Index of

Last updated : Thu May 18 02:15:23 JST 2017
Total : 312 (244) in this page
072100273.b3lyp_6-31g(d).inp

072100273.b3lyp_6-31g(d).qchem.inp (generated)

072100273.b3lyp_6-31g(d).gjf (generated)

072100273.b3lyp_6-31g(d).firefly.inp (generated)

072100273.b3lyp_6-31g(d).smash.inp (generated)

072100273.b3lyp_6-31g(d).nwchem.inp (generated) 072100273.b3lyp_6-31g(d).log.xz 072100273.td-b3lyp_6-31g+(d).inp 072100273.td-b3lyp_6-31g+(d).log.xz

072100273.td-b3lyp_6-31+g(d).qchem.inp (generated)

072100273.td-b3lyp_6-31+g(d).gjf (generated)

072100273.td-b3lyp_6-31+g(d).firefly.inp (generated)

072100273.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072100273.mol 072100273.PUBCHEM 072100273.mol (via Jmol)
072100447.b3lyp_6-31g(d).inp

072100447.b3lyp_6-31g(d).qchem.inp (generated)

072100447.b3lyp_6-31g(d).gjf (generated)

072100447.b3lyp_6-31g(d).firefly.inp (generated)

072100447.b3lyp_6-31g(d).smash.inp (generated)

072100447.b3lyp_6-31g(d).nwchem.inp (generated) 072100447.b3lyp_6-31g(d).log.xz 072100447.td-b3lyp_6-31g+(d).inp 072100447.td-b3lyp_6-31g+(d).log.xz

072100447.td-b3lyp_6-31+g(d).qchem.inp (generated)

072100447.td-b3lyp_6-31+g(d).gjf (generated)

072100447.td-b3lyp_6-31+g(d).firefly.inp (generated)

072100447.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072100447.mol 072100447.PUBCHEM 072100447.mol (via Jmol)
072100497.b3lyp_6-31g(d).inp

072100497.b3lyp_6-31g(d).qchem.inp (generated)

072100497.b3lyp_6-31g(d).gjf (generated)

072100497.b3lyp_6-31g(d).firefly.inp (generated)

072100497.b3lyp_6-31g(d).smash.inp (generated)

072100497.b3lyp_6-31g(d).nwchem.inp (generated) 072100497.b3lyp_6-31g(d).log.xz 072100497.td-b3lyp_6-31g+(d).inp 072100497.td-b3lyp_6-31g+(d).log.xz

072100497.td-b3lyp_6-31+g(d).qchem.inp (generated)

072100497.td-b3lyp_6-31+g(d).gjf (generated)

072100497.td-b3lyp_6-31+g(d).firefly.inp (generated)

072100497.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072100497.mol 072100497.PUBCHEM 072100497.mol (via Jmol)
072100541.b3lyp_6-31g(d).inp

072100541.b3lyp_6-31g(d).qchem.inp (generated)

072100541.b3lyp_6-31g(d).gjf (generated)

072100541.b3lyp_6-31g(d).firefly.inp (generated)

072100541.b3lyp_6-31g(d).smash.inp (generated)

072100541.b3lyp_6-31g(d).nwchem.inp (generated) 072100541.b3lyp_6-31g(d).log.xz 072100541.td-b3lyp_6-31g+(d).inp 072100541.td-b3lyp_6-31g+(d).log.xz

072100541.td-b3lyp_6-31+g(d).qchem.inp (generated)

072100541.td-b3lyp_6-31+g(d).gjf (generated)

072100541.td-b3lyp_6-31+g(d).firefly.inp (generated)

072100541.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072100541.mol 072100541.PUBCHEM 072100541.mol (via Jmol)
072100569.b3lyp_6-31g(d).inp

072100569.b3lyp_6-31g(d).qchem.inp (generated)

072100569.b3lyp_6-31g(d).gjf (generated)

072100569.b3lyp_6-31g(d).firefly.inp (generated)

072100569.b3lyp_6-31g(d).smash.inp (generated)

072100569.b3lyp_6-31g(d).nwchem.inp (generated) 072100569.b3lyp_6-31g(d).log.xz 072100569.td-b3lyp_6-31g+(d).inp 072100569.td-b3lyp_6-31g+(d).log.xz

072100569.td-b3lyp_6-31+g(d).qchem.inp (generated)

072100569.td-b3lyp_6-31+g(d).gjf (generated)

072100569.td-b3lyp_6-31+g(d).firefly.inp (generated)

072100569.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072100569.mol 072100569.PUBCHEM 072100569.mol (via Jmol)
072100684.b3lyp_6-31g(d).inp

072100684.b3lyp_6-31g(d).qchem.inp (generated)

072100684.b3lyp_6-31g(d).gjf (generated)

072100684.b3lyp_6-31g(d).firefly.inp (generated)

072100684.b3lyp_6-31g(d).smash.inp (generated)

072100684.b3lyp_6-31g(d).nwchem.inp (generated) 072100684.b3lyp_6-31g(d).log.xz 072100684.td-b3lyp_6-31g+(d).inp 072100684.td-b3lyp_6-31g+(d).log.xz

072100684.td-b3lyp_6-31+g(d).qchem.inp (generated)

072100684.td-b3lyp_6-31+g(d).gjf (generated)

072100684.td-b3lyp_6-31+g(d).firefly.inp (generated)

072100684.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072100684.mol 072100684.PUBCHEM 072100684.mol (via Jmol)
072100695.b3lyp_6-31g(d).inp

072100695.b3lyp_6-31g(d).qchem.inp (generated)

072100695.b3lyp_6-31g(d).gjf (generated)

072100695.b3lyp_6-31g(d).firefly.inp (generated)

072100695.b3lyp_6-31g(d).smash.inp (generated)

072100695.b3lyp_6-31g(d).nwchem.inp (generated) 072100695.b3lyp_6-31g(d).log.xz 072100695.td-b3lyp_6-31g+(d).inp 072100695.td-b3lyp_6-31g+(d).log.xz

072100695.td-b3lyp_6-31+g(d).qchem.inp (generated)

072100695.td-b3lyp_6-31+g(d).gjf (generated)

072100695.td-b3lyp_6-31+g(d).firefly.inp (generated)

072100695.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072100695.mol 072100695.PUBCHEM 072100695.mol (via Jmol)
072100736.b3lyp_6-31g(d).inp

072100736.b3lyp_6-31g(d).qchem.inp (generated)

072100736.b3lyp_6-31g(d).gjf (generated)

072100736.b3lyp_6-31g(d).firefly.inp (generated)

072100736.b3lyp_6-31g(d).smash.inp (generated)

072100736.b3lyp_6-31g(d).nwchem.inp (generated) 072100736.b3lyp_6-31g(d).log.xz 072100736.td-b3lyp_6-31g+(d).inp 072100736.td-b3lyp_6-31g+(d).log.xz

072100736.td-b3lyp_6-31+g(d).qchem.inp (generated)

072100736.td-b3lyp_6-31+g(d).gjf (generated)

072100736.td-b3lyp_6-31+g(d).firefly.inp (generated)

072100736.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072100736.mol 072100736.PUBCHEM 072100736.mol (via Jmol)
072100821.b3lyp_6-31g(d).inp

072100821.b3lyp_6-31g(d).qchem.inp (generated)

072100821.b3lyp_6-31g(d).gjf (generated)

072100821.b3lyp_6-31g(d).firefly.inp (generated)

072100821.b3lyp_6-31g(d).smash.inp (generated)

072100821.b3lyp_6-31g(d).nwchem.inp (generated) 072100821.b3lyp_6-31g(d).log.xz 072100821.mol 072100821.PUBCHEM 072100821.mol (via Jmol)
072100903.b3lyp_6-31g(d).inp

072100903.b3lyp_6-31g(d).qchem.inp (generated)

072100903.b3lyp_6-31g(d).gjf (generated)

072100903.b3lyp_6-31g(d).firefly.inp (generated)

072100903.b3lyp_6-31g(d).smash.inp (generated)

072100903.b3lyp_6-31g(d).nwchem.inp (generated) 072100903.b3lyp_6-31g(d).log.xz 072100903.td-b3lyp_6-31g+(d).inp 072100903.td-b3lyp_6-31g+(d).log.xz

072100903.td-b3lyp_6-31+g(d).qchem.inp (generated)

072100903.td-b3lyp_6-31+g(d).gjf (generated)

072100903.td-b3lyp_6-31+g(d).firefly.inp (generated)

072100903.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072100903.mol 072100903.PUBCHEM 072100903.mol (via Jmol)
072100946.b3lyp_6-31g(d).inp

072100946.b3lyp_6-31g(d).qchem.inp (generated)

072100946.b3lyp_6-31g(d).gjf (generated)

072100946.b3lyp_6-31g(d).firefly.inp (generated)

072100946.b3lyp_6-31g(d).smash.inp (generated)

072100946.b3lyp_6-31g(d).nwchem.inp (generated) 072100946.b3lyp_6-31g(d).log.xz 072100946.td-b3lyp_6-31g+(d).inp 072100946.td-b3lyp_6-31g+(d).log.xz

072100946.td-b3lyp_6-31+g(d).qchem.inp (generated)

072100946.td-b3lyp_6-31+g(d).gjf (generated)

072100946.td-b3lyp_6-31+g(d).firefly.inp (generated)

072100946.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072100946.mol 072100946.PUBCHEM 072100946.mol (via Jmol)
072100949.b3lyp_6-31g(d).inp

072100949.b3lyp_6-31g(d).qchem.inp (generated)

072100949.b3lyp_6-31g(d).gjf (generated)

072100949.b3lyp_6-31g(d).firefly.inp (generated)

072100949.b3lyp_6-31g(d).smash.inp (generated)

072100949.b3lyp_6-31g(d).nwchem.inp (generated) 072100949.b3lyp_6-31g(d).log.xz 072100949.td-b3lyp_6-31g+(d).inp 072100949.td-b3lyp_6-31g+(d).log.xz

072100949.td-b3lyp_6-31+g(d).qchem.inp (generated)

072100949.td-b3lyp_6-31+g(d).gjf (generated)

072100949.td-b3lyp_6-31+g(d).firefly.inp (generated)

072100949.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072100949.mol 072100949.PUBCHEM 072100949.mol (via Jmol)
072100951.b3lyp_6-31g(d).inp

072100951.b3lyp_6-31g(d).qchem.inp (generated)

072100951.b3lyp_6-31g(d).gjf (generated)

072100951.b3lyp_6-31g(d).firefly.inp (generated)

072100951.b3lyp_6-31g(d).smash.inp (generated)

072100951.b3lyp_6-31g(d).nwchem.inp (generated) 072100951.b3lyp_6-31g(d).log.xz 072100951.td-b3lyp_6-31g+(d).inp 072100951.td-b3lyp_6-31g+(d).log.xz

072100951.td-b3lyp_6-31+g(d).qchem.inp (generated)

072100951.td-b3lyp_6-31+g(d).gjf (generated)

072100951.td-b3lyp_6-31+g(d).firefly.inp (generated)

072100951.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072100951.mol 072100951.PUBCHEM 072100951.mol (via Jmol)
072101048.b3lyp_6-31g(d).inp

072101048.b3lyp_6-31g(d).qchem.inp (generated)

072101048.b3lyp_6-31g(d).gjf (generated)

072101048.b3lyp_6-31g(d).firefly.inp (generated)

072101048.b3lyp_6-31g(d).smash.inp (generated)

072101048.b3lyp_6-31g(d).nwchem.inp (generated) 072101048.b3lyp_6-31g(d).log.xz 072101048.mol 072101048.PUBCHEM 072101048.mol (via Jmol)
072101050.b3lyp_6-31g(d).inp

072101050.b3lyp_6-31g(d).qchem.inp (generated)

072101050.b3lyp_6-31g(d).gjf (generated)

072101050.b3lyp_6-31g(d).firefly.inp (generated)

072101050.b3lyp_6-31g(d).smash.inp (generated)

072101050.b3lyp_6-31g(d).nwchem.inp (generated) 072101050.b3lyp_6-31g(d).log.xz 072101050.td-b3lyp_6-31g+(d).inp 072101050.td-b3lyp_6-31g+(d).log.xz

072101050.td-b3lyp_6-31+g(d).qchem.inp (generated)

072101050.td-b3lyp_6-31+g(d).gjf (generated)

072101050.td-b3lyp_6-31+g(d).firefly.inp (generated)

072101050.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072101050.mol 072101050.PUBCHEM 072101050.mol (via Jmol)
072101330.b3lyp_6-31g(d).inp

072101330.b3lyp_6-31g(d).qchem.inp (generated)

072101330.b3lyp_6-31g(d).gjf (generated)

072101330.b3lyp_6-31g(d).firefly.inp (generated)

072101330.b3lyp_6-31g(d).smash.inp (generated)

072101330.b3lyp_6-31g(d).nwchem.inp (generated) 072101330.b3lyp_6-31g(d).log.xz 072101330.td-b3lyp_6-31g+(d).inp 072101330.td-b3lyp_6-31g+(d).log.xz

072101330.td-b3lyp_6-31+g(d).qchem.inp (generated)

072101330.td-b3lyp_6-31+g(d).gjf (generated)

072101330.td-b3lyp_6-31+g(d).firefly.inp (generated)

072101330.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072101330.mol 072101330.PUBCHEM 072101330.mol (via Jmol)
072101331.b3lyp_6-31g(d).inp

072101331.b3lyp_6-31g(d).qchem.inp (generated)

072101331.b3lyp_6-31g(d).gjf (generated)

072101331.b3lyp_6-31g(d).firefly.inp (generated)

072101331.b3lyp_6-31g(d).smash.inp (generated)

072101331.b3lyp_6-31g(d).nwchem.inp (generated) 072101331.b3lyp_6-31g(d).log.xz 072101331.mol 072101331.PUBCHEM 072101331.mol (via Jmol)
072101334.b3lyp_6-31g(d).inp

072101334.b3lyp_6-31g(d).qchem.inp (generated)

072101334.b3lyp_6-31g(d).gjf (generated)

072101334.b3lyp_6-31g(d).firefly.inp (generated)

072101334.b3lyp_6-31g(d).smash.inp (generated)

072101334.b3lyp_6-31g(d).nwchem.inp (generated) 072101334.b3lyp_6-31g(d).log.xz 072101334.td-b3lyp_6-31g+(d).inp 072101334.td-b3lyp_6-31g+(d).log.xz

072101334.td-b3lyp_6-31+g(d).qchem.inp (generated)

072101334.td-b3lyp_6-31+g(d).gjf (generated)

072101334.td-b3lyp_6-31+g(d).firefly.inp (generated)

072101334.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072101334.mol 072101334.PUBCHEM 072101334.mol (via Jmol)
072101335.b3lyp_6-31g(d).inp

072101335.b3lyp_6-31g(d).qchem.inp (generated)

072101335.b3lyp_6-31g(d).gjf (generated)

072101335.b3lyp_6-31g(d).firefly.inp (generated)

072101335.b3lyp_6-31g(d).smash.inp (generated)

072101335.b3lyp_6-31g(d).nwchem.inp (generated) 072101335.b3lyp_6-31g(d).log.xz 072101335.td-b3lyp_6-31g+(d).inp 072101335.td-b3lyp_6-31g+(d).log.xz

072101335.td-b3lyp_6-31+g(d).qchem.inp (generated)

072101335.td-b3lyp_6-31+g(d).gjf (generated)

072101335.td-b3lyp_6-31+g(d).firefly.inp (generated)

072101335.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072101335.mol 072101335.PUBCHEM 072101335.mol (via Jmol)
072101438.b3lyp_6-31g(d).inp

072101438.b3lyp_6-31g(d).qchem.inp (generated)

072101438.b3lyp_6-31g(d).gjf (generated)

072101438.b3lyp_6-31g(d).firefly.inp (generated)

072101438.b3lyp_6-31g(d).smash.inp (generated)

072101438.b3lyp_6-31g(d).nwchem.inp (generated) 072101438.b3lyp_6-31g(d).log.xz 072101438.td-b3lyp_6-31g+(d).inp 072101438.td-b3lyp_6-31g+(d).log.xz

072101438.td-b3lyp_6-31+g(d).qchem.inp (generated)

072101438.td-b3lyp_6-31+g(d).gjf (generated)

072101438.td-b3lyp_6-31+g(d).firefly.inp (generated)

072101438.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072101438.mol 072101438.PUBCHEM 072101438.mol (via Jmol)
072101461.b3lyp_6-31g(d).inp

072101461.b3lyp_6-31g(d).qchem.inp (generated)

072101461.b3lyp_6-31g(d).gjf (generated)

072101461.b3lyp_6-31g(d).firefly.inp (generated)

072101461.b3lyp_6-31g(d).smash.inp (generated)

072101461.b3lyp_6-31g(d).nwchem.inp (generated) 072101461.b3lyp_6-31g(d).log.xz 072101461.td-b3lyp_6-31g+(d).inp 072101461.td-b3lyp_6-31g+(d).log.xz

072101461.td-b3lyp_6-31+g(d).qchem.inp (generated)

072101461.td-b3lyp_6-31+g(d).gjf (generated)

072101461.td-b3lyp_6-31+g(d).firefly.inp (generated)

072101461.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072101461.mol 072101461.PUBCHEM 072101461.mol (via Jmol)
072101473.b3lyp_6-31g(d).inp

072101473.b3lyp_6-31g(d).qchem.inp (generated)

072101473.b3lyp_6-31g(d).gjf (generated)

072101473.b3lyp_6-31g(d).firefly.inp (generated)

072101473.b3lyp_6-31g(d).smash.inp (generated)

072101473.b3lyp_6-31g(d).nwchem.inp (generated) 072101473.b3lyp_6-31g(d).log.xz 072101473.mol 072101473.PUBCHEM 072101473.mol (via Jmol)
072101755.b3lyp_6-31g(d).inp

072101755.b3lyp_6-31g(d).qchem.inp (generated)

072101755.b3lyp_6-31g(d).gjf (generated)

072101755.b3lyp_6-31g(d).firefly.inp (generated)

072101755.b3lyp_6-31g(d).smash.inp (generated)

072101755.b3lyp_6-31g(d).nwchem.inp (generated) 072101755.b3lyp_6-31g(d).log.xz 072101755.td-b3lyp_6-31g+(d).inp 072101755.td-b3lyp_6-31g+(d).log.xz

072101755.td-b3lyp_6-31+g(d).qchem.inp (generated)

072101755.td-b3lyp_6-31+g(d).gjf (generated)

072101755.td-b3lyp_6-31+g(d).firefly.inp (generated)

072101755.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072101755.mol 072101755.PUBCHEM 072101755.mol (via Jmol)
072101763.b3lyp_6-31g(d).inp

072101763.b3lyp_6-31g(d).qchem.inp (generated)

072101763.b3lyp_6-31g(d).gjf (generated)

072101763.b3lyp_6-31g(d).firefly.inp (generated)

072101763.b3lyp_6-31g(d).smash.inp (generated)

072101763.b3lyp_6-31g(d).nwchem.inp (generated) 072101763.b3lyp_6-31g(d).log.xz 072101763.td-b3lyp_6-31g+(d).inp 072101763.td-b3lyp_6-31g+(d).log.xz

072101763.td-b3lyp_6-31+g(d).qchem.inp (generated)

072101763.td-b3lyp_6-31+g(d).gjf (generated)

072101763.td-b3lyp_6-31+g(d).firefly.inp (generated)

072101763.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072101763.mol 072101763.PUBCHEM 072101763.mol (via Jmol)
072101830.b3lyp_6-31g(d).inp

072101830.b3lyp_6-31g(d).qchem.inp (generated)

072101830.b3lyp_6-31g(d).gjf (generated)

072101830.b3lyp_6-31g(d).firefly.inp (generated)

072101830.b3lyp_6-31g(d).smash.inp (generated)

072101830.b3lyp_6-31g(d).nwchem.inp (generated) 072101830.b3lyp_6-31g(d).log.xz 072101830.td-b3lyp_6-31g+(d).inp 072101830.td-b3lyp_6-31g+(d).log.xz

072101830.td-b3lyp_6-31+g(d).qchem.inp (generated)

072101830.td-b3lyp_6-31+g(d).gjf (generated)

072101830.td-b3lyp_6-31+g(d).firefly.inp (generated)

072101830.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072101830.mol 072101830.PUBCHEM 072101830.mol (via Jmol)
072101885.b3lyp_6-31g(d).inp

072101885.b3lyp_6-31g(d).qchem.inp (generated)

072101885.b3lyp_6-31g(d).gjf (generated)

072101885.b3lyp_6-31g(d).firefly.inp (generated)

072101885.b3lyp_6-31g(d).smash.inp (generated)

072101885.b3lyp_6-31g(d).nwchem.inp (generated) 072101885.b3lyp_6-31g(d).log.xz 072101885.td-b3lyp_6-31g+(d).inp 072101885.td-b3lyp_6-31g+(d).log.xz

072101885.td-b3lyp_6-31+g(d).qchem.inp (generated)

072101885.td-b3lyp_6-31+g(d).gjf (generated)

072101885.td-b3lyp_6-31+g(d).firefly.inp (generated)

072101885.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072101885.mol 072101885.PUBCHEM 072101885.mol (via Jmol)
072101969.b3lyp_6-31g(d).inp

072101969.b3lyp_6-31g(d).qchem.inp (generated)

072101969.b3lyp_6-31g(d).gjf (generated)

072101969.b3lyp_6-31g(d).firefly.inp (generated)

072101969.b3lyp_6-31g(d).smash.inp (generated)

072101969.b3lyp_6-31g(d).nwchem.inp (generated) 072101969.b3lyp_6-31g(d).log.xz 072101969.mol 072101969.PUBCHEM 072101969.mol (via Jmol)
072101982.b3lyp_6-31g(d).inp

072101982.b3lyp_6-31g(d).qchem.inp (generated)

072101982.b3lyp_6-31g(d).gjf (generated)

072101982.b3lyp_6-31g(d).firefly.inp (generated)

072101982.b3lyp_6-31g(d).smash.inp (generated)

072101982.b3lyp_6-31g(d).nwchem.inp (generated) 072101982.b3lyp_6-31g(d).log.xz 072101982.td-b3lyp_6-31g+(d).inp 072101982.td-b3lyp_6-31g+(d).log.xz

072101982.td-b3lyp_6-31+g(d).qchem.inp (generated)

072101982.td-b3lyp_6-31+g(d).gjf (generated)

072101982.td-b3lyp_6-31+g(d).firefly.inp (generated)

072101982.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072101982.mol 072101982.PUBCHEM 072101982.mol (via Jmol)
072102096.b3lyp_6-31g(d).inp

072102096.b3lyp_6-31g(d).qchem.inp (generated)

072102096.b3lyp_6-31g(d).gjf (generated)

072102096.b3lyp_6-31g(d).firefly.inp (generated)

072102096.b3lyp_6-31g(d).smash.inp (generated)

072102096.b3lyp_6-31g(d).nwchem.inp (generated) 072102096.b3lyp_6-31g(d).log.xz 072102096.td-b3lyp_6-31g+(d).inp 072102096.td-b3lyp_6-31g+(d).log.xz

072102096.td-b3lyp_6-31+g(d).qchem.inp (generated)

072102096.td-b3lyp_6-31+g(d).gjf (generated)

072102096.td-b3lyp_6-31+g(d).firefly.inp (generated)

072102096.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072102096.mol 072102096.PUBCHEM 072102096.mol (via Jmol)
072102133.b3lyp_6-31g(d).inp

072102133.b3lyp_6-31g(d).qchem.inp (generated)

072102133.b3lyp_6-31g(d).gjf (generated)

072102133.b3lyp_6-31g(d).firefly.inp (generated)

072102133.b3lyp_6-31g(d).smash.inp (generated)

072102133.b3lyp_6-31g(d).nwchem.inp (generated) 072102133.b3lyp_6-31g(d).log.xz 072102133.td-b3lyp_6-31g+(d).inp 072102133.td-b3lyp_6-31g+(d).log.xz

072102133.td-b3lyp_6-31+g(d).qchem.inp (generated)

072102133.td-b3lyp_6-31+g(d).gjf (generated)

072102133.td-b3lyp_6-31+g(d).firefly.inp (generated)

072102133.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072102133.mol 072102133.PUBCHEM 072102133.mol (via Jmol)
072102162.b3lyp_6-31g(d).inp

072102162.b3lyp_6-31g(d).qchem.inp (generated)

072102162.b3lyp_6-31g(d).gjf (generated)

072102162.b3lyp_6-31g(d).firefly.inp (generated)

072102162.b3lyp_6-31g(d).smash.inp (generated)

072102162.b3lyp_6-31g(d).nwchem.inp (generated) 072102162.b3lyp_6-31g(d).log.xz 072102162.td-b3lyp_6-31g+(d).inp 072102162.td-b3lyp_6-31g+(d).log.xz

072102162.td-b3lyp_6-31+g(d).qchem.inp (generated)

072102162.td-b3lyp_6-31+g(d).gjf (generated)

072102162.td-b3lyp_6-31+g(d).firefly.inp (generated)

072102162.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072102162.mol 072102162.PUBCHEM 072102162.mol (via Jmol)
072102163.b3lyp_6-31g(d).inp

072102163.b3lyp_6-31g(d).qchem.inp (generated)

072102163.b3lyp_6-31g(d).gjf (generated)

072102163.b3lyp_6-31g(d).firefly.inp (generated)

072102163.b3lyp_6-31g(d).smash.inp (generated)

072102163.b3lyp_6-31g(d).nwchem.inp (generated) 072102163.b3lyp_6-31g(d).log.xz 072102163.td-b3lyp_6-31g+(d).inp 072102163.td-b3lyp_6-31g+(d).log.xz

072102163.td-b3lyp_6-31+g(d).qchem.inp (generated)

072102163.td-b3lyp_6-31+g(d).gjf (generated)

072102163.td-b3lyp_6-31+g(d).firefly.inp (generated)

072102163.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072102163.mol 072102163.PUBCHEM 072102163.mol (via Jmol)
072102167.b3lyp_6-31g(d).inp

072102167.b3lyp_6-31g(d).qchem.inp (generated)

072102167.b3lyp_6-31g(d).gjf (generated)

072102167.b3lyp_6-31g(d).firefly.inp (generated)

072102167.b3lyp_6-31g(d).smash.inp (generated)

072102167.b3lyp_6-31g(d).nwchem.inp (generated) 072102167.b3lyp_6-31g(d).log.xz 072102167.td-b3lyp_6-31g+(d).inp 072102167.td-b3lyp_6-31g+(d).log.xz

072102167.td-b3lyp_6-31+g(d).qchem.inp (generated)

072102167.td-b3lyp_6-31+g(d).gjf (generated)

072102167.td-b3lyp_6-31+g(d).firefly.inp (generated)

072102167.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072102167.mol 072102167.PUBCHEM 072102167.mol (via Jmol)
072102168.b3lyp_6-31g(d).inp

072102168.b3lyp_6-31g(d).qchem.inp (generated)

072102168.b3lyp_6-31g(d).gjf (generated)

072102168.b3lyp_6-31g(d).firefly.inp (generated)

072102168.b3lyp_6-31g(d).smash.inp (generated)

072102168.b3lyp_6-31g(d).nwchem.inp (generated) 072102168.b3lyp_6-31g(d).log.xz 072102168.td-b3lyp_6-31g+(d).inp 072102168.td-b3lyp_6-31g+(d).log.xz

072102168.td-b3lyp_6-31+g(d).qchem.inp (generated)

072102168.td-b3lyp_6-31+g(d).gjf (generated)

072102168.td-b3lyp_6-31+g(d).firefly.inp (generated)

072102168.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072102168.mol 072102168.PUBCHEM 072102168.mol (via Jmol)
072102169.b3lyp_6-31g(d).inp

072102169.b3lyp_6-31g(d).qchem.inp (generated)

072102169.b3lyp_6-31g(d).gjf (generated)

072102169.b3lyp_6-31g(d).firefly.inp (generated)

072102169.b3lyp_6-31g(d).smash.inp (generated)

072102169.b3lyp_6-31g(d).nwchem.inp (generated) 072102169.b3lyp_6-31g(d).log.xz 072102169.td-b3lyp_6-31g+(d).inp 072102169.td-b3lyp_6-31g+(d).log.xz

072102169.td-b3lyp_6-31+g(d).qchem.inp (generated)

072102169.td-b3lyp_6-31+g(d).gjf (generated)

072102169.td-b3lyp_6-31+g(d).firefly.inp (generated)

072102169.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072102169.mol 072102169.PUBCHEM 072102169.mol (via Jmol)
072102294.b3lyp_6-31g(d).inp

072102294.b3lyp_6-31g(d).qchem.inp (generated)

072102294.b3lyp_6-31g(d).gjf (generated)

072102294.b3lyp_6-31g(d).firefly.inp (generated)

072102294.b3lyp_6-31g(d).smash.inp (generated)

072102294.b3lyp_6-31g(d).nwchem.inp (generated) 072102294.b3lyp_6-31g(d).log.xz 072102294.td-b3lyp_6-31g+(d).inp 072102294.td-b3lyp_6-31g+(d).log.xz

072102294.td-b3lyp_6-31+g(d).qchem.inp (generated)

072102294.td-b3lyp_6-31+g(d).gjf (generated)

072102294.td-b3lyp_6-31+g(d).firefly.inp (generated)

072102294.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072102294.mol 072102294.PUBCHEM 072102294.mol (via Jmol)
072102379.b3lyp_6-31g(d).inp

072102379.b3lyp_6-31g(d).qchem.inp (generated)

072102379.b3lyp_6-31g(d).gjf (generated)

072102379.b3lyp_6-31g(d).firefly.inp (generated)

072102379.b3lyp_6-31g(d).smash.inp (generated)

072102379.b3lyp_6-31g(d).nwchem.inp (generated) 072102379.b3lyp_6-31g(d).log.xz 072102379.mol 072102379.PUBCHEM 072102379.mol (via Jmol)
072102422.b3lyp_6-31g(d).inp

072102422.b3lyp_6-31g(d).qchem.inp (generated)

072102422.b3lyp_6-31g(d).gjf (generated)

072102422.b3lyp_6-31g(d).firefly.inp (generated)

072102422.b3lyp_6-31g(d).smash.inp (generated)

072102422.b3lyp_6-31g(d).nwchem.inp (generated) 072102422.b3lyp_6-31g(d).log.xz 072102422.td-b3lyp_6-31g+(d).inp 072102422.td-b3lyp_6-31g+(d).log.xz

072102422.td-b3lyp_6-31+g(d).qchem.inp (generated)

072102422.td-b3lyp_6-31+g(d).gjf (generated)

072102422.td-b3lyp_6-31+g(d).firefly.inp (generated)

072102422.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072102422.mol 072102422.PUBCHEM 072102422.mol (via Jmol)
072102423.b3lyp_6-31g(d).inp

072102423.b3lyp_6-31g(d).qchem.inp (generated)

072102423.b3lyp_6-31g(d).gjf (generated)

072102423.b3lyp_6-31g(d).firefly.inp (generated)

072102423.b3lyp_6-31g(d).smash.inp (generated)

072102423.b3lyp_6-31g(d).nwchem.inp (generated) 072102423.b3lyp_6-31g(d).log.xz 072102423.td-b3lyp_6-31g+(d).inp 072102423.td-b3lyp_6-31g+(d).log.xz

072102423.td-b3lyp_6-31+g(d).qchem.inp (generated)

072102423.td-b3lyp_6-31+g(d).gjf (generated)

072102423.td-b3lyp_6-31+g(d).firefly.inp (generated)

072102423.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072102423.mol 072102423.PUBCHEM 072102423.mol (via Jmol)
072102436.b3lyp_6-31g(d).inp

072102436.b3lyp_6-31g(d).qchem.inp (generated)

072102436.b3lyp_6-31g(d).gjf (generated)

072102436.b3lyp_6-31g(d).firefly.inp (generated)

072102436.b3lyp_6-31g(d).smash.inp (generated)

072102436.b3lyp_6-31g(d).nwchem.inp (generated) 072102436.b3lyp_6-31g(d).log.xz 072102436.td-b3lyp_6-31g+(d).inp 072102436.td-b3lyp_6-31g+(d).log.xz

072102436.td-b3lyp_6-31+g(d).qchem.inp (generated)

072102436.td-b3lyp_6-31+g(d).gjf (generated)

072102436.td-b3lyp_6-31+g(d).firefly.inp (generated)

072102436.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072102436.mol 072102436.PUBCHEM 072102436.mol (via Jmol)
072102547.b3lyp_6-31g(d).inp

072102547.b3lyp_6-31g(d).qchem.inp (generated)

072102547.b3lyp_6-31g(d).gjf (generated)

072102547.b3lyp_6-31g(d).firefly.inp (generated)

072102547.b3lyp_6-31g(d).smash.inp (generated)

072102547.b3lyp_6-31g(d).nwchem.inp (generated) 072102547.b3lyp_6-31g(d).log.xz 072102547.td-b3lyp_6-31g+(d).inp 072102547.td-b3lyp_6-31g+(d).log.xz

072102547.td-b3lyp_6-31+g(d).qchem.inp (generated)

072102547.td-b3lyp_6-31+g(d).gjf (generated)

072102547.td-b3lyp_6-31+g(d).firefly.inp (generated)

072102547.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072102547.mol 072102547.PUBCHEM 072102547.mol (via Jmol)
072102709.b3lyp_6-31g(d).inp

072102709.b3lyp_6-31g(d).qchem.inp (generated)

072102709.b3lyp_6-31g(d).gjf (generated)

072102709.b3lyp_6-31g(d).firefly.inp (generated)

072102709.b3lyp_6-31g(d).smash.inp (generated)

072102709.b3lyp_6-31g(d).nwchem.inp (generated) 072102709.b3lyp_6-31g(d).log.xz 072102709.td-b3lyp_6-31g+(d).inp 072102709.td-b3lyp_6-31g+(d).log.xz

072102709.td-b3lyp_6-31+g(d).qchem.inp (generated)

072102709.td-b3lyp_6-31+g(d).gjf (generated)

072102709.td-b3lyp_6-31+g(d).firefly.inp (generated)

072102709.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072102709.mol 072102709.PUBCHEM 072102709.mol (via Jmol)
072102777.b3lyp_6-31g(d).inp

072102777.b3lyp_6-31g(d).qchem.inp (generated)

072102777.b3lyp_6-31g(d).gjf (generated)

072102777.b3lyp_6-31g(d).firefly.inp (generated)

072102777.b3lyp_6-31g(d).smash.inp (generated)

072102777.b3lyp_6-31g(d).nwchem.inp (generated) 072102777.b3lyp_6-31g(d).log.xz 072102777.td-b3lyp_6-31g+(d).inp 072102777.td-b3lyp_6-31g+(d).log.xz

072102777.td-b3lyp_6-31+g(d).qchem.inp (generated)

072102777.td-b3lyp_6-31+g(d).gjf (generated)

072102777.td-b3lyp_6-31+g(d).firefly.inp (generated)

072102777.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072102777.mol 072102777.PUBCHEM 072102777.mol (via Jmol)
072102784.b3lyp_6-31g(d).inp

072102784.b3lyp_6-31g(d).qchem.inp (generated)

072102784.b3lyp_6-31g(d).gjf (generated)

072102784.b3lyp_6-31g(d).firefly.inp (generated)

072102784.b3lyp_6-31g(d).smash.inp (generated)

072102784.b3lyp_6-31g(d).nwchem.inp (generated) 072102784.b3lyp_6-31g(d).log.xz 072102784.td-b3lyp_6-31g+(d).inp 072102784.td-b3lyp_6-31g+(d).log.xz

072102784.td-b3lyp_6-31+g(d).qchem.inp (generated)

072102784.td-b3lyp_6-31+g(d).gjf (generated)

072102784.td-b3lyp_6-31+g(d).firefly.inp (generated)

072102784.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072102784.mol 072102784.PUBCHEM 072102784.mol (via Jmol)
072102800.b3lyp_6-31g(d).inp

072102800.b3lyp_6-31g(d).qchem.inp (generated)

072102800.b3lyp_6-31g(d).gjf (generated)

072102800.b3lyp_6-31g(d).firefly.inp (generated)

072102800.b3lyp_6-31g(d).smash.inp (generated)

072102800.b3lyp_6-31g(d).nwchem.inp (generated) 072102800.b3lyp_6-31g(d).log.xz 072102800.mol 072102800.PUBCHEM 072102800.mol (via Jmol)
072102801.b3lyp_6-31g(d).inp

072102801.b3lyp_6-31g(d).qchem.inp (generated)

072102801.b3lyp_6-31g(d).gjf (generated)

072102801.b3lyp_6-31g(d).firefly.inp (generated)

072102801.b3lyp_6-31g(d).smash.inp (generated)

072102801.b3lyp_6-31g(d).nwchem.inp (generated) 072102801.b3lyp_6-31g(d).log.xz 072102801.mol 072102801.PUBCHEM 072102801.mol (via Jmol)
072103182.b3lyp_6-31g(d).inp

072103182.b3lyp_6-31g(d).qchem.inp (generated)

072103182.b3lyp_6-31g(d).gjf (generated)

072103182.b3lyp_6-31g(d).firefly.inp (generated)

072103182.b3lyp_6-31g(d).smash.inp (generated)

072103182.b3lyp_6-31g(d).nwchem.inp (generated) 072103182.b3lyp_6-31g(d).log.xz 072103182.td-b3lyp_6-31g+(d).inp 072103182.td-b3lyp_6-31g+(d).log.xz

072103182.td-b3lyp_6-31+g(d).qchem.inp (generated)

072103182.td-b3lyp_6-31+g(d).gjf (generated)

072103182.td-b3lyp_6-31+g(d).firefly.inp (generated)

072103182.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072103182.mol 072103182.PUBCHEM 072103182.mol (via Jmol)
072103233.b3lyp_6-31g(d).inp

072103233.b3lyp_6-31g(d).qchem.inp (generated)

072103233.b3lyp_6-31g(d).gjf (generated)

072103233.b3lyp_6-31g(d).firefly.inp (generated)

072103233.b3lyp_6-31g(d).smash.inp (generated)

072103233.b3lyp_6-31g(d).nwchem.inp (generated) 072103233.b3lyp_6-31g(d).log.xz 072103233.mol 072103233.PUBCHEM 072103233.mol (via Jmol)
072103281.b3lyp_6-31g(d).inp

072103281.b3lyp_6-31g(d).qchem.inp (generated)

072103281.b3lyp_6-31g(d).gjf (generated)

072103281.b3lyp_6-31g(d).firefly.inp (generated)

072103281.b3lyp_6-31g(d).smash.inp (generated)

072103281.b3lyp_6-31g(d).nwchem.inp (generated) 072103281.b3lyp_6-31g(d).log.xz 072103281.td-b3lyp_6-31g+(d).inp 072103281.td-b3lyp_6-31g+(d).log.xz

072103281.td-b3lyp_6-31+g(d).qchem.inp (generated)

072103281.td-b3lyp_6-31+g(d).gjf (generated)

072103281.td-b3lyp_6-31+g(d).firefly.inp (generated)

072103281.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072103281.mol 072103281.PUBCHEM 072103281.mol (via Jmol)
072103368.b3lyp_6-31g(d).inp

072103368.b3lyp_6-31g(d).qchem.inp (generated)

072103368.b3lyp_6-31g(d).gjf (generated)

072103368.b3lyp_6-31g(d).firefly.inp (generated)

072103368.b3lyp_6-31g(d).smash.inp (generated)

072103368.b3lyp_6-31g(d).nwchem.inp (generated) 072103368.b3lyp_6-31g(d).log.xz 072103368.td-b3lyp_6-31g+(d).inp 072103368.td-b3lyp_6-31g+(d).log.xz

072103368.td-b3lyp_6-31+g(d).qchem.inp (generated)

072103368.td-b3lyp_6-31+g(d).gjf (generated)

072103368.td-b3lyp_6-31+g(d).firefly.inp (generated)

072103368.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072103368.mol 072103368.PUBCHEM 072103368.mol (via Jmol)
072103391.b3lyp_6-31g(d).inp

072103391.b3lyp_6-31g(d).qchem.inp (generated)

072103391.b3lyp_6-31g(d).gjf (generated)

072103391.b3lyp_6-31g(d).firefly.inp (generated)

072103391.b3lyp_6-31g(d).smash.inp (generated)

072103391.b3lyp_6-31g(d).nwchem.inp (generated) 072103391.b3lyp_6-31g(d).log.xz 072103391.td-b3lyp_6-31g+(d).inp 072103391.td-b3lyp_6-31g+(d).log.xz

072103391.td-b3lyp_6-31+g(d).qchem.inp (generated)

072103391.td-b3lyp_6-31+g(d).gjf (generated)

072103391.td-b3lyp_6-31+g(d).firefly.inp (generated)

072103391.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072103391.mol 072103391.PUBCHEM 072103391.mol (via Jmol)
072103712.b3lyp_6-31g(d).inp

072103712.b3lyp_6-31g(d).qchem.inp (generated)

072103712.b3lyp_6-31g(d).gjf (generated)

072103712.b3lyp_6-31g(d).firefly.inp (generated)

072103712.b3lyp_6-31g(d).smash.inp (generated)

072103712.b3lyp_6-31g(d).nwchem.inp (generated) 072103712.b3lyp_6-31g(d).log.xz 072103712.mol 072103712.PUBCHEM 072103712.mol (via Jmol)
072103724.b3lyp_6-31g(d).inp

072103724.b3lyp_6-31g(d).qchem.inp (generated)

072103724.b3lyp_6-31g(d).gjf (generated)

072103724.b3lyp_6-31g(d).firefly.inp (generated)

072103724.b3lyp_6-31g(d).smash.inp (generated)

072103724.b3lyp_6-31g(d).nwchem.inp (generated) 072103724.b3lyp_6-31g(d).log.xz 072103724.td-b3lyp_6-31g+(d).inp 072103724.td-b3lyp_6-31g+(d).log.xz

072103724.td-b3lyp_6-31+g(d).qchem.inp (generated)

072103724.td-b3lyp_6-31+g(d).gjf (generated)

072103724.td-b3lyp_6-31+g(d).firefly.inp (generated)

072103724.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072103724.mol 072103724.PUBCHEM 072103724.mol (via Jmol)
072103762.b3lyp_6-31g(d).inp

072103762.b3lyp_6-31g(d).qchem.inp (generated)

072103762.b3lyp_6-31g(d).gjf (generated)

072103762.b3lyp_6-31g(d).firefly.inp (generated)

072103762.b3lyp_6-31g(d).smash.inp (generated)

072103762.b3lyp_6-31g(d).nwchem.inp (generated) 072103762.b3lyp_6-31g(d).log.xz 072103762.mol 072103762.PUBCHEM 072103762.mol (via Jmol)
072103810.b3lyp_6-31g(d).inp

072103810.b3lyp_6-31g(d).qchem.inp (generated)

072103810.b3lyp_6-31g(d).gjf (generated)

072103810.b3lyp_6-31g(d).firefly.inp (generated)

072103810.b3lyp_6-31g(d).smash.inp (generated)

072103810.b3lyp_6-31g(d).nwchem.inp (generated) 072103810.b3lyp_6-31g(d).log.xz 072103810.td-b3lyp_6-31g+(d).inp 072103810.td-b3lyp_6-31g+(d).log.xz

072103810.td-b3lyp_6-31+g(d).qchem.inp (generated)

072103810.td-b3lyp_6-31+g(d).gjf (generated)

072103810.td-b3lyp_6-31+g(d).firefly.inp (generated)

072103810.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072103810.mol 072103810.PUBCHEM 072103810.mol (via Jmol)
072103828.b3lyp_6-31g(d).inp

072103828.b3lyp_6-31g(d).qchem.inp (generated)

072103828.b3lyp_6-31g(d).gjf (generated)

072103828.b3lyp_6-31g(d).firefly.inp (generated)

072103828.b3lyp_6-31g(d).smash.inp (generated)

072103828.b3lyp_6-31g(d).nwchem.inp (generated) 072103828.b3lyp_6-31g(d).log.xz 072103828.td-b3lyp_6-31g+(d).inp 072103828.td-b3lyp_6-31g+(d).log.xz

072103828.td-b3lyp_6-31+g(d).qchem.inp (generated)

072103828.td-b3lyp_6-31+g(d).gjf (generated)

072103828.td-b3lyp_6-31+g(d).firefly.inp (generated)

072103828.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072103828.mol 072103828.PUBCHEM 072103828.mol (via Jmol)
072103832.b3lyp_6-31g(d).inp

072103832.b3lyp_6-31g(d).qchem.inp (generated)

072103832.b3lyp_6-31g(d).gjf (generated)

072103832.b3lyp_6-31g(d).firefly.inp (generated)

072103832.b3lyp_6-31g(d).smash.inp (generated)

072103832.b3lyp_6-31g(d).nwchem.inp (generated) 072103832.b3lyp_6-31g(d).log.xz 072103832.td-b3lyp_6-31g+(d).inp 072103832.td-b3lyp_6-31g+(d).log.xz

072103832.td-b3lyp_6-31+g(d).qchem.inp (generated)

072103832.td-b3lyp_6-31+g(d).gjf (generated)

072103832.td-b3lyp_6-31+g(d).firefly.inp (generated)

072103832.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072103832.mol 072103832.PUBCHEM 072103832.mol (via Jmol)
072103836.b3lyp_6-31g(d).inp

072103836.b3lyp_6-31g(d).qchem.inp (generated)

072103836.b3lyp_6-31g(d).gjf (generated)

072103836.b3lyp_6-31g(d).firefly.inp (generated)

072103836.b3lyp_6-31g(d).smash.inp (generated)

072103836.b3lyp_6-31g(d).nwchem.inp (generated) 072103836.b3lyp_6-31g(d).log.xz 072103836.td-b3lyp_6-31g+(d).inp 072103836.td-b3lyp_6-31g+(d).log.xz

072103836.td-b3lyp_6-31+g(d).qchem.inp (generated)

072103836.td-b3lyp_6-31+g(d).gjf (generated)

072103836.td-b3lyp_6-31+g(d).firefly.inp (generated)

072103836.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072103836.mol 072103836.PUBCHEM 072103836.mol (via Jmol)
072103840.b3lyp_6-31g(d).inp

072103840.b3lyp_6-31g(d).qchem.inp (generated)

072103840.b3lyp_6-31g(d).gjf (generated)

072103840.b3lyp_6-31g(d).firefly.inp (generated)

072103840.b3lyp_6-31g(d).smash.inp (generated)

072103840.b3lyp_6-31g(d).nwchem.inp (generated) 072103840.b3lyp_6-31g(d).log.xz 072103840.mol 072103840.PUBCHEM 072103840.mol (via Jmol)
072103985.b3lyp_6-31g(d).inp

072103985.b3lyp_6-31g(d).qchem.inp (generated)

072103985.b3lyp_6-31g(d).gjf (generated)

072103985.b3lyp_6-31g(d).firefly.inp (generated)

072103985.b3lyp_6-31g(d).smash.inp (generated)

072103985.b3lyp_6-31g(d).nwchem.inp (generated) 072103985.b3lyp_6-31g(d).log.xz 072103985.td-b3lyp_6-31g+(d).inp 072103985.td-b3lyp_6-31g+(d).log.xz

072103985.td-b3lyp_6-31+g(d).qchem.inp (generated)

072103985.td-b3lyp_6-31+g(d).gjf (generated)

072103985.td-b3lyp_6-31+g(d).firefly.inp (generated)

072103985.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072103985.mol 072103985.PUBCHEM 072103985.mol (via Jmol)
072103987.b3lyp_6-31g(d).inp

072103987.b3lyp_6-31g(d).qchem.inp (generated)

072103987.b3lyp_6-31g(d).gjf (generated)

072103987.b3lyp_6-31g(d).firefly.inp (generated)

072103987.b3lyp_6-31g(d).smash.inp (generated)

072103987.b3lyp_6-31g(d).nwchem.inp (generated) 072103987.b3lyp_6-31g(d).log.xz 072103987.td-b3lyp_6-31g+(d).inp 072103987.td-b3lyp_6-31g+(d).log.xz

072103987.td-b3lyp_6-31+g(d).qchem.inp (generated)

072103987.td-b3lyp_6-31+g(d).gjf (generated)

072103987.td-b3lyp_6-31+g(d).firefly.inp (generated)

072103987.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072103987.mol 072103987.PUBCHEM 072103987.mol (via Jmol)
072104139.b3lyp_6-31g(d).inp

072104139.b3lyp_6-31g(d).qchem.inp (generated)

072104139.b3lyp_6-31g(d).gjf (generated)

072104139.b3lyp_6-31g(d).firefly.inp (generated)

072104139.b3lyp_6-31g(d).smash.inp (generated)

072104139.b3lyp_6-31g(d).nwchem.inp (generated) 072104139.b3lyp_6-31g(d).log.xz 072104139.td-b3lyp_6-31g+(d).inp 072104139.td-b3lyp_6-31g+(d).log.xz

072104139.td-b3lyp_6-31+g(d).qchem.inp (generated)

072104139.td-b3lyp_6-31+g(d).gjf (generated)

072104139.td-b3lyp_6-31+g(d).firefly.inp (generated)

072104139.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072104139.mol 072104139.PUBCHEM 072104139.mol (via Jmol)
072104145.b3lyp_6-31g(d).inp

072104145.b3lyp_6-31g(d).qchem.inp (generated)

072104145.b3lyp_6-31g(d).gjf (generated)

072104145.b3lyp_6-31g(d).firefly.inp (generated)

072104145.b3lyp_6-31g(d).smash.inp (generated)

072104145.b3lyp_6-31g(d).nwchem.inp (generated) 072104145.b3lyp_6-31g(d).log.xz 072104145.td-b3lyp_6-31g+(d).inp 072104145.td-b3lyp_6-31g+(d).log.xz

072104145.td-b3lyp_6-31+g(d).qchem.inp (generated)

072104145.td-b3lyp_6-31+g(d).gjf (generated)

072104145.td-b3lyp_6-31+g(d).firefly.inp (generated)

072104145.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072104145.mol 072104145.PUBCHEM 072104145.mol (via Jmol)
072104196.b3lyp_6-31g(d).inp

072104196.b3lyp_6-31g(d).qchem.inp (generated)

072104196.b3lyp_6-31g(d).gjf (generated)

072104196.b3lyp_6-31g(d).firefly.inp (generated)

072104196.b3lyp_6-31g(d).smash.inp (generated)

072104196.b3lyp_6-31g(d).nwchem.inp (generated) 072104196.b3lyp_6-31g(d).log.xz 072104196.td-b3lyp_6-31g+(d).inp 072104196.td-b3lyp_6-31g+(d).log.xz

072104196.td-b3lyp_6-31+g(d).qchem.inp (generated)

072104196.td-b3lyp_6-31+g(d).gjf (generated)

072104196.td-b3lyp_6-31+g(d).firefly.inp (generated)

072104196.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072104196.mol 072104196.PUBCHEM 072104196.mol (via Jmol)
072104228.b3lyp_6-31g(d).inp

072104228.b3lyp_6-31g(d).qchem.inp (generated)

072104228.b3lyp_6-31g(d).gjf (generated)

072104228.b3lyp_6-31g(d).firefly.inp (generated)

072104228.b3lyp_6-31g(d).smash.inp (generated)

072104228.b3lyp_6-31g(d).nwchem.inp (generated) 072104228.b3lyp_6-31g(d).log.xz 072104228.mol 072104228.PUBCHEM 072104228.mol (via Jmol)
072104261.b3lyp_6-31g(d).inp

072104261.b3lyp_6-31g(d).qchem.inp (generated)

072104261.b3lyp_6-31g(d).gjf (generated)

072104261.b3lyp_6-31g(d).firefly.inp (generated)

072104261.b3lyp_6-31g(d).smash.inp (generated)

072104261.b3lyp_6-31g(d).nwchem.inp (generated) 072104261.b3lyp_6-31g(d).log.xz 072104261.td-b3lyp_6-31g+(d).inp 072104261.td-b3lyp_6-31g+(d).log.xz

072104261.td-b3lyp_6-31+g(d).qchem.inp (generated)

072104261.td-b3lyp_6-31+g(d).gjf (generated)

072104261.td-b3lyp_6-31+g(d).firefly.inp (generated)

072104261.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072104261.mol 072104261.PUBCHEM 072104261.mol (via Jmol)
072104394.b3lyp_6-31g(d).inp

072104394.b3lyp_6-31g(d).qchem.inp (generated)

072104394.b3lyp_6-31g(d).gjf (generated)

072104394.b3lyp_6-31g(d).firefly.inp (generated)

072104394.b3lyp_6-31g(d).smash.inp (generated)

072104394.b3lyp_6-31g(d).nwchem.inp (generated) 072104394.b3lyp_6-31g(d).log.xz 072104394.mol 072104394.PUBCHEM 072104394.mol (via Jmol)
072104407.b3lyp_6-31g(d).inp

072104407.b3lyp_6-31g(d).qchem.inp (generated)

072104407.b3lyp_6-31g(d).gjf (generated)

072104407.b3lyp_6-31g(d).firefly.inp (generated)

072104407.b3lyp_6-31g(d).smash.inp (generated)

072104407.b3lyp_6-31g(d).nwchem.inp (generated) 072104407.b3lyp_6-31g(d).log.xz 072104407.td-b3lyp_6-31g+(d).inp 072104407.td-b3lyp_6-31g+(d).log.xz

072104407.td-b3lyp_6-31+g(d).qchem.inp (generated)

072104407.td-b3lyp_6-31+g(d).gjf (generated)

072104407.td-b3lyp_6-31+g(d).firefly.inp (generated)

072104407.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072104407.mol 072104407.PUBCHEM 072104407.mol (via Jmol)
072104417.b3lyp_6-31g(d).inp

072104417.b3lyp_6-31g(d).qchem.inp (generated)

072104417.b3lyp_6-31g(d).gjf (generated)

072104417.b3lyp_6-31g(d).firefly.inp (generated)

072104417.b3lyp_6-31g(d).smash.inp (generated)

072104417.b3lyp_6-31g(d).nwchem.inp (generated) 072104417.b3lyp_6-31g(d).log.xz 072104417.mol 072104417.PUBCHEM 072104417.mol (via Jmol)
072104418.b3lyp_6-31g(d).inp

072104418.b3lyp_6-31g(d).qchem.inp (generated)

072104418.b3lyp_6-31g(d).gjf (generated)

072104418.b3lyp_6-31g(d).firefly.inp (generated)

072104418.b3lyp_6-31g(d).smash.inp (generated)

072104418.b3lyp_6-31g(d).nwchem.inp (generated) 072104418.b3lyp_6-31g(d).log.xz 072104418.td-b3lyp_6-31g+(d).inp 072104418.td-b3lyp_6-31g+(d).log.xz

072104418.td-b3lyp_6-31+g(d).qchem.inp (generated)

072104418.td-b3lyp_6-31+g(d).gjf (generated)

072104418.td-b3lyp_6-31+g(d).firefly.inp (generated)

072104418.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072104418.mol 072104418.PUBCHEM 072104418.mol (via Jmol)
072104419.b3lyp_6-31g(d).inp

072104419.b3lyp_6-31g(d).qchem.inp (generated)

072104419.b3lyp_6-31g(d).gjf (generated)

072104419.b3lyp_6-31g(d).firefly.inp (generated)

072104419.b3lyp_6-31g(d).smash.inp (generated)

072104419.b3lyp_6-31g(d).nwchem.inp (generated) 072104419.b3lyp_6-31g(d).log.xz 072104419.td-b3lyp_6-31g+(d).inp 072104419.td-b3lyp_6-31g+(d).log.xz

072104419.td-b3lyp_6-31+g(d).qchem.inp (generated)

072104419.td-b3lyp_6-31+g(d).gjf (generated)

072104419.td-b3lyp_6-31+g(d).firefly.inp (generated)

072104419.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072104419.mol 072104419.PUBCHEM 072104419.mol (via Jmol)
072104529.b3lyp_6-31g(d).inp

072104529.b3lyp_6-31g(d).qchem.inp (generated)

072104529.b3lyp_6-31g(d).gjf (generated)

072104529.b3lyp_6-31g(d).firefly.inp (generated)

072104529.b3lyp_6-31g(d).smash.inp (generated)

072104529.b3lyp_6-31g(d).nwchem.inp (generated) 072104529.b3lyp_6-31g(d).log.xz 072104529.td-b3lyp_6-31g+(d).inp 072104529.td-b3lyp_6-31g+(d).log.xz

072104529.td-b3lyp_6-31+g(d).qchem.inp (generated)

072104529.td-b3lyp_6-31+g(d).gjf (generated)

072104529.td-b3lyp_6-31+g(d).firefly.inp (generated)

072104529.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072104529.mol 072104529.PUBCHEM 072104529.mol (via Jmol)
072104557.b3lyp_6-31g(d).inp

072104557.b3lyp_6-31g(d).qchem.inp (generated)

072104557.b3lyp_6-31g(d).gjf (generated)

072104557.b3lyp_6-31g(d).firefly.inp (generated)

072104557.b3lyp_6-31g(d).smash.inp (generated)

072104557.b3lyp_6-31g(d).nwchem.inp (generated) 072104557.b3lyp_6-31g(d).log.xz 072104557.td-b3lyp_6-31g+(d).inp 072104557.td-b3lyp_6-31g+(d).log.xz

072104557.td-b3lyp_6-31+g(d).qchem.inp (generated)

072104557.td-b3lyp_6-31+g(d).gjf (generated)

072104557.td-b3lyp_6-31+g(d).firefly.inp (generated)

072104557.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072104557.mol 072104557.PUBCHEM 072104557.mol (via Jmol)
072104652.b3lyp_6-31g(d).inp

072104652.b3lyp_6-31g(d).qchem.inp (generated)

072104652.b3lyp_6-31g(d).gjf (generated)

072104652.b3lyp_6-31g(d).firefly.inp (generated)

072104652.b3lyp_6-31g(d).smash.inp (generated)

072104652.b3lyp_6-31g(d).nwchem.inp (generated) 072104652.b3lyp_6-31g(d).log.xz 072104652.td-b3lyp_6-31g+(d).inp 072104652.td-b3lyp_6-31g+(d).log.xz

072104652.td-b3lyp_6-31+g(d).qchem.inp (generated)

072104652.td-b3lyp_6-31+g(d).gjf (generated)

072104652.td-b3lyp_6-31+g(d).firefly.inp (generated)

072104652.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072104652.mol 072104652.PUBCHEM 072104652.mol (via Jmol)
072104708.b3lyp_6-31g(d).inp

072104708.b3lyp_6-31g(d).qchem.inp (generated)

072104708.b3lyp_6-31g(d).gjf (generated)

072104708.b3lyp_6-31g(d).firefly.inp (generated)

072104708.b3lyp_6-31g(d).smash.inp (generated)

072104708.b3lyp_6-31g(d).nwchem.inp (generated) 072104708.b3lyp_6-31g(d).log.xz 072104708.td-b3lyp_6-31g+(d).inp 072104708.td-b3lyp_6-31g+(d).log.xz

072104708.td-b3lyp_6-31+g(d).qchem.inp (generated)

072104708.td-b3lyp_6-31+g(d).gjf (generated)

072104708.td-b3lyp_6-31+g(d).firefly.inp (generated)

072104708.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072104708.mol 072104708.PUBCHEM 072104708.mol (via Jmol)
072104743.b3lyp_6-31g(d).inp

072104743.b3lyp_6-31g(d).qchem.inp (generated)

072104743.b3lyp_6-31g(d).gjf (generated)

072104743.b3lyp_6-31g(d).firefly.inp (generated)

072104743.b3lyp_6-31g(d).smash.inp (generated)

072104743.b3lyp_6-31g(d).nwchem.inp (generated) 072104743.b3lyp_6-31g(d).log.xz 072104743.td-b3lyp_6-31g+(d).inp 072104743.td-b3lyp_6-31g+(d).log.xz

072104743.td-b3lyp_6-31+g(d).qchem.inp (generated)

072104743.td-b3lyp_6-31+g(d).gjf (generated)

072104743.td-b3lyp_6-31+g(d).firefly.inp (generated)

072104743.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072104743.mol 072104743.PUBCHEM 072104743.mol (via Jmol)
072104744.b3lyp_6-31g(d).inp

072104744.b3lyp_6-31g(d).qchem.inp (generated)

072104744.b3lyp_6-31g(d).gjf (generated)

072104744.b3lyp_6-31g(d).firefly.inp (generated)

072104744.b3lyp_6-31g(d).smash.inp (generated)

072104744.b3lyp_6-31g(d).nwchem.inp (generated) 072104744.b3lyp_6-31g(d).log.xz 072104744.td-b3lyp_6-31g+(d).inp 072104744.td-b3lyp_6-31g+(d).log.xz

072104744.td-b3lyp_6-31+g(d).qchem.inp (generated)

072104744.td-b3lyp_6-31+g(d).gjf (generated)

072104744.td-b3lyp_6-31+g(d).firefly.inp (generated)

072104744.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072104744.mol 072104744.PUBCHEM 072104744.mol (via Jmol)
072104788.b3lyp_6-31g(d).inp

072104788.b3lyp_6-31g(d).qchem.inp (generated)

072104788.b3lyp_6-31g(d).gjf (generated)

072104788.b3lyp_6-31g(d).firefly.inp (generated)

072104788.b3lyp_6-31g(d).smash.inp (generated)

072104788.b3lyp_6-31g(d).nwchem.inp (generated) 072104788.b3lyp_6-31g(d).log.xz 072104788.mol 072104788.PUBCHEM 072104788.mol (via Jmol)
072104790.b3lyp_6-31g(d).inp

072104790.b3lyp_6-31g(d).qchem.inp (generated)

072104790.b3lyp_6-31g(d).gjf (generated)

072104790.b3lyp_6-31g(d).firefly.inp (generated)

072104790.b3lyp_6-31g(d).smash.inp (generated)

072104790.b3lyp_6-31g(d).nwchem.inp (generated) 072104790.b3lyp_6-31g(d).log.xz 072104790.td-b3lyp_6-31g+(d).inp 072104790.td-b3lyp_6-31g+(d).log.xz

072104790.td-b3lyp_6-31+g(d).qchem.inp (generated)

072104790.td-b3lyp_6-31+g(d).gjf (generated)

072104790.td-b3lyp_6-31+g(d).firefly.inp (generated)

072104790.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072104790.mol 072104790.PUBCHEM 072104790.mol (via Jmol)
072104799.b3lyp_6-31g(d).inp

072104799.b3lyp_6-31g(d).qchem.inp (generated)

072104799.b3lyp_6-31g(d).gjf (generated)

072104799.b3lyp_6-31g(d).firefly.inp (generated)

072104799.b3lyp_6-31g(d).smash.inp (generated)

072104799.b3lyp_6-31g(d).nwchem.inp (generated) 072104799.b3lyp_6-31g(d).log.xz 072104799.td-b3lyp_6-31g+(d).inp 072104799.td-b3lyp_6-31g+(d).log.xz

072104799.td-b3lyp_6-31+g(d).qchem.inp (generated)

072104799.td-b3lyp_6-31+g(d).gjf (generated)

072104799.td-b3lyp_6-31+g(d).firefly.inp (generated)

072104799.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072104799.mol 072104799.PUBCHEM 072104799.mol (via Jmol)
072105049.b3lyp_6-31g(d).inp

072105049.b3lyp_6-31g(d).qchem.inp (generated)

072105049.b3lyp_6-31g(d).gjf (generated)

072105049.b3lyp_6-31g(d).firefly.inp (generated)

072105049.b3lyp_6-31g(d).smash.inp (generated)

072105049.b3lyp_6-31g(d).nwchem.inp (generated) 072105049.b3lyp_6-31g(d).log.xz 072105049.td-b3lyp_6-31g+(d).inp 072105049.td-b3lyp_6-31g+(d).log.xz

072105049.td-b3lyp_6-31+g(d).qchem.inp (generated)

072105049.td-b3lyp_6-31+g(d).gjf (generated)

072105049.td-b3lyp_6-31+g(d).firefly.inp (generated)

072105049.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072105049.mol 072105049.PUBCHEM 072105049.mol (via Jmol)
072105050.b3lyp_6-31g(d).inp

072105050.b3lyp_6-31g(d).qchem.inp (generated)

072105050.b3lyp_6-31g(d).gjf (generated)

072105050.b3lyp_6-31g(d).firefly.inp (generated)

072105050.b3lyp_6-31g(d).smash.inp (generated)

072105050.b3lyp_6-31g(d).nwchem.inp (generated) 072105050.b3lyp_6-31g(d).log.xz 072105050.td-b3lyp_6-31g+(d).inp 072105050.td-b3lyp_6-31g+(d).log.xz

072105050.td-b3lyp_6-31+g(d).qchem.inp (generated)

072105050.td-b3lyp_6-31+g(d).gjf (generated)

072105050.td-b3lyp_6-31+g(d).firefly.inp (generated)

072105050.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072105050.mol 072105050.PUBCHEM 072105050.mol (via Jmol)
072105056.b3lyp_6-31g(d).inp

072105056.b3lyp_6-31g(d).qchem.inp (generated)

072105056.b3lyp_6-31g(d).gjf (generated)

072105056.b3lyp_6-31g(d).firefly.inp (generated)

072105056.b3lyp_6-31g(d).smash.inp (generated)

072105056.b3lyp_6-31g(d).nwchem.inp (generated) 072105056.b3lyp_6-31g(d).log.xz 072105056.td-b3lyp_6-31g+(d).inp 072105056.td-b3lyp_6-31g+(d).log.xz

072105056.td-b3lyp_6-31+g(d).qchem.inp (generated)

072105056.td-b3lyp_6-31+g(d).gjf (generated)

072105056.td-b3lyp_6-31+g(d).firefly.inp (generated)

072105056.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072105056.mol 072105056.PUBCHEM 072105056.mol (via Jmol)
072105070.b3lyp_6-31g(d).inp

072105070.b3lyp_6-31g(d).qchem.inp (generated)

072105070.b3lyp_6-31g(d).gjf (generated)

072105070.b3lyp_6-31g(d).firefly.inp (generated)

072105070.b3lyp_6-31g(d).smash.inp (generated)

072105070.b3lyp_6-31g(d).nwchem.inp (generated) 072105070.b3lyp_6-31g(d).log.xz 072105070.td-b3lyp_6-31g+(d).inp 072105070.td-b3lyp_6-31g+(d).log.xz

072105070.td-b3lyp_6-31+g(d).qchem.inp (generated)

072105070.td-b3lyp_6-31+g(d).gjf (generated)

072105070.td-b3lyp_6-31+g(d).firefly.inp (generated)

072105070.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072105070.mol 072105070.PUBCHEM 072105070.mol (via Jmol)
072105091.b3lyp_6-31g(d).inp

072105091.b3lyp_6-31g(d).qchem.inp (generated)

072105091.b3lyp_6-31g(d).gjf (generated)

072105091.b3lyp_6-31g(d).firefly.inp (generated)

072105091.b3lyp_6-31g(d).smash.inp (generated)

072105091.b3lyp_6-31g(d).nwchem.inp (generated) 072105091.b3lyp_6-31g(d).log.xz 072105091.td-b3lyp_6-31g+(d).inp 072105091.td-b3lyp_6-31g+(d).log.xz

072105091.td-b3lyp_6-31+g(d).qchem.inp (generated)

072105091.td-b3lyp_6-31+g(d).gjf (generated)

072105091.td-b3lyp_6-31+g(d).firefly.inp (generated)

072105091.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072105091.mol 072105091.PUBCHEM 072105091.mol (via Jmol)
072105156.b3lyp_6-31g(d).inp

072105156.b3lyp_6-31g(d).qchem.inp (generated)

072105156.b3lyp_6-31g(d).gjf (generated)

072105156.b3lyp_6-31g(d).firefly.inp (generated)

072105156.b3lyp_6-31g(d).smash.inp (generated)

072105156.b3lyp_6-31g(d).nwchem.inp (generated) 072105156.b3lyp_6-31g(d).log.xz 072105156.mol 072105156.PUBCHEM 072105156.mol (via Jmol)
072105175.b3lyp_6-31g(d).inp

072105175.b3lyp_6-31g(d).qchem.inp (generated)

072105175.b3lyp_6-31g(d).gjf (generated)

072105175.b3lyp_6-31g(d).firefly.inp (generated)

072105175.b3lyp_6-31g(d).smash.inp (generated)

072105175.b3lyp_6-31g(d).nwchem.inp (generated) 072105175.b3lyp_6-31g(d).log.xz 072105175.td-b3lyp_6-31g+(d).inp 072105175.td-b3lyp_6-31g+(d).log.xz

072105175.td-b3lyp_6-31+g(d).qchem.inp (generated)

072105175.td-b3lyp_6-31+g(d).gjf (generated)

072105175.td-b3lyp_6-31+g(d).firefly.inp (generated)

072105175.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072105175.mol 072105175.PUBCHEM 072105175.mol (via Jmol)
072105176.b3lyp_6-31g(d).inp

072105176.b3lyp_6-31g(d).qchem.inp (generated)

072105176.b3lyp_6-31g(d).gjf (generated)

072105176.b3lyp_6-31g(d).firefly.inp (generated)

072105176.b3lyp_6-31g(d).smash.inp (generated)

072105176.b3lyp_6-31g(d).nwchem.inp (generated) 072105176.b3lyp_6-31g(d).log.xz 072105176.td-b3lyp_6-31g+(d).inp 072105176.td-b3lyp_6-31g+(d).log.xz

072105176.td-b3lyp_6-31+g(d).qchem.inp (generated)

072105176.td-b3lyp_6-31+g(d).gjf (generated)

072105176.td-b3lyp_6-31+g(d).firefly.inp (generated)

072105176.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072105176.mol 072105176.PUBCHEM 072105176.mol (via Jmol)
072105177.b3lyp_6-31g(d).inp

072105177.b3lyp_6-31g(d).qchem.inp (generated)

072105177.b3lyp_6-31g(d).gjf (generated)

072105177.b3lyp_6-31g(d).firefly.inp (generated)

072105177.b3lyp_6-31g(d).smash.inp (generated)

072105177.b3lyp_6-31g(d).nwchem.inp (generated) 072105177.b3lyp_6-31g(d).log.xz 072105177.td-b3lyp_6-31g+(d).inp 072105177.td-b3lyp_6-31g+(d).log.xz

072105177.td-b3lyp_6-31+g(d).qchem.inp (generated)

072105177.td-b3lyp_6-31+g(d).gjf (generated)

072105177.td-b3lyp_6-31+g(d).firefly.inp (generated)

072105177.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072105177.mol 072105177.PUBCHEM 072105177.mol (via Jmol)
072105373.b3lyp_6-31g(d).inp

072105373.b3lyp_6-31g(d).qchem.inp (generated)

072105373.b3lyp_6-31g(d).gjf (generated)

072105373.b3lyp_6-31g(d).firefly.inp (generated)

072105373.b3lyp_6-31g(d).smash.inp (generated)

072105373.b3lyp_6-31g(d).nwchem.inp (generated) 072105373.b3lyp_6-31g(d).log.xz 072105373.td-b3lyp_6-31g+(d).inp 072105373.td-b3lyp_6-31g+(d).log.xz

072105373.td-b3lyp_6-31+g(d).qchem.inp (generated)

072105373.td-b3lyp_6-31+g(d).gjf (generated)

072105373.td-b3lyp_6-31+g(d).firefly.inp (generated)

072105373.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072105373.mol 072105373.PUBCHEM 072105373.mol (via Jmol)
072105521.b3lyp_6-31g(d).inp

072105521.b3lyp_6-31g(d).qchem.inp (generated)

072105521.b3lyp_6-31g(d).gjf (generated)

072105521.b3lyp_6-31g(d).firefly.inp (generated)

072105521.b3lyp_6-31g(d).smash.inp (generated)

072105521.b3lyp_6-31g(d).nwchem.inp (generated) 072105521.b3lyp_6-31g(d).log.xz 072105521.td-b3lyp_6-31g+(d).inp 072105521.td-b3lyp_6-31g+(d).log.xz

072105521.td-b3lyp_6-31+g(d).qchem.inp (generated)

072105521.td-b3lyp_6-31+g(d).gjf (generated)

072105521.td-b3lyp_6-31+g(d).firefly.inp (generated)

072105521.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072105521.mol 072105521.PUBCHEM 072105521.mol (via Jmol)
072105522.b3lyp_6-31g(d).inp

072105522.b3lyp_6-31g(d).qchem.inp (generated)

072105522.b3lyp_6-31g(d).gjf (generated)

072105522.b3lyp_6-31g(d).firefly.inp (generated)

072105522.b3lyp_6-31g(d).smash.inp (generated)

072105522.b3lyp_6-31g(d).nwchem.inp (generated) 072105522.b3lyp_6-31g(d).log.xz 072105522.mol 072105522.PUBCHEM 072105522.mol (via Jmol)
072105559.b3lyp_6-31g(d).inp

072105559.b3lyp_6-31g(d).qchem.inp (generated)

072105559.b3lyp_6-31g(d).gjf (generated)

072105559.b3lyp_6-31g(d).firefly.inp (generated)

072105559.b3lyp_6-31g(d).smash.inp (generated)

072105559.b3lyp_6-31g(d).nwchem.inp (generated) 072105559.b3lyp_6-31g(d).log.xz 072105559.td-b3lyp_6-31g+(d).inp 072105559.td-b3lyp_6-31g+(d).log.xz

072105559.td-b3lyp_6-31+g(d).qchem.inp (generated)

072105559.td-b3lyp_6-31+g(d).gjf (generated)

072105559.td-b3lyp_6-31+g(d).firefly.inp (generated)

072105559.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072105559.mol 072105559.PUBCHEM 072105559.mol (via Jmol)
072105701.b3lyp_6-31g(d).inp

072105701.b3lyp_6-31g(d).qchem.inp (generated)

072105701.b3lyp_6-31g(d).gjf (generated)

072105701.b3lyp_6-31g(d).firefly.inp (generated)

072105701.b3lyp_6-31g(d).smash.inp (generated)

072105701.b3lyp_6-31g(d).nwchem.inp (generated) 072105701.b3lyp_6-31g(d).log.xz 072105701.td-b3lyp_6-31g+(d).inp 072105701.td-b3lyp_6-31g+(d).log.xz

072105701.td-b3lyp_6-31+g(d).qchem.inp (generated)

072105701.td-b3lyp_6-31+g(d).gjf (generated)

072105701.td-b3lyp_6-31+g(d).firefly.inp (generated)

072105701.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072105701.mol 072105701.PUBCHEM 072105701.mol (via Jmol)
072105860.b3lyp_6-31g(d).inp

072105860.b3lyp_6-31g(d).qchem.inp (generated)

072105860.b3lyp_6-31g(d).gjf (generated)

072105860.b3lyp_6-31g(d).firefly.inp (generated)

072105860.b3lyp_6-31g(d).smash.inp (generated)

072105860.b3lyp_6-31g(d).nwchem.inp (generated) 072105860.b3lyp_6-31g(d).log.xz 072105860.td-b3lyp_6-31g+(d).inp 072105860.td-b3lyp_6-31g+(d).log.xz

072105860.td-b3lyp_6-31+g(d).qchem.inp (generated)

072105860.td-b3lyp_6-31+g(d).gjf (generated)

072105860.td-b3lyp_6-31+g(d).firefly.inp (generated)

072105860.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072105860.mol 072105860.PUBCHEM 072105860.mol (via Jmol)
072105895.b3lyp_6-31g(d).inp

072105895.b3lyp_6-31g(d).qchem.inp (generated)

072105895.b3lyp_6-31g(d).gjf (generated)

072105895.b3lyp_6-31g(d).firefly.inp (generated)

072105895.b3lyp_6-31g(d).smash.inp (generated)

072105895.b3lyp_6-31g(d).nwchem.inp (generated) 072105895.b3lyp_6-31g(d).log.xz 072105895.td-b3lyp_6-31g+(d).inp 072105895.td-b3lyp_6-31g+(d).log.xz

072105895.td-b3lyp_6-31+g(d).qchem.inp (generated)

072105895.td-b3lyp_6-31+g(d).gjf (generated)

072105895.td-b3lyp_6-31+g(d).firefly.inp (generated)

072105895.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072105895.mol 072105895.PUBCHEM 072105895.mol (via Jmol)
072106094.b3lyp_6-31g(d).inp

072106094.b3lyp_6-31g(d).qchem.inp (generated)

072106094.b3lyp_6-31g(d).gjf (generated)

072106094.b3lyp_6-31g(d).firefly.inp (generated)

072106094.b3lyp_6-31g(d).smash.inp (generated)

072106094.b3lyp_6-31g(d).nwchem.inp (generated) 072106094.b3lyp_6-31g(d).log.xz 072106094.td-b3lyp_6-31g+(d).inp 072106094.td-b3lyp_6-31g+(d).log.xz

072106094.td-b3lyp_6-31+g(d).qchem.inp (generated)

072106094.td-b3lyp_6-31+g(d).gjf (generated)

072106094.td-b3lyp_6-31+g(d).firefly.inp (generated)

072106094.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072106094.mol 072106094.PUBCHEM 072106094.mol (via Jmol)
072106132.b3lyp_6-31g(d).inp

072106132.b3lyp_6-31g(d).qchem.inp (generated)

072106132.b3lyp_6-31g(d).gjf (generated)

072106132.b3lyp_6-31g(d).firefly.inp (generated)

072106132.b3lyp_6-31g(d).smash.inp (generated)

072106132.b3lyp_6-31g(d).nwchem.inp (generated) 072106132.b3lyp_6-31g(d).log.xz 072106132.td-b3lyp_6-31g+(d).inp 072106132.td-b3lyp_6-31g+(d).log.xz

072106132.td-b3lyp_6-31+g(d).qchem.inp (generated)

072106132.td-b3lyp_6-31+g(d).gjf (generated)

072106132.td-b3lyp_6-31+g(d).firefly.inp (generated)

072106132.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072106132.mol 072106132.PUBCHEM 072106132.mol (via Jmol)
072106140.b3lyp_6-31g(d).inp

072106140.b3lyp_6-31g(d).qchem.inp (generated)

072106140.b3lyp_6-31g(d).gjf (generated)

072106140.b3lyp_6-31g(d).firefly.inp (generated)

072106140.b3lyp_6-31g(d).smash.inp (generated)

072106140.b3lyp_6-31g(d).nwchem.inp (generated) 072106140.b3lyp_6-31g(d).log.xz 072106140.td-b3lyp_6-31g+(d).inp 072106140.td-b3lyp_6-31g+(d).log.xz

072106140.td-b3lyp_6-31+g(d).qchem.inp (generated)

072106140.td-b3lyp_6-31+g(d).gjf (generated)

072106140.td-b3lyp_6-31+g(d).firefly.inp (generated)

072106140.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072106140.mol 072106140.PUBCHEM 072106140.mol (via Jmol)
072106210.b3lyp_6-31g(d).inp

072106210.b3lyp_6-31g(d).qchem.inp (generated)

072106210.b3lyp_6-31g(d).gjf (generated)

072106210.b3lyp_6-31g(d).firefly.inp (generated)

072106210.b3lyp_6-31g(d).smash.inp (generated)

072106210.b3lyp_6-31g(d).nwchem.inp (generated) 072106210.b3lyp_6-31g(d).log.xz 072106210.td-b3lyp_6-31g+(d).inp 072106210.td-b3lyp_6-31g+(d).log.xz

072106210.td-b3lyp_6-31+g(d).qchem.inp (generated)

072106210.td-b3lyp_6-31+g(d).gjf (generated)

072106210.td-b3lyp_6-31+g(d).firefly.inp (generated)

072106210.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072106210.mol 072106210.PUBCHEM 072106210.mol (via Jmol)
072106214.b3lyp_6-31g(d).inp

072106214.b3lyp_6-31g(d).qchem.inp (generated)

072106214.b3lyp_6-31g(d).gjf (generated)

072106214.b3lyp_6-31g(d).firefly.inp (generated)

072106214.b3lyp_6-31g(d).smash.inp (generated)

072106214.b3lyp_6-31g(d).nwchem.inp (generated) 072106214.b3lyp_6-31g(d).log.xz 072106214.mol 072106214.PUBCHEM 072106214.mol (via Jmol)
072106282.b3lyp_6-31g(d).inp

072106282.b3lyp_6-31g(d).qchem.inp (generated)

072106282.b3lyp_6-31g(d).gjf (generated)

072106282.b3lyp_6-31g(d).firefly.inp (generated)

072106282.b3lyp_6-31g(d).smash.inp (generated)

072106282.b3lyp_6-31g(d).nwchem.inp (generated) 072106282.b3lyp_6-31g(d).log.xz 072106282.mol 072106282.PUBCHEM 072106282.mol (via Jmol)
072106314.b3lyp_6-31g(d).inp

072106314.b3lyp_6-31g(d).qchem.inp (generated)

072106314.b3lyp_6-31g(d).gjf (generated)

072106314.b3lyp_6-31g(d).firefly.inp (generated)

072106314.b3lyp_6-31g(d).smash.inp (generated)

072106314.b3lyp_6-31g(d).nwchem.inp (generated) 072106314.b3lyp_6-31g(d).log.xz 072106314.mol 072106314.PUBCHEM 072106314.mol (via Jmol)
072106418.b3lyp_6-31g(d).inp

072106418.b3lyp_6-31g(d).qchem.inp (generated)

072106418.b3lyp_6-31g(d).gjf (generated)

072106418.b3lyp_6-31g(d).firefly.inp (generated)

072106418.b3lyp_6-31g(d).smash.inp (generated)

072106418.b3lyp_6-31g(d).nwchem.inp (generated) 072106418.b3lyp_6-31g(d).log.xz 072106418.td-b3lyp_6-31g+(d).inp 072106418.td-b3lyp_6-31g+(d).log.xz

072106418.td-b3lyp_6-31+g(d).qchem.inp (generated)

072106418.td-b3lyp_6-31+g(d).gjf (generated)

072106418.td-b3lyp_6-31+g(d).firefly.inp (generated)

072106418.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072106418.mol 072106418.PUBCHEM 072106418.mol (via Jmol)
072106600.b3lyp_6-31g(d).inp

072106600.b3lyp_6-31g(d).qchem.inp (generated)

072106600.b3lyp_6-31g(d).gjf (generated)

072106600.b3lyp_6-31g(d).firefly.inp (generated)

072106600.b3lyp_6-31g(d).smash.inp (generated)

072106600.b3lyp_6-31g(d).nwchem.inp (generated) 072106600.b3lyp_6-31g(d).log.xz 072106600.td-b3lyp_6-31g+(d).inp 072106600.td-b3lyp_6-31g+(d).log.xz

072106600.td-b3lyp_6-31+g(d).qchem.inp (generated)

072106600.td-b3lyp_6-31+g(d).gjf (generated)

072106600.td-b3lyp_6-31+g(d).firefly.inp (generated)

072106600.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072106600.mol 072106600.PUBCHEM 072106600.mol (via Jmol)
072106612.b3lyp_6-31g(d).inp

072106612.b3lyp_6-31g(d).qchem.inp (generated)

072106612.b3lyp_6-31g(d).gjf (generated)

072106612.b3lyp_6-31g(d).firefly.inp (generated)

072106612.b3lyp_6-31g(d).smash.inp (generated)

072106612.b3lyp_6-31g(d).nwchem.inp (generated) 072106612.b3lyp_6-31g(d).log.xz 072106612.td-b3lyp_6-31g+(d).inp 072106612.td-b3lyp_6-31g+(d).log.xz

072106612.td-b3lyp_6-31+g(d).qchem.inp (generated)

072106612.td-b3lyp_6-31+g(d).gjf (generated)

072106612.td-b3lyp_6-31+g(d).firefly.inp (generated)

072106612.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072106612.mol 072106612.PUBCHEM 072106612.mol (via Jmol)
072106666.b3lyp_6-31g(d).inp

072106666.b3lyp_6-31g(d).qchem.inp (generated)

072106666.b3lyp_6-31g(d).gjf (generated)

072106666.b3lyp_6-31g(d).firefly.inp (generated)

072106666.b3lyp_6-31g(d).smash.inp (generated)

072106666.b3lyp_6-31g(d).nwchem.inp (generated) 072106666.b3lyp_6-31g(d).log.xz 072106666.td-b3lyp_6-31g+(d).inp 072106666.td-b3lyp_6-31g+(d).log.xz

072106666.td-b3lyp_6-31+g(d).qchem.inp (generated)

072106666.td-b3lyp_6-31+g(d).gjf (generated)

072106666.td-b3lyp_6-31+g(d).firefly.inp (generated)

072106666.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072106666.mol 072106666.PUBCHEM 072106666.mol (via Jmol)
072106700.b3lyp_6-31g(d).inp

072106700.b3lyp_6-31g(d).qchem.inp (generated)

072106700.b3lyp_6-31g(d).gjf (generated)

072106700.b3lyp_6-31g(d).firefly.inp (generated)

072106700.b3lyp_6-31g(d).smash.inp (generated)

072106700.b3lyp_6-31g(d).nwchem.inp (generated) 072106700.b3lyp_6-31g(d).log.xz 072106700.mol 072106700.PUBCHEM 072106700.mol (via Jmol)
072106702.b3lyp_6-31g(d).inp

072106702.b3lyp_6-31g(d).qchem.inp (generated)

072106702.b3lyp_6-31g(d).gjf (generated)

072106702.b3lyp_6-31g(d).firefly.inp (generated)

072106702.b3lyp_6-31g(d).smash.inp (generated)

072106702.b3lyp_6-31g(d).nwchem.inp (generated) 072106702.b3lyp_6-31g(d).log.xz 072106702.td-b3lyp_6-31g+(d).inp 072106702.td-b3lyp_6-31g+(d).log.xz

072106702.td-b3lyp_6-31+g(d).qchem.inp (generated)

072106702.td-b3lyp_6-31+g(d).gjf (generated)

072106702.td-b3lyp_6-31+g(d).firefly.inp (generated)

072106702.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072106702.mol 072106702.PUBCHEM 072106702.mol (via Jmol)
072106761.b3lyp_6-31g(d).inp

072106761.b3lyp_6-31g(d).qchem.inp (generated)

072106761.b3lyp_6-31g(d).gjf (generated)

072106761.b3lyp_6-31g(d).firefly.inp (generated)

072106761.b3lyp_6-31g(d).smash.inp (generated)

072106761.b3lyp_6-31g(d).nwchem.inp (generated) 072106761.b3lyp_6-31g(d).log.xz 072106761.td-b3lyp_6-31g+(d).inp 072106761.td-b3lyp_6-31g+(d).log.xz

072106761.td-b3lyp_6-31+g(d).qchem.inp (generated)

072106761.td-b3lyp_6-31+g(d).gjf (generated)

072106761.td-b3lyp_6-31+g(d).firefly.inp (generated)

072106761.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072106761.mol 072106761.PUBCHEM 072106761.mol (via Jmol)
072106768.b3lyp_6-31g(d).inp

072106768.b3lyp_6-31g(d).qchem.inp (generated)

072106768.b3lyp_6-31g(d).gjf (generated)

072106768.b3lyp_6-31g(d).firefly.inp (generated)

072106768.b3lyp_6-31g(d).smash.inp (generated)

072106768.b3lyp_6-31g(d).nwchem.inp (generated) 072106768.b3lyp_6-31g(d).log.xz 072106768.td-b3lyp_6-31g+(d).inp 072106768.td-b3lyp_6-31g+(d).log.xz

072106768.td-b3lyp_6-31+g(d).qchem.inp (generated)

072106768.td-b3lyp_6-31+g(d).gjf (generated)

072106768.td-b3lyp_6-31+g(d).firefly.inp (generated)

072106768.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072106768.mol 072106768.PUBCHEM 072106768.mol (via Jmol)
072106878.b3lyp_6-31g(d).inp

072106878.b3lyp_6-31g(d).qchem.inp (generated)

072106878.b3lyp_6-31g(d).gjf (generated)

072106878.b3lyp_6-31g(d).firefly.inp (generated)

072106878.b3lyp_6-31g(d).smash.inp (generated)

072106878.b3lyp_6-31g(d).nwchem.inp (generated) 072106878.b3lyp_6-31g(d).log.xz 072106878.td-b3lyp_6-31g+(d).inp 072106878.td-b3lyp_6-31g+(d).log.xz

072106878.td-b3lyp_6-31+g(d).qchem.inp (generated)

072106878.td-b3lyp_6-31+g(d).gjf (generated)

072106878.td-b3lyp_6-31+g(d).firefly.inp (generated)

072106878.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072106878.mol 072106878.PUBCHEM 072106878.mol (via Jmol)
072106994.b3lyp_6-31g(d).inp

072106994.b3lyp_6-31g(d).qchem.inp (generated)

072106994.b3lyp_6-31g(d).gjf (generated)

072106994.b3lyp_6-31g(d).firefly.inp (generated)

072106994.b3lyp_6-31g(d).smash.inp (generated)

072106994.b3lyp_6-31g(d).nwchem.inp (generated) 072106994.b3lyp_6-31g(d).log.xz 072106994.td-b3lyp_6-31g+(d).inp 072106994.td-b3lyp_6-31g+(d).log.xz

072106994.td-b3lyp_6-31+g(d).qchem.inp (generated)

072106994.td-b3lyp_6-31+g(d).gjf (generated)

072106994.td-b3lyp_6-31+g(d).firefly.inp (generated)

072106994.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072106994.mol 072106994.PUBCHEM 072106994.mol (via Jmol)
072106997.b3lyp_6-31g(d).inp

072106997.b3lyp_6-31g(d).qchem.inp (generated)

072106997.b3lyp_6-31g(d).gjf (generated)

072106997.b3lyp_6-31g(d).firefly.inp (generated)

072106997.b3lyp_6-31g(d).smash.inp (generated)

072106997.b3lyp_6-31g(d).nwchem.inp (generated) 072106997.b3lyp_6-31g(d).log.xz 072106997.td-b3lyp_6-31g+(d).inp 072106997.td-b3lyp_6-31g+(d).log.xz

072106997.td-b3lyp_6-31+g(d).qchem.inp (generated)

072106997.td-b3lyp_6-31+g(d).gjf (generated)

072106997.td-b3lyp_6-31+g(d).firefly.inp (generated)

072106997.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072106997.mol 072106997.PUBCHEM 072106997.mol (via Jmol)
072107001.b3lyp_6-31g(d).inp

072107001.b3lyp_6-31g(d).qchem.inp (generated)

072107001.b3lyp_6-31g(d).gjf (generated)

072107001.b3lyp_6-31g(d).firefly.inp (generated)

072107001.b3lyp_6-31g(d).smash.inp (generated)

072107001.b3lyp_6-31g(d).nwchem.inp (generated) 072107001.b3lyp_6-31g(d).log.xz 072107001.td-b3lyp_6-31g+(d).inp 072107001.td-b3lyp_6-31g+(d).log.xz

072107001.td-b3lyp_6-31+g(d).qchem.inp (generated)

072107001.td-b3lyp_6-31+g(d).gjf (generated)

072107001.td-b3lyp_6-31+g(d).firefly.inp (generated)

072107001.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072107001.mol 072107001.PUBCHEM 072107001.mol (via Jmol)
072107002.b3lyp_6-31g(d).inp

072107002.b3lyp_6-31g(d).qchem.inp (generated)

072107002.b3lyp_6-31g(d).gjf (generated)

072107002.b3lyp_6-31g(d).firefly.inp (generated)

072107002.b3lyp_6-31g(d).smash.inp (generated)

072107002.b3lyp_6-31g(d).nwchem.inp (generated) 072107002.b3lyp_6-31g(d).log.xz 072107002.td-b3lyp_6-31g+(d).inp 072107002.td-b3lyp_6-31g+(d).log.xz

072107002.td-b3lyp_6-31+g(d).qchem.inp (generated)

072107002.td-b3lyp_6-31+g(d).gjf (generated)

072107002.td-b3lyp_6-31+g(d).firefly.inp (generated)

072107002.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072107002.mol 072107002.PUBCHEM 072107002.mol (via Jmol)
072107038.b3lyp_6-31g(d).inp

072107038.b3lyp_6-31g(d).qchem.inp (generated)

072107038.b3lyp_6-31g(d).gjf (generated)

072107038.b3lyp_6-31g(d).firefly.inp (generated)

072107038.b3lyp_6-31g(d).smash.inp (generated)

072107038.b3lyp_6-31g(d).nwchem.inp (generated) 072107038.b3lyp_6-31g(d).log.xz 072107038.td-b3lyp_6-31g+(d).inp 072107038.td-b3lyp_6-31g+(d).log.xz

072107038.td-b3lyp_6-31+g(d).qchem.inp (generated)

072107038.td-b3lyp_6-31+g(d).gjf (generated)

072107038.td-b3lyp_6-31+g(d).firefly.inp (generated)

072107038.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072107038.mol 072107038.PUBCHEM 072107038.mol (via Jmol)
072107045.b3lyp_6-31g(d).inp

072107045.b3lyp_6-31g(d).qchem.inp (generated)

072107045.b3lyp_6-31g(d).gjf (generated)

072107045.b3lyp_6-31g(d).firefly.inp (generated)

072107045.b3lyp_6-31g(d).smash.inp (generated)

072107045.b3lyp_6-31g(d).nwchem.inp (generated) 072107045.b3lyp_6-31g(d).log.xz 072107045.td-b3lyp_6-31g+(d).inp 072107045.td-b3lyp_6-31g+(d).log.xz

072107045.td-b3lyp_6-31+g(d).qchem.inp (generated)

072107045.td-b3lyp_6-31+g(d).gjf (generated)

072107045.td-b3lyp_6-31+g(d).firefly.inp (generated)

072107045.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072107045.mol 072107045.PUBCHEM 072107045.mol (via Jmol)
072107048.b3lyp_6-31g(d).inp

072107048.b3lyp_6-31g(d).qchem.inp (generated)

072107048.b3lyp_6-31g(d).gjf (generated)

072107048.b3lyp_6-31g(d).firefly.inp (generated)

072107048.b3lyp_6-31g(d).smash.inp (generated)

072107048.b3lyp_6-31g(d).nwchem.inp (generated) 072107048.b3lyp_6-31g(d).log.xz 072107048.mol 072107048.PUBCHEM 072107048.mol (via Jmol)
072107050.b3lyp_6-31g(d).inp

072107050.b3lyp_6-31g(d).qchem.inp (generated)

072107050.b3lyp_6-31g(d).gjf (generated)

072107050.b3lyp_6-31g(d).firefly.inp (generated)

072107050.b3lyp_6-31g(d).smash.inp (generated)

072107050.b3lyp_6-31g(d).nwchem.inp (generated) 072107050.b3lyp_6-31g(d).log.xz 072107050.td-b3lyp_6-31g+(d).inp 072107050.td-b3lyp_6-31g+(d).log.xz

072107050.td-b3lyp_6-31+g(d).qchem.inp (generated)

072107050.td-b3lyp_6-31+g(d).gjf (generated)

072107050.td-b3lyp_6-31+g(d).firefly.inp (generated)

072107050.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072107050.mol 072107050.PUBCHEM 072107050.mol (via Jmol)
072107053.b3lyp_6-31g(d).inp

072107053.b3lyp_6-31g(d).qchem.inp (generated)

072107053.b3lyp_6-31g(d).gjf (generated)

072107053.b3lyp_6-31g(d).firefly.inp (generated)

072107053.b3lyp_6-31g(d).smash.inp (generated)

072107053.b3lyp_6-31g(d).nwchem.inp (generated) 072107053.b3lyp_6-31g(d).log.xz 072107053.td-b3lyp_6-31g+(d).inp 072107053.td-b3lyp_6-31g+(d).log.xz

072107053.td-b3lyp_6-31+g(d).qchem.inp (generated)

072107053.td-b3lyp_6-31+g(d).gjf (generated)

072107053.td-b3lyp_6-31+g(d).firefly.inp (generated)

072107053.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072107053.mol 072107053.PUBCHEM 072107053.mol (via Jmol)
072107055.b3lyp_6-31g(d).inp

072107055.b3lyp_6-31g(d).qchem.inp (generated)

072107055.b3lyp_6-31g(d).gjf (generated)

072107055.b3lyp_6-31g(d).firefly.inp (generated)

072107055.b3lyp_6-31g(d).smash.inp (generated)

072107055.b3lyp_6-31g(d).nwchem.inp (generated) 072107055.b3lyp_6-31g(d).log.xz 072107055.td-b3lyp_6-31g+(d).inp 072107055.td-b3lyp_6-31g+(d).log.xz

072107055.td-b3lyp_6-31+g(d).qchem.inp (generated)

072107055.td-b3lyp_6-31+g(d).gjf (generated)

072107055.td-b3lyp_6-31+g(d).firefly.inp (generated)

072107055.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072107055.mol 072107055.PUBCHEM 072107055.mol (via Jmol)
072107056.b3lyp_6-31g(d).inp

072107056.b3lyp_6-31g(d).qchem.inp (generated)

072107056.b3lyp_6-31g(d).gjf (generated)

072107056.b3lyp_6-31g(d).firefly.inp (generated)

072107056.b3lyp_6-31g(d).smash.inp (generated)

072107056.b3lyp_6-31g(d).nwchem.inp (generated) 072107056.b3lyp_6-31g(d).log.xz 072107056.td-b3lyp_6-31g+(d).inp 072107056.td-b3lyp_6-31g+(d).log.xz

072107056.td-b3lyp_6-31+g(d).qchem.inp (generated)

072107056.td-b3lyp_6-31+g(d).gjf (generated)

072107056.td-b3lyp_6-31+g(d).firefly.inp (generated)

072107056.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072107056.mol 072107056.PUBCHEM 072107056.mol (via Jmol)
072107057.b3lyp_6-31g(d).inp

072107057.b3lyp_6-31g(d).qchem.inp (generated)

072107057.b3lyp_6-31g(d).gjf (generated)

072107057.b3lyp_6-31g(d).firefly.inp (generated)

072107057.b3lyp_6-31g(d).smash.inp (generated)

072107057.b3lyp_6-31g(d).nwchem.inp (generated) 072107057.b3lyp_6-31g(d).log.xz 072107057.td-b3lyp_6-31g+(d).inp 072107057.td-b3lyp_6-31g+(d).log.xz

072107057.td-b3lyp_6-31+g(d).qchem.inp (generated)

072107057.td-b3lyp_6-31+g(d).gjf (generated)

072107057.td-b3lyp_6-31+g(d).firefly.inp (generated)

072107057.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072107057.mol 072107057.PUBCHEM 072107057.mol (via Jmol)
072107058.b3lyp_6-31g(d).inp

072107058.b3lyp_6-31g(d).qchem.inp (generated)

072107058.b3lyp_6-31g(d).gjf (generated)

072107058.b3lyp_6-31g(d).firefly.inp (generated)

072107058.b3lyp_6-31g(d).smash.inp (generated)

072107058.b3lyp_6-31g(d).nwchem.inp (generated) 072107058.b3lyp_6-31g(d).log.xz 072107058.td-b3lyp_6-31g+(d).inp 072107058.td-b3lyp_6-31g+(d).log.xz

072107058.td-b3lyp_6-31+g(d).qchem.inp (generated)

072107058.td-b3lyp_6-31+g(d).gjf (generated)

072107058.td-b3lyp_6-31+g(d).firefly.inp (generated)

072107058.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072107058.mol 072107058.PUBCHEM 072107058.mol (via Jmol)
072107059.b3lyp_6-31g(d).inp

072107059.b3lyp_6-31g(d).qchem.inp (generated)

072107059.b3lyp_6-31g(d).gjf (generated)

072107059.b3lyp_6-31g(d).firefly.inp (generated)

072107059.b3lyp_6-31g(d).smash.inp (generated)

072107059.b3lyp_6-31g(d).nwchem.inp (generated) 072107059.b3lyp_6-31g(d).log.xz 072107059.td-b3lyp_6-31g+(d).inp 072107059.td-b3lyp_6-31g+(d).log.xz

072107059.td-b3lyp_6-31+g(d).qchem.inp (generated)

072107059.td-b3lyp_6-31+g(d).gjf (generated)

072107059.td-b3lyp_6-31+g(d).firefly.inp (generated)

072107059.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072107059.mol 072107059.PUBCHEM 072107059.mol (via Jmol)
072107060.b3lyp_6-31g(d).inp

072107060.b3lyp_6-31g(d).qchem.inp (generated)

072107060.b3lyp_6-31g(d).gjf (generated)

072107060.b3lyp_6-31g(d).firefly.inp (generated)

072107060.b3lyp_6-31g(d).smash.inp (generated)

072107060.b3lyp_6-31g(d).nwchem.inp (generated) 072107060.b3lyp_6-31g(d).log.xz 072107060.td-b3lyp_6-31g+(d).inp 072107060.td-b3lyp_6-31g+(d).log.xz

072107060.td-b3lyp_6-31+g(d).qchem.inp (generated)

072107060.td-b3lyp_6-31+g(d).gjf (generated)

072107060.td-b3lyp_6-31+g(d).firefly.inp (generated)

072107060.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072107060.mol 072107060.PUBCHEM 072107060.mol (via Jmol)
072107203.b3lyp_6-31g(d).inp

072107203.b3lyp_6-31g(d).qchem.inp (generated)

072107203.b3lyp_6-31g(d).gjf (generated)

072107203.b3lyp_6-31g(d).firefly.inp (generated)

072107203.b3lyp_6-31g(d).smash.inp (generated)

072107203.b3lyp_6-31g(d).nwchem.inp (generated) 072107203.b3lyp_6-31g(d).log.xz 072107203.td-b3lyp_6-31g+(d).inp 072107203.td-b3lyp_6-31g+(d).log.xz

072107203.td-b3lyp_6-31+g(d).qchem.inp (generated)

072107203.td-b3lyp_6-31+g(d).gjf (generated)

072107203.td-b3lyp_6-31+g(d).firefly.inp (generated)

072107203.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072107203.mol 072107203.PUBCHEM 072107203.mol (via Jmol)
072107221.b3lyp_6-31g(d).inp

072107221.b3lyp_6-31g(d).qchem.inp (generated)

072107221.b3lyp_6-31g(d).gjf (generated)

072107221.b3lyp_6-31g(d).firefly.inp (generated)

072107221.b3lyp_6-31g(d).smash.inp (generated)

072107221.b3lyp_6-31g(d).nwchem.inp (generated) 072107221.b3lyp_6-31g(d).log.xz 072107221.td-b3lyp_6-31g+(d).inp 072107221.td-b3lyp_6-31g+(d).log.xz

072107221.td-b3lyp_6-31+g(d).qchem.inp (generated)

072107221.td-b3lyp_6-31+g(d).gjf (generated)

072107221.td-b3lyp_6-31+g(d).firefly.inp (generated)

072107221.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072107221.mol 072107221.PUBCHEM 072107221.mol (via Jmol)
072107238.b3lyp_6-31g(d).inp

072107238.b3lyp_6-31g(d).qchem.inp (generated)

072107238.b3lyp_6-31g(d).gjf (generated)

072107238.b3lyp_6-31g(d).firefly.inp (generated)

072107238.b3lyp_6-31g(d).smash.inp (generated)

072107238.b3lyp_6-31g(d).nwchem.inp (generated) 072107238.b3lyp_6-31g(d).log.xz 072107238.td-b3lyp_6-31g+(d).inp 072107238.td-b3lyp_6-31g+(d).log.xz

072107238.td-b3lyp_6-31+g(d).qchem.inp (generated)

072107238.td-b3lyp_6-31+g(d).gjf (generated)

072107238.td-b3lyp_6-31+g(d).firefly.inp (generated)

072107238.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072107238.mol 072107238.PUBCHEM 072107238.mol (via Jmol)
072107240.b3lyp_6-31g(d).inp

072107240.b3lyp_6-31g(d).qchem.inp (generated)

072107240.b3lyp_6-31g(d).gjf (generated)

072107240.b3lyp_6-31g(d).firefly.inp (generated)

072107240.b3lyp_6-31g(d).smash.inp (generated)

072107240.b3lyp_6-31g(d).nwchem.inp (generated) 072107240.b3lyp_6-31g(d).log.xz 072107240.td-b3lyp_6-31g+(d).inp 072107240.td-b3lyp_6-31g+(d).log.xz

072107240.td-b3lyp_6-31+g(d).qchem.inp (generated)

072107240.td-b3lyp_6-31+g(d).gjf (generated)

072107240.td-b3lyp_6-31+g(d).firefly.inp (generated)

072107240.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072107240.mol 072107240.PUBCHEM 072107240.mol (via Jmol)
072107300.b3lyp_6-31g(d).inp

072107300.b3lyp_6-31g(d).qchem.inp (generated)

072107300.b3lyp_6-31g(d).gjf (generated)

072107300.b3lyp_6-31g(d).firefly.inp (generated)

072107300.b3lyp_6-31g(d).smash.inp (generated)

072107300.b3lyp_6-31g(d).nwchem.inp (generated) 072107300.b3lyp_6-31g(d).log.xz 072107300.mol 072107300.PUBCHEM 072107300.mol (via Jmol)
072107432.b3lyp_6-31g(d).inp

072107432.b3lyp_6-31g(d).qchem.inp (generated)

072107432.b3lyp_6-31g(d).gjf (generated)

072107432.b3lyp_6-31g(d).firefly.inp (generated)

072107432.b3lyp_6-31g(d).smash.inp (generated)

072107432.b3lyp_6-31g(d).nwchem.inp (generated) 072107432.b3lyp_6-31g(d).log.xz 072107432.td-b3lyp_6-31g+(d).inp 072107432.td-b3lyp_6-31g+(d).log.xz

072107432.td-b3lyp_6-31+g(d).qchem.inp (generated)

072107432.td-b3lyp_6-31+g(d).gjf (generated)

072107432.td-b3lyp_6-31+g(d).firefly.inp (generated)

072107432.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072107432.mol 072107432.PUBCHEM 072107432.mol (via Jmol)
072107464.b3lyp_6-31g(d).inp

072107464.b3lyp_6-31g(d).qchem.inp (generated)

072107464.b3lyp_6-31g(d).gjf (generated)

072107464.b3lyp_6-31g(d).firefly.inp (generated)

072107464.b3lyp_6-31g(d).smash.inp (generated)

072107464.b3lyp_6-31g(d).nwchem.inp (generated) 072107464.b3lyp_6-31g(d).log.xz 072107464.td-b3lyp_6-31g+(d).inp 072107464.td-b3lyp_6-31g+(d).log.xz

072107464.td-b3lyp_6-31+g(d).qchem.inp (generated)

072107464.td-b3lyp_6-31+g(d).gjf (generated)

072107464.td-b3lyp_6-31+g(d).firefly.inp (generated)

072107464.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072107464.mol 072107464.PUBCHEM 072107464.mol (via Jmol)
072107566.b3lyp_6-31g(d).inp

072107566.b3lyp_6-31g(d).qchem.inp (generated)

072107566.b3lyp_6-31g(d).gjf (generated)

072107566.b3lyp_6-31g(d).firefly.inp (generated)

072107566.b3lyp_6-31g(d).smash.inp (generated)

072107566.b3lyp_6-31g(d).nwchem.inp (generated) 072107566.b3lyp_6-31g(d).log.xz 072107566.mol 072107566.PUBCHEM 072107566.mol (via Jmol)
072107675.b3lyp_6-31g(d).inp

072107675.b3lyp_6-31g(d).qchem.inp (generated)

072107675.b3lyp_6-31g(d).gjf (generated)

072107675.b3lyp_6-31g(d).firefly.inp (generated)

072107675.b3lyp_6-31g(d).smash.inp (generated)

072107675.b3lyp_6-31g(d).nwchem.inp (generated) 072107675.b3lyp_6-31g(d).log.xz 072107675.td-b3lyp_6-31g+(d).inp 072107675.td-b3lyp_6-31g+(d).log.xz

072107675.td-b3lyp_6-31+g(d).qchem.inp (generated)

072107675.td-b3lyp_6-31+g(d).gjf (generated)

072107675.td-b3lyp_6-31+g(d).firefly.inp (generated)

072107675.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072107675.mol 072107675.PUBCHEM 072107675.mol (via Jmol)
072107684.b3lyp_6-31g(d).inp

072107684.b3lyp_6-31g(d).qchem.inp (generated)

072107684.b3lyp_6-31g(d).gjf (generated)

072107684.b3lyp_6-31g(d).firefly.inp (generated)

072107684.b3lyp_6-31g(d).smash.inp (generated)

072107684.b3lyp_6-31g(d).nwchem.inp (generated) 072107684.b3lyp_6-31g(d).log.xz 072107684.td-b3lyp_6-31g+(d).inp 072107684.td-b3lyp_6-31g+(d).log.xz

072107684.td-b3lyp_6-31+g(d).qchem.inp (generated)

072107684.td-b3lyp_6-31+g(d).gjf (generated)

072107684.td-b3lyp_6-31+g(d).firefly.inp (generated)

072107684.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072107684.mol 072107684.PUBCHEM 072107684.mol (via Jmol)
072107715.b3lyp_6-31g(d).inp

072107715.b3lyp_6-31g(d).qchem.inp (generated)

072107715.b3lyp_6-31g(d).gjf (generated)

072107715.b3lyp_6-31g(d).firefly.inp (generated)

072107715.b3lyp_6-31g(d).smash.inp (generated)

072107715.b3lyp_6-31g(d).nwchem.inp (generated) 072107715.b3lyp_6-31g(d).log.xz 072107715.td-b3lyp_6-31g+(d).inp 072107715.td-b3lyp_6-31g+(d).log.xz

072107715.td-b3lyp_6-31+g(d).qchem.inp (generated)

072107715.td-b3lyp_6-31+g(d).gjf (generated)

072107715.td-b3lyp_6-31+g(d).firefly.inp (generated)

072107715.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072107715.mol 072107715.PUBCHEM 072107715.mol (via Jmol)
072107855.b3lyp_6-31g(d).inp

072107855.b3lyp_6-31g(d).qchem.inp (generated)

072107855.b3lyp_6-31g(d).gjf (generated)

072107855.b3lyp_6-31g(d).firefly.inp (generated)

072107855.b3lyp_6-31g(d).smash.inp (generated)

072107855.b3lyp_6-31g(d).nwchem.inp (generated) 072107855.b3lyp_6-31g(d).log.xz 072107855.td-b3lyp_6-31g+(d).inp 072107855.td-b3lyp_6-31g+(d).log.xz

072107855.td-b3lyp_6-31+g(d).qchem.inp (generated)

072107855.td-b3lyp_6-31+g(d).gjf (generated)

072107855.td-b3lyp_6-31+g(d).firefly.inp (generated)

072107855.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072107855.mol 072107855.PUBCHEM 072107855.mol (via Jmol)
072107951.b3lyp_6-31g(d).inp

072107951.b3lyp_6-31g(d).qchem.inp (generated)

072107951.b3lyp_6-31g(d).gjf (generated)

072107951.b3lyp_6-31g(d).firefly.inp (generated)

072107951.b3lyp_6-31g(d).smash.inp (generated)

072107951.b3lyp_6-31g(d).nwchem.inp (generated) 072107951.b3lyp_6-31g(d).log.xz 072107951.mol 072107951.PUBCHEM 072107951.mol (via Jmol)
072108394.b3lyp_6-31g(d).inp

072108394.b3lyp_6-31g(d).qchem.inp (generated)

072108394.b3lyp_6-31g(d).gjf (generated)

072108394.b3lyp_6-31g(d).firefly.inp (generated)

072108394.b3lyp_6-31g(d).smash.inp (generated)

072108394.b3lyp_6-31g(d).nwchem.inp (generated) 072108394.b3lyp_6-31g(d).log.xz 072108394.td-b3lyp_6-31g+(d).inp 072108394.td-b3lyp_6-31g+(d).log.xz

072108394.td-b3lyp_6-31+g(d).qchem.inp (generated)

072108394.td-b3lyp_6-31+g(d).gjf (generated)

072108394.td-b3lyp_6-31+g(d).firefly.inp (generated)

072108394.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072108394.mol 072108394.PUBCHEM 072108394.mol (via Jmol)
072108558.b3lyp_6-31g(d).inp

072108558.b3lyp_6-31g(d).qchem.inp (generated)

072108558.b3lyp_6-31g(d).gjf (generated)

072108558.b3lyp_6-31g(d).firefly.inp (generated)

072108558.b3lyp_6-31g(d).smash.inp (generated)

072108558.b3lyp_6-31g(d).nwchem.inp (generated) 072108558.b3lyp_6-31g(d).log.xz 072108558.td-b3lyp_6-31g+(d).inp 072108558.td-b3lyp_6-31g+(d).log.xz

072108558.td-b3lyp_6-31+g(d).qchem.inp (generated)

072108558.td-b3lyp_6-31+g(d).gjf (generated)

072108558.td-b3lyp_6-31+g(d).firefly.inp (generated)

072108558.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072108558.mol 072108558.PUBCHEM 072108558.mol (via Jmol)
072108583.b3lyp_6-31g(d).inp

072108583.b3lyp_6-31g(d).qchem.inp (generated)

072108583.b3lyp_6-31g(d).gjf (generated)

072108583.b3lyp_6-31g(d).firefly.inp (generated)

072108583.b3lyp_6-31g(d).smash.inp (generated)

072108583.b3lyp_6-31g(d).nwchem.inp (generated) 072108583.b3lyp_6-31g(d).log.xz 072108583.mol 072108583.PUBCHEM 072108583.mol (via Jmol)
072108732.b3lyp_6-31g(d).inp

072108732.b3lyp_6-31g(d).qchem.inp (generated)

072108732.b3lyp_6-31g(d).gjf (generated)

072108732.b3lyp_6-31g(d).firefly.inp (generated)

072108732.b3lyp_6-31g(d).smash.inp (generated)

072108732.b3lyp_6-31g(d).nwchem.inp (generated) 072108732.b3lyp_6-31g(d).log.xz 072108732.td-b3lyp_6-31g+(d).inp 072108732.td-b3lyp_6-31g+(d).log.xz

072108732.td-b3lyp_6-31+g(d).qchem.inp (generated)

072108732.td-b3lyp_6-31+g(d).gjf (generated)

072108732.td-b3lyp_6-31+g(d).firefly.inp (generated)

072108732.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072108732.mol 072108732.PUBCHEM 072108732.mol (via Jmol)
072108807.b3lyp_6-31g(d).inp

072108807.b3lyp_6-31g(d).qchem.inp (generated)

072108807.b3lyp_6-31g(d).gjf (generated)

072108807.b3lyp_6-31g(d).firefly.inp (generated)

072108807.b3lyp_6-31g(d).smash.inp (generated)

072108807.b3lyp_6-31g(d).nwchem.inp (generated) 072108807.b3lyp_6-31g(d).log.xz 072108807.td-b3lyp_6-31g+(d).inp 072108807.td-b3lyp_6-31g+(d).log.xz

072108807.td-b3lyp_6-31+g(d).qchem.inp (generated)

072108807.td-b3lyp_6-31+g(d).gjf (generated)

072108807.td-b3lyp_6-31+g(d).firefly.inp (generated)

072108807.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072108807.mol 072108807.PUBCHEM 072108807.mol (via Jmol)
072108808.b3lyp_6-31g(d).inp

072108808.b3lyp_6-31g(d).qchem.inp (generated)

072108808.b3lyp_6-31g(d).gjf (generated)

072108808.b3lyp_6-31g(d).firefly.inp (generated)

072108808.b3lyp_6-31g(d).smash.inp (generated)

072108808.b3lyp_6-31g(d).nwchem.inp (generated) 072108808.b3lyp_6-31g(d).log.xz 072108808.td-b3lyp_6-31g+(d).inp 072108808.td-b3lyp_6-31g+(d).log.xz

072108808.td-b3lyp_6-31+g(d).qchem.inp (generated)

072108808.td-b3lyp_6-31+g(d).gjf (generated)

072108808.td-b3lyp_6-31+g(d).firefly.inp (generated)

072108808.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072108808.mol 072108808.PUBCHEM 072108808.mol (via Jmol)
072108815.b3lyp_6-31g(d).inp

072108815.b3lyp_6-31g(d).qchem.inp (generated)

072108815.b3lyp_6-31g(d).gjf (generated)

072108815.b3lyp_6-31g(d).firefly.inp (generated)

072108815.b3lyp_6-31g(d).smash.inp (generated)

072108815.b3lyp_6-31g(d).nwchem.inp (generated) 072108815.b3lyp_6-31g(d).log.xz 072108815.td-b3lyp_6-31g+(d).inp 072108815.td-b3lyp_6-31g+(d).log.xz

072108815.td-b3lyp_6-31+g(d).qchem.inp (generated)

072108815.td-b3lyp_6-31+g(d).gjf (generated)

072108815.td-b3lyp_6-31+g(d).firefly.inp (generated)

072108815.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072108815.mol 072108815.PUBCHEM 072108815.mol (via Jmol)
072108894.b3lyp_6-31g(d).inp

072108894.b3lyp_6-31g(d).qchem.inp (generated)

072108894.b3lyp_6-31g(d).gjf (generated)

072108894.b3lyp_6-31g(d).firefly.inp (generated)

072108894.b3lyp_6-31g(d).smash.inp (generated)

072108894.b3lyp_6-31g(d).nwchem.inp (generated) 072108894.b3lyp_6-31g(d).log.xz 072108894.td-b3lyp_6-31g+(d).inp 072108894.td-b3lyp_6-31g+(d).log.xz

072108894.td-b3lyp_6-31+g(d).qchem.inp (generated)

072108894.td-b3lyp_6-31+g(d).gjf (generated)

072108894.td-b3lyp_6-31+g(d).firefly.inp (generated)

072108894.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072108894.mol 072108894.PUBCHEM 072108894.mol (via Jmol)
072108911.b3lyp_6-31g(d).inp

072108911.b3lyp_6-31g(d).qchem.inp (generated)

072108911.b3lyp_6-31g(d).gjf (generated)

072108911.b3lyp_6-31g(d).firefly.inp (generated)

072108911.b3lyp_6-31g(d).smash.inp (generated)

072108911.b3lyp_6-31g(d).nwchem.inp (generated) 072108911.b3lyp_6-31g(d).log.xz 072108911.mol 072108911.PUBCHEM 072108911.mol (via Jmol)
072108920.b3lyp_6-31g(d).inp

072108920.b3lyp_6-31g(d).qchem.inp (generated)

072108920.b3lyp_6-31g(d).gjf (generated)

072108920.b3lyp_6-31g(d).firefly.inp (generated)

072108920.b3lyp_6-31g(d).smash.inp (generated)

072108920.b3lyp_6-31g(d).nwchem.inp (generated) 072108920.b3lyp_6-31g(d).log.xz 072108920.td-b3lyp_6-31g+(d).inp 072108920.td-b3lyp_6-31g+(d).log.xz

072108920.td-b3lyp_6-31+g(d).qchem.inp (generated)

072108920.td-b3lyp_6-31+g(d).gjf (generated)

072108920.td-b3lyp_6-31+g(d).firefly.inp (generated)

072108920.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072108920.mol 072108920.PUBCHEM 072108920.mol (via Jmol)
072109010.b3lyp_6-31g(d).inp

072109010.b3lyp_6-31g(d).qchem.inp (generated)

072109010.b3lyp_6-31g(d).gjf (generated)

072109010.b3lyp_6-31g(d).firefly.inp (generated)

072109010.b3lyp_6-31g(d).smash.inp (generated)

072109010.b3lyp_6-31g(d).nwchem.inp (generated) 072109010.b3lyp_6-31g(d).log.xz 072109010.td-b3lyp_6-31g+(d).inp 072109010.td-b3lyp_6-31g+(d).log.xz

072109010.td-b3lyp_6-31+g(d).qchem.inp (generated)

072109010.td-b3lyp_6-31+g(d).gjf (generated)

072109010.td-b3lyp_6-31+g(d).firefly.inp (generated)

072109010.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072109010.mol 072109010.PUBCHEM 072109010.mol (via Jmol)
072109090.b3lyp_6-31g(d).inp

072109090.b3lyp_6-31g(d).qchem.inp (generated)

072109090.b3lyp_6-31g(d).gjf (generated)

072109090.b3lyp_6-31g(d).firefly.inp (generated)

072109090.b3lyp_6-31g(d).smash.inp (generated)

072109090.b3lyp_6-31g(d).nwchem.inp (generated) 072109090.b3lyp_6-31g(d).log.xz 072109090.td-b3lyp_6-31g+(d).inp 072109090.td-b3lyp_6-31g+(d).log.xz

072109090.td-b3lyp_6-31+g(d).qchem.inp (generated)

072109090.td-b3lyp_6-31+g(d).gjf (generated)

072109090.td-b3lyp_6-31+g(d).firefly.inp (generated)

072109090.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072109090.mol 072109090.PUBCHEM 072109090.mol (via Jmol)
072109105.b3lyp_6-31g(d).inp

072109105.b3lyp_6-31g(d).qchem.inp (generated)

072109105.b3lyp_6-31g(d).gjf (generated)

072109105.b3lyp_6-31g(d).firefly.inp (generated)

072109105.b3lyp_6-31g(d).smash.inp (generated)

072109105.b3lyp_6-31g(d).nwchem.inp (generated) 072109105.b3lyp_6-31g(d).log.xz 072109105.td-b3lyp_6-31g+(d).inp 072109105.td-b3lyp_6-31g+(d).log.xz

072109105.td-b3lyp_6-31+g(d).qchem.inp (generated)

072109105.td-b3lyp_6-31+g(d).gjf (generated)

072109105.td-b3lyp_6-31+g(d).firefly.inp (generated)

072109105.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072109105.mol 072109105.PUBCHEM 072109105.mol (via Jmol)
072109226.b3lyp_6-31g(d).inp

072109226.b3lyp_6-31g(d).qchem.inp (generated)

072109226.b3lyp_6-31g(d).gjf (generated)

072109226.b3lyp_6-31g(d).firefly.inp (generated)

072109226.b3lyp_6-31g(d).smash.inp (generated)

072109226.b3lyp_6-31g(d).nwchem.inp (generated) 072109226.b3lyp_6-31g(d).log.xz 072109226.td-b3lyp_6-31g+(d).inp 072109226.td-b3lyp_6-31g+(d).log.xz

072109226.td-b3lyp_6-31+g(d).qchem.inp (generated)

072109226.td-b3lyp_6-31+g(d).gjf (generated)

072109226.td-b3lyp_6-31+g(d).firefly.inp (generated)

072109226.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072109226.mol 072109226.PUBCHEM 072109226.mol (via Jmol)
072109254.b3lyp_6-31g(d).inp

072109254.b3lyp_6-31g(d).qchem.inp (generated)

072109254.b3lyp_6-31g(d).gjf (generated)

072109254.b3lyp_6-31g(d).firefly.inp (generated)

072109254.b3lyp_6-31g(d).smash.inp (generated)

072109254.b3lyp_6-31g(d).nwchem.inp (generated) 072109254.b3lyp_6-31g(d).log.xz 072109254.td-b3lyp_6-31g+(d).inp 072109254.td-b3lyp_6-31g+(d).log.xz

072109254.td-b3lyp_6-31+g(d).qchem.inp (generated)

072109254.td-b3lyp_6-31+g(d).gjf (generated)

072109254.td-b3lyp_6-31+g(d).firefly.inp (generated)

072109254.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072109254.mol 072109254.PUBCHEM 072109254.mol (via Jmol)
072109508.b3lyp_6-31g(d).inp

072109508.b3lyp_6-31g(d).qchem.inp (generated)

072109508.b3lyp_6-31g(d).gjf (generated)

072109508.b3lyp_6-31g(d).firefly.inp (generated)

072109508.b3lyp_6-31g(d).smash.inp (generated)

072109508.b3lyp_6-31g(d).nwchem.inp (generated) 072109508.b3lyp_6-31g(d).log.xz 072109508.td-b3lyp_6-31g+(d).inp 072109508.td-b3lyp_6-31g+(d).log.xz

072109508.td-b3lyp_6-31+g(d).qchem.inp (generated)

072109508.td-b3lyp_6-31+g(d).gjf (generated)

072109508.td-b3lyp_6-31+g(d).firefly.inp (generated)

072109508.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072109508.mol 072109508.PUBCHEM 072109508.mol (via Jmol)
072109797.b3lyp_6-31g(d).inp

072109797.b3lyp_6-31g(d).qchem.inp (generated)

072109797.b3lyp_6-31g(d).gjf (generated)

072109797.b3lyp_6-31g(d).firefly.inp (generated)

072109797.b3lyp_6-31g(d).smash.inp (generated)

072109797.b3lyp_6-31g(d).nwchem.inp (generated) 072109797.b3lyp_6-31g(d).log.xz 072109797.mol 072109797.PUBCHEM 072109797.mol (via Jmol)
072109842.b3lyp_6-31g(d).inp

072109842.b3lyp_6-31g(d).qchem.inp (generated)

072109842.b3lyp_6-31g(d).gjf (generated)

072109842.b3lyp_6-31g(d).firefly.inp (generated)

072109842.b3lyp_6-31g(d).smash.inp (generated)

072109842.b3lyp_6-31g(d).nwchem.inp (generated) 072109842.b3lyp_6-31g(d).log.xz 072109842.td-b3lyp_6-31g+(d).inp 072109842.td-b3lyp_6-31g+(d).log.xz

072109842.td-b3lyp_6-31+g(d).qchem.inp (generated)

072109842.td-b3lyp_6-31+g(d).gjf (generated)

072109842.td-b3lyp_6-31+g(d).firefly.inp (generated)

072109842.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072109842.mol 072109842.PUBCHEM 072109842.mol (via Jmol)
072110185.b3lyp_6-31g(d).inp

072110185.b3lyp_6-31g(d).qchem.inp (generated)

072110185.b3lyp_6-31g(d).gjf (generated)

072110185.b3lyp_6-31g(d).firefly.inp (generated)

072110185.b3lyp_6-31g(d).smash.inp (generated)

072110185.b3lyp_6-31g(d).nwchem.inp (generated) 072110185.b3lyp_6-31g(d).log.xz 072110185.mol 072110185.PUBCHEM 072110185.mol (via Jmol)
072110271.b3lyp_6-31g(d).inp

072110271.b3lyp_6-31g(d).qchem.inp (generated)

072110271.b3lyp_6-31g(d).gjf (generated)

072110271.b3lyp_6-31g(d).firefly.inp (generated)

072110271.b3lyp_6-31g(d).smash.inp (generated)

072110271.b3lyp_6-31g(d).nwchem.inp (generated) 072110271.b3lyp_6-31g(d).log.xz 072110271.td-b3lyp_6-31g+(d).inp 072110271.td-b3lyp_6-31g+(d).log.xz

072110271.td-b3lyp_6-31+g(d).qchem.inp (generated)

072110271.td-b3lyp_6-31+g(d).gjf (generated)

072110271.td-b3lyp_6-31+g(d).firefly.inp (generated)

072110271.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072110271.mol 072110271.PUBCHEM 072110271.mol (via Jmol)
072110287.b3lyp_6-31g(d).inp

072110287.b3lyp_6-31g(d).qchem.inp (generated)

072110287.b3lyp_6-31g(d).gjf (generated)

072110287.b3lyp_6-31g(d).firefly.inp (generated)

072110287.b3lyp_6-31g(d).smash.inp (generated)

072110287.b3lyp_6-31g(d).nwchem.inp (generated) 072110287.b3lyp_6-31g(d).log.xz 072110287.mol 072110287.PUBCHEM 072110287.mol (via Jmol)
072110494.b3lyp_6-31g(d).inp

072110494.b3lyp_6-31g(d).qchem.inp (generated)

072110494.b3lyp_6-31g(d).gjf (generated)

072110494.b3lyp_6-31g(d).firefly.inp (generated)

072110494.b3lyp_6-31g(d).smash.inp (generated)

072110494.b3lyp_6-31g(d).nwchem.inp (generated) 072110494.b3lyp_6-31g(d).log.xz 072110494.mol 072110494.PUBCHEM 072110494.mol (via Jmol)
072110677.b3lyp_6-31g(d).inp

072110677.b3lyp_6-31g(d).qchem.inp (generated)

072110677.b3lyp_6-31g(d).gjf (generated)

072110677.b3lyp_6-31g(d).firefly.inp (generated)

072110677.b3lyp_6-31g(d).smash.inp (generated)

072110677.b3lyp_6-31g(d).nwchem.inp (generated) 072110677.b3lyp_6-31g(d).log.xz 072110677.td-b3lyp_6-31g+(d).inp 072110677.td-b3lyp_6-31g+(d).log.xz

072110677.td-b3lyp_6-31+g(d).qchem.inp (generated)

072110677.td-b3lyp_6-31+g(d).gjf (generated)

072110677.td-b3lyp_6-31+g(d).firefly.inp (generated)

072110677.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072110677.mol 072110677.PUBCHEM 072110677.mol (via Jmol)
072110759.b3lyp_6-31g(d).inp

072110759.b3lyp_6-31g(d).qchem.inp (generated)

072110759.b3lyp_6-31g(d).gjf (generated)

072110759.b3lyp_6-31g(d).firefly.inp (generated)

072110759.b3lyp_6-31g(d).smash.inp (generated)

072110759.b3lyp_6-31g(d).nwchem.inp (generated) 072110759.b3lyp_6-31g(d).log.xz 072110759.mol 072110759.PUBCHEM 072110759.mol (via Jmol)
072110855.b3lyp_6-31g(d).inp

072110855.b3lyp_6-31g(d).qchem.inp (generated)

072110855.b3lyp_6-31g(d).gjf (generated)

072110855.b3lyp_6-31g(d).firefly.inp (generated)

072110855.b3lyp_6-31g(d).smash.inp (generated)

072110855.b3lyp_6-31g(d).nwchem.inp (generated) 072110855.b3lyp_6-31g(d).log.xz 072110855.mol 072110855.PUBCHEM 072110855.mol (via Jmol)
072110857.b3lyp_6-31g(d).inp

072110857.b3lyp_6-31g(d).qchem.inp (generated)

072110857.b3lyp_6-31g(d).gjf (generated)

072110857.b3lyp_6-31g(d).firefly.inp (generated)

072110857.b3lyp_6-31g(d).smash.inp (generated)

072110857.b3lyp_6-31g(d).nwchem.inp (generated) 072110857.b3lyp_6-31g(d).log.xz 072110857.td-b3lyp_6-31g+(d).inp 072110857.td-b3lyp_6-31g+(d).log.xz

072110857.td-b3lyp_6-31+g(d).qchem.inp (generated)

072110857.td-b3lyp_6-31+g(d).gjf (generated)

072110857.td-b3lyp_6-31+g(d).firefly.inp (generated)

072110857.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072110857.mol 072110857.PUBCHEM 072110857.mol (via Jmol)
072110879.b3lyp_6-31g(d).inp

072110879.b3lyp_6-31g(d).qchem.inp (generated)

072110879.b3lyp_6-31g(d).gjf (generated)

072110879.b3lyp_6-31g(d).firefly.inp (generated)

072110879.b3lyp_6-31g(d).smash.inp (generated)

072110879.b3lyp_6-31g(d).nwchem.inp (generated) 072110879.b3lyp_6-31g(d).log.xz 072110879.mol 072110879.PUBCHEM 072110879.mol (via Jmol)
072110906.b3lyp_6-31g(d).inp

072110906.b3lyp_6-31g(d).qchem.inp (generated)

072110906.b3lyp_6-31g(d).gjf (generated)

072110906.b3lyp_6-31g(d).firefly.inp (generated)

072110906.b3lyp_6-31g(d).smash.inp (generated)

072110906.b3lyp_6-31g(d).nwchem.inp (generated) 072110906.b3lyp_6-31g(d).log.xz 072110906.td-b3lyp_6-31g+(d).inp 072110906.td-b3lyp_6-31g+(d).log.xz

072110906.td-b3lyp_6-31+g(d).qchem.inp (generated)

072110906.td-b3lyp_6-31+g(d).gjf (generated)

072110906.td-b3lyp_6-31+g(d).firefly.inp (generated)

072110906.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072110906.mol 072110906.PUBCHEM 072110906.mol (via Jmol)
072110907.b3lyp_6-31g(d).inp

072110907.b3lyp_6-31g(d).qchem.inp (generated)

072110907.b3lyp_6-31g(d).gjf (generated)

072110907.b3lyp_6-31g(d).firefly.inp (generated)

072110907.b3lyp_6-31g(d).smash.inp (generated)

072110907.b3lyp_6-31g(d).nwchem.inp (generated) 072110907.b3lyp_6-31g(d).log.xz 072110907.td-b3lyp_6-31g+(d).inp 072110907.td-b3lyp_6-31g+(d).log.xz

072110907.td-b3lyp_6-31+g(d).qchem.inp (generated)

072110907.td-b3lyp_6-31+g(d).gjf (generated)

072110907.td-b3lyp_6-31+g(d).firefly.inp (generated)

072110907.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072110907.mol 072110907.PUBCHEM 072110907.mol (via Jmol)
072110920.b3lyp_6-31g(d).inp

072110920.b3lyp_6-31g(d).qchem.inp (generated)

072110920.b3lyp_6-31g(d).gjf (generated)

072110920.b3lyp_6-31g(d).firefly.inp (generated)

072110920.b3lyp_6-31g(d).smash.inp (generated)

072110920.b3lyp_6-31g(d).nwchem.inp (generated) 072110920.b3lyp_6-31g(d).log.xz 072110920.mol 072110920.PUBCHEM 072110920.mol (via Jmol)
072110931.b3lyp_6-31g(d).inp

072110931.b3lyp_6-31g(d).qchem.inp (generated)

072110931.b3lyp_6-31g(d).gjf (generated)

072110931.b3lyp_6-31g(d).firefly.inp (generated)

072110931.b3lyp_6-31g(d).smash.inp (generated)

072110931.b3lyp_6-31g(d).nwchem.inp (generated) 072110931.b3lyp_6-31g(d).log.xz 072110931.td-b3lyp_6-31g+(d).inp 072110931.td-b3lyp_6-31g+(d).log.xz

072110931.td-b3lyp_6-31+g(d).qchem.inp (generated)

072110931.td-b3lyp_6-31+g(d).gjf (generated)

072110931.td-b3lyp_6-31+g(d).firefly.inp (generated)

072110931.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072110931.mol 072110931.PUBCHEM 072110931.mol (via Jmol)
072110932.b3lyp_6-31g(d).inp

072110932.b3lyp_6-31g(d).qchem.inp (generated)

072110932.b3lyp_6-31g(d).gjf (generated)

072110932.b3lyp_6-31g(d).firefly.inp (generated)

072110932.b3lyp_6-31g(d).smash.inp (generated)

072110932.b3lyp_6-31g(d).nwchem.inp (generated) 072110932.b3lyp_6-31g(d).log.xz 072110932.td-b3lyp_6-31g+(d).inp 072110932.td-b3lyp_6-31g+(d).log.xz

072110932.td-b3lyp_6-31+g(d).qchem.inp (generated)

072110932.td-b3lyp_6-31+g(d).gjf (generated)

072110932.td-b3lyp_6-31+g(d).firefly.inp (generated)

072110932.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072110932.mol 072110932.PUBCHEM 072110932.mol (via Jmol)
072110966.b3lyp_6-31g(d).inp

072110966.b3lyp_6-31g(d).qchem.inp (generated)

072110966.b3lyp_6-31g(d).gjf (generated)

072110966.b3lyp_6-31g(d).firefly.inp (generated)

072110966.b3lyp_6-31g(d).smash.inp (generated)

072110966.b3lyp_6-31g(d).nwchem.inp (generated) 072110966.b3lyp_6-31g(d).log.xz 072110966.td-b3lyp_6-31g+(d).inp 072110966.td-b3lyp_6-31g+(d).log.xz

072110966.td-b3lyp_6-31+g(d).qchem.inp (generated)

072110966.td-b3lyp_6-31+g(d).gjf (generated)

072110966.td-b3lyp_6-31+g(d).firefly.inp (generated)

072110966.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072110966.mol 072110966.PUBCHEM 072110966.mol (via Jmol)
072111003.b3lyp_6-31g(d).inp

072111003.b3lyp_6-31g(d).qchem.inp (generated)

072111003.b3lyp_6-31g(d).gjf (generated)

072111003.b3lyp_6-31g(d).firefly.inp (generated)

072111003.b3lyp_6-31g(d).smash.inp (generated)

072111003.b3lyp_6-31g(d).nwchem.inp (generated) 072111003.b3lyp_6-31g(d).log.xz 072111003.mol 072111003.PUBCHEM 072111003.mol (via Jmol)
072111004.b3lyp_6-31g(d).inp

072111004.b3lyp_6-31g(d).qchem.inp (generated)

072111004.b3lyp_6-31g(d).gjf (generated)

072111004.b3lyp_6-31g(d).firefly.inp (generated)

072111004.b3lyp_6-31g(d).smash.inp (generated)

072111004.b3lyp_6-31g(d).nwchem.inp (generated) 072111004.b3lyp_6-31g(d).log.xz 072111004.td-b3lyp_6-31g+(d).inp 072111004.td-b3lyp_6-31g+(d).log.xz

072111004.td-b3lyp_6-31+g(d).qchem.inp (generated)

072111004.td-b3lyp_6-31+g(d).gjf (generated)

072111004.td-b3lyp_6-31+g(d).firefly.inp (generated)

072111004.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072111004.mol 072111004.PUBCHEM 072111004.mol (via Jmol)
072111015.b3lyp_6-31g(d).inp

072111015.b3lyp_6-31g(d).qchem.inp (generated)

072111015.b3lyp_6-31g(d).gjf (generated)

072111015.b3lyp_6-31g(d).firefly.inp (generated)

072111015.b3lyp_6-31g(d).smash.inp (generated)

072111015.b3lyp_6-31g(d).nwchem.inp (generated) 072111015.b3lyp_6-31g(d).log.xz 072111015.td-b3lyp_6-31g+(d).inp 072111015.td-b3lyp_6-31g+(d).log.xz

072111015.td-b3lyp_6-31+g(d).qchem.inp (generated)

072111015.td-b3lyp_6-31+g(d).gjf (generated)

072111015.td-b3lyp_6-31+g(d).firefly.inp (generated)

072111015.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072111015.mol 072111015.PUBCHEM 072111015.mol (via Jmol)
072111054.b3lyp_6-31g(d).inp

072111054.b3lyp_6-31g(d).qchem.inp (generated)

072111054.b3lyp_6-31g(d).gjf (generated)

072111054.b3lyp_6-31g(d).firefly.inp (generated)

072111054.b3lyp_6-31g(d).smash.inp (generated)

072111054.b3lyp_6-31g(d).nwchem.inp (generated) 072111054.b3lyp_6-31g(d).log.xz 072111054.mol 072111054.PUBCHEM 072111054.mol (via Jmol)
072111183.b3lyp_6-31g(d).inp

072111183.b3lyp_6-31g(d).qchem.inp (generated)

072111183.b3lyp_6-31g(d).gjf (generated)

072111183.b3lyp_6-31g(d).firefly.inp (generated)

072111183.b3lyp_6-31g(d).smash.inp (generated)

072111183.b3lyp_6-31g(d).nwchem.inp (generated) 072111183.b3lyp_6-31g(d).log.xz 072111183.td-b3lyp_6-31g+(d).inp 072111183.td-b3lyp_6-31g+(d).log.xz

072111183.td-b3lyp_6-31+g(d).qchem.inp (generated)

072111183.td-b3lyp_6-31+g(d).gjf (generated)

072111183.td-b3lyp_6-31+g(d).firefly.inp (generated)

072111183.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072111183.mol 072111183.PUBCHEM 072111183.mol (via Jmol)
072111964.b3lyp_6-31g(d).inp

072111964.b3lyp_6-31g(d).qchem.inp (generated)

072111964.b3lyp_6-31g(d).gjf (generated)

072111964.b3lyp_6-31g(d).firefly.inp (generated)

072111964.b3lyp_6-31g(d).smash.inp (generated)

072111964.b3lyp_6-31g(d).nwchem.inp (generated) 072111964.b3lyp_6-31g(d).log.xz 072111964.td-b3lyp_6-31g+(d).inp 072111964.td-b3lyp_6-31g+(d).log.xz

072111964.td-b3lyp_6-31+g(d).qchem.inp (generated)

072111964.td-b3lyp_6-31+g(d).gjf (generated)

072111964.td-b3lyp_6-31+g(d).firefly.inp (generated)

072111964.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072111964.mol 072111964.PUBCHEM 072111964.mol (via Jmol)
072111974.b3lyp_6-31g(d).inp

072111974.b3lyp_6-31g(d).qchem.inp (generated)

072111974.b3lyp_6-31g(d).gjf (generated)

072111974.b3lyp_6-31g(d).firefly.inp (generated)

072111974.b3lyp_6-31g(d).smash.inp (generated)

072111974.b3lyp_6-31g(d).nwchem.inp (generated) 072111974.b3lyp_6-31g(d).log.xz 072111974.td-b3lyp_6-31g+(d).inp 072111974.td-b3lyp_6-31g+(d).log.xz

072111974.td-b3lyp_6-31+g(d).qchem.inp (generated)

072111974.td-b3lyp_6-31+g(d).gjf (generated)

072111974.td-b3lyp_6-31+g(d).firefly.inp (generated)

072111974.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072111974.mol 072111974.PUBCHEM 072111974.mol (via Jmol)
072111975.b3lyp_6-31g(d).inp

072111975.b3lyp_6-31g(d).qchem.inp (generated)

072111975.b3lyp_6-31g(d).gjf (generated)

072111975.b3lyp_6-31g(d).firefly.inp (generated)

072111975.b3lyp_6-31g(d).smash.inp (generated)

072111975.b3lyp_6-31g(d).nwchem.inp (generated) 072111975.b3lyp_6-31g(d).log.xz 072111975.td-b3lyp_6-31g+(d).inp 072111975.td-b3lyp_6-31g+(d).log.xz

072111975.td-b3lyp_6-31+g(d).qchem.inp (generated)

072111975.td-b3lyp_6-31+g(d).gjf (generated)

072111975.td-b3lyp_6-31+g(d).firefly.inp (generated)

072111975.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072111975.mol 072111975.PUBCHEM 072111975.mol (via Jmol)
072112164.b3lyp_6-31g(d).inp

072112164.b3lyp_6-31g(d).qchem.inp (generated)

072112164.b3lyp_6-31g(d).gjf (generated)

072112164.b3lyp_6-31g(d).firefly.inp (generated)

072112164.b3lyp_6-31g(d).smash.inp (generated)

072112164.b3lyp_6-31g(d).nwchem.inp (generated) 072112164.b3lyp_6-31g(d).log.xz 072112164.td-b3lyp_6-31g+(d).inp 072112164.td-b3lyp_6-31g+(d).log.xz

072112164.td-b3lyp_6-31+g(d).qchem.inp (generated)

072112164.td-b3lyp_6-31+g(d).gjf (generated)

072112164.td-b3lyp_6-31+g(d).firefly.inp (generated)

072112164.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072112164.mol 072112164.PUBCHEM 072112164.mol (via Jmol)
072112184.b3lyp_6-31g(d).inp

072112184.b3lyp_6-31g(d).qchem.inp (generated)

072112184.b3lyp_6-31g(d).gjf (generated)

072112184.b3lyp_6-31g(d).firefly.inp (generated)

072112184.b3lyp_6-31g(d).smash.inp (generated)

072112184.b3lyp_6-31g(d).nwchem.inp (generated) 072112184.b3lyp_6-31g(d).log.xz 072112184.mol 072112184.PUBCHEM 072112184.mol (via Jmol)
072112185.b3lyp_6-31g(d).inp

072112185.b3lyp_6-31g(d).qchem.inp (generated)

072112185.b3lyp_6-31g(d).gjf (generated)

072112185.b3lyp_6-31g(d).firefly.inp (generated)

072112185.b3lyp_6-31g(d).smash.inp (generated)

072112185.b3lyp_6-31g(d).nwchem.inp (generated) 072112185.b3lyp_6-31g(d).log.xz 072112185.mol 072112185.PUBCHEM 072112185.mol (via Jmol)
072112228.b3lyp_6-31g(d).inp

072112228.b3lyp_6-31g(d).qchem.inp (generated)

072112228.b3lyp_6-31g(d).gjf (generated)

072112228.b3lyp_6-31g(d).firefly.inp (generated)

072112228.b3lyp_6-31g(d).smash.inp (generated)

072112228.b3lyp_6-31g(d).nwchem.inp (generated) 072112228.b3lyp_6-31g(d).log.xz 072112228.mol 072112228.PUBCHEM 072112228.mol (via Jmol)
072112356.b3lyp_6-31g(d).inp

072112356.b3lyp_6-31g(d).qchem.inp (generated)

072112356.b3lyp_6-31g(d).gjf (generated)

072112356.b3lyp_6-31g(d).firefly.inp (generated)

072112356.b3lyp_6-31g(d).smash.inp (generated)

072112356.b3lyp_6-31g(d).nwchem.inp (generated) 072112356.b3lyp_6-31g(d).log.xz 072112356.td-b3lyp_6-31g+(d).inp 072112356.td-b3lyp_6-31g+(d).log.xz

072112356.td-b3lyp_6-31+g(d).qchem.inp (generated)

072112356.td-b3lyp_6-31+g(d).gjf (generated)

072112356.td-b3lyp_6-31+g(d).firefly.inp (generated)

072112356.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072112356.mol 072112356.PUBCHEM 072112356.mol (via Jmol)
072112486.b3lyp_6-31g(d).inp

072112486.b3lyp_6-31g(d).qchem.inp (generated)

072112486.b3lyp_6-31g(d).gjf (generated)

072112486.b3lyp_6-31g(d).firefly.inp (generated)

072112486.b3lyp_6-31g(d).smash.inp (generated)

072112486.b3lyp_6-31g(d).nwchem.inp (generated) 072112486.b3lyp_6-31g(d).log.xz 072112486.td-b3lyp_6-31g+(d).inp 072112486.td-b3lyp_6-31g+(d).log.xz

072112486.td-b3lyp_6-31+g(d).qchem.inp (generated)

072112486.td-b3lyp_6-31+g(d).gjf (generated)

072112486.td-b3lyp_6-31+g(d).firefly.inp (generated)

072112486.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072112486.mol 072112486.PUBCHEM 072112486.mol (via Jmol)
072112489.b3lyp_6-31g(d).inp

072112489.b3lyp_6-31g(d).qchem.inp (generated)

072112489.b3lyp_6-31g(d).gjf (generated)

072112489.b3lyp_6-31g(d).firefly.inp (generated)

072112489.b3lyp_6-31g(d).smash.inp (generated)

072112489.b3lyp_6-31g(d).nwchem.inp (generated) 072112489.b3lyp_6-31g(d).log.xz 072112489.td-b3lyp_6-31g+(d).inp 072112489.td-b3lyp_6-31g+(d).log.xz

072112489.td-b3lyp_6-31+g(d).qchem.inp (generated)

072112489.td-b3lyp_6-31+g(d).gjf (generated)

072112489.td-b3lyp_6-31+g(d).firefly.inp (generated)

072112489.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072112489.mol 072112489.PUBCHEM 072112489.mol (via Jmol)
072112531.b3lyp_6-31g(d).inp

072112531.b3lyp_6-31g(d).qchem.inp (generated)

072112531.b3lyp_6-31g(d).gjf (generated)

072112531.b3lyp_6-31g(d).firefly.inp (generated)

072112531.b3lyp_6-31g(d).smash.inp (generated)

072112531.b3lyp_6-31g(d).nwchem.inp (generated) 072112531.b3lyp_6-31g(d).log.xz 072112531.td-b3lyp_6-31g+(d).inp 072112531.td-b3lyp_6-31g+(d).log.xz

072112531.td-b3lyp_6-31+g(d).qchem.inp (generated)

072112531.td-b3lyp_6-31+g(d).gjf (generated)

072112531.td-b3lyp_6-31+g(d).firefly.inp (generated)

072112531.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072112531.mol 072112531.PUBCHEM 072112531.mol (via Jmol)
072112532.b3lyp_6-31g(d).inp

072112532.b3lyp_6-31g(d).qchem.inp (generated)

072112532.b3lyp_6-31g(d).gjf (generated)

072112532.b3lyp_6-31g(d).firefly.inp (generated)

072112532.b3lyp_6-31g(d).smash.inp (generated)

072112532.b3lyp_6-31g(d).nwchem.inp (generated) 072112532.b3lyp_6-31g(d).log.xz 072112532.td-b3lyp_6-31g+(d).inp 072112532.td-b3lyp_6-31g+(d).log.xz

072112532.td-b3lyp_6-31+g(d).qchem.inp (generated)

072112532.td-b3lyp_6-31+g(d).gjf (generated)

072112532.td-b3lyp_6-31+g(d).firefly.inp (generated)

072112532.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072112532.mol 072112532.PUBCHEM 072112532.mol (via Jmol)
072112567.b3lyp_6-31g(d).inp

072112567.b3lyp_6-31g(d).qchem.inp (generated)

072112567.b3lyp_6-31g(d).gjf (generated)

072112567.b3lyp_6-31g(d).firefly.inp (generated)

072112567.b3lyp_6-31g(d).smash.inp (generated)

072112567.b3lyp_6-31g(d).nwchem.inp (generated) 072112567.b3lyp_6-31g(d).log.xz 072112567.td-b3lyp_6-31g+(d).inp 072112567.td-b3lyp_6-31g+(d).log.xz

072112567.td-b3lyp_6-31+g(d).qchem.inp (generated)

072112567.td-b3lyp_6-31+g(d).gjf (generated)

072112567.td-b3lyp_6-31+g(d).firefly.inp (generated)

072112567.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072112567.mol 072112567.PUBCHEM 072112567.mol (via Jmol)
072112783.b3lyp_6-31g(d).inp

072112783.b3lyp_6-31g(d).qchem.inp (generated)

072112783.b3lyp_6-31g(d).gjf (generated)

072112783.b3lyp_6-31g(d).firefly.inp (generated)

072112783.b3lyp_6-31g(d).smash.inp (generated)

072112783.b3lyp_6-31g(d).nwchem.inp (generated) 072112783.b3lyp_6-31g(d).log.xz 072112783.mol 072112783.PUBCHEM 072112783.mol (via Jmol)
072112993.b3lyp_6-31g(d).inp

072112993.b3lyp_6-31g(d).qchem.inp (generated)

072112993.b3lyp_6-31g(d).gjf (generated)

072112993.b3lyp_6-31g(d).firefly.inp (generated)

072112993.b3lyp_6-31g(d).smash.inp (generated)

072112993.b3lyp_6-31g(d).nwchem.inp (generated) 072112993.b3lyp_6-31g(d).log.xz 072112993.td-b3lyp_6-31g+(d).inp 072112993.td-b3lyp_6-31g+(d).log.xz

072112993.td-b3lyp_6-31+g(d).qchem.inp (generated)

072112993.td-b3lyp_6-31+g(d).gjf (generated)

072112993.td-b3lyp_6-31+g(d).firefly.inp (generated)

072112993.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072112993.mol 072112993.PUBCHEM 072112993.mol (via Jmol)
072113114.b3lyp_6-31g(d).inp

072113114.b3lyp_6-31g(d).qchem.inp (generated)

072113114.b3lyp_6-31g(d).gjf (generated)

072113114.b3lyp_6-31g(d).firefly.inp (generated)

072113114.b3lyp_6-31g(d).smash.inp (generated)

072113114.b3lyp_6-31g(d).nwchem.inp (generated) 072113114.b3lyp_6-31g(d).log.xz 072113114.td-b3lyp_6-31g+(d).inp 072113114.td-b3lyp_6-31g+(d).log.xz

072113114.td-b3lyp_6-31+g(d).qchem.inp (generated)

072113114.td-b3lyp_6-31+g(d).gjf (generated)

072113114.td-b3lyp_6-31+g(d).firefly.inp (generated)

072113114.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072113114.mol 072113114.PUBCHEM 072113114.mol (via Jmol)
072113346.b3lyp_6-31g(d).inp

072113346.b3lyp_6-31g(d).qchem.inp (generated)

072113346.b3lyp_6-31g(d).gjf (generated)

072113346.b3lyp_6-31g(d).firefly.inp (generated)

072113346.b3lyp_6-31g(d).smash.inp (generated)

072113346.b3lyp_6-31g(d).nwchem.inp (generated) 072113346.b3lyp_6-31g(d).log.xz 072113346.td-b3lyp_6-31g+(d).inp 072113346.td-b3lyp_6-31g+(d).log.xz

072113346.td-b3lyp_6-31+g(d).qchem.inp (generated)

072113346.td-b3lyp_6-31+g(d).gjf (generated)

072113346.td-b3lyp_6-31+g(d).firefly.inp (generated)

072113346.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072113346.mol 072113346.PUBCHEM 072113346.mol (via Jmol)
072113778.b3lyp_6-31g(d).inp

072113778.b3lyp_6-31g(d).qchem.inp (generated)

072113778.b3lyp_6-31g(d).gjf (generated)

072113778.b3lyp_6-31g(d).firefly.inp (generated)

072113778.b3lyp_6-31g(d).smash.inp (generated)

072113778.b3lyp_6-31g(d).nwchem.inp (generated) 072113778.b3lyp_6-31g(d).log.xz 072113778.mol 072113778.PUBCHEM 072113778.mol (via Jmol)
072113835.b3lyp_6-31g(d).inp

072113835.b3lyp_6-31g(d).qchem.inp (generated)

072113835.b3lyp_6-31g(d).gjf (generated)

072113835.b3lyp_6-31g(d).firefly.inp (generated)

072113835.b3lyp_6-31g(d).smash.inp (generated)

072113835.b3lyp_6-31g(d).nwchem.inp (generated) 072113835.b3lyp_6-31g(d).log.xz 072113835.td-b3lyp_6-31g+(d).inp 072113835.td-b3lyp_6-31g+(d).log.xz

072113835.td-b3lyp_6-31+g(d).qchem.inp (generated)

072113835.td-b3lyp_6-31+g(d).gjf (generated)

072113835.td-b3lyp_6-31+g(d).firefly.inp (generated)

072113835.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072113835.mol 072113835.PUBCHEM 072113835.mol (via Jmol)
072113957.b3lyp_6-31g(d).inp

072113957.b3lyp_6-31g(d).qchem.inp (generated)

072113957.b3lyp_6-31g(d).gjf (generated)

072113957.b3lyp_6-31g(d).firefly.inp (generated)

072113957.b3lyp_6-31g(d).smash.inp (generated)

072113957.b3lyp_6-31g(d).nwchem.inp (generated) 072113957.b3lyp_6-31g(d).log.xz 072113957.td-b3lyp_6-31g+(d).inp 072113957.td-b3lyp_6-31g+(d).log.xz

072113957.td-b3lyp_6-31+g(d).qchem.inp (generated)

072113957.td-b3lyp_6-31+g(d).gjf (generated)

072113957.td-b3lyp_6-31+g(d).firefly.inp (generated)

072113957.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072113957.mol 072113957.PUBCHEM 072113957.mol (via Jmol)
072114163.b3lyp_6-31g(d).inp

072114163.b3lyp_6-31g(d).qchem.inp (generated)

072114163.b3lyp_6-31g(d).gjf (generated)

072114163.b3lyp_6-31g(d).firefly.inp (generated)

072114163.b3lyp_6-31g(d).smash.inp (generated)

072114163.b3lyp_6-31g(d).nwchem.inp (generated) 072114163.b3lyp_6-31g(d).log.xz 072114163.td-b3lyp_6-31g+(d).inp 072114163.td-b3lyp_6-31g+(d).log.xz

072114163.td-b3lyp_6-31+g(d).qchem.inp (generated)

072114163.td-b3lyp_6-31+g(d).gjf (generated)

072114163.td-b3lyp_6-31+g(d).firefly.inp (generated)

072114163.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072114163.mol 072114163.PUBCHEM 072114163.mol (via Jmol)
072114166.b3lyp_6-31g(d).inp

072114166.b3lyp_6-31g(d).qchem.inp (generated)

072114166.b3lyp_6-31g(d).gjf (generated)

072114166.b3lyp_6-31g(d).firefly.inp (generated)

072114166.b3lyp_6-31g(d).smash.inp (generated)

072114166.b3lyp_6-31g(d).nwchem.inp (generated) 072114166.b3lyp_6-31g(d).log.xz 072114166.td-b3lyp_6-31g+(d).inp 072114166.td-b3lyp_6-31g+(d).log.xz

072114166.td-b3lyp_6-31+g(d).qchem.inp (generated)

072114166.td-b3lyp_6-31+g(d).gjf (generated)

072114166.td-b3lyp_6-31+g(d).firefly.inp (generated)

072114166.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072114166.mol 072114166.PUBCHEM 072114166.mol (via Jmol)
072114193.b3lyp_6-31g(d).inp

072114193.b3lyp_6-31g(d).qchem.inp (generated)

072114193.b3lyp_6-31g(d).gjf (generated)

072114193.b3lyp_6-31g(d).firefly.inp (generated)

072114193.b3lyp_6-31g(d).smash.inp (generated)

072114193.b3lyp_6-31g(d).nwchem.inp (generated) 072114193.b3lyp_6-31g(d).log.xz 072114193.mol 072114193.PUBCHEM 072114193.mol (via Jmol)
072114209.b3lyp_6-31g(d).inp

072114209.b3lyp_6-31g(d).qchem.inp (generated)

072114209.b3lyp_6-31g(d).gjf (generated)

072114209.b3lyp_6-31g(d).firefly.inp (generated)

072114209.b3lyp_6-31g(d).smash.inp (generated)

072114209.b3lyp_6-31g(d).nwchem.inp (generated) 072114209.b3lyp_6-31g(d).log.xz 072114209.td-b3lyp_6-31g+(d).inp 072114209.td-b3lyp_6-31g+(d).log.xz

072114209.td-b3lyp_6-31+g(d).qchem.inp (generated)

072114209.td-b3lyp_6-31+g(d).gjf (generated)

072114209.td-b3lyp_6-31+g(d).firefly.inp (generated)

072114209.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072114209.mol 072114209.PUBCHEM 072114209.mol (via Jmol)
072114249.b3lyp_6-31g(d).inp

072114249.b3lyp_6-31g(d).qchem.inp (generated)

072114249.b3lyp_6-31g(d).gjf (generated)

072114249.b3lyp_6-31g(d).firefly.inp (generated)

072114249.b3lyp_6-31g(d).smash.inp (generated)

072114249.b3lyp_6-31g(d).nwchem.inp (generated) 072114249.b3lyp_6-31g(d).log.xz 072114249.td-b3lyp_6-31g+(d).inp 072114249.td-b3lyp_6-31g+(d).log.xz

072114249.td-b3lyp_6-31+g(d).qchem.inp (generated)

072114249.td-b3lyp_6-31+g(d).gjf (generated)

072114249.td-b3lyp_6-31+g(d).firefly.inp (generated)

072114249.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072114249.mol 072114249.PUBCHEM 072114249.mol (via Jmol)
072114284.b3lyp_6-31g(d).inp

072114284.b3lyp_6-31g(d).qchem.inp (generated)

072114284.b3lyp_6-31g(d).gjf (generated)

072114284.b3lyp_6-31g(d).firefly.inp (generated)

072114284.b3lyp_6-31g(d).smash.inp (generated)

072114284.b3lyp_6-31g(d).nwchem.inp (generated) 072114284.b3lyp_6-31g(d).log.xz 072114284.mol 072114284.PUBCHEM 072114284.mol (via Jmol)
072114311.b3lyp_6-31g(d).inp

072114311.b3lyp_6-31g(d).qchem.inp (generated)

072114311.b3lyp_6-31g(d).gjf (generated)

072114311.b3lyp_6-31g(d).firefly.inp (generated)

072114311.b3lyp_6-31g(d).smash.inp (generated)

072114311.b3lyp_6-31g(d).nwchem.inp (generated) 072114311.b3lyp_6-31g(d).log.xz 072114311.td-b3lyp_6-31g+(d).inp 072114311.td-b3lyp_6-31g+(d).log.xz

072114311.td-b3lyp_6-31+g(d).qchem.inp (generated)

072114311.td-b3lyp_6-31+g(d).gjf (generated)

072114311.td-b3lyp_6-31+g(d).firefly.inp (generated)

072114311.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072114311.mol 072114311.PUBCHEM 072114311.mol (via Jmol)
072114319.b3lyp_6-31g(d).inp

072114319.b3lyp_6-31g(d).qchem.inp (generated)

072114319.b3lyp_6-31g(d).gjf (generated)

072114319.b3lyp_6-31g(d).firefly.inp (generated)

072114319.b3lyp_6-31g(d).smash.inp (generated)

072114319.b3lyp_6-31g(d).nwchem.inp (generated) 072114319.b3lyp_6-31g(d).log.xz 072114319.td-b3lyp_6-31g+(d).inp 072114319.td-b3lyp_6-31g+(d).log.xz

072114319.td-b3lyp_6-31+g(d).qchem.inp (generated)

072114319.td-b3lyp_6-31+g(d).gjf (generated)

072114319.td-b3lyp_6-31+g(d).firefly.inp (generated)

072114319.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072114319.mol 072114319.PUBCHEM 072114319.mol (via Jmol)
072114351.b3lyp_6-31g(d).inp

072114351.b3lyp_6-31g(d).qchem.inp (generated)

072114351.b3lyp_6-31g(d).gjf (generated)

072114351.b3lyp_6-31g(d).firefly.inp (generated)

072114351.b3lyp_6-31g(d).smash.inp (generated)

072114351.b3lyp_6-31g(d).nwchem.inp (generated) 072114351.b3lyp_6-31g(d).log.xz 072114351.td-b3lyp_6-31g+(d).inp 072114351.td-b3lyp_6-31g+(d).log.xz

072114351.td-b3lyp_6-31+g(d).qchem.inp (generated)

072114351.td-b3lyp_6-31+g(d).gjf (generated)

072114351.td-b3lyp_6-31+g(d).firefly.inp (generated)

072114351.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072114351.mol 072114351.PUBCHEM 072114351.mol (via Jmol)
072114753.b3lyp_6-31g(d).inp

072114753.b3lyp_6-31g(d).qchem.inp (generated)

072114753.b3lyp_6-31g(d).gjf (generated)

072114753.b3lyp_6-31g(d).firefly.inp (generated)

072114753.b3lyp_6-31g(d).smash.inp (generated)

072114753.b3lyp_6-31g(d).nwchem.inp (generated) 072114753.b3lyp_6-31g(d).log.xz 072114753.td-b3lyp_6-31g+(d).inp 072114753.td-b3lyp_6-31g+(d).log.xz

072114753.td-b3lyp_6-31+g(d).qchem.inp (generated)

072114753.td-b3lyp_6-31+g(d).gjf (generated)

072114753.td-b3lyp_6-31+g(d).firefly.inp (generated)

072114753.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072114753.mol 072114753.PUBCHEM 072114753.mol (via Jmol)
072114855.b3lyp_6-31g(d).inp

072114855.b3lyp_6-31g(d).qchem.inp (generated)

072114855.b3lyp_6-31g(d).gjf (generated)

072114855.b3lyp_6-31g(d).firefly.inp (generated)

072114855.b3lyp_6-31g(d).smash.inp (generated)

072114855.b3lyp_6-31g(d).nwchem.inp (generated) 072114855.b3lyp_6-31g(d).log.xz 072114855.td-b3lyp_6-31g+(d).inp 072114855.td-b3lyp_6-31g+(d).log.xz

072114855.td-b3lyp_6-31+g(d).qchem.inp (generated)

072114855.td-b3lyp_6-31+g(d).gjf (generated)

072114855.td-b3lyp_6-31+g(d).firefly.inp (generated)

072114855.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072114855.mol 072114855.PUBCHEM 072114855.mol (via Jmol)
072114898.b3lyp_6-31g(d).inp

072114898.b3lyp_6-31g(d).qchem.inp (generated)

072114898.b3lyp_6-31g(d).gjf (generated)

072114898.b3lyp_6-31g(d).firefly.inp (generated)

072114898.b3lyp_6-31g(d).smash.inp (generated)

072114898.b3lyp_6-31g(d).nwchem.inp (generated) 072114898.b3lyp_6-31g(d).log.xz 072114898.mol 072114898.PUBCHEM 072114898.mol (via Jmol)
072115003.b3lyp_6-31g(d).inp

072115003.b3lyp_6-31g(d).qchem.inp (generated)

072115003.b3lyp_6-31g(d).gjf (generated)

072115003.b3lyp_6-31g(d).firefly.inp (generated)

072115003.b3lyp_6-31g(d).smash.inp (generated)

072115003.b3lyp_6-31g(d).nwchem.inp (generated) 072115003.b3lyp_6-31g(d).log.xz 072115003.td-b3lyp_6-31g+(d).inp 072115003.td-b3lyp_6-31g+(d).log.xz

072115003.td-b3lyp_6-31+g(d).qchem.inp (generated)

072115003.td-b3lyp_6-31+g(d).gjf (generated)

072115003.td-b3lyp_6-31+g(d).firefly.inp (generated)

072115003.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072115003.mol 072115003.PUBCHEM 072115003.mol (via Jmol)
072115012.b3lyp_6-31g(d).inp

072115012.b3lyp_6-31g(d).qchem.inp (generated)

072115012.b3lyp_6-31g(d).gjf (generated)

072115012.b3lyp_6-31g(d).firefly.inp (generated)

072115012.b3lyp_6-31g(d).smash.inp (generated)

072115012.b3lyp_6-31g(d).nwchem.inp (generated) 072115012.b3lyp_6-31g(d).log.xz 072115012.td-b3lyp_6-31g+(d).inp 072115012.td-b3lyp_6-31g+(d).log.xz

072115012.td-b3lyp_6-31+g(d).qchem.inp (generated)

072115012.td-b3lyp_6-31+g(d).gjf (generated)

072115012.td-b3lyp_6-31+g(d).firefly.inp (generated)

072115012.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072115012.mol 072115012.PUBCHEM 072115012.mol (via Jmol)
072115026.b3lyp_6-31g(d).inp

072115026.b3lyp_6-31g(d).qchem.inp (generated)

072115026.b3lyp_6-31g(d).gjf (generated)

072115026.b3lyp_6-31g(d).firefly.inp (generated)

072115026.b3lyp_6-31g(d).smash.inp (generated)

072115026.b3lyp_6-31g(d).nwchem.inp (generated) 072115026.b3lyp_6-31g(d).log.xz 072115026.td-b3lyp_6-31g+(d).inp 072115026.td-b3lyp_6-31g+(d).log.xz

072115026.td-b3lyp_6-31+g(d).qchem.inp (generated)

072115026.td-b3lyp_6-31+g(d).gjf (generated)

072115026.td-b3lyp_6-31+g(d).firefly.inp (generated)

072115026.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072115026.mol 072115026.PUBCHEM 072115026.mol (via Jmol)
072115027.b3lyp_6-31g(d).inp

072115027.b3lyp_6-31g(d).qchem.inp (generated)

072115027.b3lyp_6-31g(d).gjf (generated)

072115027.b3lyp_6-31g(d).firefly.inp (generated)

072115027.b3lyp_6-31g(d).smash.inp (generated)

072115027.b3lyp_6-31g(d).nwchem.inp (generated) 072115027.b3lyp_6-31g(d).log.xz 072115027.td-b3lyp_6-31g+(d).inp 072115027.td-b3lyp_6-31g+(d).log.xz

072115027.td-b3lyp_6-31+g(d).qchem.inp (generated)

072115027.td-b3lyp_6-31+g(d).gjf (generated)

072115027.td-b3lyp_6-31+g(d).firefly.inp (generated)

072115027.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072115027.mol 072115027.PUBCHEM 072115027.mol (via Jmol)
072115031.b3lyp_6-31g(d).inp

072115031.b3lyp_6-31g(d).qchem.inp (generated)

072115031.b3lyp_6-31g(d).gjf (generated)

072115031.b3lyp_6-31g(d).firefly.inp (generated)

072115031.b3lyp_6-31g(d).smash.inp (generated)

072115031.b3lyp_6-31g(d).nwchem.inp (generated) 072115031.b3lyp_6-31g(d).log.xz 072115031.td-b3lyp_6-31g+(d).inp 072115031.td-b3lyp_6-31g+(d).log.xz

072115031.td-b3lyp_6-31+g(d).qchem.inp (generated)

072115031.td-b3lyp_6-31+g(d).gjf (generated)

072115031.td-b3lyp_6-31+g(d).firefly.inp (generated)

072115031.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072115031.mol 072115031.PUBCHEM 072115031.mol (via Jmol)
072115039.b3lyp_6-31g(d).inp

072115039.b3lyp_6-31g(d).qchem.inp (generated)

072115039.b3lyp_6-31g(d).gjf (generated)

072115039.b3lyp_6-31g(d).firefly.inp (generated)

072115039.b3lyp_6-31g(d).smash.inp (generated)

072115039.b3lyp_6-31g(d).nwchem.inp (generated) 072115039.b3lyp_6-31g(d).log.xz 072115039.td-b3lyp_6-31g+(d).inp 072115039.td-b3lyp_6-31g+(d).log.xz

072115039.td-b3lyp_6-31+g(d).qchem.inp (generated)

072115039.td-b3lyp_6-31+g(d).gjf (generated)

072115039.td-b3lyp_6-31+g(d).firefly.inp (generated)

072115039.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072115039.mol 072115039.PUBCHEM 072115039.mol (via Jmol)
072115072.b3lyp_6-31g(d).inp

072115072.b3lyp_6-31g(d).qchem.inp (generated)

072115072.b3lyp_6-31g(d).gjf (generated)

072115072.b3lyp_6-31g(d).firefly.inp (generated)

072115072.b3lyp_6-31g(d).smash.inp (generated)

072115072.b3lyp_6-31g(d).nwchem.inp (generated) 072115072.b3lyp_6-31g(d).log.xz 072115072.mol 072115072.PUBCHEM 072115072.mol (via Jmol)
072115093.b3lyp_6-31g(d).inp

072115093.b3lyp_6-31g(d).qchem.inp (generated)

072115093.b3lyp_6-31g(d).gjf (generated)

072115093.b3lyp_6-31g(d).firefly.inp (generated)

072115093.b3lyp_6-31g(d).smash.inp (generated)

072115093.b3lyp_6-31g(d).nwchem.inp (generated) 072115093.b3lyp_6-31g(d).log.xz 072115093.td-b3lyp_6-31g+(d).inp 072115093.td-b3lyp_6-31g+(d).log.xz

072115093.td-b3lyp_6-31+g(d).qchem.inp (generated)

072115093.td-b3lyp_6-31+g(d).gjf (generated)

072115093.td-b3lyp_6-31+g(d).firefly.inp (generated)

072115093.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072115093.mol 072115093.PUBCHEM 072115093.mol (via Jmol)
072115097.b3lyp_6-31g(d).inp

072115097.b3lyp_6-31g(d).qchem.inp (generated)

072115097.b3lyp_6-31g(d).gjf (generated)

072115097.b3lyp_6-31g(d).firefly.inp (generated)

072115097.b3lyp_6-31g(d).smash.inp (generated)

072115097.b3lyp_6-31g(d).nwchem.inp (generated) 072115097.b3lyp_6-31g(d).log.xz 072115097.td-b3lyp_6-31g+(d).inp 072115097.td-b3lyp_6-31g+(d).log.xz

072115097.td-b3lyp_6-31+g(d).qchem.inp (generated)

072115097.td-b3lyp_6-31+g(d).gjf (generated)

072115097.td-b3lyp_6-31+g(d).firefly.inp (generated)

072115097.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072115097.mol 072115097.PUBCHEM 072115097.mol (via Jmol)
072115115.b3lyp_6-31g(d).inp

072115115.b3lyp_6-31g(d).qchem.inp (generated)

072115115.b3lyp_6-31g(d).gjf (generated)

072115115.b3lyp_6-31g(d).firefly.inp (generated)

072115115.b3lyp_6-31g(d).smash.inp (generated)

072115115.b3lyp_6-31g(d).nwchem.inp (generated) 072115115.b3lyp_6-31g(d).log.xz 072115115.td-b3lyp_6-31g+(d).inp 072115115.td-b3lyp_6-31g+(d).log.xz

072115115.td-b3lyp_6-31+g(d).qchem.inp (generated)

072115115.td-b3lyp_6-31+g(d).gjf (generated)

072115115.td-b3lyp_6-31+g(d).firefly.inp (generated)

072115115.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072115115.mol 072115115.PUBCHEM 072115115.mol (via Jmol)
072115120.b3lyp_6-31g(d).inp

072115120.b3lyp_6-31g(d).qchem.inp (generated)

072115120.b3lyp_6-31g(d).gjf (generated)

072115120.b3lyp_6-31g(d).firefly.inp (generated)

072115120.b3lyp_6-31g(d).smash.inp (generated)

072115120.b3lyp_6-31g(d).nwchem.inp (generated) 072115120.b3lyp_6-31g(d).log.xz 072115120.td-b3lyp_6-31g+(d).inp 072115120.td-b3lyp_6-31g+(d).log.xz

072115120.td-b3lyp_6-31+g(d).qchem.inp (generated)

072115120.td-b3lyp_6-31+g(d).gjf (generated)

072115120.td-b3lyp_6-31+g(d).firefly.inp (generated)

072115120.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072115120.mol 072115120.PUBCHEM 072115120.mol (via Jmol)
072115122.b3lyp_6-31g(d).inp

072115122.b3lyp_6-31g(d).qchem.inp (generated)

072115122.b3lyp_6-31g(d).gjf (generated)

072115122.b3lyp_6-31g(d).firefly.inp (generated)

072115122.b3lyp_6-31g(d).smash.inp (generated)

072115122.b3lyp_6-31g(d).nwchem.inp (generated) 072115122.b3lyp_6-31g(d).log.xz 072115122.mol 072115122.PUBCHEM 072115122.mol (via Jmol)
072115126.b3lyp_6-31g(d).inp

072115126.b3lyp_6-31g(d).qchem.inp (generated)

072115126.b3lyp_6-31g(d).gjf (generated)

072115126.b3lyp_6-31g(d).firefly.inp (generated)

072115126.b3lyp_6-31g(d).smash.inp (generated)

072115126.b3lyp_6-31g(d).nwchem.inp (generated) 072115126.b3lyp_6-31g(d).log.xz 072115126.mol 072115126.PUBCHEM 072115126.mol (via Jmol)
072115208.b3lyp_6-31g(d).inp

072115208.b3lyp_6-31g(d).qchem.inp (generated)

072115208.b3lyp_6-31g(d).gjf (generated)

072115208.b3lyp_6-31g(d).firefly.inp (generated)

072115208.b3lyp_6-31g(d).smash.inp (generated)

072115208.b3lyp_6-31g(d).nwchem.inp (generated) 072115208.b3lyp_6-31g(d).log.xz 072115208.td-b3lyp_6-31g+(d).inp 072115208.td-b3lyp_6-31g+(d).log.xz

072115208.td-b3lyp_6-31+g(d).qchem.inp (generated)

072115208.td-b3lyp_6-31+g(d).gjf (generated)

072115208.td-b3lyp_6-31+g(d).firefly.inp (generated)

072115208.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072115208.mol 072115208.PUBCHEM 072115208.mol (via Jmol)
072115243.b3lyp_6-31g(d).inp

072115243.b3lyp_6-31g(d).qchem.inp (generated)

072115243.b3lyp_6-31g(d).gjf (generated)

072115243.b3lyp_6-31g(d).firefly.inp (generated)

072115243.b3lyp_6-31g(d).smash.inp (generated)

072115243.b3lyp_6-31g(d).nwchem.inp (generated) 072115243.b3lyp_6-31g(d).log.xz 072115243.td-b3lyp_6-31g+(d).inp 072115243.td-b3lyp_6-31g+(d).log.xz

072115243.td-b3lyp_6-31+g(d).qchem.inp (generated)

072115243.td-b3lyp_6-31+g(d).gjf (generated)

072115243.td-b3lyp_6-31+g(d).firefly.inp (generated)

072115243.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072115243.mol 072115243.PUBCHEM 072115243.mol (via Jmol)
072115245.b3lyp_6-31g(d).inp

072115245.b3lyp_6-31g(d).qchem.inp (generated)

072115245.b3lyp_6-31g(d).gjf (generated)

072115245.b3lyp_6-31g(d).firefly.inp (generated)

072115245.b3lyp_6-31g(d).smash.inp (generated)

072115245.b3lyp_6-31g(d).nwchem.inp (generated) 072115245.b3lyp_6-31g(d).log.xz 072115245.mol 072115245.PUBCHEM 072115245.mol (via Jmol)
072115318.b3lyp_6-31g(d).inp

072115318.b3lyp_6-31g(d).qchem.inp (generated)

072115318.b3lyp_6-31g(d).gjf (generated)

072115318.b3lyp_6-31g(d).firefly.inp (generated)

072115318.b3lyp_6-31g(d).smash.inp (generated)

072115318.b3lyp_6-31g(d).nwchem.inp (generated) 072115318.b3lyp_6-31g(d).log.xz 072115318.td-b3lyp_6-31g+(d).inp 072115318.td-b3lyp_6-31g+(d).log.xz

072115318.td-b3lyp_6-31+g(d).qchem.inp (generated)

072115318.td-b3lyp_6-31+g(d).gjf (generated)

072115318.td-b3lyp_6-31+g(d).firefly.inp (generated)

072115318.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072115318.mol 072115318.PUBCHEM 072115318.mol (via Jmol)
072115437.b3lyp_6-31g(d).inp

072115437.b3lyp_6-31g(d).qchem.inp (generated)

072115437.b3lyp_6-31g(d).gjf (generated)

072115437.b3lyp_6-31g(d).firefly.inp (generated)

072115437.b3lyp_6-31g(d).smash.inp (generated)

072115437.b3lyp_6-31g(d).nwchem.inp (generated) 072115437.b3lyp_6-31g(d).log.xz 072115437.td-b3lyp_6-31g+(d).inp 072115437.td-b3lyp_6-31g+(d).log.xz

072115437.td-b3lyp_6-31+g(d).qchem.inp (generated)

072115437.td-b3lyp_6-31+g(d).gjf (generated)

072115437.td-b3lyp_6-31+g(d).firefly.inp (generated)

072115437.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072115437.mol 072115437.PUBCHEM 072115437.mol (via Jmol)
072115473.b3lyp_6-31g(d).inp

072115473.b3lyp_6-31g(d).qchem.inp (generated)

072115473.b3lyp_6-31g(d).gjf (generated)

072115473.b3lyp_6-31g(d).firefly.inp (generated)

072115473.b3lyp_6-31g(d).smash.inp (generated)

072115473.b3lyp_6-31g(d).nwchem.inp (generated) 072115473.b3lyp_6-31g(d).log.xz 072115473.td-b3lyp_6-31g+(d).inp 072115473.td-b3lyp_6-31g+(d).log.xz

072115473.td-b3lyp_6-31+g(d).qchem.inp (generated)

072115473.td-b3lyp_6-31+g(d).gjf (generated)

072115473.td-b3lyp_6-31+g(d).firefly.inp (generated)

072115473.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072115473.mol 072115473.PUBCHEM 072115473.mol (via Jmol)
072115493.b3lyp_6-31g(d).inp

072115493.b3lyp_6-31g(d).qchem.inp (generated)

072115493.b3lyp_6-31g(d).gjf (generated)

072115493.b3lyp_6-31g(d).firefly.inp (generated)

072115493.b3lyp_6-31g(d).smash.inp (generated)

072115493.b3lyp_6-31g(d).nwchem.inp (generated) 072115493.b3lyp_6-31g(d).log.xz 072115493.td-b3lyp_6-31g+(d).inp 072115493.td-b3lyp_6-31g+(d).log.xz

072115493.td-b3lyp_6-31+g(d).qchem.inp (generated)

072115493.td-b3lyp_6-31+g(d).gjf (generated)

072115493.td-b3lyp_6-31+g(d).firefly.inp (generated)

072115493.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072115493.mol 072115493.PUBCHEM 072115493.mol (via Jmol)
072115495.b3lyp_6-31g(d).inp

072115495.b3lyp_6-31g(d).qchem.inp (generated)

072115495.b3lyp_6-31g(d).gjf (generated)

072115495.b3lyp_6-31g(d).firefly.inp (generated)

072115495.b3lyp_6-31g(d).smash.inp (generated)

072115495.b3lyp_6-31g(d).nwchem.inp (generated) 072115495.b3lyp_6-31g(d).log.xz 072115495.td-b3lyp_6-31g+(d).inp 072115495.td-b3lyp_6-31g+(d).log.xz

072115495.td-b3lyp_6-31+g(d).qchem.inp (generated)

072115495.td-b3lyp_6-31+g(d).gjf (generated)

072115495.td-b3lyp_6-31+g(d).firefly.inp (generated)

072115495.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072115495.mol 072115495.PUBCHEM 072115495.mol (via Jmol)
072115497.b3lyp_6-31g(d).inp

072115497.b3lyp_6-31g(d).qchem.inp (generated)

072115497.b3lyp_6-31g(d).gjf (generated)

072115497.b3lyp_6-31g(d).firefly.inp (generated)

072115497.b3lyp_6-31g(d).smash.inp (generated)

072115497.b3lyp_6-31g(d).nwchem.inp (generated) 072115497.b3lyp_6-31g(d).log.xz 072115497.td-b3lyp_6-31g+(d).inp 072115497.td-b3lyp_6-31g+(d).log.xz

072115497.td-b3lyp_6-31+g(d).qchem.inp (generated)

072115497.td-b3lyp_6-31+g(d).gjf (generated)

072115497.td-b3lyp_6-31+g(d).firefly.inp (generated)

072115497.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072115497.mol 072115497.PUBCHEM 072115497.mol (via Jmol)
072115503.b3lyp_6-31g(d).inp

072115503.b3lyp_6-31g(d).qchem.inp (generated)

072115503.b3lyp_6-31g(d).gjf (generated)

072115503.b3lyp_6-31g(d).firefly.inp (generated)

072115503.b3lyp_6-31g(d).smash.inp (generated)

072115503.b3lyp_6-31g(d).nwchem.inp (generated) 072115503.b3lyp_6-31g(d).log.xz 072115503.mol 072115503.PUBCHEM 072115503.mol (via Jmol)
072115512.b3lyp_6-31g(d).inp

072115512.b3lyp_6-31g(d).qchem.inp (generated)

072115512.b3lyp_6-31g(d).gjf (generated)

072115512.b3lyp_6-31g(d).firefly.inp (generated)

072115512.b3lyp_6-31g(d).smash.inp (generated)

072115512.b3lyp_6-31g(d).nwchem.inp (generated) 072115512.b3lyp_6-31g(d).log.xz 072115512.td-b3lyp_6-31g+(d).inp 072115512.td-b3lyp_6-31g+(d).log.xz

072115512.td-b3lyp_6-31+g(d).qchem.inp (generated)

072115512.td-b3lyp_6-31+g(d).gjf (generated)

072115512.td-b3lyp_6-31+g(d).firefly.inp (generated)

072115512.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072115512.mol 072115512.PUBCHEM 072115512.mol (via Jmol)
072115547.b3lyp_6-31g(d).inp

072115547.b3lyp_6-31g(d).qchem.inp (generated)

072115547.b3lyp_6-31g(d).gjf (generated)

072115547.b3lyp_6-31g(d).firefly.inp (generated)

072115547.b3lyp_6-31g(d).smash.inp (generated)

072115547.b3lyp_6-31g(d).nwchem.inp (generated) 072115547.b3lyp_6-31g(d).log.xz 072115547.td-b3lyp_6-31g+(d).inp 072115547.td-b3lyp_6-31g+(d).log.xz

072115547.td-b3lyp_6-31+g(d).qchem.inp (generated)

072115547.td-b3lyp_6-31+g(d).gjf (generated)

072115547.td-b3lyp_6-31+g(d).firefly.inp (generated)

072115547.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072115547.mol 072115547.PUBCHEM 072115547.mol (via Jmol)
072115585.b3lyp_6-31g(d).inp

072115585.b3lyp_6-31g(d).qchem.inp (generated)

072115585.b3lyp_6-31g(d).gjf (generated)

072115585.b3lyp_6-31g(d).firefly.inp (generated)

072115585.b3lyp_6-31g(d).smash.inp (generated)

072115585.b3lyp_6-31g(d).nwchem.inp (generated) 072115585.b3lyp_6-31g(d).log.xz 072115585.td-b3lyp_6-31g+(d).inp 072115585.td-b3lyp_6-31g+(d).log.xz

072115585.td-b3lyp_6-31+g(d).qchem.inp (generated)

072115585.td-b3lyp_6-31+g(d).gjf (generated)

072115585.td-b3lyp_6-31+g(d).firefly.inp (generated)

072115585.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072115585.mol 072115585.PUBCHEM 072115585.mol (via Jmol)
072115590.b3lyp_6-31g(d).inp

072115590.b3lyp_6-31g(d).qchem.inp (generated)

072115590.b3lyp_6-31g(d).gjf (generated)

072115590.b3lyp_6-31g(d).firefly.inp (generated)

072115590.b3lyp_6-31g(d).smash.inp (generated)

072115590.b3lyp_6-31g(d).nwchem.inp (generated) 072115590.b3lyp_6-31g(d).log.xz 072115590.mol 072115590.PUBCHEM 072115590.mol (via Jmol)
072115633.b3lyp_6-31g(d).inp

072115633.b3lyp_6-31g(d).qchem.inp (generated)

072115633.b3lyp_6-31g(d).gjf (generated)

072115633.b3lyp_6-31g(d).firefly.inp (generated)

072115633.b3lyp_6-31g(d).smash.inp (generated)

072115633.b3lyp_6-31g(d).nwchem.inp (generated) 072115633.b3lyp_6-31g(d).log.xz 072115633.mol 072115633.PUBCHEM 072115633.mol (via Jmol)
072115654.b3lyp_6-31g(d).inp

072115654.b3lyp_6-31g(d).qchem.inp (generated)

072115654.b3lyp_6-31g(d).gjf (generated)

072115654.b3lyp_6-31g(d).firefly.inp (generated)

072115654.b3lyp_6-31g(d).smash.inp (generated)

072115654.b3lyp_6-31g(d).nwchem.inp (generated) 072115654.b3lyp_6-31g(d).log.xz 072115654.mol 072115654.PUBCHEM 072115654.mol (via Jmol)
072115732.b3lyp_6-31g(d).inp

072115732.b3lyp_6-31g(d).qchem.inp (generated)

072115732.b3lyp_6-31g(d).gjf (generated)

072115732.b3lyp_6-31g(d).firefly.inp (generated)

072115732.b3lyp_6-31g(d).smash.inp (generated)

072115732.b3lyp_6-31g(d).nwchem.inp (generated) 072115732.b3lyp_6-31g(d).log.xz 072115732.td-b3lyp_6-31g+(d).inp 072115732.td-b3lyp_6-31g+(d).log.xz

072115732.td-b3lyp_6-31+g(d).qchem.inp (generated)

072115732.td-b3lyp_6-31+g(d).gjf (generated)

072115732.td-b3lyp_6-31+g(d).firefly.inp (generated)

072115732.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072115732.mol 072115732.PUBCHEM 072115732.mol (via Jmol)
072115733.b3lyp_6-31g(d).inp

072115733.b3lyp_6-31g(d).qchem.inp (generated)

072115733.b3lyp_6-31g(d).gjf (generated)

072115733.b3lyp_6-31g(d).firefly.inp (generated)

072115733.b3lyp_6-31g(d).smash.inp (generated)

072115733.b3lyp_6-31g(d).nwchem.inp (generated) 072115733.b3lyp_6-31g(d).log.xz 072115733.td-b3lyp_6-31g+(d).inp 072115733.td-b3lyp_6-31g+(d).log.xz

072115733.td-b3lyp_6-31+g(d).qchem.inp (generated)

072115733.td-b3lyp_6-31+g(d).gjf (generated)

072115733.td-b3lyp_6-31+g(d).firefly.inp (generated)

072115733.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072115733.mol 072115733.PUBCHEM 072115733.mol (via Jmol)
072115904.b3lyp_6-31g(d).inp

072115904.b3lyp_6-31g(d).qchem.inp (generated)

072115904.b3lyp_6-31g(d).gjf (generated)

072115904.b3lyp_6-31g(d).firefly.inp (generated)

072115904.b3lyp_6-31g(d).smash.inp (generated)

072115904.b3lyp_6-31g(d).nwchem.inp (generated) 072115904.b3lyp_6-31g(d).log.xz 072115904.td-b3lyp_6-31g+(d).inp 072115904.td-b3lyp_6-31g+(d).log.xz

072115904.td-b3lyp_6-31+g(d).qchem.inp (generated)

072115904.td-b3lyp_6-31+g(d).gjf (generated)

072115904.td-b3lyp_6-31+g(d).firefly.inp (generated)

072115904.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072115904.mol 072115904.PUBCHEM 072115904.mol (via Jmol)
072115933.b3lyp_6-31g(d).inp

072115933.b3lyp_6-31g(d).qchem.inp (generated)

072115933.b3lyp_6-31g(d).gjf (generated)

072115933.b3lyp_6-31g(d).firefly.inp (generated)

072115933.b3lyp_6-31g(d).smash.inp (generated)

072115933.b3lyp_6-31g(d).nwchem.inp (generated) 072115933.b3lyp_6-31g(d).log.xz 072115933.mol 072115933.PUBCHEM 072115933.mol (via Jmol)
072116038.b3lyp_6-31g(d).inp

072116038.b3lyp_6-31g(d).qchem.inp (generated)

072116038.b3lyp_6-31g(d).gjf (generated)

072116038.b3lyp_6-31g(d).firefly.inp (generated)

072116038.b3lyp_6-31g(d).smash.inp (generated)

072116038.b3lyp_6-31g(d).nwchem.inp (generated) 072116038.b3lyp_6-31g(d).log.xz 072116038.mol 072116038.PUBCHEM 072116038.mol (via Jmol)
072116140.b3lyp_6-31g(d).inp

072116140.b3lyp_6-31g(d).qchem.inp (generated)

072116140.b3lyp_6-31g(d).gjf (generated)

072116140.b3lyp_6-31g(d).firefly.inp (generated)

072116140.b3lyp_6-31g(d).smash.inp (generated)

072116140.b3lyp_6-31g(d).nwchem.inp (generated) 072116140.b3lyp_6-31g(d).log.xz 072116140.mol 072116140.PUBCHEM 072116140.mol (via Jmol)
072116589.b3lyp_6-31g(d).inp

072116589.b3lyp_6-31g(d).qchem.inp (generated)

072116589.b3lyp_6-31g(d).gjf (generated)

072116589.b3lyp_6-31g(d).firefly.inp (generated)

072116589.b3lyp_6-31g(d).smash.inp (generated)

072116589.b3lyp_6-31g(d).nwchem.inp (generated) 072116589.b3lyp_6-31g(d).log.xz 072116589.td-b3lyp_6-31g+(d).inp 072116589.td-b3lyp_6-31g+(d).log.xz

072116589.td-b3lyp_6-31+g(d).qchem.inp (generated)

072116589.td-b3lyp_6-31+g(d).gjf (generated)

072116589.td-b3lyp_6-31+g(d).firefly.inp (generated)

072116589.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072116589.mol 072116589.PUBCHEM 072116589.mol (via Jmol)
072116838.b3lyp_6-31g(d).inp

072116838.b3lyp_6-31g(d).qchem.inp (generated)

072116838.b3lyp_6-31g(d).gjf (generated)

072116838.b3lyp_6-31g(d).firefly.inp (generated)

072116838.b3lyp_6-31g(d).smash.inp (generated)

072116838.b3lyp_6-31g(d).nwchem.inp (generated) 072116838.b3lyp_6-31g(d).log.xz 072116838.td-b3lyp_6-31g+(d).inp 072116838.td-b3lyp_6-31g+(d).log.xz

072116838.td-b3lyp_6-31+g(d).qchem.inp (generated)

072116838.td-b3lyp_6-31+g(d).gjf (generated)

072116838.td-b3lyp_6-31+g(d).firefly.inp (generated)

072116838.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072116838.mol 072116838.PUBCHEM 072116838.mol (via Jmol)
072116883.b3lyp_6-31g(d).inp

072116883.b3lyp_6-31g(d).qchem.inp (generated)

072116883.b3lyp_6-31g(d).gjf (generated)

072116883.b3lyp_6-31g(d).firefly.inp (generated)

072116883.b3lyp_6-31g(d).smash.inp (generated)

072116883.b3lyp_6-31g(d).nwchem.inp (generated) 072116883.b3lyp_6-31g(d).log.xz 072116883.td-b3lyp_6-31g+(d).inp 072116883.td-b3lyp_6-31g+(d).log.xz

072116883.td-b3lyp_6-31+g(d).qchem.inp (generated)

072116883.td-b3lyp_6-31+g(d).gjf (generated)

072116883.td-b3lyp_6-31+g(d).firefly.inp (generated)

072116883.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072116883.mol 072116883.PUBCHEM 072116883.mol (via Jmol)
072116950.b3lyp_6-31g(d).inp

072116950.b3lyp_6-31g(d).qchem.inp (generated)

072116950.b3lyp_6-31g(d).gjf (generated)

072116950.b3lyp_6-31g(d).firefly.inp (generated)

072116950.b3lyp_6-31g(d).smash.inp (generated)

072116950.b3lyp_6-31g(d).nwchem.inp (generated) 072116950.b3lyp_6-31g(d).log.xz 072116950.td-b3lyp_6-31g+(d).inp 072116950.td-b3lyp_6-31g+(d).log.xz

072116950.td-b3lyp_6-31+g(d).qchem.inp (generated)

072116950.td-b3lyp_6-31+g(d).gjf (generated)

072116950.td-b3lyp_6-31+g(d).firefly.inp (generated)

072116950.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072116950.mol 072116950.PUBCHEM 072116950.mol (via Jmol)
072116960.b3lyp_6-31g(d).inp

072116960.b3lyp_6-31g(d).qchem.inp (generated)

072116960.b3lyp_6-31g(d).gjf (generated)

072116960.b3lyp_6-31g(d).firefly.inp (generated)

072116960.b3lyp_6-31g(d).smash.inp (generated)

072116960.b3lyp_6-31g(d).nwchem.inp (generated) 072116960.b3lyp_6-31g(d).log.xz 072116960.td-b3lyp_6-31g+(d).inp 072116960.td-b3lyp_6-31g+(d).log.xz

072116960.td-b3lyp_6-31+g(d).qchem.inp (generated)

072116960.td-b3lyp_6-31+g(d).gjf (generated)

072116960.td-b3lyp_6-31+g(d).firefly.inp (generated)

072116960.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072116960.mol 072116960.PUBCHEM 072116960.mol (via Jmol)
072117020.b3lyp_6-31g(d).inp

072117020.b3lyp_6-31g(d).qchem.inp (generated)

072117020.b3lyp_6-31g(d).gjf (generated)

072117020.b3lyp_6-31g(d).firefly.inp (generated)

072117020.b3lyp_6-31g(d).smash.inp (generated)

072117020.b3lyp_6-31g(d).nwchem.inp (generated) 072117020.b3lyp_6-31g(d).log.xz 072117020.td-b3lyp_6-31g+(d).inp 072117020.td-b3lyp_6-31g+(d).log.xz

072117020.td-b3lyp_6-31+g(d).qchem.inp (generated)

072117020.td-b3lyp_6-31+g(d).gjf (generated)

072117020.td-b3lyp_6-31+g(d).firefly.inp (generated)

072117020.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072117020.mol 072117020.PUBCHEM 072117020.mol (via Jmol)
072117040.b3lyp_6-31g(d).inp

072117040.b3lyp_6-31g(d).qchem.inp (generated)

072117040.b3lyp_6-31g(d).gjf (generated)

072117040.b3lyp_6-31g(d).firefly.inp (generated)

072117040.b3lyp_6-31g(d).smash.inp (generated)

072117040.b3lyp_6-31g(d).nwchem.inp (generated) 072117040.b3lyp_6-31g(d).log.xz 072117040.td-b3lyp_6-31g+(d).inp 072117040.td-b3lyp_6-31g+(d).log.xz

072117040.td-b3lyp_6-31+g(d).qchem.inp (generated)

072117040.td-b3lyp_6-31+g(d).gjf (generated)

072117040.td-b3lyp_6-31+g(d).firefly.inp (generated)

072117040.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072117040.mol 072117040.PUBCHEM 072117040.mol (via Jmol)
072117360.b3lyp_6-31g(d).inp

072117360.b3lyp_6-31g(d).qchem.inp (generated)

072117360.b3lyp_6-31g(d).gjf (generated)

072117360.b3lyp_6-31g(d).firefly.inp (generated)

072117360.b3lyp_6-31g(d).smash.inp (generated)

072117360.b3lyp_6-31g(d).nwchem.inp (generated) 072117360.b3lyp_6-31g(d).log.xz 072117360.mol 072117360.PUBCHEM 072117360.mol (via Jmol)
072117418.b3lyp_6-31g(d).inp

072117418.b3lyp_6-31g(d).qchem.inp (generated)

072117418.b3lyp_6-31g(d).gjf (generated)

072117418.b3lyp_6-31g(d).firefly.inp (generated)

072117418.b3lyp_6-31g(d).smash.inp (generated)

072117418.b3lyp_6-31g(d).nwchem.inp (generated) 072117418.b3lyp_6-31g(d).log.xz 072117418.td-b3lyp_6-31g+(d).inp 072117418.td-b3lyp_6-31g+(d).log.xz

072117418.td-b3lyp_6-31+g(d).qchem.inp (generated)

072117418.td-b3lyp_6-31+g(d).gjf (generated)

072117418.td-b3lyp_6-31+g(d).firefly.inp (generated)

072117418.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072117418.mol 072117418.PUBCHEM 072117418.mol (via Jmol)
072117444.b3lyp_6-31g(d).inp

072117444.b3lyp_6-31g(d).qchem.inp (generated)

072117444.b3lyp_6-31g(d).gjf (generated)

072117444.b3lyp_6-31g(d).firefly.inp (generated)

072117444.b3lyp_6-31g(d).smash.inp (generated)

072117444.b3lyp_6-31g(d).nwchem.inp (generated) 072117444.b3lyp_6-31g(d).log.xz 072117444.td-b3lyp_6-31g+(d).inp 072117444.td-b3lyp_6-31g+(d).log.xz

072117444.td-b3lyp_6-31+g(d).qchem.inp (generated)

072117444.td-b3lyp_6-31+g(d).gjf (generated)

072117444.td-b3lyp_6-31+g(d).firefly.inp (generated)

072117444.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072117444.mol 072117444.PUBCHEM 072117444.mol (via Jmol)
072117541.b3lyp_6-31g(d).inp

072117541.b3lyp_6-31g(d).qchem.inp (generated)

072117541.b3lyp_6-31g(d).gjf (generated)

072117541.b3lyp_6-31g(d).firefly.inp (generated)

072117541.b3lyp_6-31g(d).smash.inp (generated)

072117541.b3lyp_6-31g(d).nwchem.inp (generated) 072117541.b3lyp_6-31g(d).log.xz 072117541.mol 072117541.PUBCHEM 072117541.mol (via Jmol)
072117718.b3lyp_6-31g(d).inp

072117718.b3lyp_6-31g(d).qchem.inp (generated)

072117718.b3lyp_6-31g(d).gjf (generated)

072117718.b3lyp_6-31g(d).firefly.inp (generated)

072117718.b3lyp_6-31g(d).smash.inp (generated)

072117718.b3lyp_6-31g(d).nwchem.inp (generated) 072117718.b3lyp_6-31g(d).log.xz 072117718.td-b3lyp_6-31g+(d).inp 072117718.td-b3lyp_6-31g+(d).log.xz

072117718.td-b3lyp_6-31+g(d).qchem.inp (generated)

072117718.td-b3lyp_6-31+g(d).gjf (generated)

072117718.td-b3lyp_6-31+g(d).firefly.inp (generated)

072117718.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072117718.mol 072117718.PUBCHEM 072117718.mol (via Jmol)
072117719.b3lyp_6-31g(d).inp

072117719.b3lyp_6-31g(d).qchem.inp (generated)

072117719.b3lyp_6-31g(d).gjf (generated)

072117719.b3lyp_6-31g(d).firefly.inp (generated)

072117719.b3lyp_6-31g(d).smash.inp (generated)

072117719.b3lyp_6-31g(d).nwchem.inp (generated) 072117719.b3lyp_6-31g(d).log.xz 072117719.mol 072117719.PUBCHEM 072117719.mol (via Jmol)
072118581.b3lyp_6-31g(d).inp

072118581.b3lyp_6-31g(d).qchem.inp (generated)

072118581.b3lyp_6-31g(d).gjf (generated)

072118581.b3lyp_6-31g(d).firefly.inp (generated)

072118581.b3lyp_6-31g(d).smash.inp (generated)

072118581.b3lyp_6-31g(d).nwchem.inp (generated) 072118581.b3lyp_6-31g(d).log.xz 072118581.mol 072118581.PUBCHEM 072118581.mol (via Jmol)
072118670.b3lyp_6-31g(d).inp

072118670.b3lyp_6-31g(d).qchem.inp (generated)

072118670.b3lyp_6-31g(d).gjf (generated)

072118670.b3lyp_6-31g(d).firefly.inp (generated)

072118670.b3lyp_6-31g(d).smash.inp (generated)

072118670.b3lyp_6-31g(d).nwchem.inp (generated) 072118670.b3lyp_6-31g(d).log.xz 072118670.td-b3lyp_6-31g+(d).inp 072118670.td-b3lyp_6-31g+(d).log.xz

072118670.td-b3lyp_6-31+g(d).qchem.inp (generated)

072118670.td-b3lyp_6-31+g(d).gjf (generated)

072118670.td-b3lyp_6-31+g(d).firefly.inp (generated)

072118670.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072118670.mol 072118670.PUBCHEM 072118670.mol (via Jmol)
072118762.b3lyp_6-31g(d).inp

072118762.b3lyp_6-31g(d).qchem.inp (generated)

072118762.b3lyp_6-31g(d).gjf (generated)

072118762.b3lyp_6-31g(d).firefly.inp (generated)

072118762.b3lyp_6-31g(d).smash.inp (generated)

072118762.b3lyp_6-31g(d).nwchem.inp (generated) 072118762.b3lyp_6-31g(d).log.xz 072118762.td-b3lyp_6-31g+(d).inp 072118762.td-b3lyp_6-31g+(d).log.xz

072118762.td-b3lyp_6-31+g(d).qchem.inp (generated)

072118762.td-b3lyp_6-31+g(d).gjf (generated)

072118762.td-b3lyp_6-31+g(d).firefly.inp (generated)

072118762.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072118762.mol 072118762.PUBCHEM 072118762.mol (via Jmol)
072118763.b3lyp_6-31g(d).inp

072118763.b3lyp_6-31g(d).qchem.inp (generated)

072118763.b3lyp_6-31g(d).gjf (generated)

072118763.b3lyp_6-31g(d).firefly.inp (generated)

072118763.b3lyp_6-31g(d).smash.inp (generated)

072118763.b3lyp_6-31g(d).nwchem.inp (generated) 072118763.b3lyp_6-31g(d).log.xz 072118763.td-b3lyp_6-31g+(d).inp 072118763.td-b3lyp_6-31g+(d).log.xz

072118763.td-b3lyp_6-31+g(d).qchem.inp (generated)

072118763.td-b3lyp_6-31+g(d).gjf (generated)

072118763.td-b3lyp_6-31+g(d).firefly.inp (generated)

072118763.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072118763.mol 072118763.PUBCHEM 072118763.mol (via Jmol)
072118766.b3lyp_6-31g(d).inp

072118766.b3lyp_6-31g(d).qchem.inp (generated)

072118766.b3lyp_6-31g(d).gjf (generated)

072118766.b3lyp_6-31g(d).firefly.inp (generated)

072118766.b3lyp_6-31g(d).smash.inp (generated)

072118766.b3lyp_6-31g(d).nwchem.inp (generated) 072118766.b3lyp_6-31g(d).log.xz 072118766.td-b3lyp_6-31g+(d).inp 072118766.td-b3lyp_6-31g+(d).log.xz

072118766.td-b3lyp_6-31+g(d).qchem.inp (generated)

072118766.td-b3lyp_6-31+g(d).gjf (generated)

072118766.td-b3lyp_6-31+g(d).firefly.inp (generated)

072118766.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072118766.mol 072118766.PUBCHEM 072118766.mol (via Jmol)
072118897.b3lyp_6-31g(d).inp

072118897.b3lyp_6-31g(d).qchem.inp (generated)

072118897.b3lyp_6-31g(d).gjf (generated)

072118897.b3lyp_6-31g(d).firefly.inp (generated)

072118897.b3lyp_6-31g(d).smash.inp (generated)

072118897.b3lyp_6-31g(d).nwchem.inp (generated) 072118897.b3lyp_6-31g(d).log.xz 072118897.mol 072118897.PUBCHEM 072118897.mol (via Jmol)
072119195.b3lyp_6-31g(d).inp

072119195.b3lyp_6-31g(d).qchem.inp (generated)

072119195.b3lyp_6-31g(d).gjf (generated)

072119195.b3lyp_6-31g(d).firefly.inp (generated)

072119195.b3lyp_6-31g(d).smash.inp (generated)

072119195.b3lyp_6-31g(d).nwchem.inp (generated) 072119195.b3lyp_6-31g(d).log.xz 072119195.td-b3lyp_6-31g+(d).inp 072119195.td-b3lyp_6-31g+(d).log.xz

072119195.td-b3lyp_6-31+g(d).qchem.inp (generated)

072119195.td-b3lyp_6-31+g(d).gjf (generated)

072119195.td-b3lyp_6-31+g(d).firefly.inp (generated)

072119195.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072119195.mol 072119195.PUBCHEM 072119195.mol (via Jmol)
072119199.b3lyp_6-31g(d).inp

072119199.b3lyp_6-31g(d).qchem.inp (generated)

072119199.b3lyp_6-31g(d).gjf (generated)

072119199.b3lyp_6-31g(d).firefly.inp (generated)

072119199.b3lyp_6-31g(d).smash.inp (generated)

072119199.b3lyp_6-31g(d).nwchem.inp (generated) 072119199.b3lyp_6-31g(d).log.xz 072119199.td-b3lyp_6-31g+(d).inp 072119199.td-b3lyp_6-31g+(d).log.xz

072119199.td-b3lyp_6-31+g(d).qchem.inp (generated)

072119199.td-b3lyp_6-31+g(d).gjf (generated)

072119199.td-b3lyp_6-31+g(d).firefly.inp (generated)

072119199.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072119199.mol 072119199.PUBCHEM 072119199.mol (via Jmol)
072119201.b3lyp_6-31g(d).inp

072119201.b3lyp_6-31g(d).qchem.inp (generated)

072119201.b3lyp_6-31g(d).gjf (generated)

072119201.b3lyp_6-31g(d).firefly.inp (generated)

072119201.b3lyp_6-31g(d).smash.inp (generated)

072119201.b3lyp_6-31g(d).nwchem.inp (generated) 072119201.b3lyp_6-31g(d).log.xz 072119201.td-b3lyp_6-31g+(d).inp 072119201.td-b3lyp_6-31g+(d).log.xz

072119201.td-b3lyp_6-31+g(d).qchem.inp (generated)

072119201.td-b3lyp_6-31+g(d).gjf (generated)

072119201.td-b3lyp_6-31+g(d).firefly.inp (generated)

072119201.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072119201.mol 072119201.PUBCHEM 072119201.mol (via Jmol)
072119255.b3lyp_6-31g(d).inp

072119255.b3lyp_6-31g(d).qchem.inp (generated)

072119255.b3lyp_6-31g(d).gjf (generated)

072119255.b3lyp_6-31g(d).firefly.inp (generated)

072119255.b3lyp_6-31g(d).smash.inp (generated)

072119255.b3lyp_6-31g(d).nwchem.inp (generated) 072119255.b3lyp_6-31g(d).log.xz 072119255.td-b3lyp_6-31g+(d).inp 072119255.td-b3lyp_6-31g+(d).log.xz

072119255.td-b3lyp_6-31+g(d).qchem.inp (generated)

072119255.td-b3lyp_6-31+g(d).gjf (generated)

072119255.td-b3lyp_6-31+g(d).firefly.inp (generated)

072119255.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072119255.mol 072119255.PUBCHEM 072119255.mol (via Jmol)
072119301.b3lyp_6-31g(d).inp

072119301.b3lyp_6-31g(d).qchem.inp (generated)

072119301.b3lyp_6-31g(d).gjf (generated)

072119301.b3lyp_6-31g(d).firefly.inp (generated)

072119301.b3lyp_6-31g(d).smash.inp (generated)

072119301.b3lyp_6-31g(d).nwchem.inp (generated) 072119301.b3lyp_6-31g(d).log.xz 072119301.mol 072119301.PUBCHEM 072119301.mol (via Jmol)
072119316.b3lyp_6-31g(d).inp

072119316.b3lyp_6-31g(d).qchem.inp (generated)

072119316.b3lyp_6-31g(d).gjf (generated)

072119316.b3lyp_6-31g(d).firefly.inp (generated)

072119316.b3lyp_6-31g(d).smash.inp (generated)

072119316.b3lyp_6-31g(d).nwchem.inp (generated) 072119316.b3lyp_6-31g(d).log.xz 072119316.td-b3lyp_6-31g+(d).inp 072119316.td-b3lyp_6-31g+(d).log.xz

072119316.td-b3lyp_6-31+g(d).qchem.inp (generated)

072119316.td-b3lyp_6-31+g(d).gjf (generated)

072119316.td-b3lyp_6-31+g(d).firefly.inp (generated)

072119316.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072119316.mol 072119316.PUBCHEM 072119316.mol (via Jmol)
072119335.b3lyp_6-31g(d).inp

072119335.b3lyp_6-31g(d).qchem.inp (generated)

072119335.b3lyp_6-31g(d).gjf (generated)

072119335.b3lyp_6-31g(d).firefly.inp (generated)

072119335.b3lyp_6-31g(d).smash.inp (generated)

072119335.b3lyp_6-31g(d).nwchem.inp (generated) 072119335.b3lyp_6-31g(d).log.xz 072119335.td-b3lyp_6-31g+(d).inp 072119335.td-b3lyp_6-31g+(d).log.xz

072119335.td-b3lyp_6-31+g(d).qchem.inp (generated)

072119335.td-b3lyp_6-31+g(d).gjf (generated)

072119335.td-b3lyp_6-31+g(d).firefly.inp (generated)

072119335.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072119335.mol 072119335.PUBCHEM 072119335.mol (via Jmol)
072119352.b3lyp_6-31g(d).inp

072119352.b3lyp_6-31g(d).qchem.inp (generated)

072119352.b3lyp_6-31g(d).gjf (generated)

072119352.b3lyp_6-31g(d).firefly.inp (generated)

072119352.b3lyp_6-31g(d).smash.inp (generated)

072119352.b3lyp_6-31g(d).nwchem.inp (generated) 072119352.b3lyp_6-31g(d).log.xz 072119352.td-b3lyp_6-31g+(d).inp 072119352.td-b3lyp_6-31g+(d).log.xz

072119352.td-b3lyp_6-31+g(d).qchem.inp (generated)

072119352.td-b3lyp_6-31+g(d).gjf (generated)

072119352.td-b3lyp_6-31+g(d).firefly.inp (generated)

072119352.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072119352.mol 072119352.PUBCHEM 072119352.mol (via Jmol)
072119436.b3lyp_6-31g(d).inp

072119436.b3lyp_6-31g(d).qchem.inp (generated)

072119436.b3lyp_6-31g(d).gjf (generated)

072119436.b3lyp_6-31g(d).firefly.inp (generated)

072119436.b3lyp_6-31g(d).smash.inp (generated)

072119436.b3lyp_6-31g(d).nwchem.inp (generated) 072119436.b3lyp_6-31g(d).log.xz 072119436.td-b3lyp_6-31g+(d).inp 072119436.td-b3lyp_6-31g+(d).log.xz

072119436.td-b3lyp_6-31+g(d).qchem.inp (generated)

072119436.td-b3lyp_6-31+g(d).gjf (generated)

072119436.td-b3lyp_6-31+g(d).firefly.inp (generated)

072119436.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072119436.mol 072119436.PUBCHEM 072119436.mol (via Jmol)
072119889.b3lyp_6-31g(d).inp

072119889.b3lyp_6-31g(d).qchem.inp (generated)

072119889.b3lyp_6-31g(d).gjf (generated)

072119889.b3lyp_6-31g(d).firefly.inp (generated)

072119889.b3lyp_6-31g(d).smash.inp (generated)

072119889.b3lyp_6-31g(d).nwchem.inp (generated) 072119889.b3lyp_6-31g(d).log.xz 072119889.td-b3lyp_6-31g+(d).inp 072119889.td-b3lyp_6-31g+(d).log.xz

072119889.td-b3lyp_6-31+g(d).qchem.inp (generated)

072119889.td-b3lyp_6-31+g(d).gjf (generated)

072119889.td-b3lyp_6-31+g(d).firefly.inp (generated)

072119889.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072119889.mol 072119889.PUBCHEM 072119889.mol (via Jmol)
072119890.b3lyp_6-31g(d).inp

072119890.b3lyp_6-31g(d).qchem.inp (generated)

072119890.b3lyp_6-31g(d).gjf (generated)

072119890.b3lyp_6-31g(d).firefly.inp (generated)

072119890.b3lyp_6-31g(d).smash.inp (generated)

072119890.b3lyp_6-31g(d).nwchem.inp (generated) 072119890.b3lyp_6-31g(d).log.xz 072119890.td-b3lyp_6-31g+(d).inp 072119890.td-b3lyp_6-31g+(d).log.xz

072119890.td-b3lyp_6-31+g(d).qchem.inp (generated)

072119890.td-b3lyp_6-31+g(d).gjf (generated)

072119890.td-b3lyp_6-31+g(d).firefly.inp (generated)

072119890.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072119890.mol 072119890.PUBCHEM 072119890.mol (via Jmol)
072119891.b3lyp_6-31g(d).inp

072119891.b3lyp_6-31g(d).qchem.inp (generated)

072119891.b3lyp_6-31g(d).gjf (generated)

072119891.b3lyp_6-31g(d).firefly.inp (generated)

072119891.b3lyp_6-31g(d).smash.inp (generated)

072119891.b3lyp_6-31g(d).nwchem.inp (generated) 072119891.b3lyp_6-31g(d).log.xz 072119891.mol 072119891.PUBCHEM 072119891.mol (via Jmol)
072119892.b3lyp_6-31g(d).inp

072119892.b3lyp_6-31g(d).qchem.inp (generated)

072119892.b3lyp_6-31g(d).gjf (generated)

072119892.b3lyp_6-31g(d).firefly.inp (generated)

072119892.b3lyp_6-31g(d).smash.inp (generated)

072119892.b3lyp_6-31g(d).nwchem.inp (generated) 072119892.b3lyp_6-31g(d).log.xz 072119892.mol 072119892.PUBCHEM 072119892.mol (via Jmol)
072119907.b3lyp_6-31g(d).inp

072119907.b3lyp_6-31g(d).qchem.inp (generated)

072119907.b3lyp_6-31g(d).gjf (generated)

072119907.b3lyp_6-31g(d).firefly.inp (generated)

072119907.b3lyp_6-31g(d).smash.inp (generated)

072119907.b3lyp_6-31g(d).nwchem.inp (generated) 072119907.b3lyp_6-31g(d).log.xz 072119907.td-b3lyp_6-31g+(d).inp 072119907.td-b3lyp_6-31g+(d).log.xz

072119907.td-b3lyp_6-31+g(d).qchem.inp (generated)

072119907.td-b3lyp_6-31+g(d).gjf (generated)

072119907.td-b3lyp_6-31+g(d).firefly.inp (generated)

072119907.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072119907.mol 072119907.PUBCHEM 072119907.mol (via Jmol)
072120017.b3lyp_6-31g(d).inp

072120017.b3lyp_6-31g(d).qchem.inp (generated)

072120017.b3lyp_6-31g(d).gjf (generated)

072120017.b3lyp_6-31g(d).firefly.inp (generated)

072120017.b3lyp_6-31g(d).smash.inp (generated)

072120017.b3lyp_6-31g(d).nwchem.inp (generated) 072120017.b3lyp_6-31g(d).log.xz 072120017.td-b3lyp_6-31g+(d).inp 072120017.td-b3lyp_6-31g+(d).log.xz

072120017.td-b3lyp_6-31+g(d).qchem.inp (generated)

072120017.td-b3lyp_6-31+g(d).gjf (generated)

072120017.td-b3lyp_6-31+g(d).firefly.inp (generated)

072120017.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072120017.mol 072120017.PUBCHEM 072120017.mol (via Jmol)
072120200.b3lyp_6-31g(d).inp

072120200.b3lyp_6-31g(d).qchem.inp (generated)

072120200.b3lyp_6-31g(d).gjf (generated)

072120200.b3lyp_6-31g(d).firefly.inp (generated)

072120200.b3lyp_6-31g(d).smash.inp (generated)

072120200.b3lyp_6-31g(d).nwchem.inp (generated) 072120200.b3lyp_6-31g(d).log.xz 072120200.mol 072120200.PUBCHEM 072120200.mol (via Jmol)
072120230.b3lyp_6-31g(d).inp

072120230.b3lyp_6-31g(d).qchem.inp (generated)

072120230.b3lyp_6-31g(d).gjf (generated)

072120230.b3lyp_6-31g(d).firefly.inp (generated)

072120230.b3lyp_6-31g(d).smash.inp (generated)

072120230.b3lyp_6-31g(d).nwchem.inp (generated) 072120230.b3lyp_6-31g(d).log.xz 072120230.td-b3lyp_6-31g+(d).inp 072120230.td-b3lyp_6-31g+(d).log.xz

072120230.td-b3lyp_6-31+g(d).qchem.inp (generated)

072120230.td-b3lyp_6-31+g(d).gjf (generated)

072120230.td-b3lyp_6-31+g(d).firefly.inp (generated)

072120230.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072120230.mol 072120230.PUBCHEM 072120230.mol (via Jmol)
072120258.b3lyp_6-31g(d).inp

072120258.b3lyp_6-31g(d).qchem.inp (generated)

072120258.b3lyp_6-31g(d).gjf (generated)

072120258.b3lyp_6-31g(d).firefly.inp (generated)

072120258.b3lyp_6-31g(d).smash.inp (generated)

072120258.b3lyp_6-31g(d).nwchem.inp (generated) 072120258.b3lyp_6-31g(d).log.xz 072120258.td-b3lyp_6-31g+(d).inp 072120258.td-b3lyp_6-31g+(d).log.xz

072120258.td-b3lyp_6-31+g(d).qchem.inp (generated)

072120258.td-b3lyp_6-31+g(d).gjf (generated)

072120258.td-b3lyp_6-31+g(d).firefly.inp (generated)

072120258.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072120258.mol 072120258.PUBCHEM 072120258.mol (via Jmol)
072120278.b3lyp_6-31g(d).inp

072120278.b3lyp_6-31g(d).qchem.inp (generated)

072120278.b3lyp_6-31g(d).gjf (generated)

072120278.b3lyp_6-31g(d).firefly.inp (generated)

072120278.b3lyp_6-31g(d).smash.inp (generated)

072120278.b3lyp_6-31g(d).nwchem.inp (generated) 072120278.b3lyp_6-31g(d).log.xz 072120278.td-b3lyp_6-31g+(d).inp 072120278.td-b3lyp_6-31g+(d).log.xz

072120278.td-b3lyp_6-31+g(d).qchem.inp (generated)

072120278.td-b3lyp_6-31+g(d).gjf (generated)

072120278.td-b3lyp_6-31+g(d).firefly.inp (generated)

072120278.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072120278.mol 072120278.PUBCHEM 072120278.mol (via Jmol)
072120279.b3lyp_6-31g(d).inp

072120279.b3lyp_6-31g(d).qchem.inp (generated)

072120279.b3lyp_6-31g(d).gjf (generated)

072120279.b3lyp_6-31g(d).firefly.inp (generated)

072120279.b3lyp_6-31g(d).smash.inp (generated)

072120279.b3lyp_6-31g(d).nwchem.inp (generated) 072120279.b3lyp_6-31g(d).log.xz 072120279.mol 072120279.PUBCHEM 072120279.mol (via Jmol)
072120280.b3lyp_6-31g(d).inp

072120280.b3lyp_6-31g(d).qchem.inp (generated)

072120280.b3lyp_6-31g(d).gjf (generated)

072120280.b3lyp_6-31g(d).firefly.inp (generated)

072120280.b3lyp_6-31g(d).smash.inp (generated)

072120280.b3lyp_6-31g(d).nwchem.inp (generated) 072120280.b3lyp_6-31g(d).log.xz 072120280.td-b3lyp_6-31g+(d).inp 072120280.td-b3lyp_6-31g+(d).log.xz

072120280.td-b3lyp_6-31+g(d).qchem.inp (generated)

072120280.td-b3lyp_6-31+g(d).gjf (generated)

072120280.td-b3lyp_6-31+g(d).firefly.inp (generated)

072120280.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072120280.mol 072120280.PUBCHEM 072120280.mol (via Jmol)
072120281.b3lyp_6-31g(d).inp

072120281.b3lyp_6-31g(d).qchem.inp (generated)

072120281.b3lyp_6-31g(d).gjf (generated)

072120281.b3lyp_6-31g(d).firefly.inp (generated)

072120281.b3lyp_6-31g(d).smash.inp (generated)

072120281.b3lyp_6-31g(d).nwchem.inp (generated) 072120281.b3lyp_6-31g(d).log.xz 072120281.td-b3lyp_6-31g+(d).inp 072120281.td-b3lyp_6-31g+(d).log.xz

072120281.td-b3lyp_6-31+g(d).qchem.inp (generated)

072120281.td-b3lyp_6-31+g(d).gjf (generated)

072120281.td-b3lyp_6-31+g(d).firefly.inp (generated)

072120281.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072120281.mol 072120281.PUBCHEM 072120281.mol (via Jmol)
072120282.b3lyp_6-31g(d).inp

072120282.b3lyp_6-31g(d).qchem.inp (generated)

072120282.b3lyp_6-31g(d).gjf (generated)

072120282.b3lyp_6-31g(d).firefly.inp (generated)

072120282.b3lyp_6-31g(d).smash.inp (generated)

072120282.b3lyp_6-31g(d).nwchem.inp (generated) 072120282.b3lyp_6-31g(d).log.xz 072120282.td-b3lyp_6-31g+(d).inp 072120282.td-b3lyp_6-31g+(d).log.xz

072120282.td-b3lyp_6-31+g(d).qchem.inp (generated)

072120282.td-b3lyp_6-31+g(d).gjf (generated)

072120282.td-b3lyp_6-31+g(d).firefly.inp (generated)

072120282.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072120282.mol 072120282.PUBCHEM 072120282.mol (via Jmol)
072120289.b3lyp_6-31g(d).inp

072120289.b3lyp_6-31g(d).qchem.inp (generated)

072120289.b3lyp_6-31g(d).gjf (generated)

072120289.b3lyp_6-31g(d).firefly.inp (generated)

072120289.b3lyp_6-31g(d).smash.inp (generated)

072120289.b3lyp_6-31g(d).nwchem.inp (generated) 072120289.b3lyp_6-31g(d).log.xz 072120289.td-b3lyp_6-31g+(d).inp 072120289.td-b3lyp_6-31g+(d).log.xz

072120289.td-b3lyp_6-31+g(d).qchem.inp (generated)

072120289.td-b3lyp_6-31+g(d).gjf (generated)

072120289.td-b3lyp_6-31+g(d).firefly.inp (generated)

072120289.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072120289.mol 072120289.PUBCHEM 072120289.mol (via Jmol)
072120420.b3lyp_6-31g(d).inp

072120420.b3lyp_6-31g(d).qchem.inp (generated)

072120420.b3lyp_6-31g(d).gjf (generated)

072120420.b3lyp_6-31g(d).firefly.inp (generated)

072120420.b3lyp_6-31g(d).smash.inp (generated)

072120420.b3lyp_6-31g(d).nwchem.inp (generated) 072120420.b3lyp_6-31g(d).log.xz 072120420.td-b3lyp_6-31g+(d).inp 072120420.td-b3lyp_6-31g+(d).log.xz

072120420.td-b3lyp_6-31+g(d).qchem.inp (generated)

072120420.td-b3lyp_6-31+g(d).gjf (generated)

072120420.td-b3lyp_6-31+g(d).firefly.inp (generated)

072120420.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072120420.mol 072120420.PUBCHEM 072120420.mol (via Jmol)
072120535.b3lyp_6-31g(d).inp

072120535.b3lyp_6-31g(d).qchem.inp (generated)

072120535.b3lyp_6-31g(d).gjf (generated)

072120535.b3lyp_6-31g(d).firefly.inp (generated)

072120535.b3lyp_6-31g(d).smash.inp (generated)

072120535.b3lyp_6-31g(d).nwchem.inp (generated) 072120535.b3lyp_6-31g(d).log.xz 072120535.td-b3lyp_6-31g+(d).inp 072120535.td-b3lyp_6-31g+(d).log.xz

072120535.td-b3lyp_6-31+g(d).qchem.inp (generated)

072120535.td-b3lyp_6-31+g(d).gjf (generated)

072120535.td-b3lyp_6-31+g(d).firefly.inp (generated)

072120535.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072120535.mol 072120535.PUBCHEM 072120535.mol (via Jmol)
072120539.b3lyp_6-31g(d).inp

072120539.b3lyp_6-31g(d).qchem.inp (generated)

072120539.b3lyp_6-31g(d).gjf (generated)

072120539.b3lyp_6-31g(d).firefly.inp (generated)

072120539.b3lyp_6-31g(d).smash.inp (generated)

072120539.b3lyp_6-31g(d).nwchem.inp (generated) 072120539.b3lyp_6-31g(d).log.xz 072120539.td-b3lyp_6-31g+(d).inp 072120539.td-b3lyp_6-31g+(d).log.xz

072120539.td-b3lyp_6-31+g(d).qchem.inp (generated)

072120539.td-b3lyp_6-31+g(d).gjf (generated)

072120539.td-b3lyp_6-31+g(d).firefly.inp (generated)

072120539.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072120539.mol 072120539.PUBCHEM 072120539.mol (via Jmol)
072120571.b3lyp_6-31g(d).inp

072120571.b3lyp_6-31g(d).qchem.inp (generated)

072120571.b3lyp_6-31g(d).gjf (generated)

072120571.b3lyp_6-31g(d).firefly.inp (generated)

072120571.b3lyp_6-31g(d).smash.inp (generated)

072120571.b3lyp_6-31g(d).nwchem.inp (generated) 072120571.b3lyp_6-31g(d).log.xz 072120571.td-b3lyp_6-31g+(d).inp 072120571.td-b3lyp_6-31g+(d).log.xz

072120571.td-b3lyp_6-31+g(d).qchem.inp (generated)

072120571.td-b3lyp_6-31+g(d).gjf (generated)

072120571.td-b3lyp_6-31+g(d).firefly.inp (generated)

072120571.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072120571.mol 072120571.PUBCHEM 072120571.mol (via Jmol)
072120658.b3lyp_6-31g(d).inp

072120658.b3lyp_6-31g(d).qchem.inp (generated)

072120658.b3lyp_6-31g(d).gjf (generated)

072120658.b3lyp_6-31g(d).firefly.inp (generated)

072120658.b3lyp_6-31g(d).smash.inp (generated)

072120658.b3lyp_6-31g(d).nwchem.inp (generated) 072120658.b3lyp_6-31g(d).log.xz 072120658.td-b3lyp_6-31g+(d).inp 072120658.td-b3lyp_6-31g+(d).log.xz

072120658.td-b3lyp_6-31+g(d).qchem.inp (generated)

072120658.td-b3lyp_6-31+g(d).gjf (generated)

072120658.td-b3lyp_6-31+g(d).firefly.inp (generated)

072120658.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072120658.mol 072120658.PUBCHEM 072120658.mol (via Jmol)
072120660.b3lyp_6-31g(d).inp

072120660.b3lyp_6-31g(d).qchem.inp (generated)

072120660.b3lyp_6-31g(d).gjf (generated)

072120660.b3lyp_6-31g(d).firefly.inp (generated)

072120660.b3lyp_6-31g(d).smash.inp (generated)

072120660.b3lyp_6-31g(d).nwchem.inp (generated) 072120660.b3lyp_6-31g(d).log.xz 072120660.td-b3lyp_6-31g+(d).inp 072120660.td-b3lyp_6-31g+(d).log.xz

072120660.td-b3lyp_6-31+g(d).qchem.inp (generated)

072120660.td-b3lyp_6-31+g(d).gjf (generated)

072120660.td-b3lyp_6-31+g(d).firefly.inp (generated)

072120660.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072120660.mol 072120660.PUBCHEM 072120660.mol (via Jmol)
072120747.b3lyp_6-31g(d).inp

072120747.b3lyp_6-31g(d).qchem.inp (generated)

072120747.b3lyp_6-31g(d).gjf (generated)

072120747.b3lyp_6-31g(d).firefly.inp (generated)

072120747.b3lyp_6-31g(d).smash.inp (generated)

072120747.b3lyp_6-31g(d).nwchem.inp (generated) 072120747.b3lyp_6-31g(d).log.xz 072120747.td-b3lyp_6-31g+(d).inp 072120747.td-b3lyp_6-31g+(d).log.xz

072120747.td-b3lyp_6-31+g(d).qchem.inp (generated)

072120747.td-b3lyp_6-31+g(d).gjf (generated)

072120747.td-b3lyp_6-31+g(d).firefly.inp (generated)

072120747.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072120747.mol 072120747.PUBCHEM 072120747.mol (via Jmol)
072120750.b3lyp_6-31g(d).inp

072120750.b3lyp_6-31g(d).qchem.inp (generated)

072120750.b3lyp_6-31g(d).gjf (generated)

072120750.b3lyp_6-31g(d).firefly.inp (generated)

072120750.b3lyp_6-31g(d).smash.inp (generated)

072120750.b3lyp_6-31g(d).nwchem.inp (generated) 072120750.b3lyp_6-31g(d).log.xz 072120750.td-b3lyp_6-31g+(d).inp 072120750.td-b3lyp_6-31g+(d).log.xz

072120750.td-b3lyp_6-31+g(d).qchem.inp (generated)

072120750.td-b3lyp_6-31+g(d).gjf (generated)

072120750.td-b3lyp_6-31+g(d).firefly.inp (generated)

072120750.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072120750.mol 072120750.PUBCHEM 072120750.mol (via Jmol)
072120752.b3lyp_6-31g(d).inp

072120752.b3lyp_6-31g(d).qchem.inp (generated)

072120752.b3lyp_6-31g(d).gjf (generated)

072120752.b3lyp_6-31g(d).firefly.inp (generated)

072120752.b3lyp_6-31g(d).smash.inp (generated)

072120752.b3lyp_6-31g(d).nwchem.inp (generated) 072120752.b3lyp_6-31g(d).log.xz 072120752.td-b3lyp_6-31g+(d).inp 072120752.td-b3lyp_6-31g+(d).log.xz

072120752.td-b3lyp_6-31+g(d).qchem.inp (generated)

072120752.td-b3lyp_6-31+g(d).gjf (generated)

072120752.td-b3lyp_6-31+g(d).firefly.inp (generated)

072120752.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072120752.mol 072120752.PUBCHEM 072120752.mol (via Jmol)
072120801.b3lyp_6-31g(d).inp

072120801.b3lyp_6-31g(d).qchem.inp (generated)

072120801.b3lyp_6-31g(d).gjf (generated)

072120801.b3lyp_6-31g(d).firefly.inp (generated)

072120801.b3lyp_6-31g(d).smash.inp (generated)

072120801.b3lyp_6-31g(d).nwchem.inp (generated) 072120801.b3lyp_6-31g(d).log.xz 072120801.td-b3lyp_6-31g+(d).inp 072120801.td-b3lyp_6-31g+(d).log.xz

072120801.td-b3lyp_6-31+g(d).qchem.inp (generated)

072120801.td-b3lyp_6-31+g(d).gjf (generated)

072120801.td-b3lyp_6-31+g(d).firefly.inp (generated)

072120801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072120801.mol 072120801.PUBCHEM 072120801.mol (via Jmol)
072120961.b3lyp_6-31g(d).inp

072120961.b3lyp_6-31g(d).qchem.inp (generated)

072120961.b3lyp_6-31g(d).gjf (generated)

072120961.b3lyp_6-31g(d).firefly.inp (generated)

072120961.b3lyp_6-31g(d).smash.inp (generated)

072120961.b3lyp_6-31g(d).nwchem.inp (generated) 072120961.b3lyp_6-31g(d).log.xz 072120961.td-b3lyp_6-31g+(d).inp 072120961.td-b3lyp_6-31g+(d).log.xz

072120961.td-b3lyp_6-31+g(d).qchem.inp (generated)

072120961.td-b3lyp_6-31+g(d).gjf (generated)

072120961.td-b3lyp_6-31+g(d).firefly.inp (generated)

072120961.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072120961.mol 072120961.PUBCHEM 072120961.mol (via Jmol)
072120967.b3lyp_6-31g(d).inp

072120967.b3lyp_6-31g(d).qchem.inp (generated)

072120967.b3lyp_6-31g(d).gjf (generated)

072120967.b3lyp_6-31g(d).firefly.inp (generated)

072120967.b3lyp_6-31g(d).smash.inp (generated)

072120967.b3lyp_6-31g(d).nwchem.inp (generated) 072120967.b3lyp_6-31g(d).log.xz 072120967.td-b3lyp_6-31g+(d).inp 072120967.td-b3lyp_6-31g+(d).log.xz

072120967.td-b3lyp_6-31+g(d).qchem.inp (generated)

072120967.td-b3lyp_6-31+g(d).gjf (generated)

072120967.td-b3lyp_6-31+g(d).firefly.inp (generated)

072120967.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072120967.mol 072120967.PUBCHEM 072120967.mol (via Jmol)
072121023.b3lyp_6-31g(d).inp

072121023.b3lyp_6-31g(d).qchem.inp (generated)

072121023.b3lyp_6-31g(d).gjf (generated)

072121023.b3lyp_6-31g(d).firefly.inp (generated)

072121023.b3lyp_6-31g(d).smash.inp (generated)

072121023.b3lyp_6-31g(d).nwchem.inp (generated) 072121023.b3lyp_6-31g(d).log.xz 072121023.td-b3lyp_6-31g+(d).inp 072121023.td-b3lyp_6-31g+(d).log.xz

072121023.td-b3lyp_6-31+g(d).qchem.inp (generated)

072121023.td-b3lyp_6-31+g(d).gjf (generated)

072121023.td-b3lyp_6-31+g(d).firefly.inp (generated)

072121023.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072121023.mol 072121023.PUBCHEM 072121023.mol (via Jmol)
072121736.b3lyp_6-31g(d).inp

072121736.b3lyp_6-31g(d).qchem.inp (generated)

072121736.b3lyp_6-31g(d).gjf (generated)

072121736.b3lyp_6-31g(d).firefly.inp (generated)

072121736.b3lyp_6-31g(d).smash.inp (generated)

072121736.b3lyp_6-31g(d).nwchem.inp (generated) 072121736.b3lyp_6-31g(d).log.xz 072121736.td-b3lyp_6-31g+(d).inp 072121736.td-b3lyp_6-31g+(d).log.xz

072121736.td-b3lyp_6-31+g(d).qchem.inp (generated)

072121736.td-b3lyp_6-31+g(d).gjf (generated)

072121736.td-b3lyp_6-31+g(d).firefly.inp (generated)

072121736.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072121736.mol 072121736.PUBCHEM 072121736.mol (via Jmol)
072121796.b3lyp_6-31g(d).inp

072121796.b3lyp_6-31g(d).qchem.inp (generated)

072121796.b3lyp_6-31g(d).gjf (generated)

072121796.b3lyp_6-31g(d).firefly.inp (generated)

072121796.b3lyp_6-31g(d).smash.inp (generated)

072121796.b3lyp_6-31g(d).nwchem.inp (generated) 072121796.b3lyp_6-31g(d).log.xz 072121796.td-b3lyp_6-31g+(d).inp 072121796.td-b3lyp_6-31g+(d).log.xz

072121796.td-b3lyp_6-31+g(d).qchem.inp (generated)

072121796.td-b3lyp_6-31+g(d).gjf (generated)

072121796.td-b3lyp_6-31+g(d).firefly.inp (generated)

072121796.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072121796.mol 072121796.PUBCHEM 072121796.mol (via Jmol)
072122344.b3lyp_6-31g(d).inp

072122344.b3lyp_6-31g(d).qchem.inp (generated)

072122344.b3lyp_6-31g(d).gjf (generated)

072122344.b3lyp_6-31g(d).firefly.inp (generated)

072122344.b3lyp_6-31g(d).smash.inp (generated)

072122344.b3lyp_6-31g(d).nwchem.inp (generated) 072122344.b3lyp_6-31g(d).log.xz 072122344.td-b3lyp_6-31g+(d).inp 072122344.td-b3lyp_6-31g+(d).log.xz

072122344.td-b3lyp_6-31+g(d).qchem.inp (generated)

072122344.td-b3lyp_6-31+g(d).gjf (generated)

072122344.td-b3lyp_6-31+g(d).firefly.inp (generated)

072122344.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072122344.mol 072122344.PUBCHEM 072122344.mol (via Jmol)
072124256.b3lyp_6-31g(d).inp

072124256.b3lyp_6-31g(d).qchem.inp (generated)

072124256.b3lyp_6-31g(d).gjf (generated)

072124256.b3lyp_6-31g(d).firefly.inp (generated)

072124256.b3lyp_6-31g(d).smash.inp (generated)

072124256.b3lyp_6-31g(d).nwchem.inp (generated) 072124256.b3lyp_6-31g(d).log.xz 072124256.td-b3lyp_6-31g+(d).inp 072124256.td-b3lyp_6-31g+(d).log.xz

072124256.td-b3lyp_6-31+g(d).qchem.inp (generated)

072124256.td-b3lyp_6-31+g(d).gjf (generated)

072124256.td-b3lyp_6-31+g(d).firefly.inp (generated)

072124256.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072124256.mol 072124256.PUBCHEM 072124256.mol (via Jmol)
072124258.b3lyp_6-31g(d).inp

072124258.b3lyp_6-31g(d).qchem.inp (generated)

072124258.b3lyp_6-31g(d).gjf (generated)

072124258.b3lyp_6-31g(d).firefly.inp (generated)

072124258.b3lyp_6-31g(d).smash.inp (generated)

072124258.b3lyp_6-31g(d).nwchem.inp (generated) 072124258.b3lyp_6-31g(d).log.xz 072124258.td-b3lyp_6-31g+(d).inp 072124258.td-b3lyp_6-31g+(d).log.xz

072124258.td-b3lyp_6-31+g(d).qchem.inp (generated)

072124258.td-b3lyp_6-31+g(d).gjf (generated)

072124258.td-b3lyp_6-31+g(d).firefly.inp (generated)

072124258.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072124258.mol 072124258.PUBCHEM 072124258.mol (via Jmol)
072124410.b3lyp_6-31g(d).inp

072124410.b3lyp_6-31g(d).qchem.inp (generated)

072124410.b3lyp_6-31g(d).gjf (generated)

072124410.b3lyp_6-31g(d).firefly.inp (generated)

072124410.b3lyp_6-31g(d).smash.inp (generated)

072124410.b3lyp_6-31g(d).nwchem.inp (generated) 072124410.b3lyp_6-31g(d).log.xz 072124410.td-b3lyp_6-31g+(d).inp 072124410.td-b3lyp_6-31g+(d).log.xz

072124410.td-b3lyp_6-31+g(d).qchem.inp (generated)

072124410.td-b3lyp_6-31+g(d).gjf (generated)

072124410.td-b3lyp_6-31+g(d).firefly.inp (generated)

072124410.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072124410.mol 072124410.PUBCHEM 072124410.mol (via Jmol)
072124811.b3lyp_6-31g(d).inp

072124811.b3lyp_6-31g(d).qchem.inp (generated)

072124811.b3lyp_6-31g(d).gjf (generated)

072124811.b3lyp_6-31g(d).firefly.inp (generated)

072124811.b3lyp_6-31g(d).smash.inp (generated)

072124811.b3lyp_6-31g(d).nwchem.inp (generated) 072124811.b3lyp_6-31g(d).log.xz 072124811.td-b3lyp_6-31g+(d).inp 072124811.td-b3lyp_6-31g+(d).log.xz

072124811.td-b3lyp_6-31+g(d).qchem.inp (generated)

072124811.td-b3lyp_6-31+g(d).gjf (generated)

072124811.td-b3lyp_6-31+g(d).firefly.inp (generated)

072124811.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072124811.mol 072124811.PUBCHEM 072124811.mol (via Jmol)
072124879.b3lyp_6-31g(d).inp

072124879.b3lyp_6-31g(d).qchem.inp (generated)

072124879.b3lyp_6-31g(d).gjf (generated)

072124879.b3lyp_6-31g(d).firefly.inp (generated)

072124879.b3lyp_6-31g(d).smash.inp (generated)

072124879.b3lyp_6-31g(d).nwchem.inp (generated) 072124879.b3lyp_6-31g(d).log.xz 072124879.td-b3lyp_6-31g+(d).inp 072124879.td-b3lyp_6-31g+(d).log.xz

072124879.td-b3lyp_6-31+g(d).qchem.inp (generated)

072124879.td-b3lyp_6-31+g(d).gjf (generated)

072124879.td-b3lyp_6-31+g(d).firefly.inp (generated)

072124879.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072124879.mol 072124879.PUBCHEM 072124879.mol (via Jmol)
072124933.b3lyp_6-31g(d).inp

072124933.b3lyp_6-31g(d).qchem.inp (generated)

072124933.b3lyp_6-31g(d).gjf (generated)

072124933.b3lyp_6-31g(d).firefly.inp (generated)

072124933.b3lyp_6-31g(d).smash.inp (generated)

072124933.b3lyp_6-31g(d).nwchem.inp (generated) 072124933.b3lyp_6-31g(d).log.xz 072124933.td-b3lyp_6-31g+(d).inp 072124933.td-b3lyp_6-31g+(d).log.xz

072124933.td-b3lyp_6-31+g(d).qchem.inp (generated)

072124933.td-b3lyp_6-31+g(d).gjf (generated)

072124933.td-b3lyp_6-31+g(d).firefly.inp (generated)

072124933.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072124933.mol 072124933.PUBCHEM 072124933.mol (via Jmol)
072124934.b3lyp_6-31g(d).inp

072124934.b3lyp_6-31g(d).qchem.inp (generated)

072124934.b3lyp_6-31g(d).gjf (generated)

072124934.b3lyp_6-31g(d).firefly.inp (generated)

072124934.b3lyp_6-31g(d).smash.inp (generated)

072124934.b3lyp_6-31g(d).nwchem.inp (generated) 072124934.b3lyp_6-31g(d).log.xz 072124934.mol 072124934.PUBCHEM 072124934.mol (via Jmol)
072124935.b3lyp_6-31g(d).inp

072124935.b3lyp_6-31g(d).qchem.inp (generated)

072124935.b3lyp_6-31g(d).gjf (generated)

072124935.b3lyp_6-31g(d).firefly.inp (generated)

072124935.b3lyp_6-31g(d).smash.inp (generated)

072124935.b3lyp_6-31g(d).nwchem.inp (generated) 072124935.b3lyp_6-31g(d).log.xz 072124935.td-b3lyp_6-31g+(d).inp 072124935.td-b3lyp_6-31g+(d).log.xz

072124935.td-b3lyp_6-31+g(d).qchem.inp (generated)

072124935.td-b3lyp_6-31+g(d).gjf (generated)

072124935.td-b3lyp_6-31+g(d).firefly.inp (generated)

072124935.td-b3lyp_6-31+g(d).nwchem.inp (generated) 072124935.mol 072124935.PUBCHEM 072124935.mol (via Jmol)


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