyp_6-31g(d).gjf (generated)

047028775.b3lyp_6-31g(d).firefly.inp (generated)

047028775.b3lyp_6-31g(d).smash.inp (generated)

047028775.b3lyp_6-31g(d).nwchem.inp (generated) 047028775.b3lyp_6-31g(d).log.xz 047028775.td-b3lyp_6-31g+(d).inp 047028775.td-b3lyp_6-31g+(d).log.xz

047028775.td-b3lyp_6-31+g(d).qchem.inp (generated)

047028775.td-b3lyp_6-31+g(d).gjf (generated)

047028775.td-b3lyp_6-31+g(d).firefly.inp (generated)

047028775.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047028775.mol 047028775.PUBCHEM 047028775.mol (via Jmol)
047028776.b3lyp_6-31g(d).inp

047028776.b3lyp_6-31g(d).qchem.inp (generated)

047028776.b3lyp_6-31g(d).gjf (generated)

047028776.b3lyp_6-31g(d).firefly.inp (generated)

047028776.b3lyp_6-31g(d).smash.inp (generated)

047028776.b3lyp_6-31g(d).nwchem.inp (generated) 047028776.b3lyp_6-31g(d).log.xz 047028776.mol 047028776.PUBCHEM 047028776.mol (via Jmol)
047028777.b3lyp_6-31g(d).inp

047028777.b3lyp_6-31g(d).qchem.inp (generated)

047028777.b3lyp_6-31g(d).gjf (generated)

047028777.b3lyp_6-31g(d).firefly.inp (generated)

047028777.b3lyp_6-31g(d).smash.inp (generated)

047028777.b3lyp_6-31g(d).nwchem.inp (generated) 047028777.b3lyp_6-31g(d).log.xz 047028777.td-b3lyp_6-31g+(d).inp 047028777.td-b3lyp_6-31g+(d).log.xz

047028777.td-b3lyp_6-31+g(d).qchem.inp (generated)

047028777.td-b3lyp_6-31+g(d).gjf (generated)

047028777.td-b3lyp_6-31+g(d).firefly.inp (generated)

047028777.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047028777.mol 047028777.PUBCHEM 047028777.mol (via Jmol)
047028779.b3lyp_6-31g(d).inp

047028779.b3lyp_6-31g(d).qchem.inp (generated)

047028779.b3lyp_6-31g(d).gjf (generated)

047028779.b3lyp_6-31g(d).firefly.inp (generated)

047028779.b3lyp_6-31g(d).smash.inp (generated)

047028779.b3lyp_6-31g(d).nwchem.inp (generated) 047028779.b3lyp_6-31g(d).log.xz 047028779.td-b3lyp_6-31g+(d).inp 047028779.td-b3lyp_6-31g+(d).log.xz

047028779.td-b3lyp_6-31+g(d).qchem.inp (generated)

047028779.td-b3lyp_6-31+g(d).gjf (generated)

047028779.td-b3lyp_6-31+g(d).firefly.inp (generated)

047028779.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047028779.mol 047028779.PUBCHEM 047028779.mol (via Jmol)
047028790.b3lyp_6-31g(d).inp

047028790.b3lyp_6-31g(d).qchem.inp (generated)

047028790.b3lyp_6-31g(d).gjf (generated)

047028790.b3lyp_6-31g(d).firefly.inp (generated)

047028790.b3lyp_6-31g(d).smash.inp (generated)

047028790.b3lyp_6-31g(d).nwchem.inp (generated) 047028790.b3lyp_6-31g(d).log.xz 047028790.td-b3lyp_6-31g+(d).inp 047028790.td-b3lyp_6-31g+(d).log.xz

047028790.td-b3lyp_6-31+g(d).qchem.inp (generated)

047028790.td-b3lyp_6-31+g(d).gjf (generated)

047028790.td-b3lyp_6-31+g(d).firefly.inp (generated)

047028790.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047028790.mol 047028790.PUBCHEM 047028790.mol (via Jmol)
047028833.b3lyp_6-31g(d).inp

047028833.b3lyp_6-31g(d).qchem.inp (generated)

047028833.b3lyp_6-31g(d).gjf (generated)

047028833.b3lyp_6-31g(d).firefly.inp (generated)

047028833.b3lyp_6-31g(d).smash.inp (generated)

047028833.b3lyp_6-31g(d).nwchem.inp (generated) 047028833.b3lyp_6-31g(d).log.xz 047028833.td-b3lyp_6-31g+(d).inp 047028833.td-b3lyp_6-31g+(d).log.xz

047028833.td-b3lyp_6-31+g(d).qchem.inp (generated)

047028833.td-b3lyp_6-31+g(d).gjf (generated)

047028833.td-b3lyp_6-31+g(d).firefly.inp (generated)

047028833.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047028833.mol 047028833.PUBCHEM 047028833.mol (via Jmol)
047029032.b3lyp_6-31g(d).inp

047029032.b3lyp_6-31g(d).qchem.inp (generated)

047029032.b3lyp_6-31g(d).gjf (generated)

047029032.b3lyp_6-31g(d).firefly.inp (generated)

047029032.b3lyp_6-31g(d).smash.inp (generated)

047029032.b3lyp_6-31g(d).nwchem.inp (generated) 047029032.b3lyp_6-31g(d).log.xz 047029032.td-b3lyp_6-31g+(d).inp 047029032.td-b3lyp_6-31g+(d).log.xz

047029032.td-b3lyp_6-31+g(d).qchem.inp (generated)

047029032.td-b3lyp_6-31+g(d).gjf (generated)

047029032.td-b3lyp_6-31+g(d).firefly.inp (generated)

047029032.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047029032.mol 047029032.PUBCHEM 047029032.mol (via Jmol)
047029033.b3lyp_6-31g(d).inp

047029033.b3lyp_6-31g(d).qchem.inp (generated)

047029033.b3lyp_6-31g(d).gjf (generated)

047029033.b3lyp_6-31g(d).firefly.inp (generated)

047029033.b3lyp_6-31g(d).smash.inp (generated)

047029033.b3lyp_6-31g(d).nwchem.inp (generated) 047029033.b3lyp_6-31g(d).log.xz 047029033.mol 047029033.PUBCHEM 047029033.mol (via Jmol)
047029034.b3lyp_6-31g(d).inp

047029034.b3lyp_6-31g(d).qchem.inp (generated)

047029034.b3lyp_6-31g(d).gjf (generated)

047029034.b3lyp_6-31g(d).firefly.inp (generated)

047029034.b3lyp_6-31g(d).smash.inp (generated)

047029034.b3lyp_6-31g(d).nwchem.inp (generated) 047029034.b3lyp_6-31g(d).log.xz 047029034.td-b3lyp_6-31g+(d).inp 047029034.td-b3lyp_6-31g+(d).log.xz

047029034.td-b3lyp_6-31+g(d).qchem.inp (generated)

047029034.td-b3lyp_6-31+g(d).gjf (generated)

047029034.td-b3lyp_6-31+g(d).firefly.inp (generated)

047029034.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047029034.mol 047029034.PUBCHEM 047029034.mol (via Jmol)
047029067.b3lyp_6-31g(d).inp

047029067.b3lyp_6-31g(d).qchem.inp (generated)

047029067.b3lyp_6-31g(d).gjf (generated)

047029067.b3lyp_6-31g(d).firefly.inp (generated)

047029067.b3lyp_6-31g(d).smash.inp (generated)

047029067.b3lyp_6-31g(d).nwchem.inp (generated) 047029067.b3lyp_6-31g(d).log.xz 047029067.td-b3lyp_6-31g+(d).inp 047029067.td-b3lyp_6-31g+(d).log.xz

047029067.td-b3lyp_6-31+g(d).qchem.inp (generated)

047029067.td-b3lyp_6-31+g(d).gjf (generated)

047029067.td-b3lyp_6-31+g(d).firefly.inp (generated)

047029067.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047029067.mol 047029067.PUBCHEM 047029067.mol (via Jmol)
047029382.b3lyp_6-31g(d).inp

047029382.b3lyp_6-31g(d).qchem.inp (generated)

047029382.b3lyp_6-31g(d).gjf (generated)

047029382.b3lyp_6-31g(d).firefly.inp (generated)

047029382.b3lyp_6-31g(d).smash.inp (generated)

047029382.b3lyp_6-31g(d).nwchem.inp (generated) 047029382.b3lyp_6-31g(d).log.xz 047029382.td-b3lyp_6-31g+(d).inp 047029382.td-b3lyp_6-31g+(d).log.xz

047029382.td-b3lyp_6-31+g(d).qchem.inp (generated)

047029382.td-b3lyp_6-31+g(d).gjf (generated)

047029382.td-b3lyp_6-31+g(d).firefly.inp (generated)

047029382.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047029382.mol 047029382.PUBCHEM 047029382.mol (via Jmol)
047029668.b3lyp_6-31g(d).inp

047029668.b3lyp_6-31g(d).qchem.inp (generated)

047029668.b3lyp_6-31g(d).gjf (generated)

047029668.b3lyp_6-31g(d).firefly.inp (generated)

047029668.b3lyp_6-31g(d).smash.inp (generated)

047029668.b3lyp_6-31g(d).nwchem.inp (generated) 047029668.b3lyp_6-31g(d).log.xz 047029668.mol 047029668.PUBCHEM 047029668.mol (via Jmol)
047029672.b3lyp_6-31g(d).inp

047029672.b3lyp_6-31g(d).qchem.inp (generated)

047029672.b3lyp_6-31g(d).gjf (generated)

047029672.b3lyp_6-31g(d).firefly.inp (generated)

047029672.b3lyp_6-31g(d).smash.inp (generated)

047029672.b3lyp_6-31g(d).nwchem.inp (generated) 047029672.b3lyp_6-31g(d).log.xz 047029672.td-b3lyp_6-31g+(d).inp 047029672.td-b3lyp_6-31g+(d).log.xz

047029672.td-b3lyp_6-31+g(d).qchem.inp (generated)

047029672.td-b3lyp_6-31+g(d).gjf (generated)

047029672.td-b3lyp_6-31+g(d).firefly.inp (generated)

047029672.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047029672.mol 047029672.PUBCHEM 047029672.mol (via Jmol)
047029673.b3lyp_6-31g(d).inp

047029673.b3lyp_6-31g(d).qchem.inp (generated)

047029673.b3lyp_6-31g(d).gjf (generated)

047029673.b3lyp_6-31g(d).firefly.inp (generated)

047029673.b3lyp_6-31g(d).smash.inp (generated)

047029673.b3lyp_6-31g(d).nwchem.inp (generated) 047029673.b3lyp_6-31g(d).log.xz 047029673.td-b3lyp_6-31g+(d).inp 047029673.td-b3lyp_6-31g+(d).log.xz

047029673.td-b3lyp_6-31+g(d).qchem.inp (generated)

047029673.td-b3lyp_6-31+g(d).gjf (generated)

047029673.td-b3lyp_6-31+g(d).firefly.inp (generated)

047029673.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047029673.mol 047029673.PUBCHEM 047029673.mol (via Jmol)
047029683.b3lyp_6-31g(d).inp

047029683.b3lyp_6-31g(d).qchem.inp (generated)

047029683.b3lyp_6-31g(d).gjf (generated)

047029683.b3lyp_6-31g(d).firefly.inp (generated)

047029683.b3lyp_6-31g(d).smash.inp (generated)

047029683.b3lyp_6-31g(d).nwchem.inp (generated) 047029683.b3lyp_6-31g(d).log.xz 047029683.mol 047029683.PUBCHEM 047029683.mol (via Jmol)
047029688.b3lyp_6-31g(d).inp

047029688.b3lyp_6-31g(d).qchem.inp (generated)

047029688.b3lyp_6-31g(d).gjf (generated)

047029688.b3lyp_6-31g(d).firefly.inp (generated)

047029688.b3lyp_6-31g(d).smash.inp (generated)

047029688.b3lyp_6-31g(d).nwchem.inp (generated) 047029688.b3lyp_6-31g(d).log.xz 047029688.td-b3lyp_6-31g+(d).inp 047029688.td-b3lyp_6-31g+(d).log.xz

047029688.td-b3lyp_6-31+g(d).qchem.inp (generated)

047029688.td-b3lyp_6-31+g(d).gjf (generated)

047029688.td-b3lyp_6-31+g(d).firefly.inp (generated)

047029688.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047029688.mol 047029688.PUBCHEM 047029688.mol (via Jmol)
047029733.b3lyp_6-31g(d).inp

047029733.b3lyp_6-31g(d).qchem.inp (generated)

047029733.b3lyp_6-31g(d).gjf (generated)

047029733.b3lyp_6-31g(d).firefly.inp (generated)

047029733.b3lyp_6-31g(d).smash.inp (generated)

047029733.b3lyp_6-31g(d).nwchem.inp (generated) 047029733.b3lyp_6-31g(d).log.xz 047029733.td-b3lyp_6-31g+(d).inp 047029733.td-b3lyp_6-31g+(d).log.xz

047029733.td-b3lyp_6-31+g(d).qchem.inp (generated)

047029733.td-b3lyp_6-31+g(d).gjf (generated)

047029733.td-b3lyp_6-31+g(d).firefly.inp (generated)

047029733.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047029733.mol 047029733.PUBCHEM 047029733.mol (via Jmol)
047029739.b3lyp_6-31g(d).inp

047029739.b3lyp_6-31g(d).qchem.inp (generated)

047029739.b3lyp_6-31g(d).gjf (generated)

047029739.b3lyp_6-31g(d).firefly.inp (generated)

047029739.b3lyp_6-31g(d).smash.inp (generated)

047029739.b3lyp_6-31g(d).nwchem.inp (generated) 047029739.b3lyp_6-31g(d).log.xz 047029739.td-b3lyp_6-31g+(d).inp 047029739.td-b3lyp_6-31g+(d).log.xz

047029739.td-b3lyp_6-31+g(d).qchem.inp (generated)

047029739.td-b3lyp_6-31+g(d).gjf (generated)

047029739.td-b3lyp_6-31+g(d).firefly.inp (generated)

047029739.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047029739.mol 047029739.PUBCHEM 047029739.mol (via Jmol)
047029800.b3lyp_6-31g(d).inp

047029800.b3lyp_6-31g(d).qchem.inp (generated)

047029800.b3lyp_6-31g(d).gjf (generated)

047029800.b3lyp_6-31g(d).firefly.inp (generated)

047029800.b3lyp_6-31g(d).smash.inp (generated)

047029800.b3lyp_6-31g(d).nwchem.inp (generated) 047029800.b3lyp_6-31g(d).log.xz 047029800.td-b3lyp_6-31g+(d).inp 047029800.td-b3lyp_6-31g+(d).log.xz

047029800.td-b3lyp_6-31+g(d).qchem.inp (generated)

047029800.td-b3lyp_6-31+g(d).gjf (generated)

047029800.td-b3lyp_6-31+g(d).firefly.inp (generated)

047029800.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047029800.mol 047029800.PUBCHEM 047029800.mol (via Jmol)
047029801.b3lyp_6-31g(d).inp

047029801.b3lyp_6-31g(d).qchem.inp (generated)

047029801.b3lyp_6-31g(d).gjf (generated)

047029801.b3lyp_6-31g(d).firefly.inp (generated)

047029801.b3lyp_6-31g(d).smash.inp (generated)

047029801.b3lyp_6-31g(d).nwchem.inp (generated) 047029801.b3lyp_6-31g(d).log.xz 047029801.td-b3lyp_6-31g+(d).inp 047029801.td-b3lyp_6-31g+(d).log.xz

047029801.td-b3lyp_6-31+g(d).qchem.inp (generated)

047029801.td-b3lyp_6-31+g(d).gjf (generated)

047029801.td-b3lyp_6-31+g(d).firefly.inp (generated)

047029801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047029801.mol 047029801.PUBCHEM 047029801.mol (via Jmol)
047029802.b3lyp_6-31g(d).inp

047029802.b3lyp_6-31g(d).qchem.inp (generated)

047029802.b3lyp_6-31g(d).gjf (generated)

047029802.b3lyp_6-31g(d).firefly.inp (generated)

047029802.b3lyp_6-31g(d).smash.inp (generated)

047029802.b3lyp_6-31g(d).nwchem.inp (generated) 047029802.b3lyp_6-31g(d).log.xz 047029802.mol 047029802.PUBCHEM 047029802.mol (via Jmol)
047029856.b3lyp_6-31g(d).inp

047029856.b3lyp_6-31g(d).qchem.inp (generated)

047029856.b3lyp_6-31g(d).gjf (generated)

047029856.b3lyp_6-31g(d).firefly.inp (generated)

047029856.b3lyp_6-31g(d).smash.inp (generated)

047029856.b3lyp_6-31g(d).nwchem.inp (generated) 047029856.b3lyp_6-31g(d).log.xz 047029856.td-b3lyp_6-31g+(d).inp 047029856.td-b3lyp_6-31g+(d).log.xz

047029856.td-b3lyp_6-31+g(d).qchem.inp (generated)

047029856.td-b3lyp_6-31+g(d).gjf (generated)

047029856.td-b3lyp_6-31+g(d).firefly.inp (generated)

047029856.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047029856.mol 047029856.PUBCHEM 047029856.mol (via Jmol)
047030121.b3lyp_6-31g(d).inp

047030121.b3lyp_6-31g(d).qchem.inp (generated)

047030121.b3lyp_6-31g(d).gjf (generated)

047030121.b3lyp_6-31g(d).firefly.inp (generated)

047030121.b3lyp_6-31g(d).smash.inp (generated)

047030121.b3lyp_6-31g(d).nwchem.inp (generated) 047030121.b3lyp_6-31g(d).log.xz 047030121.td-b3lyp_6-31g+(d).inp 047030121.td-b3lyp_6-31g+(d).log.xz

047030121.td-b3lyp_6-31+g(d).qchem.inp (generated)

047030121.td-b3lyp_6-31+g(d).gjf (generated)

047030121.td-b3lyp_6-31+g(d).firefly.inp (generated)

047030121.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047030121.mol 047030121.PUBCHEM 047030121.mol (via Jmol)
047030152.b3lyp_6-31g(d).inp

047030152.b3lyp_6-31g(d).qchem.inp (generated)

047030152.b3lyp_6-31g(d).gjf (generated)

047030152.b3lyp_6-31g(d).firefly.inp (generated)

047030152.b3lyp_6-31g(d).smash.inp (generated)

047030152.b3lyp_6-31g(d).nwchem.inp (generated) 047030152.b3lyp_6-31g(d).log.xz 047030152.td-b3lyp_6-31g+(d).inp 047030152.td-b3lyp_6-31g+(d).log.xz

047030152.td-b3lyp_6-31+g(d).qchem.inp (generated)

047030152.td-b3lyp_6-31+g(d).gjf (generated)

047030152.td-b3lyp_6-31+g(d).firefly.inp (generated)

047030152.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047030152.mol 047030152.PUBCHEM 047030152.mol (via Jmol)
047030265.b3lyp_6-31g(d).inp

047030265.b3lyp_6-31g(d).qchem.inp (generated)

047030265.b3lyp_6-31g(d).gjf (generated)

047030265.b3lyp_6-31g(d).firefly.inp (generated)

047030265.b3lyp_6-31g(d).smash.inp (generated)

047030265.b3lyp_6-31g(d).nwchem.inp (generated) 047030265.b3lyp_6-31g(d).log.xz 047030265.mol 047030265.PUBCHEM 047030265.mol (via Jmol)
047030767.b3lyp_6-31g(d).inp

047030767.b3lyp_6-31g(d).qchem.inp (generated)

047030767.b3lyp_6-31g(d).gjf (generated)

047030767.b3lyp_6-31g(d).firefly.inp (generated)

047030767.b3lyp_6-31g(d).smash.inp (generated)

047030767.b3lyp_6-31g(d).nwchem.inp (generated) 047030767.b3lyp_6-31g(d).log.xz 047030767.td-b3lyp_6-31g+(d).inp 047030767.td-b3lyp_6-31g+(d).log.xz

047030767.td-b3lyp_6-31+g(d).qchem.inp (generated)

047030767.td-b3lyp_6-31+g(d).gjf (generated)

047030767.td-b3lyp_6-31+g(d).firefly.inp (generated)

047030767.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047030767.mol 047030767.PUBCHEM 047030767.mol (via Jmol)
047030798.b3lyp_6-31g(d).inp

047030798.b3lyp_6-31g(d).qchem.inp (generated)

047030798.b3lyp_6-31g(d).gjf (generated)

047030798.b3lyp_6-31g(d).firefly.inp (generated)

047030798.b3lyp_6-31g(d).smash.inp (generated)

047030798.b3lyp_6-31g(d).nwchem.inp (generated) 047030798.b3lyp_6-31g(d).log.xz 047030798.td-b3lyp_6-31g+(d).inp 047030798.td-b3lyp_6-31g+(d).log.xz

047030798.td-b3lyp_6-31+g(d).qchem.inp (generated)

047030798.td-b3lyp_6-31+g(d).gjf (generated)

047030798.td-b3lyp_6-31+g(d).firefly.inp (generated)

047030798.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047030798.mol 047030798.PUBCHEM 047030798.mol (via Jmol)
047030856.b3lyp_6-31g(d).inp

047030856.b3lyp_6-31g(d).qchem.inp (generated)

047030856.b3lyp_6-31g(d).gjf (generated)

047030856.b3lyp_6-31g(d).firefly.inp (generated)

047030856.b3lyp_6-31g(d).smash.inp (generated)

047030856.b3lyp_6-31g(d).nwchem.inp (generated) 047030856.b3lyp_6-31g(d).log.xz 047030856.td-b3lyp_6-31g+(d).inp 047030856.td-b3lyp_6-31g+(d).log.xz

047030856.td-b3lyp_6-31+g(d).qchem.inp (generated)

047030856.td-b3lyp_6-31+g(d).gjf (generated)

047030856.td-b3lyp_6-31+g(d).firefly.inp (generated)

047030856.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047030856.mol 047030856.PUBCHEM 047030856.mol (via Jmol)
047030857.b3lyp_6-31g(d).inp

047030857.b3lyp_6-31g(d).qchem.inp (generated)

047030857.b3lyp_6-31g(d).gjf (generated)

047030857.b3lyp_6-31g(d).firefly.inp (generated)

047030857.b3lyp_6-31g(d).smash.inp (generated)

047030857.b3lyp_6-31g(d).nwchem.inp (generated) 047030857.b3lyp_6-31g(d).log.xz 047030857.td-b3lyp_6-31g+(d).inp 047030857.td-b3lyp_6-31g+(d).log.xz

047030857.td-b3lyp_6-31+g(d).qchem.inp (generated)

047030857.td-b3lyp_6-31+g(d).gjf (generated)

047030857.td-b3lyp_6-31+g(d).firefly.inp (generated)

047030857.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047030857.mol 047030857.PUBCHEM 047030857.mol (via Jmol)
047030861.b3lyp_6-31g(d).inp

047030861.b3lyp_6-31g(d).qchem.inp (generated)

047030861.b3lyp_6-31g(d).gjf (generated)

047030861.b3lyp_6-31g(d).firefly.inp (generated)

047030861.b3lyp_6-31g(d).smash.inp (generated)

047030861.b3lyp_6-31g(d).nwchem.inp (generated) 047030861.b3lyp_6-31g(d).log.xz 047030861.mol 047030861.PUBCHEM 047030861.mol (via Jmol)
047030865.b3lyp_6-31g(d).inp

047030865.b3lyp_6-31g(d).qchem.inp (generated)

047030865.b3lyp_6-31g(d).gjf (generated)

047030865.b3lyp_6-31g(d).firefly.inp (generated)

047030865.b3lyp_6-31g(d).smash.inp (generated)

047030865.b3lyp_6-31g(d).nwchem.inp (generated) 047030865.b3lyp_6-31g(d).log.xz 047030865.td-b3lyp_6-31g+(d).inp 047030865.td-b3lyp_6-31g+(d).log.xz

047030865.td-b3lyp_6-31+g(d).qchem.inp (generated)

047030865.td-b3lyp_6-31+g(d).gjf (generated)

047030865.td-b3lyp_6-31+g(d).firefly.inp (generated)

047030865.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047030865.mol 047030865.PUBCHEM 047030865.mol (via Jmol)
047030878.b3lyp_6-31g(d).inp

047030878.b3lyp_6-31g(d).qchem.inp (generated)

047030878.b3lyp_6-31g(d).gjf (generated)

047030878.b3lyp_6-31g(d).firefly.inp (generated)

047030878.b3lyp_6-31g(d).smash.inp (generated)

047030878.b3lyp_6-31g(d).nwchem.inp (generated) 047030878.b3lyp_6-31g(d).log.xz 047030878.td-b3lyp_6-31g+(d).inp 047030878.td-b3lyp_6-31g+(d).log.xz

047030878.td-b3lyp_6-31+g(d).qchem.inp (generated)

047030878.td-b3lyp_6-31+g(d).gjf (generated)

047030878.td-b3lyp_6-31+g(d).firefly.inp (generated)

047030878.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047030878.mol 047030878.PUBCHEM 047030878.mol (via Jmol)
047030905.b3lyp_6-31g(d).inp

047030905.b3lyp_6-31g(d).qchem.inp (generated)

047030905.b3lyp_6-31g(d).gjf (generated)

047030905.b3lyp_6-31g(d).firefly.inp (generated)

047030905.b3lyp_6-31g(d).smash.inp (generated)

047030905.b3lyp_6-31g(d).nwchem.inp (generated) 047030905.b3lyp_6-31g(d).log.xz 047030905.td-b3lyp_6-31g+(d).inp 047030905.td-b3lyp_6-31g+(d).log.xz

047030905.td-b3lyp_6-31+g(d).qchem.inp (generated)

047030905.td-b3lyp_6-31+g(d).gjf (generated)

047030905.td-b3lyp_6-31+g(d).firefly.inp (generated)

047030905.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047030905.mol 047030905.PUBCHEM 047030905.mol (via Jmol)
047030908.b3lyp_6-31g(d).inp

047030908.b3lyp_6-31g(d).qchem.inp (generated)

047030908.b3lyp_6-31g(d).gjf (generated)

047030908.b3lyp_6-31g(d).firefly.inp (generated)

047030908.b3lyp_6-31g(d).smash.inp (generated)

047030908.b3lyp_6-31g(d).nwchem.inp (generated) 047030908.b3lyp_6-31g(d).log.xz 047030908.td-b3lyp_6-31g+(d).inp 047030908.td-b3lyp_6-31g+(d).log.xz

047030908.td-b3lyp_6-31+g(d).qchem.inp (generated)

047030908.td-b3lyp_6-31+g(d).gjf (generated)

047030908.td-b3lyp_6-31+g(d).firefly.inp (generated)

047030908.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047030908.mol 047030908.PUBCHEM 047030908.mol (via Jmol)
047030941.b3lyp_6-31g(d).inp

047030941.b3lyp_6-31g(d).qchem.inp (generated)

047030941.b3lyp_6-31g(d).gjf (generated)

047030941.b3lyp_6-31g(d).firefly.inp (generated)

047030941.b3lyp_6-31g(d).smash.inp (generated)

047030941.b3lyp_6-31g(d).nwchem.inp (generated) 047030941.b3lyp_6-31g(d).log.xz 047030941.mol 047030941.PUBCHEM 047030941.mol (via Jmol)
047030942.b3lyp_6-31g(d).inp

047030942.b3lyp_6-31g(d).qchem.inp (generated)

047030942.b3lyp_6-31g(d).gjf (generated)

047030942.b3lyp_6-31g(d).firefly.inp (generated)

047030942.b3lyp_6-31g(d).smash.inp (generated)

047030942.b3lyp_6-31g(d).nwchem.inp (generated) 047030942.b3lyp_6-31g(d).log.xz 047030942.mol 047030942.PUBCHEM 047030942.mol (via Jmol)
047030950.b3lyp_6-31g(d).inp

047030950.b3lyp_6-31g(d).qchem.inp (generated)

047030950.b3lyp_6-31g(d).gjf (generated)

047030950.b3lyp_6-31g(d).firefly.inp (generated)

047030950.b3lyp_6-31g(d).smash.inp (generated)

047030950.b3lyp_6-31g(d).nwchem.inp (generated) 047030950.b3lyp_6-31g(d).log.xz 047030950.td-b3lyp_6-31g+(d).inp 047030950.td-b3lyp_6-31g+(d).log.xz

047030950.td-b3lyp_6-31+g(d).qchem.inp (generated)

047030950.td-b3lyp_6-31+g(d).gjf (generated)

047030950.td-b3lyp_6-31+g(d).firefly.inp (generated)

047030950.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047030950.mol 047030950.PUBCHEM 047030950.mol (via Jmol)
047030961.b3lyp_6-31g(d).inp

047030961.b3lyp_6-31g(d).qchem.inp (generated)

047030961.b3lyp_6-31g(d).gjf (generated)

047030961.b3lyp_6-31g(d).firefly.inp (generated)

047030961.b3lyp_6-31g(d).smash.inp (generated)

047030961.b3lyp_6-31g(d).nwchem.inp (generated) 047030961.b3lyp_6-31g(d).log.xz 047030961.td-b3lyp_6-31g+(d).inp 047030961.td-b3lyp_6-31g+(d).log.xz

047030961.td-b3lyp_6-31+g(d).qchem.inp (generated)

047030961.td-b3lyp_6-31+g(d).gjf (generated)

047030961.td-b3lyp_6-31+g(d).firefly.inp (generated)

047030961.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047030961.mol 047030961.PUBCHEM 047030961.mol (via Jmol)
047030979.b3lyp_6-31g(d).inp

047030979.b3lyp_6-31g(d).qchem.inp (generated)

047030979.b3lyp_6-31g(d).gjf (generated)

047030979.b3lyp_6-31g(d).firefly.inp (generated)

047030979.b3lyp_6-31g(d).smash.inp (generated)

047030979.b3lyp_6-31g(d).nwchem.inp (generated) 047030979.b3lyp_6-31g(d).log.xz 047030979.td-b3lyp_6-31g+(d).inp 047030979.td-b3lyp_6-31g+(d).log.xz

047030979.td-b3lyp_6-31+g(d).qchem.inp (generated)

047030979.td-b3lyp_6-31+g(d).gjf (generated)

047030979.td-b3lyp_6-31+g(d).firefly.inp (generated)

047030979.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047030979.mol 047030979.PUBCHEM 047030979.mol (via Jmol)
047030985.b3lyp_6-31g(d).inp

047030985.b3lyp_6-31g(d).qchem.inp (generated)

047030985.b3lyp_6-31g(d).gjf (generated)

047030985.b3lyp_6-31g(d).firefly.inp (generated)

047030985.b3lyp_6-31g(d).smash.inp (generated)

047030985.b3lyp_6-31g(d).nwchem.inp (generated) 047030985.b3lyp_6-31g(d).log.xz 047030985.td-b3lyp_6-31g+(d).inp 047030985.td-b3lyp_6-31g+(d).log.xz

047030985.td-b3lyp_6-31+g(d).qchem.inp (generated)

047030985.td-b3lyp_6-31+g(d).gjf (generated)

047030985.td-b3lyp_6-31+g(d).firefly.inp (generated)

047030985.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047030985.mol 047030985.PUBCHEM 047030985.mol (via Jmol)
047030991.b3lyp_6-31g(d).inp

047030991.b3lyp_6-31g(d).qchem.inp (generated)

047030991.b3lyp_6-31g(d).gjf (generated)

047030991.b3lyp_6-31g(d).firefly.inp (generated)

047030991.b3lyp_6-31g(d).smash.inp (generated)

047030991.b3lyp_6-31g(d).nwchem.inp (generated) 047030991.b3lyp_6-31g(d).log.xz 047030991.td-b3lyp_6-31g+(d).inp 047030991.td-b3lyp_6-31g+(d).log.xz

047030991.td-b3lyp_6-31+g(d).qchem.inp (generated)

047030991.td-b3lyp_6-31+g(d).gjf (generated)

047030991.td-b3lyp_6-31+g(d).firefly.inp (generated)

047030991.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047030991.mol 047030991.PUBCHEM 047030991.mol (via Jmol)
047030999.b3lyp_6-31g(d).inp

047030999.b3lyp_6-31g(d).qchem.inp (generated)

047030999.b3lyp_6-31g(d).gjf (generated)

047030999.b3lyp_6-31g(d).firefly.inp (generated)

047030999.b3lyp_6-31g(d).smash.inp (generated)

047030999.b3lyp_6-31g(d).nwchem.inp (generated) 047030999.b3lyp_6-31g(d).log.xz 047030999.td-b3lyp_6-31g+(d).inp 047030999.td-b3lyp_6-31g+(d).log.xz

047030999.td-b3lyp_6-31+g(d).qchem.inp (generated)

047030999.td-b3lyp_6-31+g(d).gjf (generated)

047030999.td-b3lyp_6-31+g(d).firefly.inp (generated)

047030999.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047030999.mol 047030999.PUBCHEM 047030999.mol (via Jmol)
047031000.b3lyp_6-31g(d).inp

047031000.b3lyp_6-31g(d).qchem.inp (generated)

047031000.b3lyp_6-31g(d).gjf (generated)

047031000.b3lyp_6-31g(d).firefly.inp (generated)

047031000.b3lyp_6-31g(d).smash.inp (generated)

047031000.b3lyp_6-31g(d).nwchem.inp (generated) 047031000.b3lyp_6-31g(d).log.xz 047031000.td-b3lyp_6-31g+(d).inp 047031000.td-b3lyp_6-31g+(d).log.xz

047031000.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031000.td-b3lyp_6-31+g(d).gjf (generated)

047031000.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031000.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031000.mol 047031000.PUBCHEM 047031000.mol (via Jmol)
047031004.b3lyp_6-31g(d).inp

047031004.b3lyp_6-31g(d).qchem.inp (generated)

047031004.b3lyp_6-31g(d).gjf (generated)

047031004.b3lyp_6-31g(d).firefly.inp (generated)

047031004.b3lyp_6-31g(d).smash.inp (generated)

047031004.b3lyp_6-31g(d).nwchem.inp (generated) 047031004.b3lyp_6-31g(d).log.xz 047031004.mol 047031004.PUBCHEM 047031004.mol (via Jmol)
047031005.b3lyp_6-31g(d).inp

047031005.b3lyp_6-31g(d).qchem.inp (generated)

047031005.b3lyp_6-31g(d).gjf (generated)

047031005.b3lyp_6-31g(d).firefly.inp (generated)

047031005.b3lyp_6-31g(d).smash.inp (generated)

047031005.b3lyp_6-31g(d).nwchem.inp (generated) 047031005.b3lyp_6-31g(d).log.xz 047031005.td-b3lyp_6-31g+(d).inp 047031005.td-b3lyp_6-31g+(d).log.xz

047031005.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031005.td-b3lyp_6-31+g(d).gjf (generated)

047031005.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031005.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031005.mol 047031005.PUBCHEM 047031005.mol (via Jmol)
047031007.b3lyp_6-31g(d).inp

047031007.b3lyp_6-31g(d).qchem.inp (generated)

047031007.b3lyp_6-31g(d).gjf (generated)

047031007.b3lyp_6-31g(d).firefly.inp (generated)

047031007.b3lyp_6-31g(d).smash.inp (generated)

047031007.b3lyp_6-31g(d).nwchem.inp (generated) 047031007.b3lyp_6-31g(d).log.xz 047031007.td-b3lyp_6-31g+(d).inp 047031007.td-b3lyp_6-31g+(d).log.xz

047031007.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031007.td-b3lyp_6-31+g(d).gjf (generated)

047031007.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031007.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031007.mol 047031007.PUBCHEM 047031007.mol (via Jmol)
047031010.b3lyp_6-31g(d).inp

047031010.b3lyp_6-31g(d).qchem.inp (generated)

047031010.b3lyp_6-31g(d).gjf (generated)

047031010.b3lyp_6-31g(d).firefly.inp (generated)

047031010.b3lyp_6-31g(d).smash.inp (generated)

047031010.b3lyp_6-31g(d).nwchem.inp (generated) 047031010.b3lyp_6-31g(d).log.xz 047031010.mol 047031010.PUBCHEM 047031010.mol (via Jmol)
047031022.b3lyp_6-31g(d).inp

047031022.b3lyp_6-31g(d).qchem.inp (generated)

047031022.b3lyp_6-31g(d).gjf (generated)

047031022.b3lyp_6-31g(d).firefly.inp (generated)

047031022.b3lyp_6-31g(d).smash.inp (generated)

047031022.b3lyp_6-31g(d).nwchem.inp (generated) 047031022.b3lyp_6-31g(d).log.xz 047031022.mol 047031022.PUBCHEM 047031022.mol (via Jmol)
047031024.b3lyp_6-31g(d).inp

047031024.b3lyp_6-31g(d).qchem.inp (generated)

047031024.b3lyp_6-31g(d).gjf (generated)

047031024.b3lyp_6-31g(d).firefly.inp (generated)

047031024.b3lyp_6-31g(d).smash.inp (generated)

047031024.b3lyp_6-31g(d).nwchem.inp (generated) 047031024.b3lyp_6-31g(d).log.xz 047031024.td-b3lyp_6-31g+(d).inp 047031024.td-b3lyp_6-31g+(d).log.xz

047031024.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031024.td-b3lyp_6-31+g(d).gjf (generated)

047031024.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031024.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031024.mol 047031024.PUBCHEM 047031024.mol (via Jmol)
047031036.b3lyp_6-31g(d).inp

047031036.b3lyp_6-31g(d).qchem.inp (generated)

047031036.b3lyp_6-31g(d).gjf (generated)

047031036.b3lyp_6-31g(d).firefly.inp (generated)

047031036.b3lyp_6-31g(d).smash.inp (generated)

047031036.b3lyp_6-31g(d).nwchem.inp (generated) 047031036.b3lyp_6-31g(d).log.xz 047031036.td-b3lyp_6-31g+(d).inp 047031036.td-b3lyp_6-31g+(d).log.xz

047031036.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031036.td-b3lyp_6-31+g(d).gjf (generated)

047031036.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031036.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031036.mol 047031036.PUBCHEM 047031036.mol (via Jmol)
047031053.b3lyp_6-31g(d).inp

047031053.b3lyp_6-31g(d).qchem.inp (generated)

047031053.b3lyp_6-31g(d).gjf (generated)

047031053.b3lyp_6-31g(d).firefly.inp (generated)

047031053.b3lyp_6-31g(d).smash.inp (generated)

047031053.b3lyp_6-31g(d).nwchem.inp (generated) 047031053.b3lyp_6-31g(d).log.xz 047031053.td-b3lyp_6-31g+(d).inp 047031053.td-b3lyp_6-31g+(d).log.xz

047031053.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031053.td-b3lyp_6-31+g(d).gjf (generated)

047031053.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031053.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031053.mol 047031053.PUBCHEM 047031053.mol (via Jmol)
047031056.b3lyp_6-31g(d).inp

047031056.b3lyp_6-31g(d).qchem.inp (generated)

047031056.b3lyp_6-31g(d).gjf (generated)

047031056.b3lyp_6-31g(d).firefly.inp (generated)

047031056.b3lyp_6-31g(d).smash.inp (generated)

047031056.b3lyp_6-31g(d).nwchem.inp (generated) 047031056.b3lyp_6-31g(d).log.xz 047031056.td-b3lyp_6-31g+(d).inp 047031056.td-b3lyp_6-31g+(d).log.xz

047031056.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031056.td-b3lyp_6-31+g(d).gjf (generated)

047031056.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031056.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031056.mol 047031056.PUBCHEM 047031056.mol (via Jmol)
047031067.b3lyp_6-31g(d).inp

047031067.b3lyp_6-31g(d).qchem.inp (generated)

047031067.b3lyp_6-31g(d).gjf (generated)

047031067.b3lyp_6-31g(d).firefly.inp (generated)

047031067.b3lyp_6-31g(d).smash.inp (generated)

047031067.b3lyp_6-31g(d).nwchem.inp (generated) 047031067.b3lyp_6-31g(d).log.xz 047031067.mol 047031067.PUBCHEM 047031067.mol (via Jmol)
047031086.b3lyp_6-31g(d).inp

047031086.b3lyp_6-31g(d).qchem.inp (generated)

047031086.b3lyp_6-31g(d).gjf (generated)

047031086.b3lyp_6-31g(d).firefly.inp (generated)

047031086.b3lyp_6-31g(d).smash.inp (generated)

047031086.b3lyp_6-31g(d).nwchem.inp (generated) 047031086.b3lyp_6-31g(d).log.xz 047031086.mol 047031086.PUBCHEM 047031086.mol (via Jmol)
047031087.b3lyp_6-31g(d).inp

047031087.b3lyp_6-31g(d).qchem.inp (generated)

047031087.b3lyp_6-31g(d).gjf (generated)

047031087.b3lyp_6-31g(d).firefly.inp (generated)

047031087.b3lyp_6-31g(d).smash.inp (generated)

047031087.b3lyp_6-31g(d).nwchem.inp (generated) 047031087.b3lyp_6-31g(d).log.xz 047031087.td-b3lyp_6-31g+(d).inp 047031087.td-b3lyp_6-31g+(d).log.xz

047031087.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031087.td-b3lyp_6-31+g(d).gjf (generated)

047031087.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031087.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031087.mol 047031087.PUBCHEM 047031087.mol (via Jmol)
047031088.b3lyp_6-31g(d).inp

047031088.b3lyp_6-31g(d).qchem.inp (generated)

047031088.b3lyp_6-31g(d).gjf (generated)

047031088.b3lyp_6-31g(d).firefly.inp (generated)

047031088.b3lyp_6-31g(d).smash.inp (generated)

047031088.b3lyp_6-31g(d).nwchem.inp (generated) 047031088.b3lyp_6-31g(d).log.xz 047031088.td-b3lyp_6-31g+(d).inp 047031088.td-b3lyp_6-31g+(d).log.xz

047031088.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031088.td-b3lyp_6-31+g(d).gjf (generated)

047031088.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031088.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031088.mol 047031088.PUBCHEM 047031088.mol (via Jmol)
047031095.b3lyp_6-31g(d).inp

047031095.b3lyp_6-31g(d).qchem.inp (generated)

047031095.b3lyp_6-31g(d).gjf (generated)

047031095.b3lyp_6-31g(d).firefly.inp (generated)

047031095.b3lyp_6-31g(d).smash.inp (generated)

047031095.b3lyp_6-31g(d).nwchem.inp (generated) 047031095.b3lyp_6-31g(d).log.xz 047031095.td-b3lyp_6-31g+(d).inp 047031095.td-b3lyp_6-31g+(d).log.xz

047031095.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031095.td-b3lyp_6-31+g(d).gjf (generated)

047031095.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031095.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031095.mol 047031095.PUBCHEM 047031095.mol (via Jmol)
047031106.b3lyp_6-31g(d).inp

047031106.b3lyp_6-31g(d).qchem.inp (generated)

047031106.b3lyp_6-31g(d).gjf (generated)

047031106.b3lyp_6-31g(d).firefly.inp (generated)

047031106.b3lyp_6-31g(d).smash.inp (generated)

047031106.b3lyp_6-31g(d).nwchem.inp (generated) 047031106.b3lyp_6-31g(d).log.xz 047031106.td-b3lyp_6-31g+(d).inp 047031106.td-b3lyp_6-31g+(d).log.xz

047031106.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031106.td-b3lyp_6-31+g(d).gjf (generated)

047031106.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031106.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031106.mol 047031106.PUBCHEM 047031106.mol (via Jmol)
047031116.b3lyp_6-31g(d).inp

047031116.b3lyp_6-31g(d).qchem.inp (generated)

047031116.b3lyp_6-31g(d).gjf (generated)

047031116.b3lyp_6-31g(d).firefly.inp (generated)

047031116.b3lyp_6-31g(d).smash.inp (generated)

047031116.b3lyp_6-31g(d).nwchem.inp (generated) 047031116.b3lyp_6-31g(d).log.xz 047031116.td-b3lyp_6-31g+(d).inp 047031116.td-b3lyp_6-31g+(d).log.xz

047031116.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031116.td-b3lyp_6-31+g(d).gjf (generated)

047031116.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031116.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031116.mol 047031116.PUBCHEM 047031116.mol (via Jmol)
047031120.b3lyp_6-31g(d).inp

047031120.b3lyp_6-31g(d).qchem.inp (generated)

047031120.b3lyp_6-31g(d).gjf (generated)

047031120.b3lyp_6-31g(d).firefly.inp (generated)

047031120.b3lyp_6-31g(d).smash.inp (generated)

047031120.b3lyp_6-31g(d).nwchem.inp (generated) 047031120.b3lyp_6-31g(d).log.xz 047031120.td-b3lyp_6-31g+(d).inp 047031120.td-b3lyp_6-31g+(d).log.xz

047031120.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031120.td-b3lyp_6-31+g(d).gjf (generated)

047031120.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031120.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031120.mol 047031120.PUBCHEM 047031120.mol (via Jmol)
047031122.b3lyp_6-31g(d).inp

047031122.b3lyp_6-31g(d).qchem.inp (generated)

047031122.b3lyp_6-31g(d).gjf (generated)

047031122.b3lyp_6-31g(d).firefly.inp (generated)

047031122.b3lyp_6-31g(d).smash.inp (generated)

047031122.b3lyp_6-31g(d).nwchem.inp (generated) 047031122.b3lyp_6-31g(d).log.xz 047031122.td-b3lyp_6-31g+(d).inp 047031122.td-b3lyp_6-31g+(d).log.xz

047031122.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031122.td-b3lyp_6-31+g(d).gjf (generated)

047031122.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031122.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031122.mol 047031122.PUBCHEM 047031122.mol (via Jmol)
047031124.b3lyp_6-31g(d).inp

047031124.b3lyp_6-31g(d).qchem.inp (generated)

047031124.b3lyp_6-31g(d).gjf (generated)

047031124.b3lyp_6-31g(d).firefly.inp (generated)

047031124.b3lyp_6-31g(d).smash.inp (generated)

047031124.b3lyp_6-31g(d).nwchem.inp (generated) 047031124.b3lyp_6-31g(d).log.xz 047031124.mol 047031124.PUBCHEM 047031124.mol (via Jmol)
047031125.b3lyp_6-31g(d).inp

047031125.b3lyp_6-31g(d).qchem.inp (generated)

047031125.b3lyp_6-31g(d).gjf (generated)

047031125.b3lyp_6-31g(d).firefly.inp (generated)

047031125.b3lyp_6-31g(d).smash.inp (generated)

047031125.b3lyp_6-31g(d).nwchem.inp (generated) 047031125.b3lyp_6-31g(d).log.xz 047031125.td-b3lyp_6-31g+(d).inp 047031125.td-b3lyp_6-31g+(d).log.xz

047031125.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031125.td-b3lyp_6-31+g(d).gjf (generated)

047031125.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031125.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031125.mol 047031125.PUBCHEM 047031125.mol (via Jmol)
047031126.b3lyp_6-31g(d).inp

047031126.b3lyp_6-31g(d).qchem.inp (generated)

047031126.b3lyp_6-31g(d).gjf (generated)

047031126.b3lyp_6-31g(d).firefly.inp (generated)

047031126.b3lyp_6-31g(d).smash.inp (generated)

047031126.b3lyp_6-31g(d).nwchem.inp (generated) 047031126.b3lyp_6-31g(d).log.xz 047031126.td-b3lyp_6-31g+(d).inp 047031126.td-b3lyp_6-31g+(d).log.xz

047031126.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031126.td-b3lyp_6-31+g(d).gjf (generated)

047031126.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031126.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031126.mol 047031126.PUBCHEM 047031126.mol (via Jmol)
047031127.b3lyp_6-31g(d).inp

047031127.b3lyp_6-31g(d).qchem.inp (generated)

047031127.b3lyp_6-31g(d).gjf (generated)

047031127.b3lyp_6-31g(d).firefly.inp (generated)

047031127.b3lyp_6-31g(d).smash.inp (generated)

047031127.b3lyp_6-31g(d).nwchem.inp (generated) 047031127.b3lyp_6-31g(d).log.xz 047031127.td-b3lyp_6-31g+(d).inp 047031127.td-b3lyp_6-31g+(d).log.xz

047031127.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031127.td-b3lyp_6-31+g(d).gjf (generated)

047031127.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031127.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031127.mol 047031127.PUBCHEM 047031127.mol (via Jmol)
047031129.b3lyp_6-31g(d).inp

047031129.b3lyp_6-31g(d).qchem.inp (generated)

047031129.b3lyp_6-31g(d).gjf (generated)

047031129.b3lyp_6-31g(d).firefly.inp (generated)

047031129.b3lyp_6-31g(d).smash.inp (generated)

047031129.b3lyp_6-31g(d).nwchem.inp (generated) 047031129.b3lyp_6-31g(d).log.xz 047031129.mol 047031129.PUBCHEM 047031129.mol (via Jmol)
047031133.b3lyp_6-31g(d).inp

047031133.b3lyp_6-31g(d).qchem.inp (generated)

047031133.b3lyp_6-31g(d).gjf (generated)

047031133.b3lyp_6-31g(d).firefly.inp (generated)

047031133.b3lyp_6-31g(d).smash.inp (generated)

047031133.b3lyp_6-31g(d).nwchem.inp (generated) 047031133.b3lyp_6-31g(d).log.xz 047031133.td-b3lyp_6-31g+(d).inp 047031133.td-b3lyp_6-31g+(d).log.xz

047031133.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031133.td-b3lyp_6-31+g(d).gjf (generated)

047031133.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031133.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031133.mol 047031133.PUBCHEM 047031133.mol (via Jmol)
047031175.b3lyp_6-31g(d).inp

047031175.b3lyp_6-31g(d).qchem.inp (generated)

047031175.b3lyp_6-31g(d).gjf (generated)

047031175.b3lyp_6-31g(d).firefly.inp (generated)

047031175.b3lyp_6-31g(d).smash.inp (generated)

047031175.b3lyp_6-31g(d).nwchem.inp (generated) 047031175.b3lyp_6-31g(d).log.xz 047031175.td-b3lyp_6-31g+(d).inp 047031175.td-b3lyp_6-31g+(d).log.xz

047031175.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031175.td-b3lyp_6-31+g(d).gjf (generated)

047031175.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031175.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031175.mol 047031175.PUBCHEM 047031175.mol (via Jmol)
047031182.b3lyp_6-31g(d).inp

047031182.b3lyp_6-31g(d).qchem.inp (generated)

047031182.b3lyp_6-31g(d).gjf (generated)

047031182.b3lyp_6-31g(d).firefly.inp (generated)

047031182.b3lyp_6-31g(d).smash.inp (generated)

047031182.b3lyp_6-31g(d).nwchem.inp (generated) 047031182.b3lyp_6-31g(d).log.xz 047031182.td-b3lyp_6-31g+(d).inp 047031182.td-b3lyp_6-31g+(d).log.xz

047031182.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031182.td-b3lyp_6-31+g(d).gjf (generated)

047031182.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031182.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031182.mol 047031182.PUBCHEM 047031182.mol (via Jmol)
047031222.b3lyp_6-31g(d).inp

047031222.b3lyp_6-31g(d).qchem.inp (generated)

047031222.b3lyp_6-31g(d).gjf (generated)

047031222.b3lyp_6-31g(d).firefly.inp (generated)

047031222.b3lyp_6-31g(d).smash.inp (generated)

047031222.b3lyp_6-31g(d).nwchem.inp (generated) 047031222.b3lyp_6-31g(d).log.xz 047031222.mol 047031222.PUBCHEM 047031222.mol (via Jmol)
047031258.b3lyp_6-31g(d).inp

047031258.b3lyp_6-31g(d).qchem.inp (generated)

047031258.b3lyp_6-31g(d).gjf (generated)

047031258.b3lyp_6-31g(d).firefly.inp (generated)

047031258.b3lyp_6-31g(d).smash.inp (generated)

047031258.b3lyp_6-31g(d).nwchem.inp (generated) 047031258.b3lyp_6-31g(d).log.xz 047031258.mol 047031258.PUBCHEM 047031258.mol (via Jmol)
047031275.b3lyp_6-31g(d).inp

047031275.b3lyp_6-31g(d).qchem.inp (generated)

047031275.b3lyp_6-31g(d).gjf (generated)

047031275.b3lyp_6-31g(d).firefly.inp (generated)

047031275.b3lyp_6-31g(d).smash.inp (generated)

047031275.b3lyp_6-31g(d).nwchem.inp (generated) 047031275.b3lyp_6-31g(d).log.xz 047031275.td-b3lyp_6-31g+(d).inp 047031275.td-b3lyp_6-31g+(d).log.xz

047031275.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031275.td-b3lyp_6-31+g(d).gjf (generated)

047031275.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031275.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031275.mol 047031275.PUBCHEM 047031275.mol (via Jmol)
047031277.b3lyp_6-31g(d).inp

047031277.b3lyp_6-31g(d).qchem.inp (generated)

047031277.b3lyp_6-31g(d).gjf (generated)

047031277.b3lyp_6-31g(d).firefly.inp (generated)

047031277.b3lyp_6-31g(d).smash.inp (generated)

047031277.b3lyp_6-31g(d).nwchem.inp (generated) 047031277.b3lyp_6-31g(d).log.xz 047031277.td-b3lyp_6-31g+(d).inp 047031277.td-b3lyp_6-31g+(d).log.xz

047031277.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031277.td-b3lyp_6-31+g(d).gjf (generated)

047031277.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031277.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031277.mol 047031277.PUBCHEM 047031277.mol (via Jmol)
047031279.b3lyp_6-31g(d).inp

047031279.b3lyp_6-31g(d).qchem.inp (generated)

047031279.b3lyp_6-31g(d).gjf (generated)

047031279.b3lyp_6-31g(d).firefly.inp (generated)

047031279.b3lyp_6-31g(d).smash.inp (generated)

047031279.b3lyp_6-31g(d).nwchem.inp (generated) 047031279.b3lyp_6-31g(d).log.xz 047031279.td-b3lyp_6-31g+(d).inp 047031279.td-b3lyp_6-31g+(d).log.xz

047031279.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031279.td-b3lyp_6-31+g(d).gjf (generated)

047031279.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031279.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031279.mol 047031279.PUBCHEM 047031279.mol (via Jmol)
047031280.b3lyp_6-31g(d).inp

047031280.b3lyp_6-31g(d).qchem.inp (generated)

047031280.b3lyp_6-31g(d).gjf (generated)

047031280.b3lyp_6-31g(d).firefly.inp (generated)

047031280.b3lyp_6-31g(d).smash.inp (generated)

047031280.b3lyp_6-31g(d).nwchem.inp (generated) 047031280.b3lyp_6-31g(d).log.xz 047031280.td-b3lyp_6-31g+(d).inp 047031280.td-b3lyp_6-31g+(d).log.xz

047031280.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031280.td-b3lyp_6-31+g(d).gjf (generated)

047031280.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031280.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031280.mol 047031280.PUBCHEM 047031280.mol (via Jmol)
047031282.b3lyp_6-31g(d).inp

047031282.b3lyp_6-31g(d).qchem.inp (generated)

047031282.b3lyp_6-31g(d).gjf (generated)

047031282.b3lyp_6-31g(d).firefly.inp (generated)

047031282.b3lyp_6-31g(d).smash.inp (generated)

047031282.b3lyp_6-31g(d).nwchem.inp (generated) 047031282.b3lyp_6-31g(d).log.xz 047031282.td-b3lyp_6-31g+(d).inp 047031282.td-b3lyp_6-31g+(d).log.xz

047031282.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031282.td-b3lyp_6-31+g(d).gjf (generated)

047031282.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031282.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031282.mol 047031282.PUBCHEM 047031282.mol (via Jmol)
047031283.b3lyp_6-31g(d).inp

047031283.b3lyp_6-31g(d).qchem.inp (generated)

047031283.b3lyp_6-31g(d).gjf (generated)

047031283.b3lyp_6-31g(d).firefly.inp (generated)

047031283.b3lyp_6-31g(d).smash.inp (generated)

047031283.b3lyp_6-31g(d).nwchem.inp (generated) 047031283.b3lyp_6-31g(d).log.xz 047031283.td-b3lyp_6-31g+(d).inp 047031283.td-b3lyp_6-31g+(d).log.xz

047031283.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031283.td-b3lyp_6-31+g(d).gjf (generated)

047031283.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031283.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031283.mol 047031283.PUBCHEM 047031283.mol (via Jmol)
047031291.b3lyp_6-31g(d).inp

047031291.b3lyp_6-31g(d).qchem.inp (generated)

047031291.b3lyp_6-31g(d).gjf (generated)

047031291.b3lyp_6-31g(d).firefly.inp (generated)

047031291.b3lyp_6-31g(d).smash.inp (generated)

047031291.b3lyp_6-31g(d).nwchem.inp (generated) 047031291.b3lyp_6-31g(d).log.xz 047031291.td-b3lyp_6-31g+(d).inp 047031291.td-b3lyp_6-31g+(d).log.xz

047031291.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031291.td-b3lyp_6-31+g(d).gjf (generated)

047031291.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031291.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031291.mol 047031291.PUBCHEM 047031291.mol (via Jmol)
047031328.b3lyp_6-31g(d).inp

047031328.b3lyp_6-31g(d).qchem.inp (generated)

047031328.b3lyp_6-31g(d).gjf (generated)

047031328.b3lyp_6-31g(d).firefly.inp (generated)

047031328.b3lyp_6-31g(d).smash.inp (generated)

047031328.b3lyp_6-31g(d).nwchem.inp (generated) 047031328.b3lyp_6-31g(d).log.xz 047031328.td-b3lyp_6-31g+(d).inp 047031328.td-b3lyp_6-31g+(d).log.xz

047031328.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031328.td-b3lyp_6-31+g(d).gjf (generated)

047031328.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031328.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031328.mol 047031328.PUBCHEM 047031328.mol (via Jmol)
047031329.b3lyp_6-31g(d).inp

047031329.b3lyp_6-31g(d).qchem.inp (generated)

047031329.b3lyp_6-31g(d).gjf (generated)

047031329.b3lyp_6-31g(d).firefly.inp (generated)

047031329.b3lyp_6-31g(d).smash.inp (generated)

047031329.b3lyp_6-31g(d).nwchem.inp (generated) 047031329.b3lyp_6-31g(d).log.xz 047031329.td-b3lyp_6-31g+(d).inp 047031329.td-b3lyp_6-31g+(d).log.xz

047031329.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031329.td-b3lyp_6-31+g(d).gjf (generated)

047031329.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031329.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031329.mol 047031329.PUBCHEM 047031329.mol (via Jmol)
047031330.b3lyp_6-31g(d).inp

047031330.b3lyp_6-31g(d).qchem.inp (generated)

047031330.b3lyp_6-31g(d).gjf (generated)

047031330.b3lyp_6-31g(d).firefly.inp (generated)

047031330.b3lyp_6-31g(d).smash.inp (generated)

047031330.b3lyp_6-31g(d).nwchem.inp (generated) 047031330.b3lyp_6-31g(d).log.xz 047031330.td-b3lyp_6-31g+(d).inp 047031330.td-b3lyp_6-31g+(d).log.xz

047031330.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031330.td-b3lyp_6-31+g(d).gjf (generated)

047031330.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031330.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031330.mol 047031330.PUBCHEM 047031330.mol (via Jmol)
047031354.b3lyp_6-31g(d).inp

047031354.b3lyp_6-31g(d).qchem.inp (generated)

047031354.b3lyp_6-31g(d).gjf (generated)

047031354.b3lyp_6-31g(d).firefly.inp (generated)

047031354.b3lyp_6-31g(d).smash.inp (generated)

047031354.b3lyp_6-31g(d).nwchem.inp (generated) 047031354.b3lyp_6-31g(d).log.xz 047031354.td-b3lyp_6-31g+(d).inp 047031354.td-b3lyp_6-31g+(d).log.xz

047031354.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031354.td-b3lyp_6-31+g(d).gjf (generated)

047031354.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031354.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031354.mol 047031354.PUBCHEM 047031354.mol (via Jmol)
047031377.b3lyp_6-31g(d).inp

047031377.b3lyp_6-31g(d).qchem.inp (generated)

047031377.b3lyp_6-31g(d).gjf (generated)

047031377.b3lyp_6-31g(d).firefly.inp (generated)

047031377.b3lyp_6-31g(d).smash.inp (generated)

047031377.b3lyp_6-31g(d).nwchem.inp (generated) 047031377.b3lyp_6-31g(d).log.xz 047031377.td-b3lyp_6-31g+(d).inp 047031377.td-b3lyp_6-31g+(d).log.xz

047031377.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031377.td-b3lyp_6-31+g(d).gjf (generated)

047031377.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031377.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031377.mol 047031377.PUBCHEM 047031377.mol (via Jmol)
047031384.b3lyp_6-31g(d).inp

047031384.b3lyp_6-31g(d).qchem.inp (generated)

047031384.b3lyp_6-31g(d).gjf (generated)

047031384.b3lyp_6-31g(d).firefly.inp (generated)

047031384.b3lyp_6-31g(d).smash.inp (generated)

047031384.b3lyp_6-31g(d).nwchem.inp (generated) 047031384.b3lyp_6-31g(d).log.xz 047031384.td-b3lyp_6-31g+(d).inp 047031384.td-b3lyp_6-31g+(d).log.xz

047031384.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031384.td-b3lyp_6-31+g(d).gjf (generated)

047031384.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031384.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031384.mol 047031384.PUBCHEM 047031384.mol (via Jmol)
047031386.b3lyp_6-31g(d).inp

047031386.b3lyp_6-31g(d).qchem.inp (generated)

047031386.b3lyp_6-31g(d).gjf (generated)

047031386.b3lyp_6-31g(d).firefly.inp (generated)

047031386.b3lyp_6-31g(d).smash.inp (generated)

047031386.b3lyp_6-31g(d).nwchem.inp (generated) 047031386.b3lyp_6-31g(d).log.xz 047031386.td-b3lyp_6-31g+(d).inp 047031386.td-b3lyp_6-31g+(d).log.xz

047031386.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031386.td-b3lyp_6-31+g(d).gjf (generated)

047031386.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031386.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031386.mol 047031386.PUBCHEM 047031386.mol (via Jmol)
047031644.b3lyp_6-31g(d).inp

047031644.b3lyp_6-31g(d).qchem.inp (generated)

047031644.b3lyp_6-31g(d).gjf (generated)

047031644.b3lyp_6-31g(d).firefly.inp (generated)

047031644.b3lyp_6-31g(d).smash.inp (generated)

047031644.b3lyp_6-31g(d).nwchem.inp (generated) 047031644.b3lyp_6-31g(d).log.xz 047031644.td-b3lyp_6-31g+(d).inp 047031644.td-b3lyp_6-31g+(d).log.xz

047031644.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031644.td-b3lyp_6-31+g(d).gjf (generated)

047031644.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031644.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031644.mol 047031644.PUBCHEM 047031644.mol (via Jmol)
047031645.b3lyp_6-31g(d).inp

047031645.b3lyp_6-31g(d).qchem.inp (generated)

047031645.b3lyp_6-31g(d).gjf (generated)

047031645.b3lyp_6-31g(d).firefly.inp (generated)

047031645.b3lyp_6-31g(d).smash.inp (generated)

047031645.b3lyp_6-31g(d).nwchem.inp (generated) 047031645.b3lyp_6-31g(d).log.xz 047031645.td-b3lyp_6-31g+(d).inp 047031645.td-b3lyp_6-31g+(d).log.xz

047031645.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031645.td-b3lyp_6-31+g(d).gjf (generated)

047031645.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031645.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031645.mol 047031645.PUBCHEM 047031645.mol (via Jmol)
047031654.b3lyp_6-31g(d).inp

047031654.b3lyp_6-31g(d).qchem.inp (generated)

047031654.b3lyp_6-31g(d).gjf (generated)

047031654.b3lyp_6-31g(d).firefly.inp (generated)

047031654.b3lyp_6-31g(d).smash.inp (generated)

047031654.b3lyp_6-31g(d).nwchem.inp (generated) 047031654.b3lyp_6-31g(d).log.xz 047031654.td-b3lyp_6-31g+(d).inp 047031654.td-b3lyp_6-31g+(d).log.xz

047031654.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031654.td-b3lyp_6-31+g(d).gjf (generated)

047031654.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031654.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031654.mol 047031654.PUBCHEM 047031654.mol (via Jmol)
047031752.b3lyp_6-31g(d).inp

047031752.b3lyp_6-31g(d).qchem.inp (generated)

047031752.b3lyp_6-31g(d).gjf (generated)

047031752.b3lyp_6-31g(d).firefly.inp (generated)

047031752.b3lyp_6-31g(d).smash.inp (generated)

047031752.b3lyp_6-31g(d).nwchem.inp (generated) 047031752.b3lyp_6-31g(d).log.xz 047031752.td-b3lyp_6-31g+(d).inp 047031752.td-b3lyp_6-31g+(d).log.xz

047031752.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031752.td-b3lyp_6-31+g(d).gjf (generated)

047031752.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031752.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031752.mol 047031752.PUBCHEM 047031752.mol (via Jmol)
047031784.b3lyp_6-31g(d).inp

047031784.b3lyp_6-31g(d).qchem.inp (generated)

047031784.b3lyp_6-31g(d).gjf (generated)

047031784.b3lyp_6-31g(d).firefly.inp (generated)

047031784.b3lyp_6-31g(d).smash.inp (generated)

047031784.b3lyp_6-31g(d).nwchem.inp (generated) 047031784.b3lyp_6-31g(d).log.xz 047031784.td-b3lyp_6-31g+(d).inp 047031784.td-b3lyp_6-31g+(d).log.xz

047031784.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031784.td-b3lyp_6-31+g(d).gjf (generated)

047031784.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031784.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031784.mol 047031784.PUBCHEM 047031784.mol (via Jmol)
047031896.b3lyp_6-31g(d).inp

047031896.b3lyp_6-31g(d).qchem.inp (generated)

047031896.b3lyp_6-31g(d).gjf (generated)

047031896.b3lyp_6-31g(d).firefly.inp (generated)

047031896.b3lyp_6-31g(d).smash.inp (generated)

047031896.b3lyp_6-31g(d).nwchem.inp (generated) 047031896.b3lyp_6-31g(d).log.xz 047031896.td-b3lyp_6-31g+(d).inp 047031896.td-b3lyp_6-31g+(d).log.xz

047031896.td-b3lyp_6-31+g(d).qchem.inp (generated)

047031896.td-b3lyp_6-31+g(d).gjf (generated)

047031896.td-b3lyp_6-31+g(d).firefly.inp (generated)

047031896.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047031896.mol 047031896.PUBCHEM 047031896.mol (via Jmol)
047032060.b3lyp_6-31g(d).inp

047032060.b3lyp_6-31g(d).qchem.inp (generated)

047032060.b3lyp_6-31g(d).gjf (generated)

047032060.b3lyp_6-31g(d).firefly.inp (generated)

047032060.b3lyp_6-31g(d).smash.inp (generated)

047032060.b3lyp_6-31g(d).nwchem.inp (generated) 047032060.b3lyp_6-31g(d).log.xz 047032060.mol 047032060.PUBCHEM 047032060.mol (via Jmol)
047032091.b3lyp_6-31g(d).inp

047032091.b3lyp_6-31g(d).qchem.inp (generated)

047032091.b3lyp_6-31g(d).gjf (generated)

047032091.b3lyp_6-31g(d).firefly.inp (generated)

047032091.b3lyp_6-31g(d).smash.inp (generated)

047032091.b3lyp_6-31g(d).nwchem.inp (generated) 047032091.b3lyp_6-31g(d).log.xz 047032091.mol 047032091.PUBCHEM 047032091.mol (via Jmol)
047032107.b3lyp_6-31g(d).inp

047032107.b3lyp_6-31g(d).qchem.inp (generated)

047032107.b3lyp_6-31g(d).gjf (generated)

047032107.b3lyp_6-31g(d).firefly.inp (generated)

047032107.b3lyp_6-31g(d).smash.inp (generated)

047032107.b3lyp_6-31g(d).nwchem.inp (generated) 047032107.b3lyp_6-31g(d).log.xz 047032107.td-b3lyp_6-31g+(d).inp 047032107.td-b3lyp_6-31g+(d).log.xz

047032107.td-b3lyp_6-31+g(d).qchem.inp (generated)

047032107.td-b3lyp_6-31+g(d).gjf (generated)

047032107.td-b3lyp_6-31+g(d).firefly.inp (generated)

047032107.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047032107.mol 047032107.PUBCHEM 047032107.mol (via Jmol)
047032108.b3lyp_6-31g(d).inp

047032108.b3lyp_6-31g(d).qchem.inp (generated)

047032108.b3lyp_6-31g(d).gjf (generated)

047032108.b3lyp_6-31g(d).firefly.inp (generated)

047032108.b3lyp_6-31g(d).smash.inp (generated)

047032108.b3lyp_6-31g(d).nwchem.inp (generated) 047032108.b3lyp_6-31g(d).log.xz 047032108.td-b3lyp_6-31g+(d).inp 047032108.td-b3lyp_6-31g+(d).log.xz

047032108.td-b3lyp_6-31+g(d).qchem.inp (generated)

047032108.td-b3lyp_6-31+g(d).gjf (generated)

047032108.td-b3lyp_6-31+g(d).firefly.inp (generated)

047032108.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047032108.mol 047032108.PUBCHEM 047032108.mol (via Jmol)
047032113.b3lyp_6-31g(d).inp

047032113.b3lyp_6-31g(d).qchem.inp (generated)

047032113.b3lyp_6-31g(d).gjf (generated)

047032113.b3lyp_6-31g(d).firefly.inp (generated)

047032113.b3lyp_6-31g(d).smash.inp (generated)

047032113.b3lyp_6-31g(d).nwchem.inp (generated) 047032113.b3lyp_6-31g(d).log.xz 047032113.td-b3lyp_6-31g+(d).inp 047032113.td-b3lyp_6-31g+(d).log.xz

047032113.td-b3lyp_6-31+g(d).qchem.inp (generated)

047032113.td-b3lyp_6-31+g(d).gjf (generated)

047032113.td-b3lyp_6-31+g(d).firefly.inp (generated)

047032113.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047032113.mol 047032113.PUBCHEM 047032113.mol (via Jmol)
047032116.b3lyp_6-31g(d).inp

047032116.b3lyp_6-31g(d).qchem.inp (generated)

047032116.b3lyp_6-31g(d).gjf (generated)

047032116.b3lyp_6-31g(d).firefly.inp (generated)

047032116.b3lyp_6-31g(d).smash.inp (generated)

047032116.b3lyp_6-31g(d).nwchem.inp (generated) 047032116.b3lyp_6-31g(d).log.xz 047032116.td-b3lyp_6-31g+(d).inp 047032116.td-b3lyp_6-31g+(d).log.xz

047032116.td-b3lyp_6-31+g(d).qchem.inp (generated)

047032116.td-b3lyp_6-31+g(d).gjf (generated)

047032116.td-b3lyp_6-31+g(d).firefly.inp (generated)

047032116.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047032116.mol 047032116.PUBCHEM 047032116.mol (via Jmol)
047032180.b3lyp_6-31g(d).inp

047032180.b3lyp_6-31g(d).qchem.inp (generated)

047032180.b3lyp_6-31g(d).gjf (generated)

047032180.b3lyp_6-31g(d).firefly.inp (generated)

047032180.b3lyp_6-31g(d).smash.inp (generated)

047032180.b3lyp_6-31g(d).nwchem.inp (generated) 047032180.b3lyp_6-31g(d).log.xz 047032180.td-b3lyp_6-31g+(d).inp 047032180.td-b3lyp_6-31g+(d).log.xz

047032180.td-b3lyp_6-31+g(d).qchem.inp (generated)

047032180.td-b3lyp_6-31+g(d).gjf (generated)

047032180.td-b3lyp_6-31+g(d).firefly.inp (generated)

047032180.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047032180.mol 047032180.PUBCHEM 047032180.mol (via Jmol)
047032185.b3lyp_6-31g(d).inp

047032185.b3lyp_6-31g(d).qchem.inp (generated)

047032185.b3lyp_6-31g(d).gjf (generated)

047032185.b3lyp_6-31g(d).firefly.inp (generated)

047032185.b3lyp_6-31g(d).smash.inp (generated)

047032185.b3lyp_6-31g(d).nwchem.inp (generated) 047032185.b3lyp_6-31g(d).log.xz 047032185.td-b3lyp_6-31g+(d).inp 047032185.td-b3lyp_6-31g+(d).log.xz

047032185.td-b3lyp_6-31+g(d).qchem.inp (generated)

047032185.td-b3lyp_6-31+g(d).gjf (generated)

047032185.td-b3lyp_6-31+g(d).firefly.inp (generated)

047032185.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047032185.mol 047032185.PUBCHEM 047032185.mol (via Jmol)
047032190.b3lyp_6-31g(d).inp

047032190.b3lyp_6-31g(d).qchem.inp (generated)

047032190.b3lyp_6-31g(d).gjf (generated)

047032190.b3lyp_6-31g(d).firefly.inp (generated)

047032190.b3lyp_6-31g(d).smash.inp (generated)

047032190.b3lyp_6-31g(d).nwchem.inp (generated) 047032190.b3lyp_6-31g(d).log.xz 047032190.td-b3lyp_6-31g+(d).inp 047032190.td-b3lyp_6-31g+(d).log.xz

047032190.td-b3lyp_6-31+g(d).qchem.inp (generated)

047032190.td-b3lyp_6-31+g(d).gjf (generated)

047032190.td-b3lyp_6-31+g(d).firefly.inp (generated)

047032190.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047032190.mol 047032190.PUBCHEM 047032190.mol (via Jmol)
047032235.b3lyp_6-31g(d).inp

047032235.b3lyp_6-31g(d).qchem.inp (generated)

047032235.b3lyp_6-31g(d).gjf (generated)

047032235.b3lyp_6-31g(d).firefly.inp (generated)

047032235.b3lyp_6-31g(d).smash.inp (generated)

047032235.b3lyp_6-31g(d).nwchem.inp (generated) 047032235.b3lyp_6-31g(d).log.xz 047032235.mol 047032235.PUBCHEM 047032235.mol (via Jmol)
047032236.b3lyp_6-31g(d).inp

047032236.b3lyp_6-31g(d).qchem.inp (generated)

047032236.b3lyp_6-31g(d).gjf (generated)

047032236.b3lyp_6-31g(d).firefly.inp (generated)

047032236.b3lyp_6-31g(d).smash.inp (generated)

047032236.b3lyp_6-31g(d).nwchem.inp (generated) 047032236.b3lyp_6-31g(d).log.xz 047032236.td-b3lyp_6-31g+(d).inp 047032236.td-b3lyp_6-31g+(d).log.xz

047032236.td-b3lyp_6-31+g(d).qchem.inp (generated)

047032236.td-b3lyp_6-31+g(d).gjf (generated)

047032236.td-b3lyp_6-31+g(d).firefly.inp (generated)

047032236.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047032236.mol 047032236.PUBCHEM 047032236.mol (via Jmol)
047032290.b3lyp_6-31g(d).inp

047032290.b3lyp_6-31g(d).qchem.inp (generated)

047032290.b3lyp_6-31g(d).gjf (generated)

047032290.b3lyp_6-31g(d).firefly.inp (generated)

047032290.b3lyp_6-31g(d).smash.inp (generated)

047032290.b3lyp_6-31g(d).nwchem.inp (generated) 047032290.b3lyp_6-31g(d).log.xz 047032290.td-b3lyp_6-31g+(d).inp 047032290.td-b3lyp_6-31g+(d).log.xz

047032290.td-b3lyp_6-31+g(d).qchem.inp (generated)

047032290.td-b3lyp_6-31+g(d).gjf (generated)

047032290.td-b3lyp_6-31+g(d).firefly.inp (generated)

047032290.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047032290.mol 047032290.PUBCHEM 047032290.mol (via Jmol)
047032357.b3lyp_6-31g(d).inp

047032357.b3lyp_6-31g(d).qchem.inp (generated)

047032357.b3lyp_6-31g(d).gjf (generated)

047032357.b3lyp_6-31g(d).firefly.inp (generated)

047032357.b3lyp_6-31g(d).smash.inp (generated)

047032357.b3lyp_6-31g(d).nwchem.inp (generated) 047032357.b3lyp_6-31g(d).log.xz 047032357.td-b3lyp_6-31g+(d).inp 047032357.td-b3lyp_6-31g+(d).log.xz

047032357.td-b3lyp_6-31+g(d).qchem.inp (generated)

047032357.td-b3lyp_6-31+g(d).gjf (generated)

047032357.td-b3lyp_6-31+g(d).firefly.inp (generated)

047032357.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047032357.mol 047032357.PUBCHEM 047032357.mol (via Jmol)
047032428.b3lyp_6-31g(d).inp

047032428.b3lyp_6-31g(d).qchem.inp (generated)

047032428.b3lyp_6-31g(d).gjf (generated)

047032428.b3lyp_6-31g(d).firefly.inp (generated)

047032428.b3lyp_6-31g(d).smash.inp (generated)

047032428.b3lyp_6-31g(d).nwchem.inp (generated) 047032428.b3lyp_6-31g(d).log.xz 047032428.mol 047032428.PUBCHEM 047032428.mol (via Jmol)
047032521.b3lyp_6-31g(d).inp

047032521.b3lyp_6-31g(d).qchem.inp (generated)

047032521.b3lyp_6-31g(d).gjf (generated)

047032521.b3lyp_6-31g(d).firefly.inp (generated)

047032521.b3lyp_6-31g(d).smash.inp (generated)

047032521.b3lyp_6-31g(d).nwchem.inp (generated) 047032521.b3lyp_6-31g(d).log.xz 047032521.td-b3lyp_6-31g+(d).inp 047032521.td-b3lyp_6-31g+(d).log.xz

047032521.td-b3lyp_6-31+g(d).qchem.inp (generated)

047032521.td-b3lyp_6-31+g(d).gjf (generated)

047032521.td-b3lyp_6-31+g(d).firefly.inp (generated)

047032521.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047032521.mol 047032521.PUBCHEM 047032521.mol (via Jmol)
047032697.b3lyp_6-31g(d).inp

047032697.b3lyp_6-31g(d).qchem.inp (generated)

047032697.b3lyp_6-31g(d).gjf (generated)

047032697.b3lyp_6-31g(d).firefly.inp (generated)

047032697.b3lyp_6-31g(d).smash.inp (generated)

047032697.b3lyp_6-31g(d).nwchem.inp (generated) 047032697.b3lyp_6-31g(d).log.xz 047032697.td-b3lyp_6-31g+(d).inp 047032697.td-b3lyp_6-31g+(d).log.xz

047032697.td-b3lyp_6-31+g(d).qchem.inp (generated)

047032697.td-b3lyp_6-31+g(d).gjf (generated)

047032697.td-b3lyp_6-31+g(d).firefly.inp (generated)

047032697.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047032697.mol 047032697.PUBCHEM 047032697.mol (via Jmol)
047032882.b3lyp_6-31g(d).inp

047032882.b3lyp_6-31g(d).qchem.inp (generated)

047032882.b3lyp_6-31g(d).gjf (generated)

047032882.b3lyp_6-31g(d).firefly.inp (generated)

047032882.b3lyp_6-31g(d).smash.inp (generated)

047032882.b3lyp_6-31g(d).nwchem.inp (generated) 047032882.b3lyp_6-31g(d).log.xz 047032882.mol 047032882.PUBCHEM 047032882.mol (via Jmol)
047032966.b3lyp_6-31g(d).inp

047032966.b3lyp_6-31g(d).qchem.inp (generated)

047032966.b3lyp_6-31g(d).gjf (generated)

047032966.b3lyp_6-31g(d).firefly.inp (generated)

047032966.b3lyp_6-31g(d).smash.inp (generated)

047032966.b3lyp_6-31g(d).nwchem.inp (generated) 047032966.b3lyp_6-31g(d).log.xz 047032966.mol 047032966.PUBCHEM 047032966.mol (via Jmol)
047032989.b3lyp_6-31g(d).inp

047032989.b3lyp_6-31g(d).qchem.inp (generated)

047032989.b3lyp_6-31g(d).gjf (generated)

047032989.b3lyp_6-31g(d).firefly.inp (generated)

047032989.b3lyp_6-31g(d).smash.inp (generated)

047032989.b3lyp_6-31g(d).nwchem.inp (generated) 047032989.b3lyp_6-31g(d).log.xz 047032989.td-b3lyp_6-31g+(d).inp 047032989.td-b3lyp_6-31g+(d).log.xz

047032989.td-b3lyp_6-31+g(d).qchem.inp (generated)

047032989.td-b3lyp_6-31+g(d).gjf (generated)

047032989.td-b3lyp_6-31+g(d).firefly.inp (generated)

047032989.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047032989.mol 047032989.PUBCHEM 047032989.mol (via Jmol)
047033041.b3lyp_6-31g(d).inp

047033041.b3lyp_6-31g(d).qchem.inp (generated)

047033041.b3lyp_6-31g(d).gjf (generated)

047033041.b3lyp_6-31g(d).firefly.inp (generated)

047033041.b3lyp_6-31g(d).smash.inp (generated)

047033041.b3lyp_6-31g(d).nwchem.inp (generated) 047033041.b3lyp_6-31g(d).log.xz 047033041.td-b3lyp_6-31g+(d).inp 047033041.td-b3lyp_6-31g+(d).log.xz

047033041.td-b3lyp_6-31+g(d).qchem.inp (generated)

047033041.td-b3lyp_6-31+g(d).gjf (generated)

047033041.td-b3lyp_6-31+g(d).firefly.inp (generated)

047033041.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047033041.mol 047033041.PUBCHEM 047033041.mol (via Jmol)
047033049.b3lyp_6-31g(d).inp

047033049.b3lyp_6-31g(d).qchem.inp (generated)

047033049.b3lyp_6-31g(d).gjf (generated)

047033049.b3lyp_6-31g(d).firefly.inp (generated)

047033049.b3lyp_6-31g(d).smash.inp (generated)

047033049.b3lyp_6-31g(d).nwchem.inp (generated) 047033049.b3lyp_6-31g(d).log.xz 047033049.mol 047033049.PUBCHEM 047033049.mol (via Jmol)
047033053.b3lyp_6-31g(d).inp

047033053.b3lyp_6-31g(d).qchem.inp (generated)

047033053.b3lyp_6-31g(d).gjf (generated)

047033053.b3lyp_6-31g(d).firefly.inp (generated)

047033053.b3lyp_6-31g(d).smash.inp (generated)

047033053.b3lyp_6-31g(d).nwchem.inp (generated) 047033053.b3lyp_6-31g(d).log.xz 047033053.td-b3lyp_6-31g+(d).inp 047033053.td-b3lyp_6-31g+(d).log.xz

047033053.td-b3lyp_6-31+g(d).qchem.inp (generated)

047033053.td-b3lyp_6-31+g(d).gjf (generated)

047033053.td-b3lyp_6-31+g(d).firefly.inp (generated)

047033053.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047033053.mol 047033053.PUBCHEM 047033053.mol (via Jmol)
047033133.b3lyp_6-31g(d).inp

047033133.b3lyp_6-31g(d).qchem.inp (generated)

047033133.b3lyp_6-31g(d).gjf (generated)

047033133.b3lyp_6-31g(d).firefly.inp (generated)

047033133.b3lyp_6-31g(d).smash.inp (generated)

047033133.b3lyp_6-31g(d).nwchem.inp (generated) 047033133.b3lyp_6-31g(d).log.xz 047033133.td-b3lyp_6-31g+(d).inp 047033133.td-b3lyp_6-31g+(d).log.xz

047033133.td-b3lyp_6-31+g(d).qchem.inp (generated)

047033133.td-b3lyp_6-31+g(d).gjf (generated)

047033133.td-b3lyp_6-31+g(d).firefly.inp (generated)

047033133.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047033133.mol 047033133.PUBCHEM 047033133.mol (via Jmol)
047033356.b3lyp_6-31g(d).inp

047033356.b3lyp_6-31g(d).qchem.inp (generated)

047033356.b3lyp_6-31g(d).gjf (generated)

047033356.b3lyp_6-31g(d).firefly.inp (generated)

047033356.b3lyp_6-31g(d).smash.inp (generated)

047033356.b3lyp_6-31g(d).nwchem.inp (generated) 047033356.b3lyp_6-31g(d).log.xz 047033356.td-b3lyp_6-31g+(d).inp 047033356.td-b3lyp_6-31g+(d).log.xz

047033356.td-b3lyp_6-31+g(d).qchem.inp (generated)

047033356.td-b3lyp_6-31+g(d).gjf (generated)

047033356.td-b3lyp_6-31+g(d).firefly.inp (generated)

047033356.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047033356.mol 047033356.PUBCHEM 047033356.mol (via Jmol)
047033362.b3lyp_6-31g(d).inp

047033362.b3lyp_6-31g(d).qchem.inp (generated)

047033362.b3lyp_6-31g(d).gjf (generated)

047033362.b3lyp_6-31g(d).firefly.inp (generated)

047033362.b3lyp_6-31g(d).smash.inp (generated)

047033362.b3lyp_6-31g(d).nwchem.inp (generated) 047033362.b3lyp_6-31g(d).log.xz 047033362.td-b3lyp_6-31g+(d).inp 047033362.td-b3lyp_6-31g+(d).log.xz

047033362.td-b3lyp_6-31+g(d).qchem.inp (generated)

047033362.td-b3lyp_6-31+g(d).gjf (generated)

047033362.td-b3lyp_6-31+g(d).firefly.inp (generated)

047033362.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047033362.mol 047033362.PUBCHEM 047033362.mol (via Jmol)
047033371.b3lyp_6-31g(d).inp

047033371.b3lyp_6-31g(d).qchem.inp (generated)

047033371.b3lyp_6-31g(d).gjf (generated)

047033371.b3lyp_6-31g(d).firefly.inp (generated)

047033371.b3lyp_6-31g(d).smash.inp (generated)

047033371.b3lyp_6-31g(d).nwchem.inp (generated) 047033371.b3lyp_6-31g(d).log.xz 047033371.td-b3lyp_6-31g+(d).inp 047033371.td-b3lyp_6-31g+(d).log.xz

047033371.td-b3lyp_6-31+g(d).qchem.inp (generated)

047033371.td-b3lyp_6-31+g(d).gjf (generated)

047033371.td-b3lyp_6-31+g(d).firefly.inp (generated)

047033371.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047033371.mol 047033371.PUBCHEM 047033371.mol (via Jmol)
047033376.b3lyp_6-31g(d).inp

047033376.b3lyp_6-31g(d).qchem.inp (generated)

047033376.b3lyp_6-31g(d).gjf (generated)

047033376.b3lyp_6-31g(d).firefly.inp (generated)

047033376.b3lyp_6-31g(d).smash.inp (generated)

047033376.b3lyp_6-31g(d).nwchem.inp (generated) 047033376.b3lyp_6-31g(d).log.xz 047033376.td-b3lyp_6-31g+(d).inp 047033376.td-b3lyp_6-31g+(d).log.xz

047033376.td-b3lyp_6-31+g(d).qchem.inp (generated)

047033376.td-b3lyp_6-31+g(d).gjf (generated)

047033376.td-b3lyp_6-31+g(d).firefly.inp (generated)

047033376.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047033376.mol 047033376.PUBCHEM 047033376.mol (via Jmol)
047033550.b3lyp_6-31g(d).inp

047033550.b3lyp_6-31g(d).qchem.inp (generated)

047033550.b3lyp_6-31g(d).gjf (generated)

047033550.b3lyp_6-31g(d).firefly.inp (generated)

047033550.b3lyp_6-31g(d).smash.inp (generated)

047033550.b3lyp_6-31g(d).nwchem.inp (generated) 047033550.b3lyp_6-31g(d).log.xz 047033550.mol 047033550.PUBCHEM 047033550.mol (via Jmol)
047033623.b3lyp_6-31g(d).inp

047033623.b3lyp_6-31g(d).qchem.inp (generated)

047033623.b3lyp_6-31g(d).gjf (generated)

047033623.b3lyp_6-31g(d).firefly.inp (generated)

047033623.b3lyp_6-31g(d).smash.inp (generated)

047033623.b3lyp_6-31g(d).nwchem.inp (generated) 047033623.b3lyp_6-31g(d).log.xz 047033623.td-b3lyp_6-31g+(d).inp 047033623.td-b3lyp_6-31g+(d).log.xz

047033623.td-b3lyp_6-31+g(d).qchem.inp (generated)

047033623.td-b3lyp_6-31+g(d).gjf (generated)

047033623.td-b3lyp_6-31+g(d).firefly.inp (generated)

047033623.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047033623.mol 047033623.PUBCHEM 047033623.mol (via Jmol)
047033741.b3lyp_6-31g(d).inp

047033741.b3lyp_6-31g(d).qchem.inp (generated)

047033741.b3lyp_6-31g(d).gjf (generated)

047033741.b3lyp_6-31g(d).firefly.inp (generated)

047033741.b3lyp_6-31g(d).smash.inp (generated)

047033741.b3lyp_6-31g(d).nwchem.inp (generated) 047033741.b3lyp_6-31g(d).log.xz 047033741.td-b3lyp_6-31g+(d).inp 047033741.td-b3lyp_6-31g+(d).log.xz

047033741.td-b3lyp_6-31+g(d).qchem.inp (generated)

047033741.td-b3lyp_6-31+g(d).gjf (generated)

047033741.td-b3lyp_6-31+g(d).firefly.inp (generated)

047033741.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047033741.mol 047033741.PUBCHEM 047033741.mol (via Jmol)
047033990.b3lyp_6-31g(d).inp

047033990.b3lyp_6-31g(d).qchem.inp (generated)

047033990.b3lyp_6-31g(d).gjf (generated)

047033990.b3lyp_6-31g(d).firefly.inp (generated)

047033990.b3lyp_6-31g(d).smash.inp (generated)

047033990.b3lyp_6-31g(d).nwchem.inp (generated) 047033990.b3lyp_6-31g(d).log.xz 047033990.td-b3lyp_6-31g+(d).inp 047033990.td-b3lyp_6-31g+(d).log.xz

047033990.td-b3lyp_6-31+g(d).qchem.inp (generated)

047033990.td-b3lyp_6-31+g(d).gjf (generated)

047033990.td-b3lyp_6-31+g(d).firefly.inp (generated)

047033990.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047033990.mol 047033990.PUBCHEM 047033990.mol (via Jmol)
047033998.b3lyp_6-31g(d).inp

047033998.b3lyp_6-31g(d).qchem.inp (generated)

047033998.b3lyp_6-31g(d).gjf (generated)

047033998.b3lyp_6-31g(d).firefly.inp (generated)

047033998.b3lyp_6-31g(d).smash.inp (generated)

047033998.b3lyp_6-31g(d).nwchem.inp (generated) 047033998.b3lyp_6-31g(d).log.xz 047033998.mol 047033998.PUBCHEM 047033998.mol (via Jmol)
047034007.b3lyp_6-31g(d).inp

047034007.b3lyp_6-31g(d).qchem.inp (generated)

047034007.b3lyp_6-31g(d).gjf (generated)

047034007.b3lyp_6-31g(d).firefly.inp (generated)

047034007.b3lyp_6-31g(d).smash.inp (generated)

047034007.b3lyp_6-31g(d).nwchem.inp (generated) 047034007.b3lyp_6-31g(d).log.xz 047034007.td-b3lyp_6-31g+(d).inp 047034007.td-b3lyp_6-31g+(d).log.xz

047034007.td-b3lyp_6-31+g(d).qchem.inp (generated)

047034007.td-b3lyp_6-31+g(d).gjf (generated)

047034007.td-b3lyp_6-31+g(d).firefly.inp (generated)

047034007.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047034007.mol 047034007.PUBCHEM 047034007.mol (via Jmol)
047034016.b3lyp_6-31g(d).inp

047034016.b3lyp_6-31g(d).qchem.inp (generated)

047034016.b3lyp_6-31g(d).gjf (generated)

047034016.b3lyp_6-31g(d).firefly.inp (generated)

047034016.b3lyp_6-31g(d).smash.inp (generated)

047034016.b3lyp_6-31g(d).nwchem.inp (generated) 047034016.b3lyp_6-31g(d).log.xz 047034016.td-b3lyp_6-31g+(d).inp 047034016.td-b3lyp_6-31g+(d).log.xz

047034016.td-b3lyp_6-31+g(d).qchem.inp (generated)

047034016.td-b3lyp_6-31+g(d).gjf (generated)

047034016.td-b3lyp_6-31+g(d).firefly.inp (generated)

047034016.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047034016.mol 047034016.PUBCHEM 047034016.mol (via Jmol)
047034026.b3lyp_6-31g(d).inp

047034026.b3lyp_6-31g(d).qchem.inp (generated)

047034026.b3lyp_6-31g(d).gjf (generated)

047034026.b3lyp_6-31g(d).firefly.inp (generated)

047034026.b3lyp_6-31g(d).smash.inp (generated)

047034026.b3lyp_6-31g(d).nwchem.inp (generated) 047034026.b3lyp_6-31g(d).log.xz 047034026.mol 047034026.PUBCHEM 047034026.mol (via Jmol)
047034241.b3lyp_6-31g(d).inp

047034241.b3lyp_6-31g(d).qchem.inp (generated)

047034241.b3lyp_6-31g(d).gjf (generated)

047034241.b3lyp_6-31g(d).firefly.inp (generated)

047034241.b3lyp_6-31g(d).smash.inp (generated)

047034241.b3lyp_6-31g(d).nwchem.inp (generated) 047034241.b3lyp_6-31g(d).log.xz 047034241.td-b3lyp_6-31g+(d).inp 047034241.td-b3lyp_6-31g+(d).log.xz

047034241.td-b3lyp_6-31+g(d).qchem.inp (generated)

047034241.td-b3lyp_6-31+g(d).gjf (generated)

047034241.td-b3lyp_6-31+g(d).firefly.inp (generated)

047034241.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047034241.mol 047034241.PUBCHEM 047034241.mol (via Jmol)
047034245.b3lyp_6-31g(d).inp

047034245.b3lyp_6-31g(d).qchem.inp (generated)

047034245.b3lyp_6-31g(d).gjf (generated)

047034245.b3lyp_6-31g(d).firefly.inp (generated)

047034245.b3lyp_6-31g(d).smash.inp (generated)

047034245.b3lyp_6-31g(d).nwchem.inp (generated) 047034245.b3lyp_6-31g(d).log.xz 047034245.td-b3lyp_6-31g+(d).inp 047034245.td-b3lyp_6-31g+(d).log.xz

047034245.td-b3lyp_6-31+g(d).qchem.inp (generated)

047034245.td-b3lyp_6-31+g(d).gjf (generated)

047034245.td-b3lyp_6-31+g(d).firefly.inp (generated)

047034245.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047034245.mol 047034245.PUBCHEM 047034245.mol (via Jmol)
047034425.b3lyp_6-31g(d).inp

047034425.b3lyp_6-31g(d).qchem.inp (generated)

047034425.b3lyp_6-31g(d).gjf (generated)

047034425.b3lyp_6-31g(d).firefly.inp (generated)

047034425.b3lyp_6-31g(d).smash.inp (generated)

047034425.b3lyp_6-31g(d).nwchem.inp (generated) 047034425.b3lyp_6-31g(d).log.xz 047034425.td-b3lyp_6-31g+(d).inp 047034425.td-b3lyp_6-31g+(d).log.xz

047034425.td-b3lyp_6-31+g(d).qchem.inp (generated)

047034425.td-b3lyp_6-31+g(d).gjf (generated)

047034425.td-b3lyp_6-31+g(d).firefly.inp (generated)

047034425.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047034425.mol 047034425.PUBCHEM 047034425.mol (via Jmol)
047034426.b3lyp_6-31g(d).inp

047034426.b3lyp_6-31g(d).qchem.inp (generated)

047034426.b3lyp_6-31g(d).gjf (generated)

047034426.b3lyp_6-31g(d).firefly.inp (generated)

047034426.b3lyp_6-31g(d).smash.inp (generated)

047034426.b3lyp_6-31g(d).nwchem.inp (generated) 047034426.b3lyp_6-31g(d).log.xz 047034426.td-b3lyp_6-31g+(d).inp 047034426.td-b3lyp_6-31g+(d).log.xz

047034426.td-b3lyp_6-31+g(d).qchem.inp (generated)

047034426.td-b3lyp_6-31+g(d).gjf (generated)

047034426.td-b3lyp_6-31+g(d).firefly.inp (generated)

047034426.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047034426.mol 047034426.PUBCHEM 047034426.mol (via Jmol)
047034625.b3lyp_6-31g(d).inp

047034625.b3lyp_6-31g(d).qchem.inp (generated)

047034625.b3lyp_6-31g(d).gjf (generated)

047034625.b3lyp_6-31g(d).firefly.inp (generated)

047034625.b3lyp_6-31g(d).smash.inp (generated)

047034625.b3lyp_6-31g(d).nwchem.inp (generated) 047034625.b3lyp_6-31g(d).log.xz 047034625.mol 047034625.PUBCHEM 047034625.mol (via Jmol)
047034632.b3lyp_6-31g(d).inp

047034632.b3lyp_6-31g(d).qchem.inp (generated)

047034632.b3lyp_6-31g(d).gjf (generated)

047034632.b3lyp_6-31g(d).firefly.inp (generated)

047034632.b3lyp_6-31g(d).smash.inp (generated)

047034632.b3lyp_6-31g(d).nwchem.inp (generated) 047034632.b3lyp_6-31g(d).log.xz 047034632.mol 047034632.PUBCHEM 047034632.mol (via Jmol)
047034633.b3lyp_6-31g(d).inp

047034633.b3lyp_6-31g(d).qchem.inp (generated)

047034633.b3lyp_6-31g(d).gjf (generated)

047034633.b3lyp_6-31g(d).firefly.inp (generated)

047034633.b3lyp_6-31g(d).smash.inp (generated)

047034633.b3lyp_6-31g(d).nwchem.inp (generated) 047034633.b3lyp_6-31g(d).log.xz 047034633.td-b3lyp_6-31g+(d).inp 047034633.td-b3lyp_6-31g+(d).log.xz

047034633.td-b3lyp_6-31+g(d).qchem.inp (generated)

047034633.td-b3lyp_6-31+g(d).gjf (generated)

047034633.td-b3lyp_6-31+g(d).firefly.inp (generated)

047034633.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047034633.mol 047034633.PUBCHEM 047034633.mol (via Jmol)
047034637.b3lyp_6-31g(d).inp

047034637.b3lyp_6-31g(d).qchem.inp (generated)

047034637.b3lyp_6-31g(d).gjf (generated)

047034637.b3lyp_6-31g(d).firefly.inp (generated)

047034637.b3lyp_6-31g(d).smash.inp (generated)

047034637.b3lyp_6-31g(d).nwchem.inp (generated) 047034637.b3lyp_6-31g(d).log.xz 047034637.td-b3lyp_6-31g+(d).inp 047034637.td-b3lyp_6-31g+(d).log.xz

047034637.td-b3lyp_6-31+g(d).qchem.inp (generated)

047034637.td-b3lyp_6-31+g(d).gjf (generated)

047034637.td-b3lyp_6-31+g(d).firefly.inp (generated)

047034637.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047034637.mol 047034637.PUBCHEM 047034637.mol (via Jmol)
047034823.b3lyp_6-31g(d).inp

047034823.b3lyp_6-31g(d).qchem.inp (generated)

047034823.b3lyp_6-31g(d).gjf (generated)

047034823.b3lyp_6-31g(d).firefly.inp (generated)

047034823.b3lyp_6-31g(d).smash.inp (generated)

047034823.b3lyp_6-31g(d).nwchem.inp (generated) 047034823.b3lyp_6-31g(d).log.xz 047034823.td-b3lyp_6-31g+(d).inp 047034823.td-b3lyp_6-31g+(d).log.xz

047034823.td-b3lyp_6-31+g(d).qchem.inp (generated)

047034823.td-b3lyp_6-31+g(d).gjf (generated)

047034823.td-b3lyp_6-31+g(d).firefly.inp (generated)

047034823.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047034823.mol 047034823.PUBCHEM 047034823.mol (via Jmol)
047034826.b3lyp_6-31g(d).inp

047034826.b3lyp_6-31g(d).qchem.inp (generated)

047034826.b3lyp_6-31g(d).gjf (generated)

047034826.b3lyp_6-31g(d).firefly.inp (generated)

047034826.b3lyp_6-31g(d).smash.inp (generated)

047034826.b3lyp_6-31g(d).nwchem.inp (generated) 047034826.b3lyp_6-31g(d).log.xz 047034826.td-b3lyp_6-31g+(d).inp 047034826.td-b3lyp_6-31g+(d).log.xz

047034826.td-b3lyp_6-31+g(d).qchem.inp (generated)

047034826.td-b3lyp_6-31+g(d).gjf (generated)

047034826.td-b3lyp_6-31+g(d).firefly.inp (generated)

047034826.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047034826.mol 047034826.PUBCHEM 047034826.mol (via Jmol)
047034836.b3lyp_6-31g(d).inp

047034836.b3lyp_6-31g(d).qchem.inp (generated)

047034836.b3lyp_6-31g(d).gjf (generated)

047034836.b3lyp_6-31g(d).firefly.inp (generated)

047034836.b3lyp_6-31g(d).smash.inp (generated)

047034836.b3lyp_6-31g(d).nwchem.inp (generated) 047034836.b3lyp_6-31g(d).log.xz 047034836.td-b3lyp_6-31g+(d).inp 047034836.td-b3lyp_6-31g+(d).log.xz

047034836.td-b3lyp_6-31+g(d).qchem.inp (generated)

047034836.td-b3lyp_6-31+g(d).gjf (generated)

047034836.td-b3lyp_6-31+g(d).firefly.inp (generated)

047034836.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047034836.mol 047034836.PUBCHEM 047034836.mol (via Jmol)
047034848.b3lyp_6-31g(d).inp

047034848.b3lyp_6-31g(d).qchem.inp (generated)

047034848.b3lyp_6-31g(d).gjf (generated)

047034848.b3lyp_6-31g(d).firefly.inp (generated)

047034848.b3lyp_6-31g(d).smash.inp (generated)

047034848.b3lyp_6-31g(d).nwchem.inp (generated) 047034848.b3lyp_6-31g(d).log.xz 047034848.mol 047034848.PUBCHEM 047034848.mol (via Jmol)
047034855.b3lyp_6-31g(d).inp

047034855.b3lyp_6-31g(d).qchem.inp (generated)

047034855.b3lyp_6-31g(d).gjf (generated)

047034855.b3lyp_6-31g(d).firefly.inp (generated)

047034855.b3lyp_6-31g(d).smash.inp (generated)

047034855.b3lyp_6-31g(d).nwchem.inp (generated) 047034855.b3lyp_6-31g(d).log.xz 047034855.td-b3lyp_6-31g+(d).inp 047034855.td-b3lyp_6-31g+(d).log.xz

047034855.td-b3lyp_6-31+g(d).qchem.inp (generated)

047034855.td-b3lyp_6-31+g(d).gjf (generated)

047034855.td-b3lyp_6-31+g(d).firefly.inp (generated)

047034855.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047034855.mol 047034855.PUBCHEM 047034855.mol (via Jmol)
047034914.b3lyp_6-31g(d).inp

047034914.b3lyp_6-31g(d).qchem.inp (generated)

047034914.b3lyp_6-31g(d).gjf (generated)

047034914.b3lyp_6-31g(d).firefly.inp (generated)

047034914.b3lyp_6-31g(d).smash.inp (generated)

047034914.b3lyp_6-31g(d).nwchem.inp (generated) 047034914.b3lyp_6-31g(d).log.xz 047034914.mol 047034914.PUBCHEM 047034914.mol (via Jmol)
047035055.b3lyp_6-31g(d).inp

047035055.b3lyp_6-31g(d).qchem.inp (generated)

047035055.b3lyp_6-31g(d).gjf (generated)

047035055.b3lyp_6-31g(d).firefly.inp (generated)

047035055.b3lyp_6-31g(d).smash.inp (generated)

047035055.b3lyp_6-31g(d).nwchem.inp (generated) 047035055.b3lyp_6-31g(d).log.xz 047035055.mol 047035055.PUBCHEM 047035055.mol (via Jmol)
047035056.b3lyp_6-31g(d).inp

047035056.b3lyp_6-31g(d).qchem.inp (generated)

047035056.b3lyp_6-31g(d).gjf (generated)

047035056.b3lyp_6-31g(d).firefly.inp (generated)

047035056.b3lyp_6-31g(d).smash.inp (generated)

047035056.b3lyp_6-31g(d).nwchem.inp (generated) 047035056.b3lyp_6-31g(d).log.xz 047035056.mol 047035056.PUBCHEM 047035056.mol (via Jmol)
047035057.b3lyp_6-31g(d).inp

047035057.b3lyp_6-31g(d).qchem.inp (generated)

047035057.b3lyp_6-31g(d).gjf (generated)

047035057.b3lyp_6-31g(d).firefly.inp (generated)

047035057.b3lyp_6-31g(d).smash.inp (generated)

047035057.b3lyp_6-31g(d).nwchem.inp (generated) 047035057.b3lyp_6-31g(d).log.xz 047035057.td-b3lyp_6-31g+(d).inp 047035057.td-b3lyp_6-31g+(d).log.xz

047035057.td-b3lyp_6-31+g(d).qchem.inp (generated)

047035057.td-b3lyp_6-31+g(d).gjf (generated)

047035057.td-b3lyp_6-31+g(d).firefly.inp (generated)

047035057.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047035057.mol 047035057.PUBCHEM 047035057.mol (via Jmol)
047035133.b3lyp_6-31g(d).inp

047035133.b3lyp_6-31g(d).qchem.inp (generated)

047035133.b3lyp_6-31g(d).gjf (generated)

047035133.b3lyp_6-31g(d).firefly.inp (generated)

047035133.b3lyp_6-31g(d).smash.inp (generated)

047035133.b3lyp_6-31g(d).nwchem.inp (generated) 047035133.b3lyp_6-31g(d).log.xz 047035133.td-b3lyp_6-31g+(d).inp 047035133.td-b3lyp_6-31g+(d).log.xz

047035133.td-b3lyp_6-31+g(d).qchem.inp (generated)

047035133.td-b3lyp_6-31+g(d).gjf (generated)

047035133.td-b3lyp_6-31+g(d).firefly.inp (generated)

047035133.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047035133.mol 047035133.PUBCHEM 047035133.mol (via Jmol)
047035134.b3lyp_6-31g(d).inp

047035134.b3lyp_6-31g(d).qchem.inp (generated)

047035134.b3lyp_6-31g(d).gjf (generated)

047035134.b3lyp_6-31g(d).firefly.inp (generated)

047035134.b3lyp_6-31g(d).smash.inp (generated)

047035134.b3lyp_6-31g(d).nwchem.inp (generated) 047035134.b3lyp_6-31g(d).log.xz 047035134.td-b3lyp_6-31g+(d).inp 047035134.td-b3lyp_6-31g+(d).log.xz

047035134.td-b3lyp_6-31+g(d).qchem.inp (generated)

047035134.td-b3lyp_6-31+g(d).gjf (generated)

047035134.td-b3lyp_6-31+g(d).firefly.inp (generated)

047035134.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047035134.mol 047035134.PUBCHEM 047035134.mol (via Jmol)
047035135.b3lyp_6-31g(d).inp

047035135.b3lyp_6-31g(d).qchem.inp (generated)

047035135.b3lyp_6-31g(d).gjf (generated)

047035135.b3lyp_6-31g(d).firefly.inp (generated)

047035135.b3lyp_6-31g(d).smash.inp (generated)

047035135.b3lyp_6-31g(d).nwchem.inp (generated) 047035135.b3lyp_6-31g(d).log.xz 047035135.td-b3lyp_6-31g+(d).inp 047035135.td-b3lyp_6-31g+(d).log.xz

047035135.td-b3lyp_6-31+g(d).qchem.inp (generated)

047035135.td-b3lyp_6-31+g(d).gjf (generated)

047035135.td-b3lyp_6-31+g(d).firefly.inp (generated)

047035135.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047035135.mol 047035135.PUBCHEM 047035135.mol (via Jmol)
047035136.b3lyp_6-31g(d).inp

047035136.b3lyp_6-31g(d).qchem.inp (generated)

047035136.b3lyp_6-31g(d).gjf (generated)

047035136.b3lyp_6-31g(d).firefly.inp (generated)

047035136.b3lyp_6-31g(d).smash.inp (generated)

047035136.b3lyp_6-31g(d).nwchem.inp (generated) 047035136.b3lyp_6-31g(d).log.xz 047035136.mol 047035136.PUBCHEM 047035136.mol (via Jmol)
047035137.b3lyp_6-31g(d).inp

047035137.b3lyp_6-31g(d).qchem.inp (generated)

047035137.b3lyp_6-31g(d).gjf (generated)

047035137.b3lyp_6-31g(d).firefly.inp (generated)

047035137.b3lyp_6-31g(d).smash.inp (generated)

047035137.b3lyp_6-31g(d).nwchem.inp (generated) 047035137.b3lyp_6-31g(d).log.xz 047035137.mol 047035137.PUBCHEM 047035137.mol (via Jmol)
047035139.b3lyp_6-31g(d).inp

047035139.b3lyp_6-31g(d).qchem.inp (generated)

047035139.b3lyp_6-31g(d).gjf (generated)

047035139.b3lyp_6-31g(d).firefly.inp (generated)

047035139.b3lyp_6-31g(d).smash.inp (generated)

047035139.b3lyp_6-31g(d).nwchem.inp (generated) 047035139.b3lyp_6-31g(d).log.xz 047035139.mol 047035139.PUBCHEM 047035139.mol (via Jmol)
047035140.b3lyp_6-31g(d).inp

047035140.b3lyp_6-31g(d).qchem.inp (generated)

047035140.b3lyp_6-31g(d).gjf (generated)

047035140.b3lyp_6-31g(d).firefly.inp (generated)

047035140.b3lyp_6-31g(d).smash.inp (generated)

047035140.b3lyp_6-31g(d).nwchem.inp (generated) 047035140.b3lyp_6-31g(d).log.xz 047035140.mol 047035140.PUBCHEM 047035140.mol (via Jmol)
047035143.b3lyp_6-31g(d).inp

047035143.b3lyp_6-31g(d).qchem.inp (generated)

047035143.b3lyp_6-31g(d).gjf (generated)

047035143.b3lyp_6-31g(d).firefly.inp (generated)

047035143.b3lyp_6-31g(d).smash.inp (generated)

047035143.b3lyp_6-31g(d).nwchem.inp (generated) 047035143.b3lyp_6-31g(d).log.xz 047035143.td-b3lyp_6-31g+(d).inp 047035143.td-b3lyp_6-31g+(d).log.xz

047035143.td-b3lyp_6-31+g(d).qchem.inp (generated)

047035143.td-b3lyp_6-31+g(d).gjf (generated)

047035143.td-b3lyp_6-31+g(d).firefly.inp (generated)

047035143.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047035143.mol 047035143.PUBCHEM 047035143.mol (via Jmol)
047035146.b3lyp_6-31g(d).inp

047035146.b3lyp_6-31g(d).qchem.inp (generated)

047035146.b3lyp_6-31g(d).gjf (generated)

047035146.b3lyp_6-31g(d).firefly.inp (generated)

047035146.b3lyp_6-31g(d).smash.inp (generated)

047035146.b3lyp_6-31g(d).nwchem.inp (generated) 047035146.b3lyp_6-31g(d).log.xz 047035146.td-b3lyp_6-31g+(d).inp 047035146.td-b3lyp_6-31g+(d).log.xz

047035146.td-b3lyp_6-31+g(d).qchem.inp (generated)

047035146.td-b3lyp_6-31+g(d).gjf (generated)

047035146.td-b3lyp_6-31+g(d).firefly.inp (generated)

047035146.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047035146.mol 047035146.PUBCHEM 047035146.mol (via Jmol)
047035147.b3lyp_6-31g(d).inp

047035147.b3lyp_6-31g(d).qchem.inp (generated)

047035147.b3lyp_6-31g(d).gjf (generated)

047035147.b3lyp_6-31g(d).firefly.inp (generated)

047035147.b3lyp_6-31g(d).smash.inp (generated)

047035147.b3lyp_6-31g(d).nwchem.inp (generated) 047035147.b3lyp_6-31g(d).log.xz 047035147.td-b3lyp_6-31g+(d).inp 047035147.td-b3lyp_6-31g+(d).log.xz

047035147.td-b3lyp_6-31+g(d).qchem.inp (generated)

047035147.td-b3lyp_6-31+g(d).gjf (generated)

047035147.td-b3lyp_6-31+g(d).firefly.inp (generated)

047035147.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047035147.mol 047035147.PUBCHEM 047035147.mol (via Jmol)
047035151.b3lyp_6-31g(d).inp

047035151.b3lyp_6-31g(d).qchem.inp (generated)

047035151.b3lyp_6-31g(d).gjf (generated)

047035151.b3lyp_6-31g(d).firefly.inp (generated)

047035151.b3lyp_6-31g(d).smash.inp (generated)

047035151.b3lyp_6-31g(d).nwchem.inp (generated) 047035151.b3lyp_6-31g(d).log.xz 047035151.td-b3lyp_6-31g+(d).inp 047035151.td-b3lyp_6-31g+(d).log.xz

047035151.td-b3lyp_6-31+g(d).qchem.inp (generated)

047035151.td-b3lyp_6-31+g(d).gjf (generated)

047035151.td-b3lyp_6-31+g(d).firefly.inp (generated)

047035151.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047035151.mol 047035151.PUBCHEM 047035151.mol (via Jmol)
047035152.b3lyp_6-31g(d).inp

047035152.b3lyp_6-31g(d).qchem.inp (generated)

047035152.b3lyp_6-31g(d).gjf (generated)

047035152.b3lyp_6-31g(d).firefly.inp (generated)

047035152.b3lyp_6-31g(d).smash.inp (generated)

047035152.b3lyp_6-31g(d).nwchem.inp (generated) 047035152.b3lyp_6-31g(d).log.xz 047035152.td-b3lyp_6-31g+(d).inp 047035152.td-b3lyp_6-31g+(d).log.xz

047035152.td-b3lyp_6-31+g(d).qchem.inp (generated)

047035152.td-b3lyp_6-31+g(d).gjf (generated)

047035152.td-b3lyp_6-31+g(d).firefly.inp (generated)

047035152.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047035152.mol 047035152.PUBCHEM 047035152.mol (via Jmol)
047035156.b3lyp_6-31g(d).inp

047035156.b3lyp_6-31g(d).qchem.inp (generated)

047035156.b3lyp_6-31g(d).gjf (generated)

047035156.b3lyp_6-31g(d).firefly.inp (generated)

047035156.b3lyp_6-31g(d).smash.inp (generated)

047035156.b3lyp_6-31g(d).nwchem.inp (generated) 047035156.b3lyp_6-31g(d).log.xz 047035156.td-b3lyp_6-31g+(d).inp 047035156.td-b3lyp_6-31g+(d).log.xz

047035156.td-b3lyp_6-31+g(d).qchem.inp (generated)

047035156.td-b3lyp_6-31+g(d).gjf (generated)

047035156.td-b3lyp_6-31+g(d).firefly.inp (generated)

047035156.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047035156.mol 047035156.PUBCHEM 047035156.mol (via Jmol)
047035293.b3lyp_6-31g(d).inp

047035293.b3lyp_6-31g(d).qchem.inp (generated)

047035293.b3lyp_6-31g(d).gjf (generated)

047035293.b3lyp_6-31g(d).firefly.inp (generated)

047035293.b3lyp_6-31g(d).smash.inp (generated)

047035293.b3lyp_6-31g(d).nwchem.inp (generated) 047035293.b3lyp_6-31g(d).log.xz 047035293.td-b3lyp_6-31g+(d).inp 047035293.td-b3lyp_6-31g+(d).log.xz

047035293.td-b3lyp_6-31+g(d).qchem.inp (generated)

047035293.td-b3lyp_6-31+g(d).gjf (generated)

047035293.td-b3lyp_6-31+g(d).firefly.inp (generated)

047035293.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047035293.mol 047035293.PUBCHEM 047035293.mol (via Jmol)
047035303.b3lyp_6-31g(d).inp

047035303.b3lyp_6-31g(d).qchem.inp (generated)

047035303.b3lyp_6-31g(d).gjf (generated)

047035303.b3lyp_6-31g(d).firefly.inp (generated)

047035303.b3lyp_6-31g(d).smash.inp (generated)

047035303.b3lyp_6-31g(d).nwchem.inp (generated) 047035303.b3lyp_6-31g(d).log.xz 047035303.td-b3lyp_6-31g+(d).inp 047035303.td-b3lyp_6-31g+(d).log.xz

047035303.td-b3lyp_6-31+g(d).qchem.inp (generated)

047035303.td-b3lyp_6-31+g(d).gjf (generated)

047035303.td-b3lyp_6-31+g(d).firefly.inp (generated)

047035303.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047035303.mol 047035303.PUBCHEM 047035303.mol (via Jmol)
047035308.b3lyp_6-31g(d).inp

047035308.b3lyp_6-31g(d).qchem.inp (generated)

047035308.b3lyp_6-31g(d).gjf (generated)

047035308.b3lyp_6-31g(d).firefly.inp (generated)

047035308.b3lyp_6-31g(d).smash.inp (generated)

047035308.b3lyp_6-31g(d).nwchem.inp (generated) 047035308.b3lyp_6-31g(d).log.xz 047035308.td-b3lyp_6-31g+(d).inp 047035308.td-b3lyp_6-31g+(d).log.xz

047035308.td-b3lyp_6-31+g(d).qchem.inp (generated)

047035308.td-b3lyp_6-31+g(d).gjf (generated)

047035308.td-b3lyp_6-31+g(d).firefly.inp (generated)

047035308.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047035308.mol 047035308.PUBCHEM 047035308.mol (via Jmol)
047035597.b3lyp_6-31g(d).inp

047035597.b3lyp_6-31g(d).qchem.inp (generated)

047035597.b3lyp_6-31g(d).gjf (generated)

047035597.b3lyp_6-31g(d).firefly.inp (generated)

047035597.b3lyp_6-31g(d).smash.inp (generated)

047035597.b3lyp_6-31g(d).nwchem.inp (generated) 047035597.b3lyp_6-31g(d).log.xz 047035597.td-b3lyp_6-31g+(d).inp 047035597.td-b3lyp_6-31g+(d).log.xz

047035597.td-b3lyp_6-31+g(d).qchem.inp (generated)

047035597.td-b3lyp_6-31+g(d).gjf (generated)

047035597.td-b3lyp_6-31+g(d).firefly.inp (generated)

047035597.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047035597.mol 047035597.PUBCHEM 047035597.mol (via Jmol)
047035670.b3lyp_6-31g(d).inp

047035670.b3lyp_6-31g(d).qchem.inp (generated)

047035670.b3lyp_6-31g(d).gjf (generated)

047035670.b3lyp_6-31g(d).firefly.inp (generated)

047035670.b3lyp_6-31g(d).smash.inp (generated)

047035670.b3lyp_6-31g(d).nwchem.inp (generated) 047035670.b3lyp_6-31g(d).log.xz 047035670.mol 047035670.PUBCHEM 047035670.mol (via Jmol)
047035671.b3lyp_6-31g(d).inp

047035671.b3lyp_6-31g(d).qchem.inp (generated)

047035671.b3lyp_6-31g(d).gjf (generated)

047035671.b3lyp_6-31g(d).firefly.inp (generated)

047035671.b3lyp_6-31g(d).smash.inp (generated)

047035671.b3lyp_6-31g(d).nwchem.inp (generated) 047035671.b3lyp_6-31g(d).log.xz 047035671.td-b3lyp_6-31g+(d).inp 047035671.td-b3lyp_6-31g+(d).log.xz

047035671.td-b3lyp_6-31+g(d).qchem.inp (generated)

047035671.td-b3lyp_6-31+g(d).gjf (generated)

047035671.td-b3lyp_6-31+g(d).firefly.inp (generated)

047035671.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047035671.mol 047035671.PUBCHEM 047035671.mol (via Jmol)
047035672.b3lyp_6-31g(d).inp

047035672.b3lyp_6-31g(d).qchem.inp (generated)

047035672.b3lyp_6-31g(d).gjf (generated)

047035672.b3lyp_6-31g(d).firefly.inp (generated)

047035672.b3lyp_6-31g(d).smash.inp (generated)

047035672.b3lyp_6-31g(d).nwchem.inp (generated) 047035672.b3lyp_6-31g(d).log.xz 047035672.td-b3lyp_6-31g+(d).inp 047035672.td-b3lyp_6-31g+(d).log.xz

047035672.td-b3lyp_6-31+g(d).qchem.inp (generated)

047035672.td-b3lyp_6-31+g(d).gjf (generated)

047035672.td-b3lyp_6-31+g(d).firefly.inp (generated)

047035672.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047035672.mol 047035672.PUBCHEM 047035672.mol (via Jmol)
047035683.b3lyp_6-31g(d).inp

047035683.b3lyp_6-31g(d).qchem.inp (generated)

047035683.b3lyp_6-31g(d).gjf (generated)

047035683.b3lyp_6-31g(d).firefly.inp (generated)

047035683.b3lyp_6-31g(d).smash.inp (generated)

047035683.b3lyp_6-31g(d).nwchem.inp (generated) 047035683.b3lyp_6-31g(d).log.xz 047035683.mol 047035683.PUBCHEM 047035683.mol (via Jmol)
047035760.b3lyp_6-31g(d).inp

047035760.b3lyp_6-31g(d).qchem.inp (generated)

047035760.b3lyp_6-31g(d).gjf (generated)

047035760.b3lyp_6-31g(d).firefly.inp (generated)

047035760.b3lyp_6-31g(d).smash.inp (generated)

047035760.b3lyp_6-31g(d).nwchem.inp (generated) 047035760.b3lyp_6-31g(d).log.xz 047035760.td-b3lyp_6-31g+(d).inp 047035760.td-b3lyp_6-31g+(d).log.xz

047035760.td-b3lyp_6-31+g(d).qchem.inp (generated)

047035760.td-b3lyp_6-31+g(d).gjf (generated)

047035760.td-b3lyp_6-31+g(d).firefly.inp (generated)

047035760.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047035760.mol 047035760.PUBCHEM 047035760.mol (via Jmol)
047035803.b3lyp_6-31g(d).inp

047035803.b3lyp_6-31g(d).qchem.inp (generated)

047035803.b3lyp_6-31g(d).gjf (generated)

047035803.b3lyp_6-31g(d).firefly.inp (generated)

047035803.b3lyp_6-31g(d).smash.inp (generated)

047035803.b3lyp_6-31g(d).nwchem.inp (generated) 047035803.b3lyp_6-31g(d).log.xz 047035803.td-b3lyp_6-31g+(d).inp 047035803.td-b3lyp_6-31g+(d).log.xz

047035803.td-b3lyp_6-31+g(d).qchem.inp (generated)

047035803.td-b3lyp_6-31+g(d).gjf (generated)

047035803.td-b3lyp_6-31+g(d).firefly.inp (generated)

047035803.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047035803.mol 047035803.PUBCHEM 047035803.mol (via Jmol)
047035816.b3lyp_6-31g(d).inp

047035816.b3lyp_6-31g(d).qchem.inp (generated)

047035816.b3lyp_6-31g(d).gjf (generated)

047035816.b3lyp_6-31g(d).firefly.inp (generated)

047035816.b3lyp_6-31g(d).smash.inp (generated)

047035816.b3lyp_6-31g(d).nwchem.inp (generated) 047035816.b3lyp_6-31g(d).log.xz 047035816.td-b3lyp_6-31g+(d).inp 047035816.td-b3lyp_6-31g+(d).log.xz

047035816.td-b3lyp_6-31+g(d).qchem.inp (generated)

047035816.td-b3lyp_6-31+g(d).gjf (generated)

047035816.td-b3lyp_6-31+g(d).firefly.inp (generated)

047035816.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047035816.mol 047035816.PUBCHEM 047035816.mol (via Jmol)
047035846.b3lyp_6-31g(d).inp

047035846.b3lyp_6-31g(d).qchem.inp (generated)

047035846.b3lyp_6-31g(d).gjf (generated)

047035846.b3lyp_6-31g(d).firefly.inp (generated)

047035846.b3lyp_6-31g(d).smash.inp (generated)

047035846.b3lyp_6-31g(d).nwchem.inp (generated) 047035846.b3lyp_6-31g(d).log.xz 047035846.td-b3lyp_6-31g+(d).inp 047035846.td-b3lyp_6-31g+(d).log.xz

047035846.td-b3lyp_6-31+g(d).qchem.inp (generated)

047035846.td-b3lyp_6-31+g(d).gjf (generated)

047035846.td-b3lyp_6-31+g(d).firefly.inp (generated)

047035846.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047035846.mol 047035846.PUBCHEM 047035846.mol (via Jmol)
047035848.b3lyp_6-31g(d).inp

047035848.b3lyp_6-31g(d).qchem.inp (generated)

047035848.b3lyp_6-31g(d).gjf (generated)

047035848.b3lyp_6-31g(d).firefly.inp (generated)

047035848.b3lyp_6-31g(d).smash.inp (generated)

047035848.b3lyp_6-31g(d).nwchem.inp (generated) 047035848.b3lyp_6-31g(d).log.xz 047035848.mol 047035848.PUBCHEM 047035848.mol (via Jmol)
047035956.b3lyp_6-31g(d).inp

047035956.b3lyp_6-31g(d).qchem.inp (generated)

047035956.b3lyp_6-31g(d).gjf (generated)

047035956.b3lyp_6-31g(d).firefly.inp (generated)

047035956.b3lyp_6-31g(d).smash.inp (generated)

047035956.b3lyp_6-31g(d).nwchem.inp (generated) 047035956.b3lyp_6-31g(d).log.xz 047035956.td-b3lyp_6-31g+(d).inp 047035956.td-b3lyp_6-31g+(d).log.xz

047035956.td-b3lyp_6-31+g(d).qchem.inp (generated)

047035956.td-b3lyp_6-31+g(d).gjf (generated)

047035956.td-b3lyp_6-31+g(d).firefly.inp (generated)

047035956.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047035956.mol 047035956.PUBCHEM 047035956.mol (via Jmol)
047036086.b3lyp_6-31g(d).inp

047036086.b3lyp_6-31g(d).qchem.inp (generated)

047036086.b3lyp_6-31g(d).gjf (generated)

047036086.b3lyp_6-31g(d).firefly.inp (generated)

047036086.b3lyp_6-31g(d).smash.inp (generated)

047036086.b3lyp_6-31g(d).nwchem.inp (generated) 047036086.b3lyp_6-31g(d).log.xz 047036086.td-b3lyp_6-31g+(d).inp 047036086.td-b3lyp_6-31g+(d).log.xz

047036086.td-b3lyp_6-31+g(d).qchem.inp (generated)

047036086.td-b3lyp_6-31+g(d).gjf (generated)

047036086.td-b3lyp_6-31+g(d).firefly.inp (generated)

047036086.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047036086.mol 047036086.PUBCHEM 047036086.mol (via Jmol)
047036089.b3lyp_6-31g(d).inp

047036089.b3lyp_6-31g(d).qchem.inp (generated)

047036089.b3lyp_6-31g(d).gjf (generated)

047036089.b3lyp_6-31g(d).firefly.inp (generated)

047036089.b3lyp_6-31g(d).smash.inp (generated)

047036089.b3lyp_6-31g(d).nwchem.inp (generated) 047036089.b3lyp_6-31g(d).log.xz 047036089.td-b3lyp_6-31g+(d).inp 047036089.td-b3lyp_6-31g+(d).log.xz

047036089.td-b3lyp_6-31+g(d).qchem.inp (generated)

047036089.td-b3lyp_6-31+g(d).gjf (generated)

047036089.td-b3lyp_6-31+g(d).firefly.inp (generated)

047036089.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047036089.mol 047036089.PUBCHEM 047036089.mol (via Jmol)
047036124.b3lyp_6-31g(d).inp

047036124.b3lyp_6-31g(d).qchem.inp (generated)

047036124.b3lyp_6-31g(d).gjf (generated)

047036124.b3lyp_6-31g(d).firefly.inp (generated)

047036124.b3lyp_6-31g(d).smash.inp (generated)

047036124.b3lyp_6-31g(d).nwchem.inp (generated) 047036124.b3lyp_6-31g(d).log.xz 047036124.mol 047036124.PUBCHEM 047036124.mol (via Jmol)
047036142.b3lyp_6-31g(d).inp

047036142.b3lyp_6-31g(d).qchem.inp (generated)

047036142.b3lyp_6-31g(d).gjf (generated)

047036142.b3lyp_6-31g(d).firefly.inp (generated)

047036142.b3lyp_6-31g(d).smash.inp (generated)

047036142.b3lyp_6-31g(d).nwchem.inp (generated) 047036142.b3lyp_6-31g(d).log.xz 047036142.td-b3lyp_6-31g+(d).inp 047036142.td-b3lyp_6-31g+(d).log.xz

047036142.td-b3lyp_6-31+g(d).qchem.inp (generated)

047036142.td-b3lyp_6-31+g(d).gjf (generated)

047036142.td-b3lyp_6-31+g(d).firefly.inp (generated)

047036142.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047036142.mol 047036142.PUBCHEM 047036142.mol (via Jmol)
047036454.b3lyp_6-31g(d).inp

047036454.b3lyp_6-31g(d).qchem.inp (generated)

047036454.b3lyp_6-31g(d).gjf (generated)

047036454.b3lyp_6-31g(d).firefly.inp (generated)

047036454.b3lyp_6-31g(d).smash.inp (generated)

047036454.b3lyp_6-31g(d).nwchem.inp (generated) 047036454.b3lyp_6-31g(d).log.xz 047036454.td-b3lyp_6-31g+(d).inp 047036454.td-b3lyp_6-31g+(d).log.xz

047036454.td-b3lyp_6-31+g(d).qchem.inp (generated)

047036454.td-b3lyp_6-31+g(d).gjf (generated)

047036454.td-b3lyp_6-31+g(d).firefly.inp (generated)

047036454.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047036454.mol 047036454.PUBCHEM 047036454.mol (via Jmol)
047036461.b3lyp_6-31g(d).inp

047036461.b3lyp_6-31g(d).qchem.inp (generated)

047036461.b3lyp_6-31g(d).gjf (generated)

047036461.b3lyp_6-31g(d).firefly.inp (generated)

047036461.b3lyp_6-31g(d).smash.inp (generated)

047036461.b3lyp_6-31g(d).nwchem.inp (generated) 047036461.b3lyp_6-31g(d).log.xz 047036461.td-b3lyp_6-31g+(d).inp 047036461.td-b3lyp_6-31g+(d).log.xz

047036461.td-b3lyp_6-31+g(d).qchem.inp (generated)

047036461.td-b3lyp_6-31+g(d).gjf (generated)

047036461.td-b3lyp_6-31+g(d).firefly.inp (generated)

047036461.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047036461.mol 047036461.PUBCHEM 047036461.mol (via Jmol)
047036464.b3lyp_6-31g(d).inp

047036464.b3lyp_6-31g(d).qchem.inp (generated)

047036464.b3lyp_6-31g(d).gjf (generated)

047036464.b3lyp_6-31g(d).firefly.inp (generated)

047036464.b3lyp_6-31g(d).smash.inp (generated)

047036464.b3lyp_6-31g(d).nwchem.inp (generated) 047036464.b3lyp_6-31g(d).log.xz 047036464.mol 047036464.PUBCHEM 047036464.mol (via Jmol)
047037331.b3lyp_6-31g(d).inp

047037331.b3lyp_6-31g(d).qchem.inp (generated)

047037331.b3lyp_6-31g(d).gjf (generated)

047037331.b3lyp_6-31g(d).firefly.inp (generated)

047037331.b3lyp_6-31g(d).smash.inp (generated)

047037331.b3lyp_6-31g(d).nwchem.inp (generated) 047037331.b3lyp_6-31g(d).log.xz 047037331.td-b3lyp_6-31g+(d).inp 047037331.td-b3lyp_6-31g+(d).log.xz

047037331.td-b3lyp_6-31+g(d).qchem.inp (generated)

047037331.td-b3lyp_6-31+g(d).gjf (generated)

047037331.td-b3lyp_6-31+g(d).firefly.inp (generated)

047037331.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047037331.mol 047037331.PUBCHEM 047037331.mol (via Jmol)
047037481.b3lyp_6-31g(d).inp

047037481.b3lyp_6-31g(d).qchem.inp (generated)

047037481.b3lyp_6-31g(d).gjf (generated)

047037481.b3lyp_6-31g(d).firefly.inp (generated)

047037481.b3lyp_6-31g(d).smash.inp (generated)

047037481.b3lyp_6-31g(d).nwchem.inp (generated) 047037481.b3lyp_6-31g(d).log.xz 047037481.td-b3lyp_6-31g+(d).inp 047037481.td-b3lyp_6-31g+(d).log.xz

047037481.td-b3lyp_6-31+g(d).qchem.inp (generated)

047037481.td-b3lyp_6-31+g(d).gjf (generated)

047037481.td-b3lyp_6-31+g(d).firefly.inp (generated)

047037481.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047037481.mol 047037481.PUBCHEM 047037481.mol (via Jmol)
047037512.b3lyp_6-31g(d).inp

047037512.b3lyp_6-31g(d).qchem.inp (generated)

047037512.b3lyp_6-31g(d).gjf (generated)

047037512.b3lyp_6-31g(d).firefly.inp (generated)

047037512.b3lyp_6-31g(d).smash.inp (generated)

047037512.b3lyp_6-31g(d).nwchem.inp (generated) 047037512.b3lyp_6-31g(d).log.xz 047037512.td-b3lyp_6-31g+(d).inp 047037512.td-b3lyp_6-31g+(d).log.xz

047037512.td-b3lyp_6-31+g(d).qchem.inp (generated)

047037512.td-b3lyp_6-31+g(d).gjf (generated)

047037512.td-b3lyp_6-31+g(d).firefly.inp (generated)

047037512.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047037512.mol 047037512.PUBCHEM 047037512.mol (via Jmol)
047037650.b3lyp_6-31g(d).inp

047037650.b3lyp_6-31g(d).qchem.inp (generated)

047037650.b3lyp_6-31g(d).gjf (generated)

047037650.b3lyp_6-31g(d).firefly.inp (generated)

047037650.b3lyp_6-31g(d).smash.inp (generated)

047037650.b3lyp_6-31g(d).nwchem.inp (generated) 047037650.b3lyp_6-31g(d).log.xz 047037650.td-b3lyp_6-31g+(d).inp 047037650.td-b3lyp_6-31g+(d).log.xz

047037650.td-b3lyp_6-31+g(d).qchem.inp (generated)

047037650.td-b3lyp_6-31+g(d).gjf (generated)

047037650.td-b3lyp_6-31+g(d).firefly.inp (generated)

047037650.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047037650.mol 047037650.PUBCHEM 047037650.mol (via Jmol)
047037654.b3lyp_6-31g(d).inp

047037654.b3lyp_6-31g(d).qchem.inp (generated)

047037654.b3lyp_6-31g(d).gjf (generated)

047037654.b3lyp_6-31g(d).firefly.inp (generated)

047037654.b3lyp_6-31g(d).smash.inp (generated)

047037654.b3lyp_6-31g(d).nwchem.inp (generated) 047037654.b3lyp_6-31g(d).log.xz 047037654.td-b3lyp_6-31g+(d).inp 047037654.td-b3lyp_6-31g+(d).log.xz

047037654.td-b3lyp_6-31+g(d).qchem.inp (generated)

047037654.td-b3lyp_6-31+g(d).gjf (generated)

047037654.td-b3lyp_6-31+g(d).firefly.inp (generated)

047037654.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047037654.mol 047037654.PUBCHEM 047037654.mol (via Jmol)
047037804.b3lyp_6-31g(d).inp

047037804.b3lyp_6-31g(d).qchem.inp (generated)

047037804.b3lyp_6-31g(d).gjf (generated)

047037804.b3lyp_6-31g(d).firefly.inp (generated)

047037804.b3lyp_6-31g(d).smash.inp (generated)

047037804.b3lyp_6-31g(d).nwchem.inp (generated) 047037804.b3lyp_6-31g(d).log.xz 047037804.td-b3lyp_6-31g+(d).inp 047037804.td-b3lyp_6-31g+(d).log.xz

047037804.td-b3lyp_6-31+g(d).qchem.inp (generated)

047037804.td-b3lyp_6-31+g(d).gjf (generated)

047037804.td-b3lyp_6-31+g(d).firefly.inp (generated)

047037804.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047037804.mol 047037804.PUBCHEM 047037804.mol (via Jmol)
047038039.b3lyp_6-31g(d).inp

047038039.b3lyp_6-31g(d).qchem.inp (generated)

047038039.b3lyp_6-31g(d).gjf (generated)

047038039.b3lyp_6-31g(d).firefly.inp (generated)

047038039.b3lyp_6-31g(d).smash.inp (generated)

047038039.b3lyp_6-31g(d).nwchem.inp (generated) 047038039.b3lyp_6-31g(d).log.xz 047038039.td-b3lyp_6-31g+(d).inp 047038039.td-b3lyp_6-31g+(d).log.xz

047038039.td-b3lyp_6-31+g(d).qchem.inp (generated)

047038039.td-b3lyp_6-31+g(d).gjf (generated)

047038039.td-b3lyp_6-31+g(d).firefly.inp (generated)

047038039.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047038039.mol 047038039.PUBCHEM 047038039.mol (via Jmol)
047038506.b3lyp_6-31g(d).inp

047038506.b3lyp_6-31g(d).qchem.inp (generated)

047038506.b3lyp_6-31g(d).gjf (generated)

047038506.b3lyp_6-31g(d).firefly.inp (generated)

047038506.b3lyp_6-31g(d).smash.inp (generated)

047038506.b3lyp_6-31g(d).nwchem.inp (generated) 047038506.b3lyp_6-31g(d).log.xz 047038506.td-b3lyp_6-31g+(d).inp 047038506.td-b3lyp_6-31g+(d).log.xz

047038506.td-b3lyp_6-31+g(d).qchem.inp (generated)

047038506.td-b3lyp_6-31+g(d).gjf (generated)

047038506.td-b3lyp_6-31+g(d).firefly.inp (generated)

047038506.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047038506.mol 047038506.PUBCHEM 047038506.mol (via Jmol)
047038519.b3lyp_6-31g(d).inp

047038519.b3lyp_6-31g(d).qchem.inp (generated)

047038519.b3lyp_6-31g(d).gjf (generated)

047038519.b3lyp_6-31g(d).firefly.inp (generated)

047038519.b3lyp_6-31g(d).smash.inp (generated)

047038519.b3lyp_6-31g(d).nwchem.inp (generated) 047038519.b3lyp_6-31g(d).log.xz 047038519.td-b3lyp_6-31g+(d).inp 047038519.td-b3lyp_6-31g+(d).log.xz

047038519.td-b3lyp_6-31+g(d).qchem.inp (generated)

047038519.td-b3lyp_6-31+g(d).gjf (generated)

047038519.td-b3lyp_6-31+g(d).firefly.inp (generated)

047038519.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047038519.mol 047038519.PUBCHEM 047038519.mol (via Jmol)
047038521.b3lyp_6-31g(d).inp

047038521.b3lyp_6-31g(d).qchem.inp (generated)

047038521.b3lyp_6-31g(d).gjf (generated)

047038521.b3lyp_6-31g(d).firefly.inp (generated)

047038521.b3lyp_6-31g(d).smash.inp (generated)

047038521.b3lyp_6-31g(d).nwchem.inp (generated) 047038521.b3lyp_6-31g(d).log.xz 047038521.td-b3lyp_6-31g+(d).inp 047038521.td-b3lyp_6-31g+(d).log.xz

047038521.td-b3lyp_6-31+g(d).qchem.inp (generated)

047038521.td-b3lyp_6-31+g(d).gjf (generated)

047038521.td-b3lyp_6-31+g(d).firefly.inp (generated)

047038521.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047038521.mol 047038521.PUBCHEM 047038521.mol (via Jmol)
047038528.b3lyp_6-31g(d).inp

047038528.b3lyp_6-31g(d).qchem.inp (generated)

047038528.b3lyp_6-31g(d).gjf (generated)

047038528.b3lyp_6-31g(d).firefly.inp (generated)

047038528.b3lyp_6-31g(d).smash.inp (generated)

047038528.b3lyp_6-31g(d).nwchem.inp (generated) 047038528.b3lyp_6-31g(d).log.xz 047038528.mol 047038528.PUBCHEM 047038528.mol (via Jmol)
047038529.b3lyp_6-31g(d).inp

047038529.b3lyp_6-31g(d).qchem.inp (generated)

047038529.b3lyp_6-31g(d).gjf (generated)

047038529.b3lyp_6-31g(d).firefly.inp (generated)

047038529.b3lyp_6-31g(d).smash.inp (generated)

047038529.b3lyp_6-31g(d).nwchem.inp (generated) 047038529.b3lyp_6-31g(d).log.xz 047038529.mol 047038529.PUBCHEM 047038529.mol (via Jmol)
047038537.b3lyp_6-31g(d).inp

047038537.b3lyp_6-31g(d).qchem.inp (generated)

047038537.b3lyp_6-31g(d).gjf (generated)

047038537.b3lyp_6-31g(d).firefly.inp (generated)

047038537.b3lyp_6-31g(d).smash.inp (generated)

047038537.b3lyp_6-31g(d).nwchem.inp (generated) 047038537.b3lyp_6-31g(d).log.xz 047038537.td-b3lyp_6-31g+(d).inp 047038537.td-b3lyp_6-31g+(d).log.xz

047038537.td-b3lyp_6-31+g(d).qchem.inp (generated)

047038537.td-b3lyp_6-31+g(d).gjf (generated)

047038537.td-b3lyp_6-31+g(d).firefly.inp (generated)

047038537.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047038537.mol 047038537.PUBCHEM 047038537.mol (via Jmol)
047038542.b3lyp_6-31g(d).inp

047038542.b3lyp_6-31g(d).qchem.inp (generated)

047038542.b3lyp_6-31g(d).gjf (generated)

047038542.b3lyp_6-31g(d).firefly.inp (generated)

047038542.b3lyp_6-31g(d).smash.inp (generated)

047038542.b3lyp_6-31g(d).nwchem.inp (generated) 047038542.b3lyp_6-31g(d).log.xz 047038542.mol 047038542.PUBCHEM 047038542.mol (via Jmol)
047038578.b3lyp_6-31g(d).inp

047038578.b3lyp_6-31g(d).qchem.inp (generated)

047038578.b3lyp_6-31g(d).gjf (generated)

047038578.b3lyp_6-31g(d).firefly.inp (generated)

047038578.b3lyp_6-31g(d).smash.inp (generated)

047038578.b3lyp_6-31g(d).nwchem.inp (generated) 047038578.b3lyp_6-31g(d).log.xz 047038578.mol 047038578.PUBCHEM 047038578.mol (via Jmol)
047038584.b3lyp_6-31g(d).inp

047038584.b3lyp_6-31g(d).qchem.inp (generated)

047038584.b3lyp_6-31g(d).gjf (generated)

047038584.b3lyp_6-31g(d).firefly.inp (generated)

047038584.b3lyp_6-31g(d).smash.inp (generated)

047038584.b3lyp_6-31g(d).nwchem.inp (generated) 047038584.b3lyp_6-31g(d).log.xz 047038584.td-b3lyp_6-31g+(d).inp 047038584.td-b3lyp_6-31g+(d).log.xz

047038584.td-b3lyp_6-31+g(d).qchem.inp (generated)

047038584.td-b3lyp_6-31+g(d).gjf (generated)

047038584.td-b3lyp_6-31+g(d).firefly.inp (generated)

047038584.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047038584.mol 047038584.PUBCHEM 047038584.mol (via Jmol)
047038588.b3lyp_6-31g(d).inp

047038588.b3lyp_6-31g(d).qchem.inp (generated)

047038588.b3lyp_6-31g(d).gjf (generated)

047038588.b3lyp_6-31g(d).firefly.inp (generated)

047038588.b3lyp_6-31g(d).smash.inp (generated)

047038588.b3lyp_6-31g(d).nwchem.inp (generated) 047038588.b3lyp_6-31g(d).log.xz 047038588.td-b3lyp_6-31g+(d).inp 047038588.td-b3lyp_6-31g+(d).log.xz

047038588.td-b3lyp_6-31+g(d).qchem.inp (generated)

047038588.td-b3lyp_6-31+g(d).gjf (generated)

047038588.td-b3lyp_6-31+g(d).firefly.inp (generated)

047038588.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047038588.mol 047038588.PUBCHEM 047038588.mol (via Jmol)
047038614.b3lyp_6-31g(d).inp

047038614.b3lyp_6-31g(d).qchem.inp (generated)

047038614.b3lyp_6-31g(d).gjf (generated)

047038614.b3lyp_6-31g(d).firefly.inp (generated)

047038614.b3lyp_6-31g(d).smash.inp (generated)

047038614.b3lyp_6-31g(d).nwchem.inp (generated) 047038614.b3lyp_6-31g(d).log.xz 047038614.mol 047038614.PUBCHEM 047038614.mol (via Jmol)
047038625.b3lyp_6-31g(d).inp

047038625.b3lyp_6-31g(d).qchem.inp (generated)

047038625.b3lyp_6-31g(d).gjf (generated)

047038625.b3lyp_6-31g(d).firefly.inp (generated)

047038625.b3lyp_6-31g(d).smash.inp (generated)

047038625.b3lyp_6-31g(d).nwchem.inp (generated) 047038625.b3lyp_6-31g(d).log.xz 047038625.td-b3lyp_6-31g+(d).inp 047038625.td-b3lyp_6-31g+(d).log.xz

047038625.td-b3lyp_6-31+g(d).qchem.inp (generated)

047038625.td-b3lyp_6-31+g(d).gjf (generated)

047038625.td-b3lyp_6-31+g(d).firefly.inp (generated)

047038625.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047038625.mol 047038625.PUBCHEM 047038625.mol (via Jmol)
047038655.b3lyp_6-31g(d).inp

047038655.b3lyp_6-31g(d).qchem.inp (generated)

047038655.b3lyp_6-31g(d).gjf (generated)

047038655.b3lyp_6-31g(d).firefly.inp (generated)

047038655.b3lyp_6-31g(d).smash.inp (generated)

047038655.b3lyp_6-31g(d).nwchem.inp (generated) 047038655.b3lyp_6-31g(d).log.xz 047038655.mol 047038655.PUBCHEM 047038655.mol (via Jmol)
047038656.b3lyp_6-31g(d).inp

047038656.b3lyp_6-31g(d).qchem.inp (generated)

047038656.b3lyp_6-31g(d).gjf (generated)

047038656.b3lyp_6-31g(d).firefly.inp (generated)

047038656.b3lyp_6-31g(d).smash.inp (generated)

047038656.b3lyp_6-31g(d).nwchem.inp (generated) 047038656.b3lyp_6-31g(d).log.xz 047038656.mol 047038656.PUBCHEM 047038656.mol (via Jmol)
047038721.b3lyp_6-31g(d).inp

047038721.b3lyp_6-31g(d).qchem.inp (generated)

047038721.b3lyp_6-31g(d).gjf (generated)

047038721.b3lyp_6-31g(d).firefly.inp (generated)

047038721.b3lyp_6-31g(d).smash.inp (generated)

047038721.b3lyp_6-31g(d).nwchem.inp (generated) 047038721.b3lyp_6-31g(d).log.xz 047038721.td-b3lyp_6-31g+(d).inp 047038721.td-b3lyp_6-31g+(d).log.xz

047038721.td-b3lyp_6-31+g(d).qchem.inp (generated)

047038721.td-b3lyp_6-31+g(d).gjf (generated)

047038721.td-b3lyp_6-31+g(d).firefly.inp (generated)

047038721.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047038721.mol 047038721.PUBCHEM 047038721.mol (via Jmol)
047038734.b3lyp_6-31g(d).inp

047038734.b3lyp_6-31g(d).qchem.inp (generated)

047038734.b3lyp_6-31g(d).gjf (generated)

047038734.b3lyp_6-31g(d).firefly.inp (generated)

047038734.b3lyp_6-31g(d).smash.inp (generated)

047038734.b3lyp_6-31g(d).nwchem.inp (generated) 047038734.b3lyp_6-31g(d).log.xz 047038734.td-b3lyp_6-31g+(d).inp 047038734.td-b3lyp_6-31g+(d).log.xz

047038734.td-b3lyp_6-31+g(d).qchem.inp (generated)

047038734.td-b3lyp_6-31+g(d).gjf (generated)

047038734.td-b3lyp_6-31+g(d).firefly.inp (generated)

047038734.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047038734.mol 047038734.PUBCHEM 047038734.mol (via Jmol)
047038750.b3lyp_6-31g(d).inp

047038750.b3lyp_6-31g(d).qchem.inp (generated)

047038750.b3lyp_6-31g(d).gjf (generated)

047038750.b3lyp_6-31g(d).firefly.inp (generated)

047038750.b3lyp_6-31g(d).smash.inp (generated)

047038750.b3lyp_6-31g(d).nwchem.inp (generated) 047038750.b3lyp_6-31g(d).log.xz 047038750.td-b3lyp_6-31g+(d).inp 047038750.td-b3lyp_6-31g+(d).log.xz

047038750.td-b3lyp_6-31+g(d).qchem.inp (generated)

047038750.td-b3lyp_6-31+g(d).gjf (generated)

047038750.td-b3lyp_6-31+g(d).firefly.inp (generated)

047038750.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047038750.mol 047038750.PUBCHEM 047038750.mol (via Jmol)
047038768.b3lyp_6-31g(d).inp

047038768.b3lyp_6-31g(d).qchem.inp (generated)

047038768.b3lyp_6-31g(d).gjf (generated)

047038768.b3lyp_6-31g(d).firefly.inp (generated)

047038768.b3lyp_6-31g(d).smash.inp (generated)

047038768.b3lyp_6-31g(d).nwchem.inp (generated) 047038768.b3lyp_6-31g(d).log.xz 047038768.td-b3lyp_6-31g+(d).inp 047038768.td-b3lyp_6-31g+(d).log.xz

047038768.td-b3lyp_6-31+g(d).qchem.inp (generated)

047038768.td-b3lyp_6-31+g(d).gjf (generated)

047038768.td-b3lyp_6-31+g(d).firefly.inp (generated)

047038768.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047038768.mol 047038768.PUBCHEM 047038768.mol (via Jmol)
047038779.b3lyp_6-31g(d).inp

047038779.b3lyp_6-31g(d).qchem.inp (generated)

047038779.b3lyp_6-31g(d).gjf (generated)

047038779.b3lyp_6-31g(d).firefly.inp (generated)

047038779.b3lyp_6-31g(d).smash.inp (generated)

047038779.b3lyp_6-31g(d).nwchem.inp (generated) 047038779.b3lyp_6-31g(d).log.xz 047038779.td-b3lyp_6-31g+(d).inp 047038779.td-b3lyp_6-31g+(d).log.xz

047038779.td-b3lyp_6-31+g(d).qchem.inp (generated)

047038779.td-b3lyp_6-31+g(d).gjf (generated)

047038779.td-b3lyp_6-31+g(d).firefly.inp (generated)

047038779.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047038779.mol 047038779.PUBCHEM 047038779.mol (via Jmol)
047038785.b3lyp_6-31g(d).inp

047038785.b3lyp_6-31g(d).qchem.inp (generated)

047038785.b3lyp_6-31g(d).gjf (generated)

047038785.b3lyp_6-31g(d).firefly.inp (generated)

047038785.b3lyp_6-31g(d).smash.inp (generated)

047038785.b3lyp_6-31g(d).nwchem.inp (generated) 047038785.b3lyp_6-31g(d).log.xz 047038785.mol 047038785.PUBCHEM 047038785.mol (via Jmol)
047038893.b3lyp_6-31g(d).inp

047038893.b3lyp_6-31g(d).qchem.inp (generated)

047038893.b3lyp_6-31g(d).gjf (generated)

047038893.b3lyp_6-31g(d).firefly.inp (generated)

047038893.b3lyp_6-31g(d).smash.inp (generated)

047038893.b3lyp_6-31g(d).nwchem.inp (generated) 047038893.b3lyp_6-31g(d).log.xz 047038893.mol 047038893.PUBCHEM 047038893.mol (via Jmol)
047038898.b3lyp_6-31g(d).inp

047038898.b3lyp_6-31g(d).qchem.inp (generated)

047038898.b3lyp_6-31g(d).gjf (generated)

047038898.b3lyp_6-31g(d).firefly.inp (generated)

047038898.b3lyp_6-31g(d).smash.inp (generated)

047038898.b3lyp_6-31g(d).nwchem.inp (generated) 047038898.b3lyp_6-31g(d).log.xz 047038898.td-b3lyp_6-31g+(d).inp 047038898.td-b3lyp_6-31g+(d).log.xz

047038898.td-b3lyp_6-31+g(d).qchem.inp (generated)

047038898.td-b3lyp_6-31+g(d).gjf (generated)

047038898.td-b3lyp_6-31+g(d).firefly.inp (generated)

047038898.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047038898.mol 047038898.PUBCHEM 047038898.mol (via Jmol)
047038906.b3lyp_6-31g(d).inp

047038906.b3lyp_6-31g(d).qchem.inp (generated)

047038906.b3lyp_6-31g(d).gjf (generated)

047038906.b3lyp_6-31g(d).firefly.inp (generated)

047038906.b3lyp_6-31g(d).smash.inp (generated)

047038906.b3lyp_6-31g(d).nwchem.inp (generated) 047038906.b3lyp_6-31g(d).log.xz 047038906.td-b3lyp_6-31g+(d).inp 047038906.td-b3lyp_6-31g+(d).log.xz

047038906.td-b3lyp_6-31+g(d).qchem.inp (generated)

047038906.td-b3lyp_6-31+g(d).gjf (generated)

047038906.td-b3lyp_6-31+g(d).firefly.inp (generated)

047038906.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047038906.mol 047038906.PUBCHEM 047038906.mol (via Jmol)
047038914.b3lyp_6-31g(d).inp

047038914.b3lyp_6-31g(d).qchem.inp (generated)

047038914.b3lyp_6-31g(d).gjf (generated)

047038914.b3lyp_6-31g(d).firefly.inp (generated)

047038914.b3lyp_6-31g(d).smash.inp (generated)

047038914.b3lyp_6-31g(d).nwchem.inp (generated) 047038914.b3lyp_6-31g(d).log.xz 047038914.td-b3lyp_6-31g+(d).inp 047038914.td-b3lyp_6-31g+(d).log.xz

047038914.td-b3lyp_6-31+g(d).qchem.inp (generated)

047038914.td-b3lyp_6-31+g(d).gjf (generated)

047038914.td-b3lyp_6-31+g(d).firefly.inp (generated)

047038914.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047038914.mol 047038914.PUBCHEM 047038914.mol (via Jmol)
047038918.b3lyp_6-31g(d).inp

047038918.b3lyp_6-31g(d).qchem.inp (generated)

047038918.b3lyp_6-31g(d).gjf (generated)

047038918.b3lyp_6-31g(d).firefly.inp (generated)

047038918.b3lyp_6-31g(d).smash.inp (generated)

047038918.b3lyp_6-31g(d).nwchem.inp (generated) 047038918.b3lyp_6-31g(d).log.xz 047038918.td-b3lyp_6-31g+(d).inp 047038918.td-b3lyp_6-31g+(d).log.xz

047038918.td-b3lyp_6-31+g(d).qchem.inp (generated)

047038918.td-b3lyp_6-31+g(d).gjf (generated)

047038918.td-b3lyp_6-31+g(d).firefly.inp (generated)

047038918.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047038918.mol 047038918.PUBCHEM 047038918.mol (via Jmol)
047038934.b3lyp_6-31g(d).inp

047038934.b3lyp_6-31g(d).qchem.inp (generated)

047038934.b3lyp_6-31g(d).gjf (generated)

047038934.b3lyp_6-31g(d).firefly.inp (generated)

047038934.b3lyp_6-31g(d).smash.inp (generated)

047038934.b3lyp_6-31g(d).nwchem.inp (generated) 047038934.b3lyp_6-31g(d).log.xz 047038934.mol 047038934.PUBCHEM 047038934.mol (via Jmol)
047038935.b3lyp_6-31g(d).inp

047038935.b3lyp_6-31g(d).qchem.inp (generated)

047038935.b3lyp_6-31g(d).gjf (generated)

047038935.b3lyp_6-31g(d).firefly.inp (generated)

047038935.b3lyp_6-31g(d).smash.inp (generated)

047038935.b3lyp_6-31g(d).nwchem.inp (generated) 047038935.b3lyp_6-31g(d).log.xz 047038935.td-b3lyp_6-31g+(d).inp 047038935.td-b3lyp_6-31g+(d).log.xz

047038935.td-b3lyp_6-31+g(d).qchem.inp (generated)

047038935.td-b3lyp_6-31+g(d).gjf (generated)

047038935.td-b3lyp_6-31+g(d).firefly.inp (generated)

047038935.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047038935.mol 047038935.PUBCHEM 047038935.mol (via Jmol)
047038937.b3lyp_6-31g(d).inp

047038937.b3lyp_6-31g(d).qchem.inp (generated)

047038937.b3lyp_6-31g(d).gjf (generated)

047038937.b3lyp_6-31g(d).firefly.inp (generated)

047038937.b3lyp_6-31g(d).smash.inp (generated)

047038937.b3lyp_6-31g(d).nwchem.inp (generated) 047038937.b3lyp_6-31g(d).log.xz 047038937.td-b3lyp_6-31g+(d).inp 047038937.td-b3lyp_6-31g+(d).log.xz

047038937.td-b3lyp_6-31+g(d).qchem.inp (generated)

047038937.td-b3lyp_6-31+g(d).gjf (generated)

047038937.td-b3lyp_6-31+g(d).firefly.inp (generated)

047038937.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047038937.mol 047038937.PUBCHEM 047038937.mol (via Jmol)
047038938.b3lyp_6-31g(d).inp

047038938.b3lyp_6-31g(d).qchem.inp (generated)

047038938.b3lyp_6-31g(d).gjf (generated)

047038938.b3lyp_6-31g(d).firefly.inp (generated)

047038938.b3lyp_6-31g(d).smash.inp (generated)

047038938.b3lyp_6-31g(d).nwchem.inp (generated) 047038938.b3lyp_6-31g(d).log.xz 047038938.td-b3lyp_6-31g+(d).inp 047038938.td-b3lyp_6-31g+(d).log.xz

047038938.td-b3lyp_6-31+g(d).qchem.inp (generated)

047038938.td-b3lyp_6-31+g(d).gjf (generated)

047038938.td-b3lyp_6-31+g(d).firefly.inp (generated)

047038938.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047038938.mol 047038938.PUBCHEM 047038938.mol (via Jmol)
047038983.b3lyp_6-31g(d).inp

047038983.b3lyp_6-31g(d).qchem.inp (generated)

047038983.b3lyp_6-31g(d).gjf (generated)

047038983.b3lyp_6-31g(d).firefly.inp (generated)

047038983.b3lyp_6-31g(d).smash.inp (generated)

047038983.b3lyp_6-31g(d).nwchem.inp (generated) 047038983.b3lyp_6-31g(d).log.xz 047038983.td-b3lyp_6-31g+(d).inp 047038983.td-b3lyp_6-31g+(d).log.xz

047038983.td-b3lyp_6-31+g(d).qchem.inp (generated)

047038983.td-b3lyp_6-31+g(d).gjf (generated)

047038983.td-b3lyp_6-31+g(d).firefly.inp (generated)

047038983.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047038983.mol 047038983.PUBCHEM 047038983.mol (via Jmol)
047038993.b3lyp_6-31g(d).inp

047038993.b3lyp_6-31g(d).qchem.inp (generated)

047038993.b3lyp_6-31g(d).gjf (generated)

047038993.b3lyp_6-31g(d).firefly.inp (generated)

047038993.b3lyp_6-31g(d).smash.inp (generated)

047038993.b3lyp_6-31g(d).nwchem.inp (generated) 047038993.b3lyp_6-31g(d).log.xz 047038993.td-b3lyp_6-31g+(d).inp 047038993.td-b3lyp_6-31g+(d).log.xz

047038993.td-b3lyp_6-31+g(d).qchem.inp (generated)

047038993.td-b3lyp_6-31+g(d).gjf (generated)

047038993.td-b3lyp_6-31+g(d).firefly.inp (generated)

047038993.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047038993.mol 047038993.PUBCHEM 047038993.mol (via Jmol)
047039144.b3lyp_6-31g(d).inp

047039144.b3lyp_6-31g(d).qchem.inp (generated)

047039144.b3lyp_6-31g(d).gjf (generated)

047039144.b3lyp_6-31g(d).firefly.inp (generated)

047039144.b3lyp_6-31g(d).smash.inp (generated)

047039144.b3lyp_6-31g(d).nwchem.inp (generated) 047039144.b3lyp_6-31g(d).log.xz 047039144.td-b3lyp_6-31g+(d).inp 047039144.td-b3lyp_6-31g+(d).log.xz

047039144.td-b3lyp_6-31+g(d).qchem.inp (generated)

047039144.td-b3lyp_6-31+g(d).gjf (generated)

047039144.td-b3lyp_6-31+g(d).firefly.inp (generated)

047039144.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047039144.mol 047039144.PUBCHEM 047039144.mol (via Jmol)
047039207.b3lyp_6-31g(d).inp

047039207.b3lyp_6-31g(d).qchem.inp (generated)

047039207.b3lyp_6-31g(d).gjf (generated)

047039207.b3lyp_6-31g(d).firefly.inp (generated)

047039207.b3lyp_6-31g(d).smash.inp (generated)

047039207.b3lyp_6-31g(d).nwchem.inp (generated) 047039207.b3lyp_6-31g(d).log.xz 047039207.td-b3lyp_6-31g+(d).inp 047039207.td-b3lyp_6-31g+(d).log.xz

047039207.td-b3lyp_6-31+g(d).qchem.inp (generated)

047039207.td-b3lyp_6-31+g(d).gjf (generated)

047039207.td-b3lyp_6-31+g(d).firefly.inp (generated)

047039207.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047039207.mol 047039207.PUBCHEM 047039207.mol (via Jmol)
047039221.b3lyp_6-31g(d).inp

047039221.b3lyp_6-31g(d).qchem.inp (generated)

047039221.b3lyp_6-31g(d).gjf (generated)

047039221.b3lyp_6-31g(d).firefly.inp (generated)

047039221.b3lyp_6-31g(d).smash.inp (generated)

047039221.b3lyp_6-31g(d).nwchem.inp (generated) 047039221.b3lyp_6-31g(d).log.xz 047039221.td-b3lyp_6-31g+(d).inp 047039221.td-b3lyp_6-31g+(d).log.xz

047039221.td-b3lyp_6-31+g(d).qchem.inp (generated)

047039221.td-b3lyp_6-31+g(d).gjf (generated)

047039221.td-b3lyp_6-31+g(d).firefly.inp (generated)

047039221.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047039221.mol 047039221.PUBCHEM 047039221.mol (via Jmol)
047039314.b3lyp_6-31g(d).inp

047039314.b3lyp_6-31g(d).qchem.inp (generated)

047039314.b3lyp_6-31g(d).gjf (generated)

047039314.b3lyp_6-31g(d).firefly.inp (generated)

047039314.b3lyp_6-31g(d).smash.inp (generated)

047039314.b3lyp_6-31g(d).nwchem.inp (generated) 047039314.b3lyp_6-31g(d).log.xz 047039314.td-b3lyp_6-31g+(d).inp 047039314.td-b3lyp_6-31g+(d).log.xz

047039314.td-b3lyp_6-31+g(d).qchem.inp (generated)

047039314.td-b3lyp_6-31+g(d).gjf (generated)

047039314.td-b3lyp_6-31+g(d).firefly.inp (generated)

047039314.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047039314.mol 047039314.PUBCHEM 047039314.mol (via Jmol)
047039416.b3lyp_6-31g(d).inp

047039416.b3lyp_6-31g(d).qchem.inp (generated)

047039416.b3lyp_6-31g(d).gjf (generated)

047039416.b3lyp_6-31g(d).firefly.inp (generated)

047039416.b3lyp_6-31g(d).smash.inp (generated)

047039416.b3lyp_6-31g(d).nwchem.inp (generated) 047039416.b3lyp_6-31g(d).log.xz 047039416.td-b3lyp_6-31g+(d).inp 047039416.td-b3lyp_6-31g+(d).log.xz

047039416.td-b3lyp_6-31+g(d).qchem.inp (generated)

047039416.td-b3lyp_6-31+g(d).gjf (generated)

047039416.td-b3lyp_6-31+g(d).firefly.inp (generated)

047039416.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047039416.mol 047039416.PUBCHEM 047039416.mol (via Jmol)
047039421.b3lyp_6-31g(d).inp

047039421.b3lyp_6-31g(d).qchem.inp (generated)

047039421.b3lyp_6-31g(d).gjf (generated)

047039421.b3lyp_6-31g(d).firefly.inp (generated)

047039421.b3lyp_6-31g(d).smash.inp (generated)

047039421.b3lyp_6-31g(d).nwchem.inp (generated) 047039421.b3lyp_6-31g(d).log.xz 047039421.td-b3lyp_6-31g+(d).inp 047039421.td-b3lyp_6-31g+(d).log.xz

047039421.td-b3lyp_6-31+g(d).qchem.inp (generated)

047039421.td-b3lyp_6-31+g(d).gjf (generated)

047039421.td-b3lyp_6-31+g(d).firefly.inp (generated)

047039421.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047039421.mol 047039421.PUBCHEM 047039421.mol (via Jmol)
047039532.b3lyp_6-31g(d).inp

047039532.b3lyp_6-31g(d).qchem.inp (generated)

047039532.b3lyp_6-31g(d).gjf (generated)

047039532.b3lyp_6-31g(d).firefly.inp (generated)

047039532.b3lyp_6-31g(d).smash.inp (generated)

047039532.b3lyp_6-31g(d).nwchem.inp (generated) 047039532.b3lyp_6-31g(d).log.xz 047039532.td-b3lyp_6-31g+(d).inp 047039532.td-b3lyp_6-31g+(d).log.xz

047039532.td-b3lyp_6-31+g(d).qchem.inp (generated)

047039532.td-b3lyp_6-31+g(d).gjf (generated)

047039532.td-b3lyp_6-31+g(d).firefly.inp (generated)

047039532.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047039532.mol 047039532.PUBCHEM 047039532.mol (via Jmol)
047039807.b3lyp_6-31g(d).inp

047039807.b3lyp_6-31g(d).qchem.inp (generated)

047039807.b3lyp_6-31g(d).gjf (generated)

047039807.b3lyp_6-31g(d).firefly.inp (generated)

047039807.b3lyp_6-31g(d).smash.inp (generated)

047039807.b3lyp_6-31g(d).nwchem.inp (generated) 047039807.b3lyp_6-31g(d).log.xz 047039807.mol 047039807.PUBCHEM 047039807.mol (via Jmol)
047039903.b3lyp_6-31g(d).inp

047039903.b3lyp_6-31g(d).qchem.inp (generated)

047039903.b3lyp_6-31g(d).gjf (generated)

047039903.b3lyp_6-31g(d).firefly.inp (generated)

047039903.b3lyp_6-31g(d).smash.inp (generated)

047039903.b3lyp_6-31g(d).nwchem.inp (generated) 047039903.b3lyp_6-31g(d).log.xz 047039903.td-b3lyp_6-31g+(d).inp 047039903.td-b3lyp_6-31g+(d).log.xz

047039903.td-b3lyp_6-31+g(d).qchem.inp (generated)

047039903.td-b3lyp_6-31+g(d).gjf (generated)

047039903.td-b3lyp_6-31+g(d).firefly.inp (generated)

047039903.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047039903.mol 047039903.PUBCHEM 047039903.mol (via Jmol)
047040352.b3lyp_6-31g(d).inp

047040352.b3lyp_6-31g(d).qchem.inp (generated)

047040352.b3lyp_6-31g(d).gjf (generated)

047040352.b3lyp_6-31g(d).firefly.inp (generated)

047040352.b3lyp_6-31g(d).smash.inp (generated)

047040352.b3lyp_6-31g(d).nwchem.inp (generated) 047040352.b3lyp_6-31g(d).log.xz 047040352.td-b3lyp_6-31g+(d).inp 047040352.td-b3lyp_6-31g+(d).log.xz

047040352.td-b3lyp_6-31+g(d).qchem.inp (generated)

047040352.td-b3lyp_6-31+g(d).gjf (generated)

047040352.td-b3lyp_6-31+g(d).firefly.inp (generated)

047040352.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047040352.mol 047040352.PUBCHEM 047040352.mol (via Jmol)
047041002.b3lyp_6-31g(d).inp

047041002.b3lyp_6-31g(d).qchem.inp (generated)

047041002.b3lyp_6-31g(d).gjf (generated)

047041002.b3lyp_6-31g(d).firefly.inp (generated)

047041002.b3lyp_6-31g(d).smash.inp (generated)

047041002.b3lyp_6-31g(d).nwchem.inp (generated) 047041002.b3lyp_6-31g(d).log.xz 047041002.td-b3lyp_6-31g+(d).inp 047041002.td-b3lyp_6-31g+(d).log.xz

047041002.td-b3lyp_6-31+g(d).qchem.inp (generated)

047041002.td-b3lyp_6-31+g(d).gjf (generated)

047041002.td-b3lyp_6-31+g(d).firefly.inp (generated)

047041002.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047041002.mol 047041002.PUBCHEM 047041002.mol (via Jmol)
047041043.b3lyp_6-31g(d).inp

047041043.b3lyp_6-31g(d).qchem.inp (generated)

047041043.b3lyp_6-31g(d).gjf (generated)

047041043.b3lyp_6-31g(d).firefly.inp (generated)

047041043.b3lyp_6-31g(d).smash.inp (generated)

047041043.b3lyp_6-31g(d).nwchem.inp (generated) 047041043.b3lyp_6-31g(d).log.xz 047041043.td-b3lyp_6-31g+(d).inp 047041043.td-b3lyp_6-31g+(d).log.xz

047041043.td-b3lyp_6-31+g(d).qchem.inp (generated)

047041043.td-b3lyp_6-31+g(d).gjf (generated)

047041043.td-b3lyp_6-31+g(d).firefly.inp (generated)

047041043.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047041043.mol 047041043.PUBCHEM 047041043.mol (via Jmol)
047041107.b3lyp_6-31g(d).inp

047041107.b3lyp_6-31g(d).qchem.inp (generated)

047041107.b3lyp_6-31g(d).gjf (generated)

047041107.b3lyp_6-31g(d).firefly.inp (generated)

047041107.b3lyp_6-31g(d).smash.inp (generated)

047041107.b3lyp_6-31g(d).nwchem.inp (generated) 047041107.b3lyp_6-31g(d).log.xz 047041107.td-b3lyp_6-31g+(d).inp 047041107.td-b3lyp_6-31g+(d).log.xz

047041107.td-b3lyp_6-31+g(d).qchem.inp (generated)

047041107.td-b3lyp_6-31+g(d).gjf (generated)

047041107.td-b3lyp_6-31+g(d).firefly.inp (generated)

047041107.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047041107.mol 047041107.PUBCHEM 047041107.mol (via Jmol)
047041687.b3lyp_6-31g(d).inp

047041687.b3lyp_6-31g(d).qchem.inp (generated)

047041687.b3lyp_6-31g(d).gjf (generated)

047041687.b3lyp_6-31g(d).firefly.inp (generated)

047041687.b3lyp_6-31g(d).smash.inp (generated)

047041687.b3lyp_6-31g(d).nwchem.inp (generated) 047041687.b3lyp_6-31g(d).log.xz 047041687.td-b3lyp_6-31g+(d).inp 047041687.td-b3lyp_6-31g+(d).log.xz

047041687.td-b3lyp_6-31+g(d).qchem.inp (generated)

047041687.td-b3lyp_6-31+g(d).gjf (generated)

047041687.td-b3lyp_6-31+g(d).firefly.inp (generated)

047041687.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047041687.mol 047041687.PUBCHEM 047041687.mol (via Jmol)
047041878.b3lyp_6-31g(d).inp

047041878.b3lyp_6-31g(d).qchem.inp (generated)

047041878.b3lyp_6-31g(d).gjf (generated)

047041878.b3lyp_6-31g(d).firefly.inp (generated)

047041878.b3lyp_6-31g(d).smash.inp (generated)

047041878.b3lyp_6-31g(d).nwchem.inp (generated) 047041878.b3lyp_6-31g(d).log.xz 047041878.td-b3lyp_6-31g+(d).inp 047041878.td-b3lyp_6-31g+(d).log.xz

047041878.td-b3lyp_6-31+g(d).qchem.inp (generated)

047041878.td-b3lyp_6-31+g(d).gjf (generated)

047041878.td-b3lyp_6-31+g(d).firefly.inp (generated)

047041878.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047041878.mol 047041878.PUBCHEM 047041878.mol (via Jmol)
047041901.b3lyp_6-31g(d).inp

047041901.b3lyp_6-31g(d).qchem.inp (generated)

047041901.b3lyp_6-31g(d).gjf (generated)

047041901.b3lyp_6-31g(d).firefly.inp (generated)

047041901.b3lyp_6-31g(d).smash.inp (generated)

047041901.b3lyp_6-31g(d).nwchem.inp (generated) 047041901.b3lyp_6-31g(d).log.xz 047041901.td-b3lyp_6-31g+(d).inp 047041901.td-b3lyp_6-31g+(d).log.xz

047041901.td-b3lyp_6-31+g(d).qchem.inp (generated)

047041901.td-b3lyp_6-31+g(d).gjf (generated)

047041901.td-b3lyp_6-31+g(d).firefly.inp (generated)

047041901.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047041901.mol 047041901.PUBCHEM 047041901.mol (via Jmol)
047042376.b3lyp_6-31g(d).inp

047042376.b3lyp_6-31g(d).qchem.inp (generated)

047042376.b3lyp_6-31g(d).gjf (generated)

047042376.b3lyp_6-31g(d).firefly.inp (generated)

047042376.b3lyp_6-31g(d).smash.inp (generated)

047042376.b3lyp_6-31g(d).nwchem.inp (generated) 047042376.b3lyp_6-31g(d).log.xz 047042376.td-b3lyp_6-31g+(d).inp 047042376.td-b3lyp_6-31g+(d).log.xz

047042376.td-b3lyp_6-31+g(d).qchem.inp (generated)

047042376.td-b3lyp_6-31+g(d).gjf (generated)

047042376.td-b3lyp_6-31+g(d).firefly.inp (generated)

047042376.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047042376.mol 047042376.PUBCHEM 047042376.mol (via Jmol)
047042542.b3lyp_6-31g(d).inp

047042542.b3lyp_6-31g(d).qchem.inp (generated)

047042542.b3lyp_6-31g(d).gjf (generated)

047042542.b3lyp_6-31g(d).firefly.inp (generated)

047042542.b3lyp_6-31g(d).smash.inp (generated)

047042542.b3lyp_6-31g(d).nwchem.inp (generated) 047042542.b3lyp_6-31g(d).log.xz 047042542.td-b3lyp_6-31g+(d).inp 047042542.td-b3lyp_6-31g+(d).log.xz

047042542.td-b3lyp_6-31+g(d).qchem.inp (generated)

047042542.td-b3lyp_6-31+g(d).gjf (generated)

047042542.td-b3lyp_6-31+g(d).firefly.inp (generated)

047042542.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047042542.mol 047042542.PUBCHEM 047042542.mol (via Jmol)
047042553.b3lyp_6-31g(d).inp

047042553.b3lyp_6-31g(d).qchem.inp (generated)

047042553.b3lyp_6-31g(d).gjf (generated)

047042553.b3lyp_6-31g(d).firefly.inp (generated)

047042553.b3lyp_6-31g(d).smash.inp (generated)

047042553.b3lyp_6-31g(d).nwchem.inp (generated) 047042553.b3lyp_6-31g(d).log.xz 047042553.td-b3lyp_6-31g+(d).inp 047042553.td-b3lyp_6-31g+(d).log.xz

047042553.td-b3lyp_6-31+g(d).qchem.inp (generated)

047042553.td-b3lyp_6-31+g(d).gjf (generated)

047042553.td-b3lyp_6-31+g(d).firefly.inp (generated)

047042553.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047042553.mol 047042553.PUBCHEM 047042553.mol (via Jmol)
047042567.b3lyp_6-31g(d).inp

047042567.b3lyp_6-31g(d).qchem.inp (generated)

047042567.b3lyp_6-31g(d).gjf (generated)

047042567.b3lyp_6-31g(d).firefly.inp (generated)

047042567.b3lyp_6-31g(d).smash.inp (generated)

047042567.b3lyp_6-31g(d).nwchem.inp (generated) 047042567.b3lyp_6-31g(d).log.xz 047042567.mol 047042567.PUBCHEM 047042567.mol (via Jmol)
047042568.b3lyp_6-31g(d).inp

047042568.b3lyp_6-31g(d).qchem.inp (generated)

047042568.b3lyp_6-31g(d).gjf (generated)

047042568.b3lyp_6-31g(d).firefly.inp (generated)

047042568.b3lyp_6-31g(d).smash.inp (generated)

047042568.b3lyp_6-31g(d).nwchem.inp (generated) 047042568.b3lyp_6-31g(d).log.xz 047042568.td-b3lyp_6-31g+(d).inp 047042568.td-b3lyp_6-31g+(d).log.xz

047042568.td-b3lyp_6-31+g(d).qchem.inp (generated)

047042568.td-b3lyp_6-31+g(d).gjf (generated)

047042568.td-b3lyp_6-31+g(d).firefly.inp (generated)

047042568.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047042568.mol 047042568.PUBCHEM 047042568.mol (via Jmol)
047042575.b3lyp_6-31g(d).inp

047042575.b3lyp_6-31g(d).qchem.inp (generated)

047042575.b3lyp_6-31g(d).gjf (generated)

047042575.b3lyp_6-31g(d).firefly.inp (generated)

047042575.b3lyp_6-31g(d).smash.inp (generated)

047042575.b3lyp_6-31g(d).nwchem.inp (generated) 047042575.b3lyp_6-31g(d).log.xz 047042575.td-b3lyp_6-31g+(d).inp 047042575.td-b3lyp_6-31g+(d).log.xz

047042575.td-b3lyp_6-31+g(d).qchem.inp (generated)

047042575.td-b3lyp_6-31+g(d).gjf (generated)

047042575.td-b3lyp_6-31+g(d).firefly.inp (generated)

047042575.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047042575.mol 047042575.PUBCHEM 047042575.mol (via Jmol)
047042576.b3lyp_6-31g(d).inp

047042576.b3lyp_6-31g(d).qchem.inp (generated)

047042576.b3lyp_6-31g(d).gjf (generated)

047042576.b3lyp_6-31g(d).firefly.inp (generated)

047042576.b3lyp_6-31g(d).smash.inp (generated)

047042576.b3lyp_6-31g(d).nwchem.inp (generated) 047042576.b3lyp_6-31g(d).log.xz 047042576.td-b3lyp_6-31g+(d).inp 047042576.td-b3lyp_6-31g+(d).log.xz

047042576.td-b3lyp_6-31+g(d).qchem.inp (generated)

047042576.td-b3lyp_6-31+g(d).gjf (generated)

047042576.td-b3lyp_6-31+g(d).firefly.inp (generated)

047042576.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047042576.mol 047042576.PUBCHEM 047042576.mol (via Jmol)
047042577.b3lyp_6-31g(d).inp

047042577.b3lyp_6-31g(d).qchem.inp (generated)

047042577.b3lyp_6-31g(d).gjf (generated)

047042577.b3lyp_6-31g(d).firefly.inp (generated)

047042577.b3lyp_6-31g(d).smash.inp (generated)

047042577.b3lyp_6-31g(d).nwchem.inp (generated) 047042577.b3lyp_6-31g(d).log.xz 047042577.td-b3lyp_6-31g+(d).inp 047042577.td-b3lyp_6-31g+(d).log.xz

047042577.td-b3lyp_6-31+g(d).qchem.inp (generated)

047042577.td-b3lyp_6-31+g(d).gjf (generated)

047042577.td-b3lyp_6-31+g(d).firefly.inp (generated)

047042577.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047042577.mol 047042577.PUBCHEM 047042577.mol (via Jmol)
047042582.b3lyp_6-31g(d).inp

047042582.b3lyp_6-31g(d).qchem.inp (generated)

047042582.b3lyp_6-31g(d).gjf (generated)

047042582.b3lyp_6-31g(d).firefly.inp (generated)

047042582.b3lyp_6-31g(d).smash.inp (generated)

047042582.b3lyp_6-31g(d).nwchem.inp (generated) 047042582.b3lyp_6-31g(d).log.xz 047042582.mol 047042582.PUBCHEM 047042582.mol (via Jmol)
047042584.b3lyp_6-31g(d).inp

047042584.b3lyp_6-31g(d).qchem.inp (generated)

047042584.b3lyp_6-31g(d).gjf (generated)

047042584.b3lyp_6-31g(d).firefly.inp (generated)

047042584.b3lyp_6-31g(d).smash.inp (generated)

047042584.b3lyp_6-31g(d).nwchem.inp (generated) 047042584.b3lyp_6-31g(d).log.xz 047042584.td-b3lyp_6-31g+(d).inp 047042584.td-b3lyp_6-31g+(d).log.xz

047042584.td-b3lyp_6-31+g(d).qchem.inp (generated)

047042584.td-b3lyp_6-31+g(d).gjf (generated)

047042584.td-b3lyp_6-31+g(d).firefly.inp (generated)

047042584.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047042584.mol 047042584.PUBCHEM 047042584.mol (via Jmol)
047042586.b3lyp_6-31g(d).inp

047042586.b3lyp_6-31g(d).qchem.inp (generated)

047042586.b3lyp_6-31g(d).gjf (generated)

047042586.b3lyp_6-31g(d).firefly.inp (generated)

047042586.b3lyp_6-31g(d).smash.inp (generated)

047042586.b3lyp_6-31g(d).nwchem.inp (generated) 047042586.b3lyp_6-31g(d).log.xz 047042586.td-b3lyp_6-31g+(d).inp 047042586.td-b3lyp_6-31g+(d).log.xz

047042586.td-b3lyp_6-31+g(d).qchem.inp (generated)

047042586.td-b3lyp_6-31+g(d).gjf (generated)

047042586.td-b3lyp_6-31+g(d).firefly.inp (generated)

047042586.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047042586.mol 047042586.PUBCHEM 047042586.mol (via Jmol)
047042664.b3lyp_6-31g(d).inp

047042664.b3lyp_6-31g(d).qchem.inp (generated)

047042664.b3lyp_6-31g(d).gjf (generated)

047042664.b3lyp_6-31g(d).firefly.inp (generated)

047042664.b3lyp_6-31g(d).smash.inp (generated)

047042664.b3lyp_6-31g(d).nwchem.inp (generated) 047042664.b3lyp_6-31g(d).log.xz 047042664.mol 047042664.PUBCHEM 047042664.mol (via Jmol)
047042667.b3lyp_6-31g(d).inp

047042667.b3lyp_6-31g(d).qchem.inp (generated)

047042667.b3lyp_6-31g(d).gjf (generated)

047042667.b3lyp_6-31g(d).firefly.inp (generated)

047042667.b3lyp_6-31g(d).smash.inp (generated)

047042667.b3lyp_6-31g(d).nwchem.inp (generated) 047042667.b3lyp_6-31g(d).log.xz 047042667.td-b3lyp_6-31g+(d).inp 047042667.td-b3lyp_6-31g+(d).log.xz

047042667.td-b3lyp_6-31+g(d).qchem.inp (generated)

047042667.td-b3lyp_6-31+g(d).gjf (generated)

047042667.td-b3lyp_6-31+g(d).firefly.inp (generated)

047042667.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047042667.mol 047042667.PUBCHEM 047042667.mol (via Jmol)
047042984.b3lyp_6-31g(d).inp

047042984.b3lyp_6-31g(d).qchem.inp (generated)

047042984.b3lyp_6-31g(d).gjf (generated)

047042984.b3lyp_6-31g(d).firefly.inp (generated)

047042984.b3lyp_6-31g(d).smash.inp (generated)

047042984.b3lyp_6-31g(d).nwchem.inp (generated) 047042984.b3lyp_6-31g(d).log.xz 047042984.mol 047042984.PUBCHEM 047042984.mol (via Jmol)
047042988.b3lyp_6-31g(d).inp

047042988.b3lyp_6-31g(d).qchem.inp (generated)

047042988.b3lyp_6-31g(d).gjf (generated)

047042988.b3lyp_6-31g(d).firefly.inp (generated)

047042988.b3lyp_6-31g(d).smash.inp (generated)

047042988.b3lyp_6-31g(d).nwchem.inp (generated) 047042988.b3lyp_6-31g(d).log.xz 047042988.td-b3lyp_6-31g+(d).inp 047042988.td-b3lyp_6-31g+(d).log.xz

047042988.td-b3lyp_6-31+g(d).qchem.inp (generated)

047042988.td-b3lyp_6-31+g(d).gjf (generated)

047042988.td-b3lyp_6-31+g(d).firefly.inp (generated)

047042988.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047042988.mol 047042988.PUBCHEM 047042988.mol (via Jmol)
047043232.b3lyp_6-31g(d).inp

047043232.b3lyp_6-31g(d).qchem.inp (generated)

047043232.b3lyp_6-31g(d).gjf (generated)

047043232.b3lyp_6-31g(d).firefly.inp (generated)

047043232.b3lyp_6-31g(d).smash.inp (generated)

047043232.b3lyp_6-31g(d).nwchem.inp (generated) 047043232.b3lyp_6-31g(d).log.xz 047043232.td-b3lyp_6-31g+(d).inp 047043232.td-b3lyp_6-31g+(d).log.xz

047043232.td-b3lyp_6-31+g(d).qchem.inp (generated)

047043232.td-b3lyp_6-31+g(d).gjf (generated)

047043232.td-b3lyp_6-31+g(d).firefly.inp (generated)

047043232.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047043232.mol 047043232.PUBCHEM 047043232.mol (via Jmol)
047043521.b3lyp_6-31g(d).inp

047043521.b3lyp_6-31g(d).qchem.inp (generated)

047043521.b3lyp_6-31g(d).gjf (generated)

047043521.b3lyp_6-31g(d).firefly.inp (generated)

047043521.b3lyp_6-31g(d).smash.inp (generated)

047043521.b3lyp_6-31g(d).nwchem.inp (generated) 047043521.b3lyp_6-31g(d).log.xz 047043521.mol 047043521.PUBCHEM 047043521.mol (via Jmol)
047043606.b3lyp_6-31g(d).inp

047043606.b3lyp_6-31g(d).qchem.inp (generated)

047043606.b3lyp_6-31g(d).gjf (generated)

047043606.b3lyp_6-31g(d).firefly.inp (generated)

047043606.b3lyp_6-31g(d).smash.inp (generated)

047043606.b3lyp_6-31g(d).nwchem.inp (generated) 047043606.b3lyp_6-31g(d).log.xz 047043606.td-b3lyp_6-31g+(d).inp 047043606.td-b3lyp_6-31g+(d).log.xz

047043606.td-b3lyp_6-31+g(d).qchem.inp (generated)

047043606.td-b3lyp_6-31+g(d).gjf (generated)

047043606.td-b3lyp_6-31+g(d).firefly.inp (generated)

047043606.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047043606.mol 047043606.PUBCHEM 047043606.mol (via Jmol)
047043607.b3lyp_6-31g(d).inp

047043607.b3lyp_6-31g(d).qchem.inp (generated)

047043607.b3lyp_6-31g(d).gjf (generated)

047043607.b3lyp_6-31g(d).firefly.inp (generated)

047043607.b3lyp_6-31g(d).smash.inp (generated)

047043607.b3lyp_6-31g(d).nwchem.inp (generated) 047043607.b3lyp_6-31g(d).log.xz 047043607.mol 047043607.PUBCHEM 047043607.mol (via Jmol)
047043610.b3lyp_6-31g(d).inp

047043610.b3lyp_6-31g(d).qchem.inp (generated)

047043610.b3lyp_6-31g(d).gjf (generated)

047043610.b3lyp_6-31g(d).firefly.inp (generated)

047043610.b3lyp_6-31g(d).smash.inp (generated)

047043610.b3lyp_6-31g(d).nwchem.inp (generated) 047043610.b3lyp_6-31g(d).log.xz 047043610.td-b3lyp_6-31g+(d).inp 047043610.td-b3lyp_6-31g+(d).log.xz

047043610.td-b3lyp_6-31+g(d).qchem.inp (generated)

047043610.td-b3lyp_6-31+g(d).gjf (generated)

047043610.td-b3lyp_6-31+g(d).firefly.inp (generated)

047043610.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047043610.mol 047043610.PUBCHEM 047043610.mol (via Jmol)
047043611.b3lyp_6-31g(d).inp

047043611.b3lyp_6-31g(d).qchem.inp (generated)

047043611.b3lyp_6-31g(d).gjf (generated)

047043611.b3lyp_6-31g(d).firefly.inp (generated)

047043611.b3lyp_6-31g(d).smash.inp (generated)

047043611.b3lyp_6-31g(d).nwchem.inp (generated) 047043611.b3lyp_6-31g(d).log.xz 047043611.td-b3lyp_6-31g+(d).inp 047043611.td-b3lyp_6-31g+(d).log.xz

047043611.td-b3lyp_6-31+g(d).qchem.inp (generated)

047043611.td-b3lyp_6-31+g(d).gjf (generated)

047043611.td-b3lyp_6-31+g(d).firefly.inp (generated)

047043611.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047043611.mol 047043611.PUBCHEM 047043611.mol (via Jmol)
047043614.b3lyp_6-31g(d).inp

047043614.b3lyp_6-31g(d).qchem.inp (generated)

047043614.b3lyp_6-31g(d).gjf (generated)

047043614.b3lyp_6-31g(d).firefly.inp (generated)

047043614.b3lyp_6-31g(d).smash.inp (generated)

047043614.b3lyp_6-31g(d).nwchem.inp (generated) 047043614.b3lyp_6-31g(d).log.xz 047043614.td-b3lyp_6-31g+(d).inp 047043614.td-b3lyp_6-31g+(d).log.xz

047043614.td-b3lyp_6-31+g(d).qchem.inp (generated)

047043614.td-b3lyp_6-31+g(d).gjf (generated)

047043614.td-b3lyp_6-31+g(d).firefly.inp (generated)

047043614.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047043614.mol 047043614.PUBCHEM 047043614.mol (via Jmol)
047043616.b3lyp_6-31g(d).inp

047043616.b3lyp_6-31g(d).qchem.inp (generated)

047043616.b3lyp_6-31g(d).gjf (generated)

047043616.b3lyp_6-31g(d).firefly.inp (generated)

047043616.b3lyp_6-31g(d).smash.inp (generated)

047043616.b3lyp_6-31g(d).nwchem.inp (generated) 047043616.b3lyp_6-31g(d).log.xz 047043616.td-b3lyp_6-31g+(d).inp 047043616.td-b3lyp_6-31g+(d).log.xz

047043616.td-b3lyp_6-31+g(d).qchem.inp (generated)

047043616.td-b3lyp_6-31+g(d).gjf (generated)

047043616.td-b3lyp_6-31+g(d).firefly.inp (generated)

047043616.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047043616.mol 047043616.PUBCHEM 047043616.mol (via Jmol)
047043621.b3lyp_6-31g(d).inp

047043621.b3lyp_6-31g(d).qchem.inp (generated)

047043621.b3lyp_6-31g(d).gjf (generated)

047043621.b3lyp_6-31g(d).firefly.inp (generated)

047043621.b3lyp_6-31g(d).smash.inp (generated)

047043621.b3lyp_6-31g(d).nwchem.inp (generated) 047043621.b3lyp_6-31g(d).log.xz 047043621.td-b3lyp_6-31g+(d).inp 047043621.td-b3lyp_6-31g+(d).log.xz

047043621.td-b3lyp_6-31+g(d).qchem.inp (generated)

047043621.td-b3lyp_6-31+g(d).gjf (generated)

047043621.td-b3lyp_6-31+g(d).firefly.inp (generated)

047043621.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047043621.mol 047043621.PUBCHEM 047043621.mol (via Jmol)
047043625.b3lyp_6-31g(d).inp

047043625.b3lyp_6-31g(d).qchem.inp (generated)

047043625.b3lyp_6-31g(d).gjf (generated)

047043625.b3lyp_6-31g(d).firefly.inp (generated)

047043625.b3lyp_6-31g(d).smash.inp (generated)

047043625.b3lyp_6-31g(d).nwchem.inp (generated) 047043625.b3lyp_6-31g(d).log.xz 047043625.td-b3lyp_6-31g+(d).inp 047043625.td-b3lyp_6-31g+(d).log.xz

047043625.td-b3lyp_6-31+g(d).qchem.inp (generated)

047043625.td-b3lyp_6-31+g(d).gjf (generated)

047043625.td-b3lyp_6-31+g(d).firefly.inp (generated)

047043625.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047043625.mol 047043625.PUBCHEM 047043625.mol (via Jmol)
047043640.b3lyp_6-31g(d).inp

047043640.b3lyp_6-31g(d).qchem.inp (generated)

047043640.b3lyp_6-31g(d).gjf (generated)

047043640.b3lyp_6-31g(d).firefly.inp (generated)

047043640.b3lyp_6-31g(d).smash.inp (generated)

047043640.b3lyp_6-31g(d).nwchem.inp (generated) 047043640.b3lyp_6-31g(d).log.xz 047043640.td-b3lyp_6-31g+(d).inp 047043640.td-b3lyp_6-31g+(d).log.xz

047043640.td-b3lyp_6-31+g(d).qchem.inp (generated)

047043640.td-b3lyp_6-31+g(d).gjf (generated)

047043640.td-b3lyp_6-31+g(d).firefly.inp (generated)

047043640.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047043640.mol 047043640.PUBCHEM 047043640.mol (via Jmol)
047043646.b3lyp_6-31g(d).inp

047043646.b3lyp_6-31g(d).qchem.inp (generated)

047043646.b3lyp_6-31g(d).gjf (generated)

047043646.b3lyp_6-31g(d).firefly.inp (generated)

047043646.b3lyp_6-31g(d).smash.inp (generated)

047043646.b3lyp_6-31g(d).nwchem.inp (generated) 047043646.b3lyp_6-31g(d).log.xz 047043646.td-b3lyp_6-31g+(d).inp 047043646.td-b3lyp_6-31g+(d).log.xz

047043646.td-b3lyp_6-31+g(d).qchem.inp (generated)

047043646.td-b3lyp_6-31+g(d).gjf (generated)

047043646.td-b3lyp_6-31+g(d).firefly.inp (generated)

047043646.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047043646.mol 047043646.PUBCHEM 047043646.mol (via Jmol)
047043648.b3lyp_6-31g(d).inp

047043648.b3lyp_6-31g(d).qchem.inp (generated)

047043648.b3lyp_6-31g(d).gjf (generated)

047043648.b3lyp_6-31g(d).firefly.inp (generated)

047043648.b3lyp_6-31g(d).smash.inp (generated)

047043648.b3lyp_6-31g(d).nwchem.inp (generated) 047043648.b3lyp_6-31g(d).log.xz 047043648.td-b3lyp_6-31g+(d).inp 047043648.td-b3lyp_6-31g+(d).log.xz

047043648.td-b3lyp_6-31+g(d).qchem.inp (generated)

047043648.td-b3lyp_6-31+g(d).gjf (generated)

047043648.td-b3lyp_6-31+g(d).firefly.inp (generated)

047043648.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047043648.mol 047043648.PUBCHEM 047043648.mol (via Jmol)
047043650.b3lyp_6-31g(d).inp

047043650.b3lyp_6-31g(d).qchem.inp (generated)

047043650.b3lyp_6-31g(d).gjf (generated)

047043650.b3lyp_6-31g(d).firefly.inp (generated)

047043650.b3lyp_6-31g(d).smash.inp (generated)

047043650.b3lyp_6-31g(d).nwchem.inp (generated) 047043650.b3lyp_6-31g(d).log.xz 047043650.td-b3lyp_6-31g+(d).inp 047043650.td-b3lyp_6-31g+(d).log.xz

047043650.td-b3lyp_6-31+g(d).qchem.inp (generated)

047043650.td-b3lyp_6-31+g(d).gjf (generated)

047043650.td-b3lyp_6-31+g(d).firefly.inp (generated)

047043650.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047043650.mol 047043650.PUBCHEM 047043650.mol (via Jmol)
047043651.b3lyp_6-31g(d).inp

047043651.b3lyp_6-31g(d).qchem.inp (generated)

047043651.b3lyp_6-31g(d).gjf (generated)

047043651.b3lyp_6-31g(d).firefly.inp (generated)

047043651.b3lyp_6-31g(d).smash.inp (generated)

047043651.b3lyp_6-31g(d).nwchem.inp (generated) 047043651.b3lyp_6-31g(d).log.xz 047043651.td-b3lyp_6-31g+(d).inp 047043651.td-b3lyp_6-31g+(d).log.xz

047043651.td-b3lyp_6-31+g(d).qchem.inp (generated)

047043651.td-b3lyp_6-31+g(d).gjf (generated)

047043651.td-b3lyp_6-31+g(d).firefly.inp (generated)

047043651.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047043651.mol 047043651.PUBCHEM 047043651.mol (via Jmol)
047043661.b3lyp_6-31g(d).inp

047043661.b3lyp_6-31g(d).qchem.inp (generated)

047043661.b3lyp_6-31g(d).gjf (generated)

047043661.b3lyp_6-31g(d).firefly.inp (generated)

047043661.b3lyp_6-31g(d).smash.inp (generated)

047043661.b3lyp_6-31g(d).nwchem.inp (generated) 047043661.b3lyp_6-31g(d).log.xz 047043661.mol 047043661.PUBCHEM 047043661.mol (via Jmol)
047043662.b3lyp_6-31g(d).inp

047043662.b3lyp_6-31g(d).qchem.inp (generated)

047043662.b3lyp_6-31g(d).gjf (generated)

047043662.b3lyp_6-31g(d).firefly.inp (generated)

047043662.b3lyp_6-31g(d).smash.inp (generated)

047043662.b3lyp_6-31g(d).nwchem.inp (generated) 047043662.b3lyp_6-31g(d).log.xz 047043662.mol 047043662.PUBCHEM 047043662.mol (via Jmol)
047043666.b3lyp_6-31g(d).inp

047043666.b3lyp_6-31g(d).qchem.inp (generated)

047043666.b3lyp_6-31g(d).gjf (generated)

047043666.b3lyp_6-31g(d).firefly.inp (generated)

047043666.b3lyp_6-31g(d).smash.inp (generated)

047043666.b3lyp_6-31g(d).nwchem.inp (generated) 047043666.b3lyp_6-31g(d).log.xz 047043666.mol 047043666.PUBCHEM 047043666.mol (via Jmol)
047043971.b3lyp_6-31g(d).inp

047043971.b3lyp_6-31g(d).qchem.inp (generated)

047043971.b3lyp_6-31g(d).gjf (generated)

047043971.b3lyp_6-31g(d).firefly.inp (generated)

047043971.b3lyp_6-31g(d).smash.inp (generated)

047043971.b3lyp_6-31g(d).nwchem.inp (generated) 047043971.b3lyp_6-31g(d).log.xz 047043971.td-b3lyp_6-31g+(d).inp 047043971.td-b3lyp_6-31g+(d).log.xz

047043971.td-b3lyp_6-31+g(d).qchem.inp (generated)

047043971.td-b3lyp_6-31+g(d).gjf (generated)

047043971.td-b3lyp_6-31+g(d).firefly.inp (generated)

047043971.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047043971.mol 047043971.PUBCHEM 047043971.mol (via Jmol)
047043979.b3lyp_6-31g(d).inp

047043979.b3lyp_6-31g(d).qchem.inp (generated)

047043979.b3lyp_6-31g(d).gjf (generated)

047043979.b3lyp_6-31g(d).firefly.inp (generated)

047043979.b3lyp_6-31g(d).smash.inp (generated)

047043979.b3lyp_6-31g(d).nwchem.inp (generated) 047043979.b3lyp_6-31g(d).log.xz 047043979.td-b3lyp_6-31g+(d).inp 047043979.td-b3lyp_6-31g+(d).log.xz

047043979.td-b3lyp_6-31+g(d).qchem.inp (generated)

047043979.td-b3lyp_6-31+g(d).gjf (generated)

047043979.td-b3lyp_6-31+g(d).firefly.inp (generated)

047043979.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047043979.mol 047043979.PUBCHEM 047043979.mol (via Jmol)
047043981.b3lyp_6-31g(d).inp

047043981.b3lyp_6-31g(d).qchem.inp (generated)

047043981.b3lyp_6-31g(d).gjf (generated)

047043981.b3lyp_6-31g(d).firefly.inp (generated)

047043981.b3lyp_6-31g(d).smash.inp (generated)

047043981.b3lyp_6-31g(d).nwchem.inp (generated) 047043981.b3lyp_6-31g(d).log.xz 047043981.td-b3lyp_6-31g+(d).inp 047043981.td-b3lyp_6-31g+(d).log.xz

047043981.td-b3lyp_6-31+g(d).qchem.inp (generated)

047043981.td-b3lyp_6-31+g(d).gjf (generated)

047043981.td-b3lyp_6-31+g(d).firefly.inp (generated)

047043981.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047043981.mol 047043981.PUBCHEM 047043981.mol (via Jmol)
047043987.b3lyp_6-31g(d).inp

047043987.b3lyp_6-31g(d).qchem.inp (generated)

047043987.b3lyp_6-31g(d).gjf (generated)

047043987.b3lyp_6-31g(d).firefly.inp (generated)

047043987.b3lyp_6-31g(d).smash.inp (generated)

047043987.b3lyp_6-31g(d).nwchem.inp (generated) 047043987.b3lyp_6-31g(d).log.xz 047043987.td-b3lyp_6-31g+(d).inp 047043987.td-b3lyp_6-31g+(d).log.xz

047043987.td-b3lyp_6-31+g(d).qchem.inp (generated)

047043987.td-b3lyp_6-31+g(d).gjf (generated)

047043987.td-b3lyp_6-31+g(d).firefly.inp (generated)

047043987.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047043987.mol 047043987.PUBCHEM 047043987.mol (via Jmol)
047044010.b3lyp_6-31g(d).inp

047044010.b3lyp_6-31g(d).qchem.inp (generated)

047044010.b3lyp_6-31g(d).gjf (generated)

047044010.b3lyp_6-31g(d).firefly.inp (generated)

047044010.b3lyp_6-31g(d).smash.inp (generated)

047044010.b3lyp_6-31g(d).nwchem.inp (generated) 047044010.b3lyp_6-31g(d).log.xz 047044010.mol 047044010.PUBCHEM 047044010.mol (via Jmol)
047044011.b3lyp_6-31g(d).inp

047044011.b3lyp_6-31g(d).qchem.inp (generated)

047044011.b3lyp_6-31g(d).gjf (generated)

047044011.b3lyp_6-31g(d).firefly.inp (generated)

047044011.b3lyp_6-31g(d).smash.inp (generated)

047044011.b3lyp_6-31g(d).nwchem.inp (generated) 047044011.b3lyp_6-31g(d).log.xz 047044011.td-b3lyp_6-31g+(d).inp 047044011.td-b3lyp_6-31g+(d).log.xz

047044011.td-b3lyp_6-31+g(d).qchem.inp (generated)

047044011.td-b3lyp_6-31+g(d).gjf (generated)

047044011.td-b3lyp_6-31+g(d).firefly.inp (generated)

047044011.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047044011.mol 047044011.PUBCHEM 047044011.mol (via Jmol)
047044012.b3lyp_6-31g(d).inp

047044012.b3lyp_6-31g(d).qchem.inp (generated)

047044012.b3lyp_6-31g(d).gjf (generated)

047044012.b3lyp_6-31g(d).firefly.inp (generated)

047044012.b3lyp_6-31g(d).smash.inp (generated)

047044012.b3lyp_6-31g(d).nwchem.inp (generated) 047044012.b3lyp_6-31g(d).log.xz 047044012.mol 047044012.PUBCHEM 047044012.mol (via Jmol)
047044013.b3lyp_6-31g(d).inp

047044013.b3lyp_6-31g(d).qchem.inp (generated)

047044013.b3lyp_6-31g(d).gjf (generated)

047044013.b3lyp_6-31g(d).firefly.inp (generated)

047044013.b3lyp_6-31g(d).smash.inp (generated)

047044013.b3lyp_6-31g(d).nwchem.inp (generated) 047044013.b3lyp_6-31g(d).log.xz 047044013.td-b3lyp_6-31g+(d).inp 047044013.td-b3lyp_6-31g+(d).log.xz

047044013.td-b3lyp_6-31+g(d).qchem.inp (generated)

047044013.td-b3lyp_6-31+g(d).gjf (generated)

047044013.td-b3lyp_6-31+g(d).firefly.inp (generated)

047044013.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047044013.mol 047044013.PUBCHEM 047044013.mol (via Jmol)
047044015.b3lyp_6-31g(d).inp

047044015.b3lyp_6-31g(d).qchem.inp (generated)

047044015.b3lyp_6-31g(d).gjf (generated)

047044015.b3lyp_6-31g(d).firefly.inp (generated)

047044015.b3lyp_6-31g(d).smash.inp (generated)

047044015.b3lyp_6-31g(d).nwchem.inp (generated) 047044015.b3lyp_6-31g(d).log.xz 047044015.td-b3lyp_6-31g+(d).inp 047044015.td-b3lyp_6-31g+(d).log.xz

047044015.td-b3lyp_6-31+g(d).qchem.inp (generated)

047044015.td-b3lyp_6-31+g(d).gjf (generated)

047044015.td-b3lyp_6-31+g(d).firefly.inp (generated)

047044015.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047044015.mol 047044015.PUBCHEM 047044015.mol (via Jmol)
047044016.b3lyp_6-31g(d).inp

047044016.b3lyp_6-31g(d).qchem.inp (generated)

047044016.b3lyp_6-31g(d).gjf (generated)

047044016.b3lyp_6-31g(d).firefly.inp (generated)

047044016.b3lyp_6-31g(d).smash.inp (generated)

047044016.b3lyp_6-31g(d).nwchem.inp (generated) 047044016.b3lyp_6-31g(d).log.xz 047044016.mol 047044016.PUBCHEM 047044016.mol (via Jmol)
047044034.b3lyp_6-31g(d).inp

047044034.b3lyp_6-31g(d).qchem.inp (generated)

047044034.b3lyp_6-31g(d).gjf (generated)

047044034.b3lyp_6-31g(d).firefly.inp (generated)

047044034.b3lyp_6-31g(d).smash.inp (generated)

047044034.b3lyp_6-31g(d).nwchem.inp (generated) 047044034.b3lyp_6-31g(d).log.xz 047044034.td-b3lyp_6-31g+(d).inp 047044034.td-b3lyp_6-31g+(d).log.xz

047044034.td-b3lyp_6-31+g(d).qchem.inp (generated)

047044034.td-b3lyp_6-31+g(d).gjf (generated)

047044034.td-b3lyp_6-31+g(d).firefly.inp (generated)

047044034.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047044034.mol 047044034.PUBCHEM 047044034.mol (via Jmol)
047044035.b3lyp_6-31g(d).inp

047044035.b3lyp_6-31g(d).qchem.inp (generated)

047044035.b3lyp_6-31g(d).gjf (generated)

047044035.b3lyp_6-31g(d).firefly.inp (generated)

047044035.b3lyp_6-31g(d).smash.inp (generated)

047044035.b3lyp_6-31g(d).nwchem.inp (generated) 047044035.b3lyp_6-31g(d).log.xz 047044035.td-b3lyp_6-31g+(d).inp 047044035.td-b3lyp_6-31g+(d).log.xz

047044035.td-b3lyp_6-31+g(d).qchem.inp (generated)

047044035.td-b3lyp_6-31+g(d).gjf (generated)

047044035.td-b3lyp_6-31+g(d).firefly.inp (generated)

047044035.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047044035.mol 047044035.PUBCHEM 047044035.mol (via Jmol)
047044044.b3lyp_6-31g(d).inp

047044044.b3lyp_6-31g(d).qchem.inp (generated)

047044044.b3lyp_6-31g(d).gjf (generated)

047044044.b3lyp_6-31g(d).firefly.inp (generated)

047044044.b3lyp_6-31g(d).smash.inp (generated)

047044044.b3lyp_6-31g(d).nwchem.inp (generated) 047044044.b3lyp_6-31g(d).log.xz 047044044.mol 047044044.PUBCHEM 047044044.mol (via Jmol)
047044051.b3lyp_6-31g(d).inp

047044051.b3lyp_6-31g(d).qchem.inp (generated)

047044051.b3lyp_6-31g(d).gjf (generated)

047044051.b3lyp_6-31g(d).firefly.inp (generated)

047044051.b3lyp_6-31g(d).smash.inp (generated)

047044051.b3lyp_6-31g(d).nwchem.inp (generated) 047044051.b3lyp_6-31g(d).log.xz 047044051.td-b3lyp_6-31g+(d).inp 047044051.td-b3lyp_6-31g+(d).log.xz

047044051.td-b3lyp_6-31+g(d).qchem.inp (generated)

047044051.td-b3lyp_6-31+g(d).gjf (generated)

047044051.td-b3lyp_6-31+g(d).firefly.inp (generated)

047044051.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047044051.mol 047044051.PUBCHEM 047044051.mol (via Jmol)
047044085.b3lyp_6-31g(d).inp

047044085.b3lyp_6-31g(d).qchem.inp (generated)

047044085.b3lyp_6-31g(d).gjf (generated)

047044085.b3lyp_6-31g(d).firefly.inp (generated)

047044085.b3lyp_6-31g(d).smash.inp (generated)

047044085.b3lyp_6-31g(d).nwchem.inp (generated) 047044085.b3lyp_6-31g(d).log.xz 047044085.td-b3lyp_6-31g+(d).inp 047044085.td-b3lyp_6-31g+(d).log.xz

047044085.td-b3lyp_6-31+g(d).qchem.inp (generated)

047044085.td-b3lyp_6-31+g(d).gjf (generated)

047044085.td-b3lyp_6-31+g(d).firefly.inp (generated)

047044085.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047044085.mol 047044085.PUBCHEM 047044085.mol (via Jmol)
047044650.b3lyp_6-31g(d).inp

047044650.b3lyp_6-31g(d).qchem.inp (generated)

047044650.b3lyp_6-31g(d).gjf (generated)

047044650.b3lyp_6-31g(d).firefly.inp (generated)

047044650.b3lyp_6-31g(d).smash.inp (generated)

047044650.b3lyp_6-31g(d).nwchem.inp (generated) 047044650.b3lyp_6-31g(d).log.xz 047044650.td-b3lyp_6-31g+(d).inp 047044650.td-b3lyp_6-31g+(d).log.xz

047044650.td-b3lyp_6-31+g(d).qchem.inp (generated)

047044650.td-b3lyp_6-31+g(d).gjf (generated)

047044650.td-b3lyp_6-31+g(d).firefly.inp (generated)

047044650.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047044650.mol 047044650.PUBCHEM 047044650.mol (via Jmol)
047044684.b3lyp_6-31g(d).inp

047044684.b3lyp_6-31g(d).qchem.inp (generated)

047044684.b3lyp_6-31g(d).gjf (generated)

047044684.b3lyp_6-31g(d).firefly.inp (generated)

047044684.b3lyp_6-31g(d).smash.inp (generated)

047044684.b3lyp_6-31g(d).nwchem.inp (generated) 047044684.b3lyp_6-31g(d).log.xz 047044684.mol 047044684.PUBCHEM 047044684.mol (via Jmol)
047044687.b3lyp_6-31g(d).inp

047044687.b3lyp_6-31g(d).qchem.inp (generated)

047044687.b3lyp_6-31g(d).gjf (generated)

047044687.b3lyp_6-31g(d).firefly.inp (generated)

047044687.b3lyp_6-31g(d).smash.inp (generated)

047044687.b3lyp_6-31g(d).nwchem.inp (generated) 047044687.b3lyp_6-31g(d).log.xz 047044687.mol 047044687.PUBCHEM 047044687.mol (via Jmol)
047044700.b3lyp_6-31g(d).inp

047044700.b3lyp_6-31g(d).qchem.inp (generated)

047044700.b3lyp_6-31g(d).gjf (generated)

047044700.b3lyp_6-31g(d).firefly.inp (generated)

047044700.b3lyp_6-31g(d).smash.inp (generated)

047044700.b3lyp_6-31g(d).nwchem.inp (generated) 047044700.b3lyp_6-31g(d).log.xz 047044700.td-b3lyp_6-31g+(d).inp 047044700.td-b3lyp_6-31g+(d).log.xz

047044700.td-b3lyp_6-31+g(d).qchem.inp (generated)

047044700.td-b3lyp_6-31+g(d).gjf (generated)

047044700.td-b3lyp_6-31+g(d).firefly.inp (generated)

047044700.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047044700.mol 047044700.PUBCHEM 047044700.mol (via Jmol)
047044716.b3lyp_6-31g(d).inp

047044716.b3lyp_6-31g(d).qchem.inp (generated)

047044716.b3lyp_6-31g(d).gjf (generated)

047044716.b3lyp_6-31g(d).firefly.inp (generated)

047044716.b3lyp_6-31g(d).smash.inp (generated)

047044716.b3lyp_6-31g(d).nwchem.inp (generated) 047044716.b3lyp_6-31g(d).log.xz 047044716.mol 047044716.PUBCHEM 047044716.mol (via Jmol)
047044756.b3lyp_6-31g(d).inp

047044756.b3lyp_6-31g(d).qchem.inp (generated)

047044756.b3lyp_6-31g(d).gjf (generated)

047044756.b3lyp_6-31g(d).firefly.inp (generated)

047044756.b3lyp_6-31g(d).smash.inp (generated)

047044756.b3lyp_6-31g(d).nwchem.inp (generated) 047044756.b3lyp_6-31g(d).log.xz 047044756.mol 047044756.PUBCHEM 047044756.mol (via Jmol)
047045400.b3lyp_6-31g(d).inp

047045400.b3lyp_6-31g(d).qchem.inp (generated)

047045400.b3lyp_6-31g(d).gjf (generated)

047045400.b3lyp_6-31g(d).firefly.inp (generated)

047045400.b3lyp_6-31g(d).smash.inp (generated)

047045400.b3lyp_6-31g(d).nwchem.inp (generated) 047045400.b3lyp_6-31g(d).log.xz 047045400.td-b3lyp_6-31g+(d).inp 047045400.td-b3lyp_6-31g+(d).log.xz

047045400.td-b3lyp_6-31+g(d).qchem.inp (generated)

047045400.td-b3lyp_6-31+g(d).gjf (generated)

047045400.td-b3lyp_6-31+g(d).firefly.inp (generated)

047045400.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047045400.mol 047045400.PUBCHEM 047045400.mol (via Jmol)
047045402.b3lyp_6-31g(d).inp

047045402.b3lyp_6-31g(d).qchem.inp (generated)

047045402.b3lyp_6-31g(d).gjf (generated)

047045402.b3lyp_6-31g(d).firefly.inp (generated)

047045402.b3lyp_6-31g(d).smash.inp (generated)

047045402.b3lyp_6-31g(d).nwchem.inp (generated) 047045402.b3lyp_6-31g(d).log.xz 047045402.td-b3lyp_6-31g+(d).inp 047045402.td-b3lyp_6-31g+(d).log.xz

047045402.td-b3lyp_6-31+g(d).qchem.inp (generated)

047045402.td-b3lyp_6-31+g(d).gjf (generated)

047045402.td-b3lyp_6-31+g(d).firefly.inp (generated)

047045402.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047045402.mol 047045402.PUBCHEM 047045402.mol (via Jmol)
047045406.b3lyp_6-31g(d).inp

047045406.b3lyp_6-31g(d).qchem.inp (generated)

047045406.b3lyp_6-31g(d).gjf (generated)

047045406.b3lyp_6-31g(d).firefly.inp (generated)

047045406.b3lyp_6-31g(d).smash.inp (generated)

047045406.b3lyp_6-31g(d).nwchem.inp (generated) 047045406.b3lyp_6-31g(d).log.xz 047045406.mol 047045406.PUBCHEM 047045406.mol (via Jmol)
047045407.b3lyp_6-31g(d).inp

047045407.b3lyp_6-31g(d).qchem.inp (generated)

047045407.b3lyp_6-31g(d).gjf (generated)

047045407.b3lyp_6-31g(d).firefly.inp (generated)

047045407.b3lyp_6-31g(d).smash.inp (generated)

047045407.b3lyp_6-31g(d).nwchem.inp (generated) 047045407.b3lyp_6-31g(d).log.xz 047045407.td-b3lyp_6-31g+(d).inp 047045407.td-b3lyp_6-31g+(d).log.xz

047045407.td-b3lyp_6-31+g(d).qchem.inp (generated)

047045407.td-b3lyp_6-31+g(d).gjf (generated)

047045407.td-b3lyp_6-31+g(d).firefly.inp (generated)

047045407.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047045407.mol 047045407.PUBCHEM 047045407.mol (via Jmol)
047045409.b3lyp_6-31g(d).inp

047045409.b3lyp_6-31g(d).qchem.inp (generated)

047045409.b3lyp_6-31g(d).gjf (generated)

047045409.b3lyp_6-31g(d).firefly.inp (generated)

047045409.b3lyp_6-31g(d).smash.inp (generated)

047045409.b3lyp_6-31g(d).nwchem.inp (generated) 047045409.b3lyp_6-31g(d).log.xz 047045409.td-b3lyp_6-31g+(d).inp 047045409.td-b3lyp_6-31g+(d).log.xz

047045409.td-b3lyp_6-31+g(d).qchem.inp (generated)

047045409.td-b3lyp_6-31+g(d).gjf (generated)

047045409.td-b3lyp_6-31+g(d).firefly.inp (generated)

047045409.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047045409.mol 047045409.PUBCHEM 047045409.mol (via Jmol)
047045414.b3lyp_6-31g(d).inp

047045414.b3lyp_6-31g(d).qchem.inp (generated)

047045414.b3lyp_6-31g(d).gjf (generated)

047045414.b3lyp_6-31g(d).firefly.inp (generated)

047045414.b3lyp_6-31g(d).smash.inp (generated)

047045414.b3lyp_6-31g(d).nwchem.inp (generated) 047045414.b3lyp_6-31g(d).log.xz 047045414.mol 047045414.PUBCHEM 047045414.mol (via Jmol)
047045416.b3lyp_6-31g(d).inp

047045416.b3lyp_6-31g(d).qchem.inp (generated)

047045416.b3lyp_6-31g(d).gjf (generated)

047045416.b3lyp_6-31g(d).firefly.inp (generated)

047045416.b3lyp_6-31g(d).smash.inp (generated)

047045416.b3lyp_6-31g(d).nwchem.inp (generated) 047045416.b3lyp_6-31g(d).log.xz 047045416.td-b3lyp_6-31g+(d).inp 047045416.td-b3lyp_6-31g+(d).log.xz

047045416.td-b3lyp_6-31+g(d).qchem.inp (generated)

047045416.td-b3lyp_6-31+g(d).gjf (generated)

047045416.td-b3lyp_6-31+g(d).firefly.inp (generated)

047045416.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047045416.mol 047045416.PUBCHEM 047045416.mol (via Jmol)
047045417.b3lyp_6-31g(d).inp

047045417.b3lyp_6-31g(d).qchem.inp (generated)

047045417.b3lyp_6-31g(d).gjf (generated)

047045417.b3lyp_6-31g(d).firefly.inp (generated)

047045417.b3lyp_6-31g(d).smash.inp (generated)

047045417.b3lyp_6-31g(d).nwchem.inp (generated) 047045417.b3lyp_6-31g(d).log.xz 047045417.td-b3lyp_6-31g+(d).inp 047045417.td-b3lyp_6-31g+(d).log.xz

047045417.td-b3lyp_6-31+g(d).qchem.inp (generated)

047045417.td-b3lyp_6-31+g(d).gjf (generated)

047045417.td-b3lyp_6-31+g(d).firefly.inp (generated)

047045417.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047045417.mol 047045417.PUBCHEM 047045417.mol (via Jmol)
047045421.b3lyp_6-31g(d).inp

047045421.b3lyp_6-31g(d).qchem.inp (generated)

047045421.b3lyp_6-31g(d).gjf (generated)

047045421.b3lyp_6-31g(d).firefly.inp (generated)

047045421.b3lyp_6-31g(d).smash.inp (generated)

047045421.b3lyp_6-31g(d).nwchem.inp (generated) 047045421.b3lyp_6-31g(d).log.xz 047045421.td-b3lyp_6-31g+(d).inp 047045421.td-b3lyp_6-31g+(d).log.xz

047045421.td-b3lyp_6-31+g(d).qchem.inp (generated)

047045421.td-b3lyp_6-31+g(d).gjf (generated)

047045421.td-b3lyp_6-31+g(d).firefly.inp (generated)

047045421.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047045421.mol 047045421.PUBCHEM 047045421.mol (via Jmol)
047045429.b3lyp_6-31g(d).inp

047045429.b3lyp_6-31g(d).qchem.inp (generated)

047045429.b3lyp_6-31g(d).gjf (generated)

047045429.b3lyp_6-31g(d).firefly.inp (generated)

047045429.b3lyp_6-31g(d).smash.inp (generated)

047045429.b3lyp_6-31g(d).nwchem.inp (generated) 047045429.b3lyp_6-31g(d).log.xz 047045429.td-b3lyp_6-31g+(d).inp 047045429.td-b3lyp_6-31g+(d).log.xz

047045429.td-b3lyp_6-31+g(d).qchem.inp (generated)

047045429.td-b3lyp_6-31+g(d).gjf (generated)

047045429.td-b3lyp_6-31+g(d).firefly.inp (generated)

047045429.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047045429.mol 047045429.PUBCHEM 047045429.mol (via Jmol)
047045432.b3lyp_6-31g(d).inp

047045432.b3lyp_6-31g(d).qchem.inp (generated)

047045432.b3lyp_6-31g(d).gjf (generated)

047045432.b3lyp_6-31g(d).firefly.inp (generated)

047045432.b3lyp_6-31g(d).smash.inp (generated)

047045432.b3lyp_6-31g(d).nwchem.inp (generated) 047045432.b3lyp_6-31g(d).log.xz 047045432.mol 047045432.PUBCHEM 047045432.mol (via Jmol)
047045435.b3lyp_6-31g(d).inp

047045435.b3lyp_6-31g(d).qchem.inp (generated)

047045435.b3lyp_6-31g(d).gjf (generated)

047045435.b3lyp_6-31g(d).firefly.inp (generated)

047045435.b3lyp_6-31g(d).smash.inp (generated)

047045435.b3lyp_6-31g(d).nwchem.inp (generated) 047045435.b3lyp_6-31g(d).log.xz 047045435.td-b3lyp_6-31g+(d).inp 047045435.td-b3lyp_6-31g+(d).log.xz

047045435.td-b3lyp_6-31+g(d).qchem.inp (generated)

047045435.td-b3lyp_6-31+g(d).gjf (generated)

047045435.td-b3lyp_6-31+g(d).firefly.inp (generated)

047045435.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047045435.mol 047045435.PUBCHEM 047045435.mol (via Jmol)
047045436.b3lyp_6-31g(d).inp

047045436.b3lyp_6-31g(d).qchem.inp (generated)

047045436.b3lyp_6-31g(d).gjf (generated)

047045436.b3lyp_6-31g(d).firefly.inp (generated)

047045436.b3lyp_6-31g(d).smash.inp (generated)

047045436.b3lyp_6-31g(d).nwchem.inp (generated) 047045436.b3lyp_6-31g(d).log.xz 047045436.td-b3lyp_6-31g+(d).inp 047045436.td-b3lyp_6-31g+(d).log.xz

047045436.td-b3lyp_6-31+g(d).qchem.inp (generated)

047045436.td-b3lyp_6-31+g(d).gjf (generated)

047045436.td-b3lyp_6-31+g(d).firefly.inp (generated)

047045436.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047045436.mol 047045436.PUBCHEM 047045436.mol (via Jmol)
047045438.b3lyp_6-31g(d).inp

047045438.b3lyp_6-31g(d).qchem.inp (generated)

047045438.b3lyp_6-31g(d).gjf (generated)

047045438.b3lyp_6-31g(d).firefly.inp (generated)

047045438.b3lyp_6-31g(d).smash.inp (generated)

047045438.b3lyp_6-31g(d).nwchem.inp (generated) 047045438.b3lyp_6-31g(d).log.xz 047045438.td-b3lyp_6-31g+(d).inp 047045438.td-b3lyp_6-31g+(d).log.xz

047045438.td-b3lyp_6-31+g(d).qchem.inp (generated)

047045438.td-b3lyp_6-31+g(d).gjf (generated)

047045438.td-b3lyp_6-31+g(d).firefly.inp (generated)

047045438.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047045438.mol 047045438.PUBCHEM 047045438.mol (via Jmol)
047045440.b3lyp_6-31g(d).inp

047045440.b3lyp_6-31g(d).qchem.inp (generated)

047045440.b3lyp_6-31g(d).gjf (generated)

047045440.b3lyp_6-31g(d).firefly.inp (generated)

047045440.b3lyp_6-31g(d).smash.inp (generated)

047045440.b3lyp_6-31g(d).nwchem.inp (generated) 047045440.b3lyp_6-31g(d).log.xz 047045440.td-b3lyp_6-31g+(d).inp 047045440.td-b3lyp_6-31g+(d).log.xz

047045440.td-b3lyp_6-31+g(d).qchem.inp (generated)

047045440.td-b3lyp_6-31+g(d).gjf (generated)

047045440.td-b3lyp_6-31+g(d).firefly.inp (generated)

047045440.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047045440.mol 047045440.PUBCHEM 047045440.mol (via Jmol)
047045450.b3lyp_6-31g(d).inp

047045450.b3lyp_6-31g(d).qchem.inp (generated)

047045450.b3lyp_6-31g(d).gjf (generated)

047045450.b3lyp_6-31g(d).firefly.inp (generated)

047045450.b3lyp_6-31g(d).smash.inp (generated)

047045450.b3lyp_6-31g(d).nwchem.inp (generated) 047045450.b3lyp_6-31g(d).log.xz 047045450.td-b3lyp_6-31g+(d).inp 047045450.td-b3lyp_6-31g+(d).log.xz

047045450.td-b3lyp_6-31+g(d).qchem.inp (generated)

047045450.td-b3lyp_6-31+g(d).gjf (generated)

047045450.td-b3lyp_6-31+g(d).firefly.inp (generated)

047045450.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047045450.mol 047045450.PUBCHEM 047045450.mol (via Jmol)
047045457.b3lyp_6-31g(d).inp

047045457.b3lyp_6-31g(d).qchem.inp (generated)

047045457.b3lyp_6-31g(d).gjf (generated)

047045457.b3lyp_6-31g(d).firefly.inp (generated)

047045457.b3lyp_6-31g(d).smash.inp (generated)

047045457.b3lyp_6-31g(d).nwchem.inp (generated) 047045457.b3lyp_6-31g(d).log.xz 047045457.td-b3lyp_6-31g+(d).inp 047045457.td-b3lyp_6-31g+(d).log.xz

047045457.td-b3lyp_6-31+g(d).qchem.inp (generated)

047045457.td-b3lyp_6-31+g(d).gjf (generated)

047045457.td-b3lyp_6-31+g(d).firefly.inp (generated)

047045457.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047045457.mol 047045457.PUBCHEM 047045457.mol (via Jmol)
047045853.b3lyp_6-31g(d).inp

047045853.b3lyp_6-31g(d).qchem.inp (generated)

047045853.b3lyp_6-31g(d).gjf (generated)

047045853.b3lyp_6-31g(d).firefly.inp (generated)

047045853.b3lyp_6-31g(d).smash.inp (generated)

047045853.b3lyp_6-31g(d).nwchem.inp (generated) 047045853.b3lyp_6-31g(d).log.xz 047045853.td-b3lyp_6-31g+(d).inp 047045853.td-b3lyp_6-31g+(d).log.xz

047045853.td-b3lyp_6-31+g(d).qchem.inp (generated)

047045853.td-b3lyp_6-31+g(d).gjf (generated)

047045853.td-b3lyp_6-31+g(d).firefly.inp (generated)

047045853.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047045853.mol 047045853.PUBCHEM 047045853.mol (via Jmol)
047046007.b3lyp_6-31g(d).inp

047046007.b3lyp_6-31g(d).qchem.inp (generated)

047046007.b3lyp_6-31g(d).gjf (generated)

047046007.b3lyp_6-31g(d).firefly.inp (generated)

047046007.b3lyp_6-31g(d).smash.inp (generated)

047046007.b3lyp_6-31g(d).nwchem.inp (generated) 047046007.b3lyp_6-31g(d).log.xz 047046007.td-b3lyp_6-31g+(d).inp 047046007.td-b3lyp_6-31g+(d).log.xz

047046007.td-b3lyp_6-31+g(d).qchem.inp (generated)

047046007.td-b3lyp_6-31+g(d).gjf (generated)

047046007.td-b3lyp_6-31+g(d).firefly.inp (generated)

047046007.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047046007.mol 047046007.PUBCHEM 047046007.mol (via Jmol)
047046166.b3lyp_6-31g(d).inp

047046166.b3lyp_6-31g(d).qchem.inp (generated)

047046166.b3lyp_6-31g(d).gjf (generated)

047046166.b3lyp_6-31g(d).firefly.inp (generated)

047046166.b3lyp_6-31g(d).smash.inp (generated)

047046166.b3lyp_6-31g(d).nwchem.inp (generated) 047046166.b3lyp_6-31g(d).log.xz 047046166.td-b3lyp_6-31g+(d).inp 047046166.td-b3lyp_6-31g+(d).log.xz

047046166.td-b3lyp_6-31+g(d).qchem.inp (generated)

047046166.td-b3lyp_6-31+g(d).gjf (generated)

047046166.td-b3lyp_6-31+g(d).firefly.inp (generated)

047046166.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047046166.mol 047046166.PUBCHEM 047046166.mol (via Jmol)
047046273.b3lyp_6-31g(d).inp

047046273.b3lyp_6-31g(d).qchem.inp (generated)

047046273.b3lyp_6-31g(d).gjf (generated)

047046273.b3lyp_6-31g(d).firefly.inp (generated)

047046273.b3lyp_6-31g(d).smash.inp (generated)

047046273.b3lyp_6-31g(d).nwchem.inp (generated) 047046273.b3lyp_6-31g(d).log.xz 047046273.td-b3lyp_6-31g+(d).inp 047046273.td-b3lyp_6-31g+(d).log.xz

047046273.td-b3lyp_6-31+g(d).qchem.inp (generated)

047046273.td-b3lyp_6-31+g(d).gjf (generated)

047046273.td-b3lyp_6-31+g(d).firefly.inp (generated)

047046273.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047046273.mol 047046273.PUBCHEM 047046273.mol (via Jmol)
047047601.b3lyp_6-31g(d).inp

047047601.b3lyp_6-31g(d).qchem.inp (generated)

047047601.b3lyp_6-31g(d).gjf (generated)

047047601.b3lyp_6-31g(d).firefly.inp (generated)

047047601.b3lyp_6-31g(d).smash.inp (generated)

047047601.b3lyp_6-31g(d).nwchem.inp (generated) 047047601.b3lyp_6-31g(d).log.xz 047047601.td-b3lyp_6-31g+(d).inp 047047601.td-b3lyp_6-31g+(d).log.xz

047047601.td-b3lyp_6-31+g(d).qchem.inp (generated)

047047601.td-b3lyp_6-31+g(d).gjf (generated)

047047601.td-b3lyp_6-31+g(d).firefly.inp (generated)

047047601.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047047601.mol 047047601.PUBCHEM 047047601.mol (via Jmol)
047047795.b3lyp_6-31g(d).inp

047047795.b3lyp_6-31g(d).qchem.inp (generated)

047047795.b3lyp_6-31g(d).gjf (generated)

047047795.b3lyp_6-31g(d).firefly.inp (generated)

047047795.b3lyp_6-31g(d).smash.inp (generated)

047047795.b3lyp_6-31g(d).nwchem.inp (generated) 047047795.b3lyp_6-31g(d).log.xz 047047795.mol 047047795.PUBCHEM 047047795.mol (via Jmol)
047047929.b3lyp_6-31g(d).inp

047047929.b3lyp_6-31g(d).qchem.inp (generated)

047047929.b3lyp_6-31g(d).gjf (generated)

047047929.b3lyp_6-31g(d).firefly.inp (generated)

047047929.b3lyp_6-31g(d).smash.inp (generated)

047047929.b3lyp_6-31g(d).nwchem.inp (generated) 047047929.b3lyp_6-31g(d).log.xz 047047929.mol 047047929.PUBCHEM 047047929.mol (via Jmol)
047048798.b3lyp_6-31g(d).inp

047048798.b3lyp_6-31g(d).qchem.inp (generated)

047048798.b3lyp_6-31g(d).gjf (generated)

047048798.b3lyp_6-31g(d).firefly.inp (generated)

047048798.b3lyp_6-31g(d).smash.inp (generated)

047048798.b3lyp_6-31g(d).nwchem.inp (generated) 047048798.b3lyp_6-31g(d).log.xz 047048798.mol 047048798.PUBCHEM 047048798.mol (via Jmol)
047049247.b3lyp_6-31g(d).inp

047049247.b3lyp_6-31g(d).qchem.inp (generated)

047049247.b3lyp_6-31g(d).gjf (generated)

047049247.b3lyp_6-31g(d).firefly.inp (generated)

047049247.b3lyp_6-31g(d).smash.inp (generated)

047049247.b3lyp_6-31g(d).nwchem.inp (generated) 047049247.b3lyp_6-31g(d).log.xz 047049247.mol 047049247.PUBCHEM 047049247.mol (via Jmol)
047049487.b3lyp_6-31g(d).inp

047049487.b3lyp_6-31g(d).qchem.inp (generated)

047049487.b3lyp_6-31g(d).gjf (generated)

047049487.b3lyp_6-31g(d).firefly.inp (generated)

047049487.b3lyp_6-31g(d).smash.inp (generated)

047049487.b3lyp_6-31g(d).nwchem.inp (generated) 047049487.b3lyp_6-31g(d).log.xz 047049487.td-b3lyp_6-31g+(d).inp 047049487.td-b3lyp_6-31g+(d).log.xz

047049487.td-b3lyp_6-31+g(d).qchem.inp (generated)

047049487.td-b3lyp_6-31+g(d).gjf (generated)

047049487.td-b3lyp_6-31+g(d).firefly.inp (generated)

047049487.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047049487.mol 047049487.PUBCHEM 047049487.mol (via Jmol)
047049562.b3lyp_6-31g(d).inp

047049562.b3lyp_6-31g(d).qchem.inp (generated)

047049562.b3lyp_6-31g(d).gjf (generated)

047049562.b3lyp_6-31g(d).firefly.inp (generated)

047049562.b3lyp_6-31g(d).smash.inp (generated)

047049562.b3lyp_6-31g(d).nwchem.inp (generated) 047049562.b3lyp_6-31g(d).log.xz 047049562.td-b3lyp_6-31g+(d).inp 047049562.td-b3lyp_6-31g+(d).log.xz

047049562.td-b3lyp_6-31+g(d).qchem.inp (generated)

047049562.td-b3lyp_6-31+g(d).gjf (generated)

047049562.td-b3lyp_6-31+g(d).firefly.inp (generated)

047049562.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047049562.mol 047049562.PUBCHEM 047049562.mol (via Jmol)


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