Index of

Last updated : Thu Aug 17 01:52:36 JST 2017
Total : 333 (239) in this page
002925004.b3lyp_6-31g(d).inp

002925004.b3lyp_6-31g(d).qchem.inp (generated)

002925004.b3lyp_6-31g(d).gjf (generated)

002925004.b3lyp_6-31g(d).firefly.inp (generated)

002925004.b3lyp_6-31g(d).smash.inp (generated)

002925004.b3lyp_6-31g(d).nwchem.inp (generated) 002925004.b3lyp_6-31g(d).log.xz 002925004.mol 002925004.PUBCHEM 002925004.mol (via Jmol)
002925086.b3lyp_6-31g(d).inp

002925086.b3lyp_6-31g(d).qchem.inp (generated)

002925086.b3lyp_6-31g(d).gjf (generated)

002925086.b3lyp_6-31g(d).firefly.inp (generated)

002925086.b3lyp_6-31g(d).smash.inp (generated)

002925086.b3lyp_6-31g(d).nwchem.inp (generated) 002925086.b3lyp_6-31g(d).log.xz 002925086.td-b3lyp_6-31g+(d).inp 002925086.td-b3lyp_6-31g+(d).log.xz

002925086.td-b3lyp_6-31+g(d).qchem.inp (generated)

002925086.td-b3lyp_6-31+g(d).gjf (generated)

002925086.td-b3lyp_6-31+g(d).firefly.inp (generated)

002925086.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002925086.mol 002925086.PUBCHEM 002925086.mol (via Jmol)
002925104.b3lyp_6-31g(d).inp

002925104.b3lyp_6-31g(d).qchem.inp (generated)

002925104.b3lyp_6-31g(d).gjf (generated)

002925104.b3lyp_6-31g(d).firefly.inp (generated)

002925104.b3lyp_6-31g(d).smash.inp (generated)

002925104.b3lyp_6-31g(d).nwchem.inp (generated) 002925104.b3lyp_6-31g(d).log.xz 002925104.mol 002925104.PUBCHEM 002925104.mol (via Jmol)
002925145.b3lyp_6-31g(d).inp

002925145.b3lyp_6-31g(d).qchem.inp (generated)

002925145.b3lyp_6-31g(d).gjf (generated)

002925145.b3lyp_6-31g(d).firefly.inp (generated)

002925145.b3lyp_6-31g(d).smash.inp (generated)

002925145.b3lyp_6-31g(d).nwchem.inp (generated) 002925145.b3lyp_6-31g(d).log.xz 002925145.td-b3lyp_6-31g+(d).inp 002925145.td-b3lyp_6-31g+(d).log.xz

002925145.td-b3lyp_6-31+g(d).qchem.inp (generated)

002925145.td-b3lyp_6-31+g(d).gjf (generated)

002925145.td-b3lyp_6-31+g(d).firefly.inp (generated)

002925145.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002925145.mol 002925145.PUBCHEM 002925145.mol (via Jmol)
002925296.b3lyp_6-31g(d).inp

002925296.b3lyp_6-31g(d).qchem.inp (generated)

002925296.b3lyp_6-31g(d).gjf (generated)

002925296.b3lyp_6-31g(d).firefly.inp (generated)

002925296.b3lyp_6-31g(d).smash.inp (generated)

002925296.b3lyp_6-31g(d).nwchem.inp (generated) 002925296.b3lyp_6-31g(d).log.xz 002925296.mol 002925296.PUBCHEM 002925296.mol (via Jmol)
002925308.b3lyp_6-31g(d).inp

002925308.b3lyp_6-31g(d).qchem.inp (generated)

002925308.b3lyp_6-31g(d).gjf (generated)

002925308.b3lyp_6-31g(d).firefly.inp (generated)

002925308.b3lyp_6-31g(d).smash.inp (generated)

002925308.b3lyp_6-31g(d).nwchem.inp (generated) 002925308.b3lyp_6-31g(d).log.xz 002925308.mol 002925308.PUBCHEM 002925308.mol (via Jmol)
002925398.b3lyp_6-31g(d).inp

002925398.b3lyp_6-31g(d).qchem.inp (generated)

002925398.b3lyp_6-31g(d).gjf (generated)

002925398.b3lyp_6-31g(d).firefly.inp (generated)

002925398.b3lyp_6-31g(d).smash.inp (generated)

002925398.b3lyp_6-31g(d).nwchem.inp (generated) 002925398.b3lyp_6-31g(d).log.xz 002925398.td-b3lyp_6-31g+(d).inp 002925398.td-b3lyp_6-31g+(d).log.xz

002925398.td-b3lyp_6-31+g(d).qchem.inp (generated)

002925398.td-b3lyp_6-31+g(d).gjf (generated)

002925398.td-b3lyp_6-31+g(d).firefly.inp (generated)

002925398.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002925398.mol 002925398.PUBCHEM 002925398.mol (via Jmol)
002925420.b3lyp_6-31g(d).inp

002925420.b3lyp_6-31g(d).qchem.inp (generated)

002925420.b3lyp_6-31g(d).gjf (generated)

002925420.b3lyp_6-31g(d).firefly.inp (generated)

002925420.b3lyp_6-31g(d).smash.inp (generated)

002925420.b3lyp_6-31g(d).nwchem.inp (generated) 002925420.b3lyp_6-31g(d).log.xz 002925420.mol 002925420.PUBCHEM 002925420.mol (via Jmol)
002925435.b3lyp_6-31g(d).inp

002925435.b3lyp_6-31g(d).qchem.inp (generated)

002925435.b3lyp_6-31g(d).gjf (generated)

002925435.b3lyp_6-31g(d).firefly.inp (generated)

002925435.b3lyp_6-31g(d).smash.inp (generated)

002925435.b3lyp_6-31g(d).nwchem.inp (generated) 002925435.b3lyp_6-31g(d).log.xz 002925435.mol 002925435.PUBCHEM 002925435.mol (via Jmol)
002925481.b3lyp_6-31g(d).inp

002925481.b3lyp_6-31g(d).qchem.inp (generated)

002925481.b3lyp_6-31g(d).gjf (generated)

002925481.b3lyp_6-31g(d).firefly.inp (generated)

002925481.b3lyp_6-31g(d).smash.inp (generated)

002925481.b3lyp_6-31g(d).nwchem.inp (generated) 002925481.b3lyp_6-31g(d).log.xz 002925481.td-b3lyp_6-31g+(d).inp 002925481.td-b3lyp_6-31g+(d).log.xz

002925481.td-b3lyp_6-31+g(d).qchem.inp (generated)

002925481.td-b3lyp_6-31+g(d).gjf (generated)

002925481.td-b3lyp_6-31+g(d).firefly.inp (generated)

002925481.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002925481.mol 002925481.PUBCHEM 002925481.mol (via Jmol)
002925487.b3lyp_6-31g(d).inp

002925487.b3lyp_6-31g(d).qchem.inp (generated)

002925487.b3lyp_6-31g(d).gjf (generated)

002925487.b3lyp_6-31g(d).firefly.inp (generated)

002925487.b3lyp_6-31g(d).smash.inp (generated)

002925487.b3lyp_6-31g(d).nwchem.inp (generated) 002925487.b3lyp_6-31g(d).log.xz 002925487.td-b3lyp_6-31g+(d).inp 002925487.td-b3lyp_6-31g+(d).log.xz

002925487.td-b3lyp_6-31+g(d).qchem.inp (generated)

002925487.td-b3lyp_6-31+g(d).gjf (generated)

002925487.td-b3lyp_6-31+g(d).firefly.inp (generated)

002925487.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002925487.mol 002925487.PUBCHEM 002925487.mol (via Jmol)
002925567.b3lyp_6-31g(d).inp

002925567.b3lyp_6-31g(d).qchem.inp (generated)

002925567.b3lyp_6-31g(d).gjf (generated)

002925567.b3lyp_6-31g(d).firefly.inp (generated)

002925567.b3lyp_6-31g(d).smash.inp (generated)

002925567.b3lyp_6-31g(d).nwchem.inp (generated) 002925567.b3lyp_6-31g(d).log.xz 002925567.td-b3lyp_6-31g+(d).inp 002925567.td-b3lyp_6-31g+(d).log.xz

002925567.td-b3lyp_6-31+g(d).qchem.inp (generated)

002925567.td-b3lyp_6-31+g(d).gjf (generated)

002925567.td-b3lyp_6-31+g(d).firefly.inp (generated)

002925567.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002925567.mol 002925567.PUBCHEM 002925567.mol (via Jmol)
002925580.b3lyp_6-31g(d).inp

002925580.b3lyp_6-31g(d).qchem.inp (generated)

002925580.b3lyp_6-31g(d).gjf (generated)

002925580.b3lyp_6-31g(d).firefly.inp (generated)

002925580.b3lyp_6-31g(d).smash.inp (generated)

002925580.b3lyp_6-31g(d).nwchem.inp (generated) 002925580.b3lyp_6-31g(d).log.xz 002925580.mol 002925580.PUBCHEM 002925580.mol (via Jmol)
002925631.b3lyp_6-31g(d).inp

002925631.b3lyp_6-31g(d).qchem.inp (generated)

002925631.b3lyp_6-31g(d).gjf (generated)

002925631.b3lyp_6-31g(d).firefly.inp (generated)

002925631.b3lyp_6-31g(d).smash.inp (generated)

002925631.b3lyp_6-31g(d).nwchem.inp (generated) 002925631.b3lyp_6-31g(d).log.xz 002925631.mol 002925631.PUBCHEM 002925631.mol (via Jmol)
002925677.b3lyp_6-31g(d).inp

002925677.b3lyp_6-31g(d).qchem.inp (generated)

002925677.b3lyp_6-31g(d).gjf (generated)

002925677.b3lyp_6-31g(d).firefly.inp (generated)

002925677.b3lyp_6-31g(d).smash.inp (generated)

002925677.b3lyp_6-31g(d).nwchem.inp (generated) 002925677.b3lyp_6-31g(d).log.xz 002925677.td-b3lyp_6-31g+(d).inp 002925677.td-b3lyp_6-31g+(d).log.xz

002925677.td-b3lyp_6-31+g(d).qchem.inp (generated)

002925677.td-b3lyp_6-31+g(d).gjf (generated)

002925677.td-b3lyp_6-31+g(d).firefly.inp (generated)

002925677.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002925677.mol 002925677.PUBCHEM 002925677.mol (via Jmol)
002925914.b3lyp_6-31g(d).inp

002925914.b3lyp_6-31g(d).qchem.inp (generated)

002925914.b3lyp_6-31g(d).gjf (generated)

002925914.b3lyp_6-31g(d).firefly.inp (generated)

002925914.b3lyp_6-31g(d).smash.inp (generated)

002925914.b3lyp_6-31g(d).nwchem.inp (generated) 002925914.b3lyp_6-31g(d).log.xz 002925914.mol 002925914.PUBCHEM 002925914.mol (via Jmol)
002925965.b3lyp_6-31g(d).inp

002925965.b3lyp_6-31g(d).qchem.inp (generated)

002925965.b3lyp_6-31g(d).gjf (generated)

002925965.b3lyp_6-31g(d).firefly.inp (generated)

002925965.b3lyp_6-31g(d).smash.inp (generated)

002925965.b3lyp_6-31g(d).nwchem.inp (generated) 002925965.b3lyp_6-31g(d).log.xz 002925965.mol 002925965.PUBCHEM 002925965.mol (via Jmol)
002926223.b3lyp_6-31g(d).inp

002926223.b3lyp_6-31g(d).qchem.inp (generated)

002926223.b3lyp_6-31g(d).gjf (generated)

002926223.b3lyp_6-31g(d).firefly.inp (generated)

002926223.b3lyp_6-31g(d).smash.inp (generated)

002926223.b3lyp_6-31g(d).nwchem.inp (generated) 002926223.b3lyp_6-31g(d).log.xz 002926223.td-b3lyp_6-31g+(d).inp 002926223.td-b3lyp_6-31g+(d).log.xz

002926223.td-b3lyp_6-31+g(d).qchem.inp (generated)

002926223.td-b3lyp_6-31+g(d).gjf (generated)

002926223.td-b3lyp_6-31+g(d).firefly.inp (generated)

002926223.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002926223.mol 002926223.PUBCHEM 002926223.mol (via Jmol)
002926433.b3lyp_6-31g(d).inp

002926433.b3lyp_6-31g(d).qchem.inp (generated)

002926433.b3lyp_6-31g(d).gjf (generated)

002926433.b3lyp_6-31g(d).firefly.inp (generated)

002926433.b3lyp_6-31g(d).smash.inp (generated)

002926433.b3lyp_6-31g(d).nwchem.inp (generated) 002926433.b3lyp_6-31g(d).log.xz 002926433.td-b3lyp_6-31g+(d).inp 002926433.td-b3lyp_6-31g+(d).log.xz

002926433.td-b3lyp_6-31+g(d).qchem.inp (generated)

002926433.td-b3lyp_6-31+g(d).gjf (generated)

002926433.td-b3lyp_6-31+g(d).firefly.inp (generated)

002926433.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002926433.mol 002926433.PUBCHEM 002926433.mol (via Jmol)
002926548.b3lyp_6-31g(d).inp

002926548.b3lyp_6-31g(d).qchem.inp (generated)

002926548.b3lyp_6-31g(d).gjf (generated)

002926548.b3lyp_6-31g(d).firefly.inp (generated)

002926548.b3lyp_6-31g(d).smash.inp (generated)

002926548.b3lyp_6-31g(d).nwchem.inp (generated) 002926548.b3lyp_6-31g(d).log.xz 002926548.mol 002926548.PUBCHEM 002926548.mol (via Jmol)
002926640.b3lyp_6-31g(d).inp

002926640.b3lyp_6-31g(d).qchem.inp (generated)

002926640.b3lyp_6-31g(d).gjf (generated)

002926640.b3lyp_6-31g(d).firefly.inp (generated)

002926640.b3lyp_6-31g(d).smash.inp (generated)

002926640.b3lyp_6-31g(d).nwchem.inp (generated) 002926640.b3lyp_6-31g(d).log.xz 002926640.mol 002926640.PUBCHEM 002926640.mol (via Jmol)
002926647.b3lyp_6-31g(d).inp

002926647.b3lyp_6-31g(d).qchem.inp (generated)

002926647.b3lyp_6-31g(d).gjf (generated)

002926647.b3lyp_6-31g(d).firefly.inp (generated)

002926647.b3lyp_6-31g(d).smash.inp (generated)

002926647.b3lyp_6-31g(d).nwchem.inp (generated) 002926647.b3lyp_6-31g(d).log.xz 002926647.td-b3lyp_6-31g+(d).inp 002926647.td-b3lyp_6-31g+(d).log.xz

002926647.td-b3lyp_6-31+g(d).qchem.inp (generated)

002926647.td-b3lyp_6-31+g(d).gjf (generated)

002926647.td-b3lyp_6-31+g(d).firefly.inp (generated)

002926647.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002926647.mol 002926647.PUBCHEM 002926647.mol (via Jmol)
002926649.b3lyp_6-31g(d).inp

002926649.b3lyp_6-31g(d).qchem.inp (generated)

002926649.b3lyp_6-31g(d).gjf (generated)

002926649.b3lyp_6-31g(d).firefly.inp (generated)

002926649.b3lyp_6-31g(d).smash.inp (generated)

002926649.b3lyp_6-31g(d).nwchem.inp (generated) 002926649.b3lyp_6-31g(d).log.xz 002926649.td-b3lyp_6-31g+(d).inp 002926649.td-b3lyp_6-31g+(d).log.xz

002926649.td-b3lyp_6-31+g(d).qchem.inp (generated)

002926649.td-b3lyp_6-31+g(d).gjf (generated)

002926649.td-b3lyp_6-31+g(d).firefly.inp (generated)

002926649.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002926649.mol 002926649.PUBCHEM 002926649.mol (via Jmol)
002926775.b3lyp_6-31g(d).inp

002926775.b3lyp_6-31g(d).qchem.inp (generated)

002926775.b3lyp_6-31g(d).gjf (generated)

002926775.b3lyp_6-31g(d).firefly.inp (generated)

002926775.b3lyp_6-31g(d).smash.inp (generated)

002926775.b3lyp_6-31g(d).nwchem.inp (generated) 002926775.b3lyp_6-31g(d).log.xz 002926775.td-b3lyp_6-31g+(d).inp 002926775.td-b3lyp_6-31g+(d).log.xz

002926775.td-b3lyp_6-31+g(d).qchem.inp (generated)

002926775.td-b3lyp_6-31+g(d).gjf (generated)

002926775.td-b3lyp_6-31+g(d).firefly.inp (generated)

002926775.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002926775.mol 002926775.PUBCHEM 002926775.mol (via Jmol)
002926798.b3lyp_6-31g(d).inp

002926798.b3lyp_6-31g(d).qchem.inp (generated)

002926798.b3lyp_6-31g(d).gjf (generated)

002926798.b3lyp_6-31g(d).firefly.inp (generated)

002926798.b3lyp_6-31g(d).smash.inp (generated)

002926798.b3lyp_6-31g(d).nwchem.inp (generated) 002926798.b3lyp_6-31g(d).log.xz 002926798.td-b3lyp_6-31g+(d).inp 002926798.td-b3lyp_6-31g+(d).log.xz

002926798.td-b3lyp_6-31+g(d).qchem.inp (generated)

002926798.td-b3lyp_6-31+g(d).gjf (generated)

002926798.td-b3lyp_6-31+g(d).firefly.inp (generated)

002926798.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002926798.mol 002926798.PUBCHEM 002926798.mol (via Jmol)
002926835.b3lyp_6-31g(d).inp

002926835.b3lyp_6-31g(d).qchem.inp (generated)

002926835.b3lyp_6-31g(d).gjf (generated)

002926835.b3lyp_6-31g(d).firefly.inp (generated)

002926835.b3lyp_6-31g(d).smash.inp (generated)

002926835.b3lyp_6-31g(d).nwchem.inp (generated) 002926835.b3lyp_6-31g(d).log.xz 002926835.mol 002926835.PUBCHEM 002926835.mol (via Jmol)
002926840.b3lyp_6-31g(d).inp

002926840.b3lyp_6-31g(d).qchem.inp (generated)

002926840.b3lyp_6-31g(d).gjf (generated)

002926840.b3lyp_6-31g(d).firefly.inp (generated)

002926840.b3lyp_6-31g(d).smash.inp (generated)

002926840.b3lyp_6-31g(d).nwchem.inp (generated) 002926840.b3lyp_6-31g(d).log.xz 002926840.td-b3lyp_6-31g+(d).inp 002926840.td-b3lyp_6-31g+(d).log.xz

002926840.td-b3lyp_6-31+g(d).qchem.inp (generated)

002926840.td-b3lyp_6-31+g(d).gjf (generated)

002926840.td-b3lyp_6-31+g(d).firefly.inp (generated)

002926840.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002926840.mol 002926840.PUBCHEM 002926840.mol (via Jmol)
002927004.b3lyp_6-31g(d).inp

002927004.b3lyp_6-31g(d).qchem.inp (generated)

002927004.b3lyp_6-31g(d).gjf (generated)

002927004.b3lyp_6-31g(d).firefly.inp (generated)

002927004.b3lyp_6-31g(d).smash.inp (generated)

002927004.b3lyp_6-31g(d).nwchem.inp (generated) 002927004.b3lyp_6-31g(d).log.xz 002927004.td-b3lyp_6-31g+(d).inp 002927004.td-b3lyp_6-31g+(d).log.xz

002927004.td-b3lyp_6-31+g(d).qchem.inp (generated)

002927004.td-b3lyp_6-31+g(d).gjf (generated)

002927004.td-b3lyp_6-31+g(d).firefly.inp (generated)

002927004.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002927004.mol 002927004.PUBCHEM 002927004.mol (via Jmol)
002927009.b3lyp_6-31g(d).inp

002927009.b3lyp_6-31g(d).qchem.inp (generated)

002927009.b3lyp_6-31g(d).gjf (generated)

002927009.b3lyp_6-31g(d).firefly.inp (generated)

002927009.b3lyp_6-31g(d).smash.inp (generated)

002927009.b3lyp_6-31g(d).nwchem.inp (generated) 002927009.b3lyp_6-31g(d).log.xz 002927009.mol 002927009.PUBCHEM 002927009.mol (via Jmol)
002927145.b3lyp_6-31g(d).inp

002927145.b3lyp_6-31g(d).qchem.inp (generated)

002927145.b3lyp_6-31g(d).gjf (generated)

002927145.b3lyp_6-31g(d).firefly.inp (generated)

002927145.b3lyp_6-31g(d).smash.inp (generated)

002927145.b3lyp_6-31g(d).nwchem.inp (generated) 002927145.b3lyp_6-31g(d).log.xz 002927145.td-b3lyp_6-31g+(d).inp 002927145.td-b3lyp_6-31g+(d).log.xz

002927145.td-b3lyp_6-31+g(d).qchem.inp (generated)

002927145.td-b3lyp_6-31+g(d).gjf (generated)

002927145.td-b3lyp_6-31+g(d).firefly.inp (generated)

002927145.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002927145.mol 002927145.PUBCHEM 002927145.mol (via Jmol)
002927147.b3lyp_6-31g(d).inp

002927147.b3lyp_6-31g(d).qchem.inp (generated)

002927147.b3lyp_6-31g(d).gjf (generated)

002927147.b3lyp_6-31g(d).firefly.inp (generated)

002927147.b3lyp_6-31g(d).smash.inp (generated)

002927147.b3lyp_6-31g(d).nwchem.inp (generated) 002927147.b3lyp_6-31g(d).log.xz 002927147.td-b3lyp_6-31g+(d).inp 002927147.td-b3lyp_6-31g+(d).log.xz

002927147.td-b3lyp_6-31+g(d).qchem.inp (generated)

002927147.td-b3lyp_6-31+g(d).gjf (generated)

002927147.td-b3lyp_6-31+g(d).firefly.inp (generated)

002927147.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002927147.mol 002927147.PUBCHEM 002927147.mol (via Jmol)
002927160.b3lyp_6-31g(d).inp

002927160.b3lyp_6-31g(d).qchem.inp (generated)

002927160.b3lyp_6-31g(d).gjf (generated)

002927160.b3lyp_6-31g(d).firefly.inp (generated)

002927160.b3lyp_6-31g(d).smash.inp (generated)

002927160.b3lyp_6-31g(d).nwchem.inp (generated) 002927160.b3lyp_6-31g(d).log.xz 002927160.mol 002927160.PUBCHEM 002927160.mol (via Jmol)
002927164.b3lyp_6-31g(d).inp

002927164.b3lyp_6-31g(d).qchem.inp (generated)

002927164.b3lyp_6-31g(d).gjf (generated)

002927164.b3lyp_6-31g(d).firefly.inp (generated)

002927164.b3lyp_6-31g(d).smash.inp (generated)

002927164.b3lyp_6-31g(d).nwchem.inp (generated) 002927164.b3lyp_6-31g(d).log.xz 002927164.td-b3lyp_6-31g+(d).inp 002927164.td-b3lyp_6-31g+(d).log.xz

002927164.td-b3lyp_6-31+g(d).qchem.inp (generated)

002927164.td-b3lyp_6-31+g(d).gjf (generated)

002927164.td-b3lyp_6-31+g(d).firefly.inp (generated)

002927164.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002927164.mol 002927164.PUBCHEM 002927164.mol (via Jmol)
002927178.b3lyp_6-31g(d).inp

002927178.b3lyp_6-31g(d).qchem.inp (generated)

002927178.b3lyp_6-31g(d).gjf (generated)

002927178.b3lyp_6-31g(d).firefly.inp (generated)

002927178.b3lyp_6-31g(d).smash.inp (generated)

002927178.b3lyp_6-31g(d).nwchem.inp (generated) 002927178.b3lyp_6-31g(d).log.xz 002927178.mol 002927178.PUBCHEM 002927178.mol (via Jmol)
002927255.b3lyp_6-31g(d).inp

002927255.b3lyp_6-31g(d).qchem.inp (generated)

002927255.b3lyp_6-31g(d).gjf (generated)

002927255.b3lyp_6-31g(d).firefly.inp (generated)

002927255.b3lyp_6-31g(d).smash.inp (generated)

002927255.b3lyp_6-31g(d).nwchem.inp (generated) 002927255.b3lyp_6-31g(d).log.xz 002927255.mol 002927255.PUBCHEM 002927255.mol (via Jmol)
002927286.b3lyp_6-31g(d).inp

002927286.b3lyp_6-31g(d).qchem.inp (generated)

002927286.b3lyp_6-31g(d).gjf (generated)

002927286.b3lyp_6-31g(d).firefly.inp (generated)

002927286.b3lyp_6-31g(d).smash.inp (generated)

002927286.b3lyp_6-31g(d).nwchem.inp (generated) 002927286.b3lyp_6-31g(d).log.xz 002927286.td-b3lyp_6-31g+(d).inp 002927286.td-b3lyp_6-31g+(d).log.xz

002927286.td-b3lyp_6-31+g(d).qchem.inp (generated)

002927286.td-b3lyp_6-31+g(d).gjf (generated)

002927286.td-b3lyp_6-31+g(d).firefly.inp (generated)

002927286.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002927286.mol 002927286.PUBCHEM 002927286.mol (via Jmol)
002927305.b3lyp_6-31g(d).inp

002927305.b3lyp_6-31g(d).qchem.inp (generated)

002927305.b3lyp_6-31g(d).gjf (generated)

002927305.b3lyp_6-31g(d).firefly.inp (generated)

002927305.b3lyp_6-31g(d).smash.inp (generated)

002927305.b3lyp_6-31g(d).nwchem.inp (generated) 002927305.b3lyp_6-31g(d).log.xz 002927305.td-b3lyp_6-31g+(d).inp 002927305.td-b3lyp_6-31g+(d).log.xz

002927305.td-b3lyp_6-31+g(d).qchem.inp (generated)

002927305.td-b3lyp_6-31+g(d).gjf (generated)

002927305.td-b3lyp_6-31+g(d).firefly.inp (generated)

002927305.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002927305.mol 002927305.PUBCHEM 002927305.mol (via Jmol)
002927458.b3lyp_6-31g(d).inp

002927458.b3lyp_6-31g(d).qchem.inp (generated)

002927458.b3lyp_6-31g(d).gjf (generated)

002927458.b3lyp_6-31g(d).firefly.inp (generated)

002927458.b3lyp_6-31g(d).smash.inp (generated)

002927458.b3lyp_6-31g(d).nwchem.inp (generated) 002927458.b3lyp_6-31g(d).log.xz 002927458.td-b3lyp_6-31g+(d).inp 002927458.td-b3lyp_6-31g+(d).log.xz

002927458.td-b3lyp_6-31+g(d).qchem.inp (generated)

002927458.td-b3lyp_6-31+g(d).gjf (generated)

002927458.td-b3lyp_6-31+g(d).firefly.inp (generated)

002927458.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002927458.mol 002927458.PUBCHEM 002927458.mol (via Jmol)
002927541.b3lyp_6-31g(d).inp

002927541.b3lyp_6-31g(d).qchem.inp (generated)

002927541.b3lyp_6-31g(d).gjf (generated)

002927541.b3lyp_6-31g(d).firefly.inp (generated)

002927541.b3lyp_6-31g(d).smash.inp (generated)

002927541.b3lyp_6-31g(d).nwchem.inp (generated) 002927541.b3lyp_6-31g(d).log.xz 002927541.td-b3lyp_6-31g+(d).inp 002927541.td-b3lyp_6-31g+(d).log.xz

002927541.td-b3lyp_6-31+g(d).qchem.inp (generated)

002927541.td-b3lyp_6-31+g(d).gjf (generated)

002927541.td-b3lyp_6-31+g(d).firefly.inp (generated)

002927541.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002927541.mol 002927541.PUBCHEM 002927541.mol (via Jmol)
002927773.b3lyp_6-31g(d).inp

002927773.b3lyp_6-31g(d).qchem.inp (generated)

002927773.b3lyp_6-31g(d).gjf (generated)

002927773.b3lyp_6-31g(d).firefly.inp (generated)

002927773.b3lyp_6-31g(d).smash.inp (generated)

002927773.b3lyp_6-31g(d).nwchem.inp (generated) 002927773.b3lyp_6-31g(d).log.xz 002927773.td-b3lyp_6-31g+(d).inp 002927773.td-b3lyp_6-31g+(d).log.xz

002927773.td-b3lyp_6-31+g(d).qchem.inp (generated)

002927773.td-b3lyp_6-31+g(d).gjf (generated)

002927773.td-b3lyp_6-31+g(d).firefly.inp (generated)

002927773.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002927773.mol 002927773.PUBCHEM 002927773.mol (via Jmol)
002927826.b3lyp_6-31g(d).inp

002927826.b3lyp_6-31g(d).qchem.inp (generated)

002927826.b3lyp_6-31g(d).gjf (generated)

002927826.b3lyp_6-31g(d).firefly.inp (generated)

002927826.b3lyp_6-31g(d).smash.inp (generated)

002927826.b3lyp_6-31g(d).nwchem.inp (generated) 002927826.b3lyp_6-31g(d).log.xz 002927826.mol 002927826.PUBCHEM 002927826.mol (via Jmol)
002927947.b3lyp_6-31g(d).inp

002927947.b3lyp_6-31g(d).qchem.inp (generated)

002927947.b3lyp_6-31g(d).gjf (generated)

002927947.b3lyp_6-31g(d).firefly.inp (generated)

002927947.b3lyp_6-31g(d).smash.inp (generated)

002927947.b3lyp_6-31g(d).nwchem.inp (generated) 002927947.b3lyp_6-31g(d).log.xz 002927947.mol 002927947.PUBCHEM 002927947.mol (via Jmol)
002927961.b3lyp_6-31g(d).inp

002927961.b3lyp_6-31g(d).qchem.inp (generated)

002927961.b3lyp_6-31g(d).gjf (generated)

002927961.b3lyp_6-31g(d).firefly.inp (generated)

002927961.b3lyp_6-31g(d).smash.inp (generated)

002927961.b3lyp_6-31g(d).nwchem.inp (generated) 002927961.b3lyp_6-31g(d).log.xz 002927961.td-b3lyp_6-31g+(d).inp 002927961.td-b3lyp_6-31g+(d).log.xz

002927961.td-b3lyp_6-31+g(d).qchem.inp (generated)

002927961.td-b3lyp_6-31+g(d).gjf (generated)

002927961.td-b3lyp_6-31+g(d).firefly.inp (generated)

002927961.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002927961.mol 002927961.PUBCHEM 002927961.mol (via Jmol)
002927973.b3lyp_6-31g(d).inp

002927973.b3lyp_6-31g(d).qchem.inp (generated)

002927973.b3lyp_6-31g(d).gjf (generated)

002927973.b3lyp_6-31g(d).firefly.inp (generated)

002927973.b3lyp_6-31g(d).smash.inp (generated)

002927973.b3lyp_6-31g(d).nwchem.inp (generated) 002927973.b3lyp_6-31g(d).log.xz 002927973.td-b3lyp_6-31g+(d).inp 002927973.td-b3lyp_6-31g+(d).log.xz

002927973.td-b3lyp_6-31+g(d).qchem.inp (generated)

002927973.td-b3lyp_6-31+g(d).gjf (generated)

002927973.td-b3lyp_6-31+g(d).firefly.inp (generated)

002927973.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002927973.mol 002927973.PUBCHEM 002927973.mol (via Jmol)
002928027.b3lyp_6-31g(d).inp

002928027.b3lyp_6-31g(d).qchem.inp (generated)

002928027.b3lyp_6-31g(d).gjf (generated)

002928027.b3lyp_6-31g(d).firefly.inp (generated)

002928027.b3lyp_6-31g(d).smash.inp (generated)

002928027.b3lyp_6-31g(d).nwchem.inp (generated) 002928027.b3lyp_6-31g(d).log.xz 002928027.mol 002928027.PUBCHEM 002928027.mol (via Jmol)
002928046.b3lyp_6-31g(d).inp

002928046.b3lyp_6-31g(d).qchem.inp (generated)

002928046.b3lyp_6-31g(d).gjf (generated)

002928046.b3lyp_6-31g(d).firefly.inp (generated)

002928046.b3lyp_6-31g(d).smash.inp (generated)

002928046.b3lyp_6-31g(d).nwchem.inp (generated) 002928046.b3lyp_6-31g(d).log.xz 002928046.td-b3lyp_6-31g+(d).inp 002928046.td-b3lyp_6-31g+(d).log.xz

002928046.td-b3lyp_6-31+g(d).qchem.inp (generated)

002928046.td-b3lyp_6-31+g(d).gjf (generated)

002928046.td-b3lyp_6-31+g(d).firefly.inp (generated)

002928046.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002928046.mol 002928046.PUBCHEM 002928046.mol (via Jmol)
002928063.b3lyp_6-31g(d).inp

002928063.b3lyp_6-31g(d).qchem.inp (generated)

002928063.b3lyp_6-31g(d).gjf (generated)

002928063.b3lyp_6-31g(d).firefly.inp (generated)

002928063.b3lyp_6-31g(d).smash.inp (generated)

002928063.b3lyp_6-31g(d).nwchem.inp (generated) 002928063.b3lyp_6-31g(d).log.xz 002928063.td-b3lyp_6-31g+(d).inp 002928063.td-b3lyp_6-31g+(d).log.xz

002928063.td-b3lyp_6-31+g(d).qchem.inp (generated)

002928063.td-b3lyp_6-31+g(d).gjf (generated)

002928063.td-b3lyp_6-31+g(d).firefly.inp (generated)

002928063.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002928063.mol 002928063.PUBCHEM 002928063.mol (via Jmol)
002928121.b3lyp_6-31g(d).inp

002928121.b3lyp_6-31g(d).qchem.inp (generated)

002928121.b3lyp_6-31g(d).gjf (generated)

002928121.b3lyp_6-31g(d).firefly.inp (generated)

002928121.b3lyp_6-31g(d).smash.inp (generated)

002928121.b3lyp_6-31g(d).nwchem.inp (generated) 002928121.b3lyp_6-31g(d).log.xz 002928121.td-b3lyp_6-31g+(d).inp 002928121.td-b3lyp_6-31g+(d).log.xz

002928121.td-b3lyp_6-31+g(d).qchem.inp (generated)

002928121.td-b3lyp_6-31+g(d).gjf (generated)

002928121.td-b3lyp_6-31+g(d).firefly.inp (generated)

002928121.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002928121.mol 002928121.PUBCHEM 002928121.mol (via Jmol)
002928273.b3lyp_6-31g(d).inp

002928273.b3lyp_6-31g(d).qchem.inp (generated)

002928273.b3lyp_6-31g(d).gjf (generated)

002928273.b3lyp_6-31g(d).firefly.inp (generated)

002928273.b3lyp_6-31g(d).smash.inp (generated)

002928273.b3lyp_6-31g(d).nwchem.inp (generated) 002928273.b3lyp_6-31g(d).log.xz 002928273.td-b3lyp_6-31g+(d).inp 002928273.td-b3lyp_6-31g+(d).log.xz

002928273.td-b3lyp_6-31+g(d).qchem.inp (generated)

002928273.td-b3lyp_6-31+g(d).gjf (generated)

002928273.td-b3lyp_6-31+g(d).firefly.inp (generated)

002928273.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002928273.mol 002928273.PUBCHEM 002928273.mol (via Jmol)
002928280.b3lyp_6-31g(d).inp

002928280.b3lyp_6-31g(d).qchem.inp (generated)

002928280.b3lyp_6-31g(d).gjf (generated)

002928280.b3lyp_6-31g(d).firefly.inp (generated)

002928280.b3lyp_6-31g(d).smash.inp (generated)

002928280.b3lyp_6-31g(d).nwchem.inp (generated) 002928280.b3lyp_6-31g(d).log.xz 002928280.td-b3lyp_6-31g+(d).inp 002928280.td-b3lyp_6-31g+(d).log.xz

002928280.td-b3lyp_6-31+g(d).qchem.inp (generated)

002928280.td-b3lyp_6-31+g(d).gjf (generated)

002928280.td-b3lyp_6-31+g(d).firefly.inp (generated)

002928280.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002928280.mol 002928280.PUBCHEM 002928280.mol (via Jmol)
002928395.b3lyp_6-31g(d).inp

002928395.b3lyp_6-31g(d).qchem.inp (generated)

002928395.b3lyp_6-31g(d).gjf (generated)

002928395.b3lyp_6-31g(d).firefly.inp (generated)

002928395.b3lyp_6-31g(d).smash.inp (generated)

002928395.b3lyp_6-31g(d).nwchem.inp (generated) 002928395.b3lyp_6-31g(d).log.xz 002928395.mol 002928395.PUBCHEM 002928395.mol (via Jmol)
002928438.b3lyp_6-31g(d).inp

002928438.b3lyp_6-31g(d).qchem.inp (generated)

002928438.b3lyp_6-31g(d).gjf (generated)

002928438.b3lyp_6-31g(d).firefly.inp (generated)

002928438.b3lyp_6-31g(d).smash.inp (generated)

002928438.b3lyp_6-31g(d).nwchem.inp (generated) 002928438.b3lyp_6-31g(d).log.xz 002928438.mol 002928438.PUBCHEM 002928438.mol (via Jmol)
002928799.b3lyp_6-31g(d).inp

002928799.b3lyp_6-31g(d).qchem.inp (generated)

002928799.b3lyp_6-31g(d).gjf (generated)

002928799.b3lyp_6-31g(d).firefly.inp (generated)

002928799.b3lyp_6-31g(d).smash.inp (generated)

002928799.b3lyp_6-31g(d).nwchem.inp (generated) 002928799.b3lyp_6-31g(d).log.xz 002928799.td-b3lyp_6-31g+(d).inp 002928799.td-b3lyp_6-31g+(d).log.xz

002928799.td-b3lyp_6-31+g(d).qchem.inp (generated)

002928799.td-b3lyp_6-31+g(d).gjf (generated)

002928799.td-b3lyp_6-31+g(d).firefly.inp (generated)

002928799.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002928799.mol 002928799.PUBCHEM 002928799.mol (via Jmol)
002928982.b3lyp_6-31g(d).inp

002928982.b3lyp_6-31g(d).qchem.inp (generated)

002928982.b3lyp_6-31g(d).gjf (generated)

002928982.b3lyp_6-31g(d).firefly.inp (generated)

002928982.b3lyp_6-31g(d).smash.inp (generated)

002928982.b3lyp_6-31g(d).nwchem.inp (generated) 002928982.b3lyp_6-31g(d).log.xz 002928982.td-b3lyp_6-31g+(d).inp 002928982.td-b3lyp_6-31g+(d).log.xz

002928982.td-b3lyp_6-31+g(d).qchem.inp (generated)

002928982.td-b3lyp_6-31+g(d).gjf (generated)

002928982.td-b3lyp_6-31+g(d).firefly.inp (generated)

002928982.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002928982.mol 002928982.PUBCHEM 002928982.mol (via Jmol)
002929088.b3lyp_6-31g(d).inp

002929088.b3lyp_6-31g(d).qchem.inp (generated)

002929088.b3lyp_6-31g(d).gjf (generated)

002929088.b3lyp_6-31g(d).firefly.inp (generated)

002929088.b3lyp_6-31g(d).smash.inp (generated)

002929088.b3lyp_6-31g(d).nwchem.inp (generated) 002929088.b3lyp_6-31g(d).log.xz 002929088.td-b3lyp_6-31g+(d).inp 002929088.td-b3lyp_6-31g+(d).log.xz

002929088.td-b3lyp_6-31+g(d).qchem.inp (generated)

002929088.td-b3lyp_6-31+g(d).gjf (generated)

002929088.td-b3lyp_6-31+g(d).firefly.inp (generated)

002929088.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002929088.mol 002929088.PUBCHEM 002929088.mol (via Jmol)
002929140.b3lyp_6-31g(d).inp

002929140.b3lyp_6-31g(d).qchem.inp (generated)

002929140.b3lyp_6-31g(d).gjf (generated)

002929140.b3lyp_6-31g(d).firefly.inp (generated)

002929140.b3lyp_6-31g(d).smash.inp (generated)

002929140.b3lyp_6-31g(d).nwchem.inp (generated) 002929140.b3lyp_6-31g(d).log.xz 002929140.td-b3lyp_6-31g+(d).inp 002929140.td-b3lyp_6-31g+(d).log.xz

002929140.td-b3lyp_6-31+g(d).qchem.inp (generated)

002929140.td-b3lyp_6-31+g(d).gjf (generated)

002929140.td-b3lyp_6-31+g(d).firefly.inp (generated)

002929140.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002929140.mol 002929140.PUBCHEM 002929140.mol (via Jmol)
002929207.b3lyp_6-31g(d).inp

002929207.b3lyp_6-31g(d).qchem.inp (generated)

002929207.b3lyp_6-31g(d).gjf (generated)

002929207.b3lyp_6-31g(d).firefly.inp (generated)

002929207.b3lyp_6-31g(d).smash.inp (generated)

002929207.b3lyp_6-31g(d).nwchem.inp (generated) 002929207.b3lyp_6-31g(d).log.xz 002929207.td-b3lyp_6-31g+(d).inp 002929207.td-b3lyp_6-31g+(d).log.xz

002929207.td-b3lyp_6-31+g(d).qchem.inp (generated)

002929207.td-b3lyp_6-31+g(d).gjf (generated)

002929207.td-b3lyp_6-31+g(d).firefly.inp (generated)

002929207.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002929207.mol 002929207.PUBCHEM 002929207.mol (via Jmol)
002929568.b3lyp_6-31g(d).inp

002929568.b3lyp_6-31g(d).qchem.inp (generated)

002929568.b3lyp_6-31g(d).gjf (generated)

002929568.b3lyp_6-31g(d).firefly.inp (generated)

002929568.b3lyp_6-31g(d).smash.inp (generated)

002929568.b3lyp_6-31g(d).nwchem.inp (generated) 002929568.b3lyp_6-31g(d).log.xz 002929568.mol 002929568.PUBCHEM 002929568.mol (via Jmol)
002929732.b3lyp_6-31g(d).inp

002929732.b3lyp_6-31g(d).qchem.inp (generated)

002929732.b3lyp_6-31g(d).gjf (generated)

002929732.b3lyp_6-31g(d).firefly.inp (generated)

002929732.b3lyp_6-31g(d).smash.inp (generated)

002929732.b3lyp_6-31g(d).nwchem.inp (generated) 002929732.b3lyp_6-31g(d).log.xz 002929732.td-b3lyp_6-31g+(d).inp 002929732.td-b3lyp_6-31g+(d).log.xz

002929732.td-b3lyp_6-31+g(d).qchem.inp (generated)

002929732.td-b3lyp_6-31+g(d).gjf (generated)

002929732.td-b3lyp_6-31+g(d).firefly.inp (generated)

002929732.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002929732.mol 002929732.PUBCHEM 002929732.mol (via Jmol)
002929908.b3lyp_6-31g(d).inp

002929908.b3lyp_6-31g(d).qchem.inp (generated)

002929908.b3lyp_6-31g(d).gjf (generated)

002929908.b3lyp_6-31g(d).firefly.inp (generated)

002929908.b3lyp_6-31g(d).smash.inp (generated)

002929908.b3lyp_6-31g(d).nwchem.inp (generated) 002929908.b3lyp_6-31g(d).log.xz 002929908.td-b3lyp_6-31g+(d).inp 002929908.td-b3lyp_6-31g+(d).log.xz

002929908.td-b3lyp_6-31+g(d).qchem.inp (generated)

002929908.td-b3lyp_6-31+g(d).gjf (generated)

002929908.td-b3lyp_6-31+g(d).firefly.inp (generated)

002929908.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002929908.mol 002929908.PUBCHEM 002929908.mol (via Jmol)
002930176.b3lyp_6-31g(d).inp

002930176.b3lyp_6-31g(d).qchem.inp (generated)

002930176.b3lyp_6-31g(d).gjf (generated)

002930176.b3lyp_6-31g(d).firefly.inp (generated)

002930176.b3lyp_6-31g(d).smash.inp (generated)

002930176.b3lyp_6-31g(d).nwchem.inp (generated) 002930176.b3lyp_6-31g(d).log.xz 002930176.mol 002930176.PUBCHEM 002930176.mol (via Jmol)
002930193.b3lyp_6-31g(d).inp

002930193.b3lyp_6-31g(d).qchem.inp (generated)

002930193.b3lyp_6-31g(d).gjf (generated)

002930193.b3lyp_6-31g(d).firefly.inp (generated)

002930193.b3lyp_6-31g(d).smash.inp (generated)

002930193.b3lyp_6-31g(d).nwchem.inp (generated) 002930193.b3lyp_6-31g(d).log.xz 002930193.mol 002930193.PUBCHEM 002930193.mol (via Jmol)
002930475.b3lyp_6-31g(d).inp

002930475.b3lyp_6-31g(d).qchem.inp (generated)

002930475.b3lyp_6-31g(d).gjf (generated)

002930475.b3lyp_6-31g(d).firefly.inp (generated)

002930475.b3lyp_6-31g(d).smash.inp (generated)

002930475.b3lyp_6-31g(d).nwchem.inp (generated) 002930475.b3lyp_6-31g(d).log.xz 002930475.mol 002930475.PUBCHEM 002930475.mol (via Jmol)
002930605.b3lyp_6-31g(d).inp

002930605.b3lyp_6-31g(d).qchem.inp (generated)

002930605.b3lyp_6-31g(d).gjf (generated)

002930605.b3lyp_6-31g(d).firefly.inp (generated)

002930605.b3lyp_6-31g(d).smash.inp (generated)

002930605.b3lyp_6-31g(d).nwchem.inp (generated) 002930605.b3lyp_6-31g(d).log.xz 002930605.td-b3lyp_6-31g+(d).inp 002930605.td-b3lyp_6-31g+(d).log.xz

002930605.td-b3lyp_6-31+g(d).qchem.inp (generated)

002930605.td-b3lyp_6-31+g(d).gjf (generated)

002930605.td-b3lyp_6-31+g(d).firefly.inp (generated)

002930605.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002930605.mol 002930605.PUBCHEM 002930605.mol (via Jmol)
002930610.b3lyp_6-31g(d).inp

002930610.b3lyp_6-31g(d).qchem.inp (generated)

002930610.b3lyp_6-31g(d).gjf (generated)

002930610.b3lyp_6-31g(d).firefly.inp (generated)

002930610.b3lyp_6-31g(d).smash.inp (generated)

002930610.b3lyp_6-31g(d).nwchem.inp (generated) 002930610.b3lyp_6-31g(d).log.xz 002930610.td-b3lyp_6-31g+(d).inp 002930610.td-b3lyp_6-31g+(d).log.xz

002930610.td-b3lyp_6-31+g(d).qchem.inp (generated)

002930610.td-b3lyp_6-31+g(d).gjf (generated)

002930610.td-b3lyp_6-31+g(d).firefly.inp (generated)

002930610.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002930610.mol 002930610.PUBCHEM 002930610.mol (via Jmol)
002930625.b3lyp_6-31g(d).inp

002930625.b3lyp_6-31g(d).qchem.inp (generated)

002930625.b3lyp_6-31g(d).gjf (generated)

002930625.b3lyp_6-31g(d).firefly.inp (generated)

002930625.b3lyp_6-31g(d).smash.inp (generated)

002930625.b3lyp_6-31g(d).nwchem.inp (generated) 002930625.b3lyp_6-31g(d).log.xz 002930625.td-b3lyp_6-31g+(d).inp 002930625.td-b3lyp_6-31g+(d).log.xz

002930625.td-b3lyp_6-31+g(d).qchem.inp (generated)

002930625.td-b3lyp_6-31+g(d).gjf (generated)

002930625.td-b3lyp_6-31+g(d).firefly.inp (generated)

002930625.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002930625.mol 002930625.PUBCHEM 002930625.mol (via Jmol)
002930642.b3lyp_6-31g(d).inp

002930642.b3lyp_6-31g(d).qchem.inp (generated)

002930642.b3lyp_6-31g(d).gjf (generated)

002930642.b3lyp_6-31g(d).firefly.inp (generated)

002930642.b3lyp_6-31g(d).smash.inp (generated)

002930642.b3lyp_6-31g(d).nwchem.inp (generated) 002930642.b3lyp_6-31g(d).log.xz 002930642.td-b3lyp_6-31g+(d).inp 002930642.td-b3lyp_6-31g+(d).log.xz

002930642.td-b3lyp_6-31+g(d).qchem.inp (generated)

002930642.td-b3lyp_6-31+g(d).gjf (generated)

002930642.td-b3lyp_6-31+g(d).firefly.inp (generated)

002930642.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002930642.mol 002930642.PUBCHEM 002930642.mol (via Jmol)
002930684.b3lyp_6-31g(d).inp

002930684.b3lyp_6-31g(d).qchem.inp (generated)

002930684.b3lyp_6-31g(d).gjf (generated)

002930684.b3lyp_6-31g(d).firefly.inp (generated)

002930684.b3lyp_6-31g(d).smash.inp (generated)

002930684.b3lyp_6-31g(d).nwchem.inp (generated) 002930684.b3lyp_6-31g(d).log.xz 002930684.td-b3lyp_6-31g+(d).inp 002930684.td-b3lyp_6-31g+(d).log.xz

002930684.td-b3lyp_6-31+g(d).qchem.inp (generated)

002930684.td-b3lyp_6-31+g(d).gjf (generated)

002930684.td-b3lyp_6-31+g(d).firefly.inp (generated)

002930684.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002930684.mol 002930684.PUBCHEM 002930684.mol (via Jmol)
002930686.b3lyp_6-31g(d).inp

002930686.b3lyp_6-31g(d).qchem.inp (generated)

002930686.b3lyp_6-31g(d).gjf (generated)

002930686.b3lyp_6-31g(d).firefly.inp (generated)

002930686.b3lyp_6-31g(d).smash.inp (generated)

002930686.b3lyp_6-31g(d).nwchem.inp (generated) 002930686.b3lyp_6-31g(d).log.xz 002930686.td-b3lyp_6-31g+(d).inp 002930686.td-b3lyp_6-31g+(d).log.xz

002930686.td-b3lyp_6-31+g(d).qchem.inp (generated)

002930686.td-b3lyp_6-31+g(d).gjf (generated)

002930686.td-b3lyp_6-31+g(d).firefly.inp (generated)

002930686.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002930686.mol 002930686.PUBCHEM 002930686.mol (via Jmol)
002930719.b3lyp_6-31g(d).inp

002930719.b3lyp_6-31g(d).qchem.inp (generated)

002930719.b3lyp_6-31g(d).gjf (generated)

002930719.b3lyp_6-31g(d).firefly.inp (generated)

002930719.b3lyp_6-31g(d).smash.inp (generated)

002930719.b3lyp_6-31g(d).nwchem.inp (generated) 002930719.b3lyp_6-31g(d).log.xz 002930719.td-b3lyp_6-31g+(d).inp 002930719.td-b3lyp_6-31g+(d).log.xz

002930719.td-b3lyp_6-31+g(d).qchem.inp (generated)

002930719.td-b3lyp_6-31+g(d).gjf (generated)

002930719.td-b3lyp_6-31+g(d).firefly.inp (generated)

002930719.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002930719.mol 002930719.PUBCHEM 002930719.mol (via Jmol)
002930880.b3lyp_6-31g(d).inp

002930880.b3lyp_6-31g(d).qchem.inp (generated)

002930880.b3lyp_6-31g(d).gjf (generated)

002930880.b3lyp_6-31g(d).firefly.inp (generated)

002930880.b3lyp_6-31g(d).smash.inp (generated)

002930880.b3lyp_6-31g(d).nwchem.inp (generated) 002930880.b3lyp_6-31g(d).log.xz 002930880.td-b3lyp_6-31g+(d).inp 002930880.td-b3lyp_6-31g+(d).log.xz

002930880.td-b3lyp_6-31+g(d).qchem.inp (generated)

002930880.td-b3lyp_6-31+g(d).gjf (generated)

002930880.td-b3lyp_6-31+g(d).firefly.inp (generated)

002930880.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002930880.mol 002930880.PUBCHEM 002930880.mol (via Jmol)
002930881.b3lyp_6-31g(d).inp

002930881.b3lyp_6-31g(d).qchem.inp (generated)

002930881.b3lyp_6-31g(d).gjf (generated)

002930881.b3lyp_6-31g(d).firefly.inp (generated)

002930881.b3lyp_6-31g(d).smash.inp (generated)

002930881.b3lyp_6-31g(d).nwchem.inp (generated) 002930881.b3lyp_6-31g(d).log.xz 002930881.td-b3lyp_6-31g+(d).inp 002930881.td-b3lyp_6-31g+(d).log.xz

002930881.td-b3lyp_6-31+g(d).qchem.inp (generated)

002930881.td-b3lyp_6-31+g(d).gjf (generated)

002930881.td-b3lyp_6-31+g(d).firefly.inp (generated)

002930881.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002930881.mol 002930881.PUBCHEM 002930881.mol (via Jmol)
002930919.b3lyp_6-31g(d).inp

002930919.b3lyp_6-31g(d).qchem.inp (generated)

002930919.b3lyp_6-31g(d).gjf (generated)

002930919.b3lyp_6-31g(d).firefly.inp (generated)

002930919.b3lyp_6-31g(d).smash.inp (generated)

002930919.b3lyp_6-31g(d).nwchem.inp (generated) 002930919.b3lyp_6-31g(d).log.xz 002930919.td-b3lyp_6-31g+(d).inp 002930919.td-b3lyp_6-31g+(d).log.xz

002930919.td-b3lyp_6-31+g(d).qchem.inp (generated)

002930919.td-b3lyp_6-31+g(d).gjf (generated)

002930919.td-b3lyp_6-31+g(d).firefly.inp (generated)

002930919.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002930919.mol 002930919.PUBCHEM 002930919.mol (via Jmol)
002931018.b3lyp_6-31g(d).inp

002931018.b3lyp_6-31g(d).qchem.inp (generated)

002931018.b3lyp_6-31g(d).gjf (generated)

002931018.b3lyp_6-31g(d).firefly.inp (generated)

002931018.b3lyp_6-31g(d).smash.inp (generated)

002931018.b3lyp_6-31g(d).nwchem.inp (generated) 002931018.b3lyp_6-31g(d).log.xz 002931018.td-b3lyp_6-31g+(d).inp 002931018.td-b3lyp_6-31g+(d).log.xz

002931018.td-b3lyp_6-31+g(d).qchem.inp (generated)

002931018.td-b3lyp_6-31+g(d).gjf (generated)

002931018.td-b3lyp_6-31+g(d).firefly.inp (generated)

002931018.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002931018.mol 002931018.PUBCHEM 002931018.mol (via Jmol)
002931030.b3lyp_6-31g(d).inp

002931030.b3lyp_6-31g(d).qchem.inp (generated)

002931030.b3lyp_6-31g(d).gjf (generated)

002931030.b3lyp_6-31g(d).firefly.inp (generated)

002931030.b3lyp_6-31g(d).smash.inp (generated)

002931030.b3lyp_6-31g(d).nwchem.inp (generated) 002931030.b3lyp_6-31g(d).log.xz 002931030.td-b3lyp_6-31g+(d).inp 002931030.td-b3lyp_6-31g+(d).log.xz

002931030.td-b3lyp_6-31+g(d).qchem.inp (generated)

002931030.td-b3lyp_6-31+g(d).gjf (generated)

002931030.td-b3lyp_6-31+g(d).firefly.inp (generated)

002931030.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002931030.mol 002931030.PUBCHEM 002931030.mol (via Jmol)
002931074.b3lyp_6-31g(d).inp

002931074.b3lyp_6-31g(d).qchem.inp (generated)

002931074.b3lyp_6-31g(d).gjf (generated)

002931074.b3lyp_6-31g(d).firefly.inp (generated)

002931074.b3lyp_6-31g(d).smash.inp (generated)

002931074.b3lyp_6-31g(d).nwchem.inp (generated) 002931074.b3lyp_6-31g(d).log.xz 002931074.mol 002931074.PUBCHEM 002931074.mol (via Jmol)
002931191.b3lyp_6-31g(d).inp

002931191.b3lyp_6-31g(d).qchem.inp (generated)

002931191.b3lyp_6-31g(d).gjf (generated)

002931191.b3lyp_6-31g(d).firefly.inp (generated)

002931191.b3lyp_6-31g(d).smash.inp (generated)

002931191.b3lyp_6-31g(d).nwchem.inp (generated) 002931191.b3lyp_6-31g(d).log.xz 002931191.td-b3lyp_6-31g+(d).inp 002931191.td-b3lyp_6-31g+(d).log.xz

002931191.td-b3lyp_6-31+g(d).qchem.inp (generated)

002931191.td-b3lyp_6-31+g(d).gjf (generated)

002931191.td-b3lyp_6-31+g(d).firefly.inp (generated)

002931191.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002931191.mol 002931191.PUBCHEM 002931191.mol (via Jmol)
002931213.b3lyp_6-31g(d).inp

002931213.b3lyp_6-31g(d).qchem.inp (generated)

002931213.b3lyp_6-31g(d).gjf (generated)

002931213.b3lyp_6-31g(d).firefly.inp (generated)

002931213.b3lyp_6-31g(d).smash.inp (generated)

002931213.b3lyp_6-31g(d).nwchem.inp (generated) 002931213.b3lyp_6-31g(d).log.xz 002931213.td-b3lyp_6-31g+(d).inp 002931213.td-b3lyp_6-31g+(d).log.xz

002931213.td-b3lyp_6-31+g(d).qchem.inp (generated)

002931213.td-b3lyp_6-31+g(d).gjf (generated)

002931213.td-b3lyp_6-31+g(d).firefly.inp (generated)

002931213.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002931213.mol 002931213.PUBCHEM 002931213.mol (via Jmol)
002931220.b3lyp_6-31g(d).inp

002931220.b3lyp_6-31g(d).qchem.inp (generated)

002931220.b3lyp_6-31g(d).gjf (generated)

002931220.b3lyp_6-31g(d).firefly.inp (generated)

002931220.b3lyp_6-31g(d).smash.inp (generated)

002931220.b3lyp_6-31g(d).nwchem.inp (generated) 002931220.b3lyp_6-31g(d).log.xz 002931220.td-b3lyp_6-31g+(d).inp 002931220.td-b3lyp_6-31g+(d).log.xz

002931220.td-b3lyp_6-31+g(d).qchem.inp (generated)

002931220.td-b3lyp_6-31+g(d).gjf (generated)

002931220.td-b3lyp_6-31+g(d).firefly.inp (generated)

002931220.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002931220.mol 002931220.PUBCHEM 002931220.mol (via Jmol)
002931276.b3lyp_6-31g(d).inp

002931276.b3lyp_6-31g(d).qchem.inp (generated)

002931276.b3lyp_6-31g(d).gjf (generated)

002931276.b3lyp_6-31g(d).firefly.inp (generated)

002931276.b3lyp_6-31g(d).smash.inp (generated)

002931276.b3lyp_6-31g(d).nwchem.inp (generated) 002931276.b3lyp_6-31g(d).log.xz 002931276.td-b3lyp_6-31g+(d).inp 002931276.td-b3lyp_6-31g+(d).log.xz

002931276.td-b3lyp_6-31+g(d).qchem.inp (generated)

002931276.td-b3lyp_6-31+g(d).gjf (generated)

002931276.td-b3lyp_6-31+g(d).firefly.inp (generated)

002931276.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002931276.mol 002931276.PUBCHEM 002931276.mol (via Jmol)
002931280.b3lyp_6-31g(d).inp

002931280.b3lyp_6-31g(d).qchem.inp (generated)

002931280.b3lyp_6-31g(d).gjf (generated)

002931280.b3lyp_6-31g(d).firefly.inp (generated)

002931280.b3lyp_6-31g(d).smash.inp (generated)

002931280.b3lyp_6-31g(d).nwchem.inp (generated) 002931280.b3lyp_6-31g(d).log.xz 002931280.td-b3lyp_6-31g+(d).inp 002931280.td-b3lyp_6-31g+(d).log.xz

002931280.td-b3lyp_6-31+g(d).qchem.inp (generated)

002931280.td-b3lyp_6-31+g(d).gjf (generated)

002931280.td-b3lyp_6-31+g(d).firefly.inp (generated)

002931280.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002931280.mol 002931280.PUBCHEM 002931280.mol (via Jmol)
002931303.b3lyp_6-31g(d).inp

002931303.b3lyp_6-31g(d).qchem.inp (generated)

002931303.b3lyp_6-31g(d).gjf (generated)

002931303.b3lyp_6-31g(d).firefly.inp (generated)

002931303.b3lyp_6-31g(d).smash.inp (generated)

002931303.b3lyp_6-31g(d).nwchem.inp (generated) 002931303.b3lyp_6-31g(d).log.xz 002931303.td-b3lyp_6-31g+(d).inp 002931303.td-b3lyp_6-31g+(d).log.xz

002931303.td-b3lyp_6-31+g(d).qchem.inp (generated)

002931303.td-b3lyp_6-31+g(d).gjf (generated)

002931303.td-b3lyp_6-31+g(d).firefly.inp (generated)

002931303.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002931303.mol 002931303.PUBCHEM 002931303.mol (via Jmol)
002931397.b3lyp_6-31g(d).inp

002931397.b3lyp_6-31g(d).qchem.inp (generated)

002931397.b3lyp_6-31g(d).gjf (generated)

002931397.b3lyp_6-31g(d).firefly.inp (generated)

002931397.b3lyp_6-31g(d).smash.inp (generated)

002931397.b3lyp_6-31g(d).nwchem.inp (generated) 002931397.b3lyp_6-31g(d).log.xz 002931397.td-b3lyp_6-31g+(d).inp 002931397.td-b3lyp_6-31g+(d).log.xz

002931397.td-b3lyp_6-31+g(d).qchem.inp (generated)

002931397.td-b3lyp_6-31+g(d).gjf (generated)

002931397.td-b3lyp_6-31+g(d).firefly.inp (generated)

002931397.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002931397.mol 002931397.PUBCHEM 002931397.mol (via Jmol)
002931490.b3lyp_6-31g(d).inp

002931490.b3lyp_6-31g(d).qchem.inp (generated)

002931490.b3lyp_6-31g(d).gjf (generated)

002931490.b3lyp_6-31g(d).firefly.inp (generated)

002931490.b3lyp_6-31g(d).smash.inp (generated)

002931490.b3lyp_6-31g(d).nwchem.inp (generated) 002931490.b3lyp_6-31g(d).log.xz 002931490.mol 002931490.PUBCHEM 002931490.mol (via Jmol)
002931514.b3lyp_6-31g(d).inp

002931514.b3lyp_6-31g(d).qchem.inp (generated)

002931514.b3lyp_6-31g(d).gjf (generated)

002931514.b3lyp_6-31g(d).firefly.inp (generated)

002931514.b3lyp_6-31g(d).smash.inp (generated)

002931514.b3lyp_6-31g(d).nwchem.inp (generated) 002931514.b3lyp_6-31g(d).log.xz 002931514.td-b3lyp_6-31g+(d).inp 002931514.td-b3lyp_6-31g+(d).log.xz

002931514.td-b3lyp_6-31+g(d).qchem.inp (generated)

002931514.td-b3lyp_6-31+g(d).gjf (generated)

002931514.td-b3lyp_6-31+g(d).firefly.inp (generated)

002931514.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002931514.mol 002931514.PUBCHEM 002931514.mol (via Jmol)
002931540.b3lyp_6-31g(d).inp

002931540.b3lyp_6-31g(d).qchem.inp (generated)

002931540.b3lyp_6-31g(d).gjf (generated)

002931540.b3lyp_6-31g(d).firefly.inp (generated)

002931540.b3lyp_6-31g(d).smash.inp (generated)

002931540.b3lyp_6-31g(d).nwchem.inp (generated) 002931540.b3lyp_6-31g(d).log.xz 002931540.mol 002931540.PUBCHEM 002931540.mol (via Jmol)
002931598.b3lyp_6-31g(d).inp

002931598.b3lyp_6-31g(d).qchem.inp (generated)

002931598.b3lyp_6-31g(d).gjf (generated)

002931598.b3lyp_6-31g(d).firefly.inp (generated)

002931598.b3lyp_6-31g(d).smash.inp (generated)

002931598.b3lyp_6-31g(d).nwchem.inp (generated) 002931598.b3lyp_6-31g(d).log.xz 002931598.mol 002931598.PUBCHEM 002931598.mol (via Jmol)
002931664.b3lyp_6-31g(d).inp

002931664.b3lyp_6-31g(d).qchem.inp (generated)

002931664.b3lyp_6-31g(d).gjf (generated)

002931664.b3lyp_6-31g(d).firefly.inp (generated)

002931664.b3lyp_6-31g(d).smash.inp (generated)

002931664.b3lyp_6-31g(d).nwchem.inp (generated) 002931664.b3lyp_6-31g(d).log.xz 002931664.mol 002931664.PUBCHEM 002931664.mol (via Jmol)
002931707.b3lyp_6-31g(d).inp

002931707.b3lyp_6-31g(d).qchem.inp (generated)

002931707.b3lyp_6-31g(d).gjf (generated)

002931707.b3lyp_6-31g(d).firefly.inp (generated)

002931707.b3lyp_6-31g(d).smash.inp (generated)

002931707.b3lyp_6-31g(d).nwchem.inp (generated) 002931707.b3lyp_6-31g(d).log.xz 002931707.td-b3lyp_6-31g+(d).inp 002931707.td-b3lyp_6-31g+(d).log.xz

002931707.td-b3lyp_6-31+g(d).qchem.inp (generated)

002931707.td-b3lyp_6-31+g(d).gjf (generated)

002931707.td-b3lyp_6-31+g(d).firefly.inp (generated)

002931707.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002931707.mol 002931707.PUBCHEM 002931707.mol (via Jmol)
002931791.b3lyp_6-31g(d).inp

002931791.b3lyp_6-31g(d).qchem.inp (generated)

002931791.b3lyp_6-31g(d).gjf (generated)

002931791.b3lyp_6-31g(d).firefly.inp (generated)

002931791.b3lyp_6-31g(d).smash.inp (generated)

002931791.b3lyp_6-31g(d).nwchem.inp (generated) 002931791.b3lyp_6-31g(d).log.xz 002931791.td-b3lyp_6-31g+(d).inp 002931791.td-b3lyp_6-31g+(d).log.xz

002931791.td-b3lyp_6-31+g(d).qchem.inp (generated)

002931791.td-b3lyp_6-31+g(d).gjf (generated)

002931791.td-b3lyp_6-31+g(d).firefly.inp (generated)

002931791.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002931791.mol 002931791.PUBCHEM 002931791.mol (via Jmol)
002931795.b3lyp_6-31g(d).inp

002931795.b3lyp_6-31g(d).qchem.inp (generated)

002931795.b3lyp_6-31g(d).gjf (generated)

002931795.b3lyp_6-31g(d).firefly.inp (generated)

002931795.b3lyp_6-31g(d).smash.inp (generated)

002931795.b3lyp_6-31g(d).nwchem.inp (generated) 002931795.b3lyp_6-31g(d).log.xz 002931795.td-b3lyp_6-31g+(d).inp 002931795.td-b3lyp_6-31g+(d).log.xz

002931795.td-b3lyp_6-31+g(d).qchem.inp (generated)

002931795.td-b3lyp_6-31+g(d).gjf (generated)

002931795.td-b3lyp_6-31+g(d).firefly.inp (generated)

002931795.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002931795.mol 002931795.PUBCHEM 002931795.mol (via Jmol)
002931807.b3lyp_6-31g(d).inp

002931807.b3lyp_6-31g(d).qchem.inp (generated)

002931807.b3lyp_6-31g(d).gjf (generated)

002931807.b3lyp_6-31g(d).firefly.inp (generated)

002931807.b3lyp_6-31g(d).smash.inp (generated)

002931807.b3lyp_6-31g(d).nwchem.inp (generated) 002931807.b3lyp_6-31g(d).log.xz 002931807.td-b3lyp_6-31g+(d).inp 002931807.td-b3lyp_6-31g+(d).log.xz

002931807.td-b3lyp_6-31+g(d).qchem.inp (generated)

002931807.td-b3lyp_6-31+g(d).gjf (generated)

002931807.td-b3lyp_6-31+g(d).firefly.inp (generated)

002931807.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002931807.mol 002931807.PUBCHEM 002931807.mol (via Jmol)
002931889.b3lyp_6-31g(d).inp

002931889.b3lyp_6-31g(d).qchem.inp (generated)

002931889.b3lyp_6-31g(d).gjf (generated)

002931889.b3lyp_6-31g(d).firefly.inp (generated)

002931889.b3lyp_6-31g(d).smash.inp (generated)

002931889.b3lyp_6-31g(d).nwchem.inp (generated) 002931889.b3lyp_6-31g(d).log.xz 002931889.td-b3lyp_6-31g+(d).inp 002931889.td-b3lyp_6-31g+(d).log.xz

002931889.td-b3lyp_6-31+g(d).qchem.inp (generated)

002931889.td-b3lyp_6-31+g(d).gjf (generated)

002931889.td-b3lyp_6-31+g(d).firefly.inp (generated)

002931889.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002931889.mol 002931889.PUBCHEM 002931889.mol (via Jmol)
002931920.b3lyp_6-31g(d).inp

002931920.b3lyp_6-31g(d).qchem.inp (generated)

002931920.b3lyp_6-31g(d).gjf (generated)

002931920.b3lyp_6-31g(d).firefly.inp (generated)

002931920.b3lyp_6-31g(d).smash.inp (generated)

002931920.b3lyp_6-31g(d).nwchem.inp (generated) 002931920.b3lyp_6-31g(d).log.xz 002931920.td-b3lyp_6-31g+(d).inp 002931920.td-b3lyp_6-31g+(d).log.xz

002931920.td-b3lyp_6-31+g(d).qchem.inp (generated)

002931920.td-b3lyp_6-31+g(d).gjf (generated)

002931920.td-b3lyp_6-31+g(d).firefly.inp (generated)

002931920.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002931920.mol 002931920.PUBCHEM 002931920.mol (via Jmol)
002931975.b3lyp_6-31g(d).inp

002931975.b3lyp_6-31g(d).qchem.inp (generated)

002931975.b3lyp_6-31g(d).gjf (generated)

002931975.b3lyp_6-31g(d).firefly.inp (generated)

002931975.b3lyp_6-31g(d).smash.inp (generated)

002931975.b3lyp_6-31g(d).nwchem.inp (generated) 002931975.b3lyp_6-31g(d).log.xz 002931975.td-b3lyp_6-31g+(d).inp 002931975.td-b3lyp_6-31g+(d).log.xz

002931975.td-b3lyp_6-31+g(d).qchem.inp (generated)

002931975.td-b3lyp_6-31+g(d).gjf (generated)

002931975.td-b3lyp_6-31+g(d).firefly.inp (generated)

002931975.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002931975.mol 002931975.PUBCHEM 002931975.mol (via Jmol)
002931999.b3lyp_6-31g(d).inp

002931999.b3lyp_6-31g(d).qchem.inp (generated)

002931999.b3lyp_6-31g(d).gjf (generated)

002931999.b3lyp_6-31g(d).firefly.inp (generated)

002931999.b3lyp_6-31g(d).smash.inp (generated)

002931999.b3lyp_6-31g(d).nwchem.inp (generated) 002931999.b3lyp_6-31g(d).log.xz 002931999.td-b3lyp_6-31g+(d).inp 002931999.td-b3lyp_6-31g+(d).log.xz

002931999.td-b3lyp_6-31+g(d).qchem.inp (generated)

002931999.td-b3lyp_6-31+g(d).gjf (generated)

002931999.td-b3lyp_6-31+g(d).firefly.inp (generated)

002931999.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002931999.mol 002931999.PUBCHEM 002931999.mol (via Jmol)
002932003.b3lyp_6-31g(d).inp

002932003.b3lyp_6-31g(d).qchem.inp (generated)

002932003.b3lyp_6-31g(d).gjf (generated)

002932003.b3lyp_6-31g(d).firefly.inp (generated)

002932003.b3lyp_6-31g(d).smash.inp (generated)

002932003.b3lyp_6-31g(d).nwchem.inp (generated) 002932003.b3lyp_6-31g(d).log.xz 002932003.td-b3lyp_6-31g+(d).inp 002932003.td-b3lyp_6-31g+(d).log.xz

002932003.td-b3lyp_6-31+g(d).qchem.inp (generated)

002932003.td-b3lyp_6-31+g(d).gjf (generated)

002932003.td-b3lyp_6-31+g(d).firefly.inp (generated)

002932003.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002932003.mol 002932003.PUBCHEM 002932003.mol (via Jmol)
002932019.b3lyp_6-31g(d).inp

002932019.b3lyp_6-31g(d).qchem.inp (generated)

002932019.b3lyp_6-31g(d).gjf (generated)

002932019.b3lyp_6-31g(d).firefly.inp (generated)

002932019.b3lyp_6-31g(d).smash.inp (generated)

002932019.b3lyp_6-31g(d).nwchem.inp (generated) 002932019.b3lyp_6-31g(d).log.xz 002932019.td-b3lyp_6-31g+(d).inp 002932019.td-b3lyp_6-31g+(d).log.xz

002932019.td-b3lyp_6-31+g(d).qchem.inp (generated)

002932019.td-b3lyp_6-31+g(d).gjf (generated)

002932019.td-b3lyp_6-31+g(d).firefly.inp (generated)

002932019.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002932019.mol 002932019.PUBCHEM 002932019.mol (via Jmol)
002932208.b3lyp_6-31g(d).inp

002932208.b3lyp_6-31g(d).qchem.inp (generated)

002932208.b3lyp_6-31g(d).gjf (generated)

002932208.b3lyp_6-31g(d).firefly.inp (generated)

002932208.b3lyp_6-31g(d).smash.inp (generated)

002932208.b3lyp_6-31g(d).nwchem.inp (generated) 002932208.b3lyp_6-31g(d).log.xz 002932208.mol 002932208.PUBCHEM 002932208.mol (via Jmol)
002932259.b3lyp_6-31g(d).inp

002932259.b3lyp_6-31g(d).qchem.inp (generated)

002932259.b3lyp_6-31g(d).gjf (generated)

002932259.b3lyp_6-31g(d).firefly.inp (generated)

002932259.b3lyp_6-31g(d).smash.inp (generated)

002932259.b3lyp_6-31g(d).nwchem.inp (generated) 002932259.b3lyp_6-31g(d).log.xz 002932259.td-b3lyp_6-31g+(d).inp 002932259.td-b3lyp_6-31g+(d).log.xz

002932259.td-b3lyp_6-31+g(d).qchem.inp (generated)

002932259.td-b3lyp_6-31+g(d).gjf (generated)

002932259.td-b3lyp_6-31+g(d).firefly.inp (generated)

002932259.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002932259.mol 002932259.PUBCHEM 002932259.mol (via Jmol)
002932320.b3lyp_6-31g(d).inp

002932320.b3lyp_6-31g(d).qchem.inp (generated)

002932320.b3lyp_6-31g(d).gjf (generated)

002932320.b3lyp_6-31g(d).firefly.inp (generated)

002932320.b3lyp_6-31g(d).smash.inp (generated)

002932320.b3lyp_6-31g(d).nwchem.inp (generated) 002932320.b3lyp_6-31g(d).log.xz 002932320.mol 002932320.PUBCHEM 002932320.mol (via Jmol)
002932338.b3lyp_6-31g(d).inp

002932338.b3lyp_6-31g(d).qchem.inp (generated)

002932338.b3lyp_6-31g(d).gjf (generated)

002932338.b3lyp_6-31g(d).firefly.inp (generated)

002932338.b3lyp_6-31g(d).smash.inp (generated)

002932338.b3lyp_6-31g(d).nwchem.inp (generated) 002932338.b3lyp_6-31g(d).log.xz 002932338.td-b3lyp_6-31g+(d).inp 002932338.td-b3lyp_6-31g+(d).log.xz

002932338.td-b3lyp_6-31+g(d).qchem.inp (generated)

002932338.td-b3lyp_6-31+g(d).gjf (generated)

002932338.td-b3lyp_6-31+g(d).firefly.inp (generated)

002932338.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002932338.mol 002932338.PUBCHEM 002932338.mol (via Jmol)
002932350.b3lyp_6-31g(d).inp

002932350.b3lyp_6-31g(d).qchem.inp (generated)

002932350.b3lyp_6-31g(d).gjf (generated)

002932350.b3lyp_6-31g(d).firefly.inp (generated)

002932350.b3lyp_6-31g(d).smash.inp (generated)

002932350.b3lyp_6-31g(d).nwchem.inp (generated) 002932350.b3lyp_6-31g(d).log.xz 002932350.td-b3lyp_6-31g+(d).inp 002932350.td-b3lyp_6-31g+(d).log.xz

002932350.td-b3lyp_6-31+g(d).qchem.inp (generated)

002932350.td-b3lyp_6-31+g(d).gjf (generated)

002932350.td-b3lyp_6-31+g(d).firefly.inp (generated)

002932350.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002932350.mol 002932350.PUBCHEM 002932350.mol (via Jmol)
002932389.b3lyp_6-31g(d).inp

002932389.b3lyp_6-31g(d).qchem.inp (generated)

002932389.b3lyp_6-31g(d).gjf (generated)

002932389.b3lyp_6-31g(d).firefly.inp (generated)

002932389.b3lyp_6-31g(d).smash.inp (generated)

002932389.b3lyp_6-31g(d).nwchem.inp (generated) 002932389.b3lyp_6-31g(d).log.xz 002932389.td-b3lyp_6-31g+(d).inp 002932389.td-b3lyp_6-31g+(d).log.xz

002932389.td-b3lyp_6-31+g(d).qchem.inp (generated)

002932389.td-b3lyp_6-31+g(d).gjf (generated)

002932389.td-b3lyp_6-31+g(d).firefly.inp (generated)

002932389.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002932389.mol 002932389.PUBCHEM 002932389.mol (via Jmol)
002932408.b3lyp_6-31g(d).inp

002932408.b3lyp_6-31g(d).qchem.inp (generated)

002932408.b3lyp_6-31g(d).gjf (generated)

002932408.b3lyp_6-31g(d).firefly.inp (generated)

002932408.b3lyp_6-31g(d).smash.inp (generated)

002932408.b3lyp_6-31g(d).nwchem.inp (generated) 002932408.b3lyp_6-31g(d).log.xz 002932408.td-b3lyp_6-31g+(d).inp 002932408.td-b3lyp_6-31g+(d).log.xz

002932408.td-b3lyp_6-31+g(d).qchem.inp (generated)

002932408.td-b3lyp_6-31+g(d).gjf (generated)

002932408.td-b3lyp_6-31+g(d).firefly.inp (generated)

002932408.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002932408.mol 002932408.PUBCHEM 002932408.mol (via Jmol)
002932413.b3lyp_6-31g(d).inp

002932413.b3lyp_6-31g(d).qchem.inp (generated)

002932413.b3lyp_6-31g(d).gjf (generated)

002932413.b3lyp_6-31g(d).firefly.inp (generated)

002932413.b3lyp_6-31g(d).smash.inp (generated)

002932413.b3lyp_6-31g(d).nwchem.inp (generated) 002932413.b3lyp_6-31g(d).log.xz 002932413.td-b3lyp_6-31g+(d).inp 002932413.td-b3lyp_6-31g+(d).log.xz

002932413.td-b3lyp_6-31+g(d).qchem.inp (generated)

002932413.td-b3lyp_6-31+g(d).gjf (generated)

002932413.td-b3lyp_6-31+g(d).firefly.inp (generated)

002932413.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002932413.mol 002932413.PUBCHEM 002932413.mol (via Jmol)
002932572.b3lyp_6-31g(d).inp

002932572.b3lyp_6-31g(d).qchem.inp (generated)

002932572.b3lyp_6-31g(d).gjf (generated)

002932572.b3lyp_6-31g(d).firefly.inp (generated)

002932572.b3lyp_6-31g(d).smash.inp (generated)

002932572.b3lyp_6-31g(d).nwchem.inp (generated) 002932572.b3lyp_6-31g(d).log.xz 002932572.td-b3lyp_6-31g+(d).inp 002932572.td-b3lyp_6-31g+(d).log.xz

002932572.td-b3lyp_6-31+g(d).qchem.inp (generated)

002932572.td-b3lyp_6-31+g(d).gjf (generated)

002932572.td-b3lyp_6-31+g(d).firefly.inp (generated)

002932572.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002932572.mol 002932572.PUBCHEM 002932572.mol (via Jmol)
002932610.b3lyp_6-31g(d).inp

002932610.b3lyp_6-31g(d).qchem.inp (generated)

002932610.b3lyp_6-31g(d).gjf (generated)

002932610.b3lyp_6-31g(d).firefly.inp (generated)

002932610.b3lyp_6-31g(d).smash.inp (generated)

002932610.b3lyp_6-31g(d).nwchem.inp (generated) 002932610.b3lyp_6-31g(d).log.xz 002932610.td-b3lyp_6-31g+(d).inp 002932610.td-b3lyp_6-31g+(d).log.xz

002932610.td-b3lyp_6-31+g(d).qchem.inp (generated)

002932610.td-b3lyp_6-31+g(d).gjf (generated)

002932610.td-b3lyp_6-31+g(d).firefly.inp (generated)

002932610.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002932610.mol 002932610.PUBCHEM 002932610.mol (via Jmol)
002932656.b3lyp_6-31g(d).inp

002932656.b3lyp_6-31g(d).qchem.inp (generated)

002932656.b3lyp_6-31g(d).gjf (generated)

002932656.b3lyp_6-31g(d).firefly.inp (generated)

002932656.b3lyp_6-31g(d).smash.inp (generated)

002932656.b3lyp_6-31g(d).nwchem.inp (generated) 002932656.b3lyp_6-31g(d).log.xz 002932656.td-b3lyp_6-31g+(d).inp 002932656.td-b3lyp_6-31g+(d).log.xz

002932656.td-b3lyp_6-31+g(d).qchem.inp (generated)

002932656.td-b3lyp_6-31+g(d).gjf (generated)

002932656.td-b3lyp_6-31+g(d).firefly.inp (generated)

002932656.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002932656.mol 002932656.PUBCHEM 002932656.mol (via Jmol)
002932684.b3lyp_6-31g(d).inp

002932684.b3lyp_6-31g(d).qchem.inp (generated)

002932684.b3lyp_6-31g(d).gjf (generated)

002932684.b3lyp_6-31g(d).firefly.inp (generated)

002932684.b3lyp_6-31g(d).smash.inp (generated)

002932684.b3lyp_6-31g(d).nwchem.inp (generated) 002932684.b3lyp_6-31g(d).log.xz 002932684.td-b3lyp_6-31g+(d).inp 002932684.td-b3lyp_6-31g+(d).log.xz

002932684.td-b3lyp_6-31+g(d).qchem.inp (generated)

002932684.td-b3lyp_6-31+g(d).gjf (generated)

002932684.td-b3lyp_6-31+g(d).firefly.inp (generated)

002932684.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002932684.mol 002932684.PUBCHEM 002932684.mol (via Jmol)
002932712.b3lyp_6-31g(d).inp

002932712.b3lyp_6-31g(d).qchem.inp (generated)

002932712.b3lyp_6-31g(d).gjf (generated)

002932712.b3lyp_6-31g(d).firefly.inp (generated)

002932712.b3lyp_6-31g(d).smash.inp (generated)

002932712.b3lyp_6-31g(d).nwchem.inp (generated) 002932712.b3lyp_6-31g(d).log.xz 002932712.td-b3lyp_6-31g+(d).inp 002932712.td-b3lyp_6-31g+(d).log.xz

002932712.td-b3lyp_6-31+g(d).qchem.inp (generated)

002932712.td-b3lyp_6-31+g(d).gjf (generated)

002932712.td-b3lyp_6-31+g(d).firefly.inp (generated)

002932712.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002932712.mol 002932712.PUBCHEM 002932712.mol (via Jmol)
002932732.b3lyp_6-31g(d).inp

002932732.b3lyp_6-31g(d).qchem.inp (generated)

002932732.b3lyp_6-31g(d).gjf (generated)

002932732.b3lyp_6-31g(d).firefly.inp (generated)

002932732.b3lyp_6-31g(d).smash.inp (generated)

002932732.b3lyp_6-31g(d).nwchem.inp (generated) 002932732.b3lyp_6-31g(d).log.xz 002932732.mol 002932732.PUBCHEM 002932732.mol (via Jmol)
002932769.b3lyp_6-31g(d).inp

002932769.b3lyp_6-31g(d).qchem.inp (generated)

002932769.b3lyp_6-31g(d).gjf (generated)

002932769.b3lyp_6-31g(d).firefly.inp (generated)

002932769.b3lyp_6-31g(d).smash.inp (generated)

002932769.b3lyp_6-31g(d).nwchem.inp (generated) 002932769.b3lyp_6-31g(d).log.xz 002932769.td-b3lyp_6-31g+(d).inp 002932769.td-b3lyp_6-31g+(d).log.xz

002932769.td-b3lyp_6-31+g(d).qchem.inp (generated)

002932769.td-b3lyp_6-31+g(d).gjf (generated)

002932769.td-b3lyp_6-31+g(d).firefly.inp (generated)

002932769.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002932769.mol 002932769.PUBCHEM 002932769.mol (via Jmol)
002932814.b3lyp_6-31g(d).inp

002932814.b3lyp_6-31g(d).qchem.inp (generated)

002932814.b3lyp_6-31g(d).gjf (generated)

002932814.b3lyp_6-31g(d).firefly.inp (generated)

002932814.b3lyp_6-31g(d).smash.inp (generated)

002932814.b3lyp_6-31g(d).nwchem.inp (generated) 002932814.b3lyp_6-31g(d).log.xz 002932814.td-b3lyp_6-31g+(d).inp 002932814.td-b3lyp_6-31g+(d).log.xz

002932814.td-b3lyp_6-31+g(d).qchem.inp (generated)

002932814.td-b3lyp_6-31+g(d).gjf (generated)

002932814.td-b3lyp_6-31+g(d).firefly.inp (generated)

002932814.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002932814.mol 002932814.PUBCHEM 002932814.mol (via Jmol)
002932827.b3lyp_6-31g(d).inp

002932827.b3lyp_6-31g(d).qchem.inp (generated)

002932827.b3lyp_6-31g(d).gjf (generated)

002932827.b3lyp_6-31g(d).firefly.inp (generated)

002932827.b3lyp_6-31g(d).smash.inp (generated)

002932827.b3lyp_6-31g(d).nwchem.inp (generated) 002932827.b3lyp_6-31g(d).log.xz 002932827.mol 002932827.PUBCHEM 002932827.mol (via Jmol)
002932830.b3lyp_6-31g(d).inp

002932830.b3lyp_6-31g(d).qchem.inp (generated)

002932830.b3lyp_6-31g(d).gjf (generated)

002932830.b3lyp_6-31g(d).firefly.inp (generated)

002932830.b3lyp_6-31g(d).smash.inp (generated)

002932830.b3lyp_6-31g(d).nwchem.inp (generated) 002932830.b3lyp_6-31g(d).log.xz 002932830.mol 002932830.PUBCHEM 002932830.mol (via Jmol)
002932836.b3lyp_6-31g(d).inp

002932836.b3lyp_6-31g(d).qchem.inp (generated)

002932836.b3lyp_6-31g(d).gjf (generated)

002932836.b3lyp_6-31g(d).firefly.inp (generated)

002932836.b3lyp_6-31g(d).smash.inp (generated)

002932836.b3lyp_6-31g(d).nwchem.inp (generated) 002932836.b3lyp_6-31g(d).log.xz 002932836.mol 002932836.PUBCHEM 002932836.mol (via Jmol)
002932856.b3lyp_6-31g(d).inp

002932856.b3lyp_6-31g(d).qchem.inp (generated)

002932856.b3lyp_6-31g(d).gjf (generated)

002932856.b3lyp_6-31g(d).firefly.inp (generated)

002932856.b3lyp_6-31g(d).smash.inp (generated)

002932856.b3lyp_6-31g(d).nwchem.inp (generated) 002932856.b3lyp_6-31g(d).log.xz 002932856.td-b3lyp_6-31g+(d).inp 002932856.td-b3lyp_6-31g+(d).log.xz

002932856.td-b3lyp_6-31+g(d).qchem.inp (generated)

002932856.td-b3lyp_6-31+g(d).gjf (generated)

002932856.td-b3lyp_6-31+g(d).firefly.inp (generated)

002932856.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002932856.mol 002932856.PUBCHEM 002932856.mol (via Jmol)
002932888.b3lyp_6-31g(d).inp

002932888.b3lyp_6-31g(d).qchem.inp (generated)

002932888.b3lyp_6-31g(d).gjf (generated)

002932888.b3lyp_6-31g(d).firefly.inp (generated)

002932888.b3lyp_6-31g(d).smash.inp (generated)

002932888.b3lyp_6-31g(d).nwchem.inp (generated) 002932888.b3lyp_6-31g(d).log.xz 002932888.td-b3lyp_6-31g+(d).inp 002932888.td-b3lyp_6-31g+(d).log.xz

002932888.td-b3lyp_6-31+g(d).qchem.inp (generated)

002932888.td-b3lyp_6-31+g(d).gjf (generated)

002932888.td-b3lyp_6-31+g(d).firefly.inp (generated)

002932888.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002932888.mol 002932888.PUBCHEM 002932888.mol (via Jmol)
002932914.b3lyp_6-31g(d).inp

002932914.b3lyp_6-31g(d).qchem.inp (generated)

002932914.b3lyp_6-31g(d).gjf (generated)

002932914.b3lyp_6-31g(d).firefly.inp (generated)

002932914.b3lyp_6-31g(d).smash.inp (generated)

002932914.b3lyp_6-31g(d).nwchem.inp (generated) 002932914.b3lyp_6-31g(d).log.xz 002932914.td-b3lyp_6-31g+(d).inp 002932914.td-b3lyp_6-31g+(d).log.xz

002932914.td-b3lyp_6-31+g(d).qchem.inp (generated)

002932914.td-b3lyp_6-31+g(d).gjf (generated)

002932914.td-b3lyp_6-31+g(d).firefly.inp (generated)

002932914.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002932914.mol 002932914.PUBCHEM 002932914.mol (via Jmol)
002932918.b3lyp_6-31g(d).inp

002932918.b3lyp_6-31g(d).qchem.inp (generated)

002932918.b3lyp_6-31g(d).gjf (generated)

002932918.b3lyp_6-31g(d).firefly.inp (generated)

002932918.b3lyp_6-31g(d).smash.inp (generated)

002932918.b3lyp_6-31g(d).nwchem.inp (generated) 002932918.b3lyp_6-31g(d).log.xz 002932918.td-b3lyp_6-31g+(d).inp 002932918.td-b3lyp_6-31g+(d).log.xz

002932918.td-b3lyp_6-31+g(d).qchem.inp (generated)

002932918.td-b3lyp_6-31+g(d).gjf (generated)

002932918.td-b3lyp_6-31+g(d).firefly.inp (generated)

002932918.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002932918.mol 002932918.PUBCHEM 002932918.mol (via Jmol)
002932925.b3lyp_6-31g(d).inp

002932925.b3lyp_6-31g(d).qchem.inp (generated)

002932925.b3lyp_6-31g(d).gjf (generated)

002932925.b3lyp_6-31g(d).firefly.inp (generated)

002932925.b3lyp_6-31g(d).smash.inp (generated)

002932925.b3lyp_6-31g(d).nwchem.inp (generated) 002932925.b3lyp_6-31g(d).log.xz 002932925.td-b3lyp_6-31g+(d).inp 002932925.td-b3lyp_6-31g+(d).log.xz

002932925.td-b3lyp_6-31+g(d).qchem.inp (generated)

002932925.td-b3lyp_6-31+g(d).gjf (generated)

002932925.td-b3lyp_6-31+g(d).firefly.inp (generated)

002932925.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002932925.mol 002932925.PUBCHEM 002932925.mol (via Jmol)
002932979.b3lyp_6-31g(d).inp

002932979.b3lyp_6-31g(d).qchem.inp (generated)

002932979.b3lyp_6-31g(d).gjf (generated)

002932979.b3lyp_6-31g(d).firefly.inp (generated)

002932979.b3lyp_6-31g(d).smash.inp (generated)

002932979.b3lyp_6-31g(d).nwchem.inp (generated) 002932979.b3lyp_6-31g(d).log.xz 002932979.mol 002932979.PUBCHEM 002932979.mol (via Jmol)
002933005.b3lyp_6-31g(d).inp

002933005.b3lyp_6-31g(d).qchem.inp (generated)

002933005.b3lyp_6-31g(d).gjf (generated)

002933005.b3lyp_6-31g(d).firefly.inp (generated)

002933005.b3lyp_6-31g(d).smash.inp (generated)

002933005.b3lyp_6-31g(d).nwchem.inp (generated) 002933005.b3lyp_6-31g(d).log.xz 002933005.td-b3lyp_6-31g+(d).inp 002933005.td-b3lyp_6-31g+(d).log.xz

002933005.td-b3lyp_6-31+g(d).qchem.inp (generated)

002933005.td-b3lyp_6-31+g(d).gjf (generated)

002933005.td-b3lyp_6-31+g(d).firefly.inp (generated)

002933005.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002933005.mol 002933005.PUBCHEM 002933005.mol (via Jmol)
002933119.b3lyp_6-31g(d).inp

002933119.b3lyp_6-31g(d).qchem.inp (generated)

002933119.b3lyp_6-31g(d).gjf (generated)

002933119.b3lyp_6-31g(d).firefly.inp (generated)

002933119.b3lyp_6-31g(d).smash.inp (generated)

002933119.b3lyp_6-31g(d).nwchem.inp (generated) 002933119.b3lyp_6-31g(d).log.xz 002933119.td-b3lyp_6-31g+(d).inp 002933119.td-b3lyp_6-31g+(d).log.xz

002933119.td-b3lyp_6-31+g(d).qchem.inp (generated)

002933119.td-b3lyp_6-31+g(d).gjf (generated)

002933119.td-b3lyp_6-31+g(d).firefly.inp (generated)

002933119.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002933119.mol 002933119.PUBCHEM 002933119.mol (via Jmol)
002933198.b3lyp_6-31g(d).inp

002933198.b3lyp_6-31g(d).qchem.inp (generated)

002933198.b3lyp_6-31g(d).gjf (generated)

002933198.b3lyp_6-31g(d).firefly.inp (generated)

002933198.b3lyp_6-31g(d).smash.inp (generated)

002933198.b3lyp_6-31g(d).nwchem.inp (generated) 002933198.b3lyp_6-31g(d).log.xz 002933198.mol 002933198.PUBCHEM 002933198.mol (via Jmol)
002933201.b3lyp_6-31g(d).inp

002933201.b3lyp_6-31g(d).qchem.inp (generated)

002933201.b3lyp_6-31g(d).gjf (generated)

002933201.b3lyp_6-31g(d).firefly.inp (generated)

002933201.b3lyp_6-31g(d).smash.inp (generated)

002933201.b3lyp_6-31g(d).nwchem.inp (generated) 002933201.b3lyp_6-31g(d).log.xz 002933201.td-b3lyp_6-31g+(d).inp 002933201.td-b3lyp_6-31g+(d).log.xz

002933201.td-b3lyp_6-31+g(d).qchem.inp (generated)

002933201.td-b3lyp_6-31+g(d).gjf (generated)

002933201.td-b3lyp_6-31+g(d).firefly.inp (generated)

002933201.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002933201.mol 002933201.PUBCHEM 002933201.mol (via Jmol)
002933217.b3lyp_6-31g(d).inp

002933217.b3lyp_6-31g(d).qchem.inp (generated)

002933217.b3lyp_6-31g(d).gjf (generated)

002933217.b3lyp_6-31g(d).firefly.inp (generated)

002933217.b3lyp_6-31g(d).smash.inp (generated)

002933217.b3lyp_6-31g(d).nwchem.inp (generated) 002933217.b3lyp_6-31g(d).log.xz 002933217.td-b3lyp_6-31g+(d).inp 002933217.td-b3lyp_6-31g+(d).log.xz

002933217.td-b3lyp_6-31+g(d).qchem.inp (generated)

002933217.td-b3lyp_6-31+g(d).gjf (generated)

002933217.td-b3lyp_6-31+g(d).firefly.inp (generated)

002933217.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002933217.mol 002933217.PUBCHEM 002933217.mol (via Jmol)
002933228.b3lyp_6-31g(d).inp

002933228.b3lyp_6-31g(d).qchem.inp (generated)

002933228.b3lyp_6-31g(d).gjf (generated)

002933228.b3lyp_6-31g(d).firefly.inp (generated)

002933228.b3lyp_6-31g(d).smash.inp (generated)

002933228.b3lyp_6-31g(d).nwchem.inp (generated) 002933228.b3lyp_6-31g(d).log.xz 002933228.td-b3lyp_6-31g+(d).inp 002933228.td-b3lyp_6-31g+(d).log.xz

002933228.td-b3lyp_6-31+g(d).qchem.inp (generated)

002933228.td-b3lyp_6-31+g(d).gjf (generated)

002933228.td-b3lyp_6-31+g(d).firefly.inp (generated)

002933228.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002933228.mol 002933228.PUBCHEM 002933228.mol (via Jmol)
002933261.b3lyp_6-31g(d).inp

002933261.b3lyp_6-31g(d).qchem.inp (generated)

002933261.b3lyp_6-31g(d).gjf (generated)

002933261.b3lyp_6-31g(d).firefly.inp (generated)

002933261.b3lyp_6-31g(d).smash.inp (generated)

002933261.b3lyp_6-31g(d).nwchem.inp (generated) 002933261.b3lyp_6-31g(d).log.xz 002933261.mol 002933261.PUBCHEM 002933261.mol (via Jmol)
002933271.b3lyp_6-31g(d).inp

002933271.b3lyp_6-31g(d).qchem.inp (generated)

002933271.b3lyp_6-31g(d).gjf (generated)

002933271.b3lyp_6-31g(d).firefly.inp (generated)

002933271.b3lyp_6-31g(d).smash.inp (generated)

002933271.b3lyp_6-31g(d).nwchem.inp (generated) 002933271.b3lyp_6-31g(d).log.xz 002933271.mol 002933271.PUBCHEM 002933271.mol (via Jmol)
002933282.b3lyp_6-31g(d).inp

002933282.b3lyp_6-31g(d).qchem.inp (generated)

002933282.b3lyp_6-31g(d).gjf (generated)

002933282.b3lyp_6-31g(d).firefly.inp (generated)

002933282.b3lyp_6-31g(d).smash.inp (generated)

002933282.b3lyp_6-31g(d).nwchem.inp (generated) 002933282.b3lyp_6-31g(d).log.xz 002933282.mol 002933282.PUBCHEM 002933282.mol (via Jmol)
002933325.b3lyp_6-31g(d).inp

002933325.b3lyp_6-31g(d).qchem.inp (generated)

002933325.b3lyp_6-31g(d).gjf (generated)

002933325.b3lyp_6-31g(d).firefly.inp (generated)

002933325.b3lyp_6-31g(d).smash.inp (generated)

002933325.b3lyp_6-31g(d).nwchem.inp (generated) 002933325.b3lyp_6-31g(d).log.xz 002933325.td-b3lyp_6-31g+(d).inp 002933325.td-b3lyp_6-31g+(d).log.xz

002933325.td-b3lyp_6-31+g(d).qchem.inp (generated)

002933325.td-b3lyp_6-31+g(d).gjf (generated)

002933325.td-b3lyp_6-31+g(d).firefly.inp (generated)

002933325.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002933325.mol 002933325.PUBCHEM 002933325.mol (via Jmol)
002933352.b3lyp_6-31g(d).inp

002933352.b3lyp_6-31g(d).qchem.inp (generated)

002933352.b3lyp_6-31g(d).gjf (generated)

002933352.b3lyp_6-31g(d).firefly.inp (generated)

002933352.b3lyp_6-31g(d).smash.inp (generated)

002933352.b3lyp_6-31g(d).nwchem.inp (generated) 002933352.b3lyp_6-31g(d).log.xz 002933352.mol 002933352.PUBCHEM 002933352.mol (via Jmol)
002933354.b3lyp_6-31g(d).inp

002933354.b3lyp_6-31g(d).qchem.inp (generated)

002933354.b3lyp_6-31g(d).gjf (generated)

002933354.b3lyp_6-31g(d).firefly.inp (generated)

002933354.b3lyp_6-31g(d).smash.inp (generated)

002933354.b3lyp_6-31g(d).nwchem.inp (generated) 002933354.b3lyp_6-31g(d).log.xz 002933354.td-b3lyp_6-31g+(d).inp 002933354.td-b3lyp_6-31g+(d).log.xz

002933354.td-b3lyp_6-31+g(d).qchem.inp (generated)

002933354.td-b3lyp_6-31+g(d).gjf (generated)

002933354.td-b3lyp_6-31+g(d).firefly.inp (generated)

002933354.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002933354.mol 002933354.PUBCHEM 002933354.mol (via Jmol)
002933365.b3lyp_6-31g(d).inp

002933365.b3lyp_6-31g(d).qchem.inp (generated)

002933365.b3lyp_6-31g(d).gjf (generated)

002933365.b3lyp_6-31g(d).firefly.inp (generated)

002933365.b3lyp_6-31g(d).smash.inp (generated)

002933365.b3lyp_6-31g(d).nwchem.inp (generated) 002933365.b3lyp_6-31g(d).log.xz 002933365.td-b3lyp_6-31g+(d).inp 002933365.td-b3lyp_6-31g+(d).log.xz

002933365.td-b3lyp_6-31+g(d).qchem.inp (generated)

002933365.td-b3lyp_6-31+g(d).gjf (generated)

002933365.td-b3lyp_6-31+g(d).firefly.inp (generated)

002933365.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002933365.mol 002933365.PUBCHEM 002933365.mol (via Jmol)
002933448.b3lyp_6-31g(d).inp

002933448.b3lyp_6-31g(d).qchem.inp (generated)

002933448.b3lyp_6-31g(d).gjf (generated)

002933448.b3lyp_6-31g(d).firefly.inp (generated)

002933448.b3lyp_6-31g(d).smash.inp (generated)

002933448.b3lyp_6-31g(d).nwchem.inp (generated) 002933448.b3lyp_6-31g(d).log.xz 002933448.td-b3lyp_6-31g+(d).inp 002933448.td-b3lyp_6-31g+(d).log.xz

002933448.td-b3lyp_6-31+g(d).qchem.inp (generated)

002933448.td-b3lyp_6-31+g(d).gjf (generated)

002933448.td-b3lyp_6-31+g(d).firefly.inp (generated)

002933448.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002933448.mol 002933448.PUBCHEM 002933448.mol (via Jmol)
002933464.b3lyp_6-31g(d).inp

002933464.b3lyp_6-31g(d).qchem.inp (generated)

002933464.b3lyp_6-31g(d).gjf (generated)

002933464.b3lyp_6-31g(d).firefly.inp (generated)

002933464.b3lyp_6-31g(d).smash.inp (generated)

002933464.b3lyp_6-31g(d).nwchem.inp (generated) 002933464.b3lyp_6-31g(d).log.xz 002933464.mol 002933464.PUBCHEM 002933464.mol (via Jmol)
002933499.b3lyp_6-31g(d).inp

002933499.b3lyp_6-31g(d).qchem.inp (generated)

002933499.b3lyp_6-31g(d).gjf (generated)

002933499.b3lyp_6-31g(d).firefly.inp (generated)

002933499.b3lyp_6-31g(d).smash.inp (generated)

002933499.b3lyp_6-31g(d).nwchem.inp (generated) 002933499.b3lyp_6-31g(d).log.xz 002933499.td-b3lyp_6-31g+(d).inp 002933499.td-b3lyp_6-31g+(d).log.xz

002933499.td-b3lyp_6-31+g(d).qchem.inp (generated)

002933499.td-b3lyp_6-31+g(d).gjf (generated)

002933499.td-b3lyp_6-31+g(d).firefly.inp (generated)

002933499.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002933499.mol 002933499.PUBCHEM 002933499.mol (via Jmol)
002933536.b3lyp_6-31g(d).inp

002933536.b3lyp_6-31g(d).qchem.inp (generated)

002933536.b3lyp_6-31g(d).gjf (generated)

002933536.b3lyp_6-31g(d).firefly.inp (generated)

002933536.b3lyp_6-31g(d).smash.inp (generated)

002933536.b3lyp_6-31g(d).nwchem.inp (generated) 002933536.b3lyp_6-31g(d).log.xz 002933536.td-b3lyp_6-31g+(d).inp 002933536.td-b3lyp_6-31g+(d).log.xz

002933536.td-b3lyp_6-31+g(d).qchem.inp (generated)

002933536.td-b3lyp_6-31+g(d).gjf (generated)

002933536.td-b3lyp_6-31+g(d).firefly.inp (generated)

002933536.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002933536.mol 002933536.PUBCHEM 002933536.mol (via Jmol)
002933570.b3lyp_6-31g(d).inp

002933570.b3lyp_6-31g(d).qchem.inp (generated)

002933570.b3lyp_6-31g(d).gjf (generated)

002933570.b3lyp_6-31g(d).firefly.inp (generated)

002933570.b3lyp_6-31g(d).smash.inp (generated)

002933570.b3lyp_6-31g(d).nwchem.inp (generated) 002933570.b3lyp_6-31g(d).log.xz 002933570.td-b3lyp_6-31g+(d).inp 002933570.td-b3lyp_6-31g+(d).log.xz

002933570.td-b3lyp_6-31+g(d).qchem.inp (generated)

002933570.td-b3lyp_6-31+g(d).gjf (generated)

002933570.td-b3lyp_6-31+g(d).firefly.inp (generated)

002933570.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002933570.mol 002933570.PUBCHEM 002933570.mol (via Jmol)
002933571.b3lyp_6-31g(d).inp

002933571.b3lyp_6-31g(d).qchem.inp (generated)

002933571.b3lyp_6-31g(d).gjf (generated)

002933571.b3lyp_6-31g(d).firefly.inp (generated)

002933571.b3lyp_6-31g(d).smash.inp (generated)

002933571.b3lyp_6-31g(d).nwchem.inp (generated) 002933571.b3lyp_6-31g(d).log.xz 002933571.td-b3lyp_6-31g+(d).inp 002933571.td-b3lyp_6-31g+(d).log.xz

002933571.td-b3lyp_6-31+g(d).qchem.inp (generated)

002933571.td-b3lyp_6-31+g(d).gjf (generated)

002933571.td-b3lyp_6-31+g(d).firefly.inp (generated)

002933571.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002933571.mol 002933571.PUBCHEM 002933571.mol (via Jmol)
002933629.b3lyp_6-31g(d).inp

002933629.b3lyp_6-31g(d).qchem.inp (generated)

002933629.b3lyp_6-31g(d).gjf (generated)

002933629.b3lyp_6-31g(d).firefly.inp (generated)

002933629.b3lyp_6-31g(d).smash.inp (generated)

002933629.b3lyp_6-31g(d).nwchem.inp (generated) 002933629.b3lyp_6-31g(d).log.xz 002933629.td-b3lyp_6-31g+(d).inp 002933629.td-b3lyp_6-31g+(d).log.xz

002933629.td-b3lyp_6-31+g(d).qchem.inp (generated)

002933629.td-b3lyp_6-31+g(d).gjf (generated)

002933629.td-b3lyp_6-31+g(d).firefly.inp (generated)

002933629.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002933629.mol 002933629.PUBCHEM 002933629.mol (via Jmol)
002933637.b3lyp_6-31g(d).inp

002933637.b3lyp_6-31g(d).qchem.inp (generated)

002933637.b3lyp_6-31g(d).gjf (generated)

002933637.b3lyp_6-31g(d).firefly.inp (generated)

002933637.b3lyp_6-31g(d).smash.inp (generated)

002933637.b3lyp_6-31g(d).nwchem.inp (generated) 002933637.b3lyp_6-31g(d).log.xz 002933637.td-b3lyp_6-31g+(d).inp 002933637.td-b3lyp_6-31g+(d).log.xz

002933637.td-b3lyp_6-31+g(d).qchem.inp (generated)

002933637.td-b3lyp_6-31+g(d).gjf (generated)

002933637.td-b3lyp_6-31+g(d).firefly.inp (generated)

002933637.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002933637.mol 002933637.PUBCHEM 002933637.mol (via Jmol)
002933673.b3lyp_6-31g(d).inp

002933673.b3lyp_6-31g(d).qchem.inp (generated)

002933673.b3lyp_6-31g(d).gjf (generated)

002933673.b3lyp_6-31g(d).firefly.inp (generated)

002933673.b3lyp_6-31g(d).smash.inp (generated)

002933673.b3lyp_6-31g(d).nwchem.inp (generated) 002933673.b3lyp_6-31g(d).log.xz 002933673.td-b3lyp_6-31g+(d).inp 002933673.td-b3lyp_6-31g+(d).log.xz

002933673.td-b3lyp_6-31+g(d).qchem.inp (generated)

002933673.td-b3lyp_6-31+g(d).gjf (generated)

002933673.td-b3lyp_6-31+g(d).firefly.inp (generated)

002933673.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002933673.mol 002933673.PUBCHEM 002933673.mol (via Jmol)
002933706.b3lyp_6-31g(d).inp

002933706.b3lyp_6-31g(d).qchem.inp (generated)

002933706.b3lyp_6-31g(d).gjf (generated)

002933706.b3lyp_6-31g(d).firefly.inp (generated)

002933706.b3lyp_6-31g(d).smash.inp (generated)

002933706.b3lyp_6-31g(d).nwchem.inp (generated) 002933706.b3lyp_6-31g(d).log.xz 002933706.td-b3lyp_6-31g+(d).inp 002933706.td-b3lyp_6-31g+(d).log.xz

002933706.td-b3lyp_6-31+g(d).qchem.inp (generated)

002933706.td-b3lyp_6-31+g(d).gjf (generated)

002933706.td-b3lyp_6-31+g(d).firefly.inp (generated)

002933706.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002933706.mol 002933706.PUBCHEM 002933706.mol (via Jmol)
002933714.b3lyp_6-31g(d).inp

002933714.b3lyp_6-31g(d).qchem.inp (generated)

002933714.b3lyp_6-31g(d).gjf (generated)

002933714.b3lyp_6-31g(d).firefly.inp (generated)

002933714.b3lyp_6-31g(d).smash.inp (generated)

002933714.b3lyp_6-31g(d).nwchem.inp (generated) 002933714.b3lyp_6-31g(d).log.xz 002933714.mol 002933714.PUBCHEM 002933714.mol (via Jmol)
002933729.b3lyp_6-31g(d).inp

002933729.b3lyp_6-31g(d).qchem.inp (generated)

002933729.b3lyp_6-31g(d).gjf (generated)

002933729.b3lyp_6-31g(d).firefly.inp (generated)

002933729.b3lyp_6-31g(d).smash.inp (generated)

002933729.b3lyp_6-31g(d).nwchem.inp (generated) 002933729.b3lyp_6-31g(d).log.xz 002933729.td-b3lyp_6-31g+(d).inp 002933729.td-b3lyp_6-31g+(d).log.xz

002933729.td-b3lyp_6-31+g(d).qchem.inp (generated)

002933729.td-b3lyp_6-31+g(d).gjf (generated)

002933729.td-b3lyp_6-31+g(d).firefly.inp (generated)

002933729.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002933729.mol 002933729.PUBCHEM 002933729.mol (via Jmol)
002933756.b3lyp_6-31g(d).inp

002933756.b3lyp_6-31g(d).qchem.inp (generated)

002933756.b3lyp_6-31g(d).gjf (generated)

002933756.b3lyp_6-31g(d).firefly.inp (generated)

002933756.b3lyp_6-31g(d).smash.inp (generated)

002933756.b3lyp_6-31g(d).nwchem.inp (generated) 002933756.b3lyp_6-31g(d).log.xz 002933756.mol 002933756.PUBCHEM 002933756.mol (via Jmol)
002933776.b3lyp_6-31g(d).inp

002933776.b3lyp_6-31g(d).qchem.inp (generated)

002933776.b3lyp_6-31g(d).gjf (generated)

002933776.b3lyp_6-31g(d).firefly.inp (generated)

002933776.b3lyp_6-31g(d).smash.inp (generated)

002933776.b3lyp_6-31g(d).nwchem.inp (generated) 002933776.b3lyp_6-31g(d).log.xz 002933776.td-b3lyp_6-31g+(d).inp 002933776.td-b3lyp_6-31g+(d).log.xz

002933776.td-b3lyp_6-31+g(d).qchem.inp (generated)

002933776.td-b3lyp_6-31+g(d).gjf (generated)

002933776.td-b3lyp_6-31+g(d).firefly.inp (generated)

002933776.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002933776.mol 002933776.PUBCHEM 002933776.mol (via Jmol)
002933839.b3lyp_6-31g(d).inp

002933839.b3lyp_6-31g(d).qchem.inp (generated)

002933839.b3lyp_6-31g(d).gjf (generated)

002933839.b3lyp_6-31g(d).firefly.inp (generated)

002933839.b3lyp_6-31g(d).smash.inp (generated)

002933839.b3lyp_6-31g(d).nwchem.inp (generated) 002933839.b3lyp_6-31g(d).log.xz 002933839.td-b3lyp_6-31g+(d).inp 002933839.td-b3lyp_6-31g+(d).log.xz

002933839.td-b3lyp_6-31+g(d).qchem.inp (generated)

002933839.td-b3lyp_6-31+g(d).gjf (generated)

002933839.td-b3lyp_6-31+g(d).firefly.inp (generated)

002933839.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002933839.mol 002933839.PUBCHEM 002933839.mol (via Jmol)
002933881.b3lyp_6-31g(d).inp

002933881.b3lyp_6-31g(d).qchem.inp (generated)

002933881.b3lyp_6-31g(d).gjf (generated)

002933881.b3lyp_6-31g(d).firefly.inp (generated)

002933881.b3lyp_6-31g(d).smash.inp (generated)

002933881.b3lyp_6-31g(d).nwchem.inp (generated) 002933881.b3lyp_6-31g(d).log.xz 002933881.mol 002933881.PUBCHEM 002933881.mol (via Jmol)
002933938.b3lyp_6-31g(d).inp

002933938.b3lyp_6-31g(d).qchem.inp (generated)

002933938.b3lyp_6-31g(d).gjf (generated)

002933938.b3lyp_6-31g(d).firefly.inp (generated)

002933938.b3lyp_6-31g(d).smash.inp (generated)

002933938.b3lyp_6-31g(d).nwchem.inp (generated) 002933938.b3lyp_6-31g(d).log.xz 002933938.td-b3lyp_6-31g+(d).inp 002933938.td-b3lyp_6-31g+(d).log.xz

002933938.td-b3lyp_6-31+g(d).qchem.inp (generated)

002933938.td-b3lyp_6-31+g(d).gjf (generated)

002933938.td-b3lyp_6-31+g(d).firefly.inp (generated)

002933938.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002933938.mol 002933938.PUBCHEM 002933938.mol (via Jmol)
002933960.b3lyp_6-31g(d).inp

002933960.b3lyp_6-31g(d).qchem.inp (generated)

002933960.b3lyp_6-31g(d).gjf (generated)

002933960.b3lyp_6-31g(d).firefly.inp (generated)

002933960.b3lyp_6-31g(d).smash.inp (generated)

002933960.b3lyp_6-31g(d).nwchem.inp (generated) 002933960.b3lyp_6-31g(d).log.xz 002933960.mol 002933960.PUBCHEM 002933960.mol (via Jmol)
002934201.b3lyp_6-31g(d).inp

002934201.b3lyp_6-31g(d).qchem.inp (generated)

002934201.b3lyp_6-31g(d).gjf (generated)

002934201.b3lyp_6-31g(d).firefly.inp (generated)

002934201.b3lyp_6-31g(d).smash.inp (generated)

002934201.b3lyp_6-31g(d).nwchem.inp (generated) 002934201.b3lyp_6-31g(d).log.xz 002934201.mol 002934201.PUBCHEM 002934201.mol (via Jmol)
002934272.b3lyp_6-31g(d).inp

002934272.b3lyp_6-31g(d).qchem.inp (generated)

002934272.b3lyp_6-31g(d).gjf (generated)

002934272.b3lyp_6-31g(d).firefly.inp (generated)

002934272.b3lyp_6-31g(d).smash.inp (generated)

002934272.b3lyp_6-31g(d).nwchem.inp (generated) 002934272.b3lyp_6-31g(d).log.xz 002934272.mol 002934272.PUBCHEM 002934272.mol (via Jmol)
002934323.b3lyp_6-31g(d).inp

002934323.b3lyp_6-31g(d).qchem.inp (generated)

002934323.b3lyp_6-31g(d).gjf (generated)

002934323.b3lyp_6-31g(d).firefly.inp (generated)

002934323.b3lyp_6-31g(d).smash.inp (generated)

002934323.b3lyp_6-31g(d).nwchem.inp (generated) 002934323.b3lyp_6-31g(d).log.xz 002934323.mol 002934323.PUBCHEM 002934323.mol (via Jmol)
002934658.b3lyp_6-31g(d).inp

002934658.b3lyp_6-31g(d).qchem.inp (generated)

002934658.b3lyp_6-31g(d).gjf (generated)

002934658.b3lyp_6-31g(d).firefly.inp (generated)

002934658.b3lyp_6-31g(d).smash.inp (generated)

002934658.b3lyp_6-31g(d).nwchem.inp (generated) 002934658.b3lyp_6-31g(d).log.xz 002934658.td-b3lyp_6-31g+(d).inp 002934658.td-b3lyp_6-31g+(d).log.xz

002934658.td-b3lyp_6-31+g(d).qchem.inp (generated)

002934658.td-b3lyp_6-31+g(d).gjf (generated)

002934658.td-b3lyp_6-31+g(d).firefly.inp (generated)

002934658.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002934658.mol 002934658.PUBCHEM 002934658.mol (via Jmol)
002934690.b3lyp_6-31g(d).inp

002934690.b3lyp_6-31g(d).qchem.inp (generated)

002934690.b3lyp_6-31g(d).gjf (generated)

002934690.b3lyp_6-31g(d).firefly.inp (generated)

002934690.b3lyp_6-31g(d).smash.inp (generated)

002934690.b3lyp_6-31g(d).nwchem.inp (generated) 002934690.b3lyp_6-31g(d).log.xz 002934690.td-b3lyp_6-31g+(d).inp 002934690.td-b3lyp_6-31g+(d).log.xz

002934690.td-b3lyp_6-31+g(d).qchem.inp (generated)

002934690.td-b3lyp_6-31+g(d).gjf (generated)

002934690.td-b3lyp_6-31+g(d).firefly.inp (generated)

002934690.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002934690.mol 002934690.PUBCHEM 002934690.mol (via Jmol)
002934754.b3lyp_6-31g(d).inp

002934754.b3lyp_6-31g(d).qchem.inp (generated)

002934754.b3lyp_6-31g(d).gjf (generated)

002934754.b3lyp_6-31g(d).firefly.inp (generated)

002934754.b3lyp_6-31g(d).smash.inp (generated)

002934754.b3lyp_6-31g(d).nwchem.inp (generated) 002934754.b3lyp_6-31g(d).log.xz 002934754.mol 002934754.PUBCHEM 002934754.mol (via Jmol)
002934872.b3lyp_6-31g(d).inp

002934872.b3lyp_6-31g(d).qchem.inp (generated)

002934872.b3lyp_6-31g(d).gjf (generated)

002934872.b3lyp_6-31g(d).firefly.inp (generated)

002934872.b3lyp_6-31g(d).smash.inp (generated)

002934872.b3lyp_6-31g(d).nwchem.inp (generated) 002934872.b3lyp_6-31g(d).log.xz 002934872.mol 002934872.PUBCHEM 002934872.mol (via Jmol)
002934875.b3lyp_6-31g(d).inp

002934875.b3lyp_6-31g(d).qchem.inp (generated)

002934875.b3lyp_6-31g(d).gjf (generated)

002934875.b3lyp_6-31g(d).firefly.inp (generated)

002934875.b3lyp_6-31g(d).smash.inp (generated)

002934875.b3lyp_6-31g(d).nwchem.inp (generated) 002934875.b3lyp_6-31g(d).log.xz 002934875.td-b3lyp_6-31g+(d).inp 002934875.td-b3lyp_6-31g+(d).log.xz

002934875.td-b3lyp_6-31+g(d).qchem.inp (generated)

002934875.td-b3lyp_6-31+g(d).gjf (generated)

002934875.td-b3lyp_6-31+g(d).firefly.inp (generated)

002934875.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002934875.mol 002934875.PUBCHEM 002934875.mol (via Jmol)
002934882.b3lyp_6-31g(d).inp

002934882.b3lyp_6-31g(d).qchem.inp (generated)

002934882.b3lyp_6-31g(d).gjf (generated)

002934882.b3lyp_6-31g(d).firefly.inp (generated)

002934882.b3lyp_6-31g(d).smash.inp (generated)

002934882.b3lyp_6-31g(d).nwchem.inp (generated) 002934882.b3lyp_6-31g(d).log.xz 002934882.mol 002934882.PUBCHEM 002934882.mol (via Jmol)
002934886.b3lyp_6-31g(d).inp

002934886.b3lyp_6-31g(d).qchem.inp (generated)

002934886.b3lyp_6-31g(d).gjf (generated)

002934886.b3lyp_6-31g(d).firefly.inp (generated)

002934886.b3lyp_6-31g(d).smash.inp (generated)

002934886.b3lyp_6-31g(d).nwchem.inp (generated) 002934886.b3lyp_6-31g(d).log.xz 002934886.td-b3lyp_6-31g+(d).inp 002934886.td-b3lyp_6-31g+(d).log.xz

002934886.td-b3lyp_6-31+g(d).qchem.inp (generated)

002934886.td-b3lyp_6-31+g(d).gjf (generated)

002934886.td-b3lyp_6-31+g(d).firefly.inp (generated)

002934886.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002934886.mol 002934886.PUBCHEM 002934886.mol (via Jmol)
002935053.b3lyp_6-31g(d).inp

002935053.b3lyp_6-31g(d).qchem.inp (generated)

002935053.b3lyp_6-31g(d).gjf (generated)

002935053.b3lyp_6-31g(d).firefly.inp (generated)

002935053.b3lyp_6-31g(d).smash.inp (generated)

002935053.b3lyp_6-31g(d).nwchem.inp (generated) 002935053.b3lyp_6-31g(d).log.xz 002935053.td-b3lyp_6-31g+(d).inp 002935053.td-b3lyp_6-31g+(d).log.xz

002935053.td-b3lyp_6-31+g(d).qchem.inp (generated)

002935053.td-b3lyp_6-31+g(d).gjf (generated)

002935053.td-b3lyp_6-31+g(d).firefly.inp (generated)

002935053.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002935053.mol 002935053.PUBCHEM 002935053.mol (via Jmol)
002935530.b3lyp_6-31g(d).inp

002935530.b3lyp_6-31g(d).qchem.inp (generated)

002935530.b3lyp_6-31g(d).gjf (generated)

002935530.b3lyp_6-31g(d).firefly.inp (generated)

002935530.b3lyp_6-31g(d).smash.inp (generated)

002935530.b3lyp_6-31g(d).nwchem.inp (generated) 002935530.b3lyp_6-31g(d).log.xz 002935530.td-b3lyp_6-31g+(d).inp 002935530.td-b3lyp_6-31g+(d).log.xz

002935530.td-b3lyp_6-31+g(d).qchem.inp (generated)

002935530.td-b3lyp_6-31+g(d).gjf (generated)

002935530.td-b3lyp_6-31+g(d).firefly.inp (generated)

002935530.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002935530.mol 002935530.PUBCHEM 002935530.mol (via Jmol)
002935551.b3lyp_6-31g(d).inp

002935551.b3lyp_6-31g(d).qchem.inp (generated)

002935551.b3lyp_6-31g(d).gjf (generated)

002935551.b3lyp_6-31g(d).firefly.inp (generated)

002935551.b3lyp_6-31g(d).smash.inp (generated)

002935551.b3lyp_6-31g(d).nwchem.inp (generated) 002935551.b3lyp_6-31g(d).log.xz 002935551.td-b3lyp_6-31g+(d).inp 002935551.td-b3lyp_6-31g+(d).log.xz

002935551.td-b3lyp_6-31+g(d).qchem.inp (generated)

002935551.td-b3lyp_6-31+g(d).gjf (generated)

002935551.td-b3lyp_6-31+g(d).firefly.inp (generated)

002935551.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002935551.mol 002935551.PUBCHEM 002935551.mol (via Jmol)
002935745.b3lyp_6-31g(d).inp

002935745.b3lyp_6-31g(d).qchem.inp (generated)

002935745.b3lyp_6-31g(d).gjf (generated)

002935745.b3lyp_6-31g(d).firefly.inp (generated)

002935745.b3lyp_6-31g(d).smash.inp (generated)

002935745.b3lyp_6-31g(d).nwchem.inp (generated) 002935745.b3lyp_6-31g(d).log.xz 002935745.td-b3lyp_6-31g+(d).inp 002935745.td-b3lyp_6-31g+(d).log.xz

002935745.td-b3lyp_6-31+g(d).qchem.inp (generated)

002935745.td-b3lyp_6-31+g(d).gjf (generated)

002935745.td-b3lyp_6-31+g(d).firefly.inp (generated)

002935745.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002935745.mol 002935745.PUBCHEM 002935745.mol (via Jmol)
002935767.b3lyp_6-31g(d).inp

002935767.b3lyp_6-31g(d).qchem.inp (generated)

002935767.b3lyp_6-31g(d).gjf (generated)

002935767.b3lyp_6-31g(d).firefly.inp (generated)

002935767.b3lyp_6-31g(d).smash.inp (generated)

002935767.b3lyp_6-31g(d).nwchem.inp (generated) 002935767.b3lyp_6-31g(d).log.xz 002935767.td-b3lyp_6-31g+(d).inp 002935767.td-b3lyp_6-31g+(d).log.xz

002935767.td-b3lyp_6-31+g(d).qchem.inp (generated)

002935767.td-b3lyp_6-31+g(d).gjf (generated)

002935767.td-b3lyp_6-31+g(d).firefly.inp (generated)

002935767.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002935767.mol 002935767.PUBCHEM 002935767.mol (via Jmol)
002935819.b3lyp_6-31g(d).inp

002935819.b3lyp_6-31g(d).qchem.inp (generated)

002935819.b3lyp_6-31g(d).gjf (generated)

002935819.b3lyp_6-31g(d).firefly.inp (generated)

002935819.b3lyp_6-31g(d).smash.inp (generated)

002935819.b3lyp_6-31g(d).nwchem.inp (generated) 002935819.b3lyp_6-31g(d).log.xz 002935819.td-b3lyp_6-31g+(d).inp 002935819.td-b3lyp_6-31g+(d).log.xz

002935819.td-b3lyp_6-31+g(d).qchem.inp (generated)

002935819.td-b3lyp_6-31+g(d).gjf (generated)

002935819.td-b3lyp_6-31+g(d).firefly.inp (generated)

002935819.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002935819.mol 002935819.PUBCHEM 002935819.mol (via Jmol)
002935869.b3lyp_6-31g(d).inp

002935869.b3lyp_6-31g(d).qchem.inp (generated)

002935869.b3lyp_6-31g(d).gjf (generated)

002935869.b3lyp_6-31g(d).firefly.inp (generated)

002935869.b3lyp_6-31g(d).smash.inp (generated)

002935869.b3lyp_6-31g(d).nwchem.inp (generated) 002935869.b3lyp_6-31g(d).log.xz 002935869.td-b3lyp_6-31g+(d).inp 002935869.td-b3lyp_6-31g+(d).log.xz

002935869.td-b3lyp_6-31+g(d).qchem.inp (generated)

002935869.td-b3lyp_6-31+g(d).gjf (generated)

002935869.td-b3lyp_6-31+g(d).firefly.inp (generated)

002935869.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002935869.mol 002935869.PUBCHEM 002935869.mol (via Jmol)
002935928.b3lyp_6-31g(d).inp

002935928.b3lyp_6-31g(d).qchem.inp (generated)

002935928.b3lyp_6-31g(d).gjf (generated)

002935928.b3lyp_6-31g(d).firefly.inp (generated)

002935928.b3lyp_6-31g(d).smash.inp (generated)

002935928.b3lyp_6-31g(d).nwchem.inp (generated) 002935928.b3lyp_6-31g(d).log.xz 002935928.td-b3lyp_6-31g+(d).inp 002935928.td-b3lyp_6-31g+(d).log.xz

002935928.td-b3lyp_6-31+g(d).qchem.inp (generated)

002935928.td-b3lyp_6-31+g(d).gjf (generated)

002935928.td-b3lyp_6-31+g(d).firefly.inp (generated)

002935928.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002935928.mol 002935928.PUBCHEM 002935928.mol (via Jmol)
002936052.b3lyp_6-31g(d).inp

002936052.b3lyp_6-31g(d).qchem.inp (generated)

002936052.b3lyp_6-31g(d).gjf (generated)

002936052.b3lyp_6-31g(d).firefly.inp (generated)

002936052.b3lyp_6-31g(d).smash.inp (generated)

002936052.b3lyp_6-31g(d).nwchem.inp (generated) 002936052.b3lyp_6-31g(d).log.xz 002936052.td-b3lyp_6-31g+(d).inp 002936052.td-b3lyp_6-31g+(d).log.xz

002936052.td-b3lyp_6-31+g(d).qchem.inp (generated)

002936052.td-b3lyp_6-31+g(d).gjf (generated)

002936052.td-b3lyp_6-31+g(d).firefly.inp (generated)

002936052.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002936052.mol 002936052.PUBCHEM 002936052.mol (via Jmol)
002936089.b3lyp_6-31g(d).inp

002936089.b3lyp_6-31g(d).qchem.inp (generated)

002936089.b3lyp_6-31g(d).gjf (generated)

002936089.b3lyp_6-31g(d).firefly.inp (generated)

002936089.b3lyp_6-31g(d).smash.inp (generated)

002936089.b3lyp_6-31g(d).nwchem.inp (generated) 002936089.b3lyp_6-31g(d).log.xz 002936089.mol 002936089.PUBCHEM 002936089.mol (via Jmol)
002936165.b3lyp_6-31g(d).inp

002936165.b3lyp_6-31g(d).qchem.inp (generated)

002936165.b3lyp_6-31g(d).gjf (generated)

002936165.b3lyp_6-31g(d).firefly.inp (generated)

002936165.b3lyp_6-31g(d).smash.inp (generated)

002936165.b3lyp_6-31g(d).nwchem.inp (generated) 002936165.b3lyp_6-31g(d).log.xz 002936165.td-b3lyp_6-31g+(d).inp 002936165.td-b3lyp_6-31g+(d).log.xz

002936165.td-b3lyp_6-31+g(d).qchem.inp (generated)

002936165.td-b3lyp_6-31+g(d).gjf (generated)

002936165.td-b3lyp_6-31+g(d).firefly.inp (generated)

002936165.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002936165.mol 002936165.PUBCHEM 002936165.mol (via Jmol)
002936241.b3lyp_6-31g(d).inp

002936241.b3lyp_6-31g(d).qchem.inp (generated)

002936241.b3lyp_6-31g(d).gjf (generated)

002936241.b3lyp_6-31g(d).firefly.inp (generated)

002936241.b3lyp_6-31g(d).smash.inp (generated)

002936241.b3lyp_6-31g(d).nwchem.inp (generated) 002936241.b3lyp_6-31g(d).log.xz 002936241.mol 002936241.PUBCHEM 002936241.mol (via Jmol)
002936392.b3lyp_6-31g(d).inp

002936392.b3lyp_6-31g(d).qchem.inp (generated)

002936392.b3lyp_6-31g(d).gjf (generated)

002936392.b3lyp_6-31g(d).firefly.inp (generated)

002936392.b3lyp_6-31g(d).smash.inp (generated)

002936392.b3lyp_6-31g(d).nwchem.inp (generated) 002936392.b3lyp_6-31g(d).log.xz 002936392.td-b3lyp_6-31g+(d).inp 002936392.td-b3lyp_6-31g+(d).log.xz

002936392.td-b3lyp_6-31+g(d).qchem.inp (generated)

002936392.td-b3lyp_6-31+g(d).gjf (generated)

002936392.td-b3lyp_6-31+g(d).firefly.inp (generated)

002936392.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002936392.mol 002936392.PUBCHEM 002936392.mol (via Jmol)
002936433.b3lyp_6-31g(d).inp

002936433.b3lyp_6-31g(d).qchem.inp (generated)

002936433.b3lyp_6-31g(d).gjf (generated)

002936433.b3lyp_6-31g(d).firefly.inp (generated)

002936433.b3lyp_6-31g(d).smash.inp (generated)

002936433.b3lyp_6-31g(d).nwchem.inp (generated) 002936433.b3lyp_6-31g(d).log.xz 002936433.td-b3lyp_6-31g+(d).inp 002936433.td-b3lyp_6-31g+(d).log.xz

002936433.td-b3lyp_6-31+g(d).qchem.inp (generated)

002936433.td-b3lyp_6-31+g(d).gjf (generated)

002936433.td-b3lyp_6-31+g(d).firefly.inp (generated)

002936433.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002936433.mol 002936433.PUBCHEM 002936433.mol (via Jmol)
002936507.b3lyp_6-31g(d).inp

002936507.b3lyp_6-31g(d).qchem.inp (generated)

002936507.b3lyp_6-31g(d).gjf (generated)

002936507.b3lyp_6-31g(d).firefly.inp (generated)

002936507.b3lyp_6-31g(d).smash.inp (generated)

002936507.b3lyp_6-31g(d).nwchem.inp (generated) 002936507.b3lyp_6-31g(d).log.xz 002936507.mol 002936507.PUBCHEM 002936507.mol (via Jmol)
002936542.b3lyp_6-31g(d).inp

002936542.b3lyp_6-31g(d).qchem.inp (generated)

002936542.b3lyp_6-31g(d).gjf (generated)

002936542.b3lyp_6-31g(d).firefly.inp (generated)

002936542.b3lyp_6-31g(d).smash.inp (generated)

002936542.b3lyp_6-31g(d).nwchem.inp (generated) 002936542.b3lyp_6-31g(d).log.xz 002936542.mol 002936542.PUBCHEM 002936542.mol (via Jmol)
002936669.b3lyp_6-31g(d).inp

002936669.b3lyp_6-31g(d).qchem.inp (generated)

002936669.b3lyp_6-31g(d).gjf (generated)

002936669.b3lyp_6-31g(d).firefly.inp (generated)

002936669.b3lyp_6-31g(d).smash.inp (generated)

002936669.b3lyp_6-31g(d).nwchem.inp (generated) 002936669.b3lyp_6-31g(d).log.xz 002936669.td-b3lyp_6-31g+(d).inp 002936669.td-b3lyp_6-31g+(d).log.xz

002936669.td-b3lyp_6-31+g(d).qchem.inp (generated)

002936669.td-b3lyp_6-31+g(d).gjf (generated)

002936669.td-b3lyp_6-31+g(d).firefly.inp (generated)

002936669.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002936669.mol 002936669.PUBCHEM 002936669.mol (via Jmol)
002936705.b3lyp_6-31g(d).inp

002936705.b3lyp_6-31g(d).qchem.inp (generated)

002936705.b3lyp_6-31g(d).gjf (generated)

002936705.b3lyp_6-31g(d).firefly.inp (generated)

002936705.b3lyp_6-31g(d).smash.inp (generated)

002936705.b3lyp_6-31g(d).nwchem.inp (generated) 002936705.b3lyp_6-31g(d).log.xz 002936705.td-b3lyp_6-31g+(d).inp 002936705.td-b3lyp_6-31g+(d).log.xz

002936705.td-b3lyp_6-31+g(d).qchem.inp (generated)

002936705.td-b3lyp_6-31+g(d).gjf (generated)

002936705.td-b3lyp_6-31+g(d).firefly.inp (generated)

002936705.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002936705.mol 002936705.PUBCHEM 002936705.mol (via Jmol)
002936748.b3lyp_6-31g(d).inp

002936748.b3lyp_6-31g(d).qchem.inp (generated)

002936748.b3lyp_6-31g(d).gjf (generated)

002936748.b3lyp_6-31g(d).firefly.inp (generated)

002936748.b3lyp_6-31g(d).smash.inp (generated)

002936748.b3lyp_6-31g(d).nwchem.inp (generated) 002936748.b3lyp_6-31g(d).log.xz 002936748.td-b3lyp_6-31g+(d).inp 002936748.td-b3lyp_6-31g+(d).log.xz

002936748.td-b3lyp_6-31+g(d).qchem.inp (generated)

002936748.td-b3lyp_6-31+g(d).gjf (generated)

002936748.td-b3lyp_6-31+g(d).firefly.inp (generated)

002936748.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002936748.mol 002936748.PUBCHEM 002936748.mol (via Jmol)
002936954.b3lyp_6-31g(d).inp

002936954.b3lyp_6-31g(d).qchem.inp (generated)

002936954.b3lyp_6-31g(d).gjf (generated)

002936954.b3lyp_6-31g(d).firefly.inp (generated)

002936954.b3lyp_6-31g(d).smash.inp (generated)

002936954.b3lyp_6-31g(d).nwchem.inp (generated) 002936954.b3lyp_6-31g(d).log.xz 002936954.mol 002936954.PUBCHEM 002936954.mol (via Jmol)
002936975.b3lyp_6-31g(d).inp

002936975.b3lyp_6-31g(d).qchem.inp (generated)

002936975.b3lyp_6-31g(d).gjf (generated)

002936975.b3lyp_6-31g(d).firefly.inp (generated)

002936975.b3lyp_6-31g(d).smash.inp (generated)

002936975.b3lyp_6-31g(d).nwchem.inp (generated) 002936975.b3lyp_6-31g(d).log.xz 002936975.td-b3lyp_6-31g+(d).inp 002936975.td-b3lyp_6-31g+(d).log.xz

002936975.td-b3lyp_6-31+g(d).qchem.inp (generated)

002936975.td-b3lyp_6-31+g(d).gjf (generated)

002936975.td-b3lyp_6-31+g(d).firefly.inp (generated)

002936975.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002936975.mol 002936975.PUBCHEM 002936975.mol (via Jmol)
002937091.b3lyp_6-31g(d).inp

002937091.b3lyp_6-31g(d).qchem.inp (generated)

002937091.b3lyp_6-31g(d).gjf (generated)

002937091.b3lyp_6-31g(d).firefly.inp (generated)

002937091.b3lyp_6-31g(d).smash.inp (generated)

002937091.b3lyp_6-31g(d).nwchem.inp (generated) 002937091.b3lyp_6-31g(d).log.xz 002937091.td-b3lyp_6-31g+(d).inp 002937091.td-b3lyp_6-31g+(d).log.xz

002937091.td-b3lyp_6-31+g(d).qchem.inp (generated)

002937091.td-b3lyp_6-31+g(d).gjf (generated)

002937091.td-b3lyp_6-31+g(d).firefly.inp (generated)

002937091.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002937091.mol 002937091.PUBCHEM 002937091.mol (via Jmol)
002937213.b3lyp_6-31g(d).inp

002937213.b3lyp_6-31g(d).qchem.inp (generated)

002937213.b3lyp_6-31g(d).gjf (generated)

002937213.b3lyp_6-31g(d).firefly.inp (generated)

002937213.b3lyp_6-31g(d).smash.inp (generated)

002937213.b3lyp_6-31g(d).nwchem.inp (generated) 002937213.b3lyp_6-31g(d).log.xz 002937213.td-b3lyp_6-31g+(d).inp 002937213.td-b3lyp_6-31g+(d).log.xz

002937213.td-b3lyp_6-31+g(d).qchem.inp (generated)

002937213.td-b3lyp_6-31+g(d).gjf (generated)

002937213.td-b3lyp_6-31+g(d).firefly.inp (generated)

002937213.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002937213.mol 002937213.PUBCHEM 002937213.mol (via Jmol)
002937256.b3lyp_6-31g(d).inp

002937256.b3lyp_6-31g(d).qchem.inp (generated)

002937256.b3lyp_6-31g(d).gjf (generated)

002937256.b3lyp_6-31g(d).firefly.inp (generated)

002937256.b3lyp_6-31g(d).smash.inp (generated)

002937256.b3lyp_6-31g(d).nwchem.inp (generated) 002937256.b3lyp_6-31g(d).log.xz 002937256.mol 002937256.PUBCHEM 002937256.mol (via Jmol)
002937275.b3lyp_6-31g(d).inp

002937275.b3lyp_6-31g(d).qchem.inp (generated)

002937275.b3lyp_6-31g(d).gjf (generated)

002937275.b3lyp_6-31g(d).firefly.inp (generated)

002937275.b3lyp_6-31g(d).smash.inp (generated)

002937275.b3lyp_6-31g(d).nwchem.inp (generated) 002937275.b3lyp_6-31g(d).log.xz 002937275.td-b3lyp_6-31g+(d).inp 002937275.td-b3lyp_6-31g+(d).log.xz

002937275.td-b3lyp_6-31+g(d).qchem.inp (generated)

002937275.td-b3lyp_6-31+g(d).gjf (generated)

002937275.td-b3lyp_6-31+g(d).firefly.inp (generated)

002937275.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002937275.mol 002937275.PUBCHEM 002937275.mol (via Jmol)
002937490.b3lyp_6-31g(d).inp

002937490.b3lyp_6-31g(d).qchem.inp (generated)

002937490.b3lyp_6-31g(d).gjf (generated)

002937490.b3lyp_6-31g(d).firefly.inp (generated)

002937490.b3lyp_6-31g(d).smash.inp (generated)

002937490.b3lyp_6-31g(d).nwchem.inp (generated) 002937490.b3lyp_6-31g(d).log.xz 002937490.td-b3lyp_6-31g+(d).inp 002937490.td-b3lyp_6-31g+(d).log.xz

002937490.td-b3lyp_6-31+g(d).qchem.inp (generated)

002937490.td-b3lyp_6-31+g(d).gjf (generated)

002937490.td-b3lyp_6-31+g(d).firefly.inp (generated)

002937490.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002937490.mol 002937490.PUBCHEM 002937490.mol (via Jmol)
002937502.b3lyp_6-31g(d).inp

002937502.b3lyp_6-31g(d).qchem.inp (generated)

002937502.b3lyp_6-31g(d).gjf (generated)

002937502.b3lyp_6-31g(d).firefly.inp (generated)

002937502.b3lyp_6-31g(d).smash.inp (generated)

002937502.b3lyp_6-31g(d).nwchem.inp (generated) 002937502.b3lyp_6-31g(d).log.xz 002937502.mol 002937502.PUBCHEM 002937502.mol (via Jmol)
002937551.b3lyp_6-31g(d).inp

002937551.b3lyp_6-31g(d).qchem.inp (generated)

002937551.b3lyp_6-31g(d).gjf (generated)

002937551.b3lyp_6-31g(d).firefly.inp (generated)

002937551.b3lyp_6-31g(d).smash.inp (generated)

002937551.b3lyp_6-31g(d).nwchem.inp (generated) 002937551.b3lyp_6-31g(d).log.xz 002937551.td-b3lyp_6-31g+(d).inp 002937551.td-b3lyp_6-31g+(d).log.xz

002937551.td-b3lyp_6-31+g(d).qchem.inp (generated)

002937551.td-b3lyp_6-31+g(d).gjf (generated)

002937551.td-b3lyp_6-31+g(d).firefly.inp (generated)

002937551.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002937551.mol 002937551.PUBCHEM 002937551.mol (via Jmol)
002937763.b3lyp_6-31g(d).inp

002937763.b3lyp_6-31g(d).qchem.inp (generated)

002937763.b3lyp_6-31g(d).gjf (generated)

002937763.b3lyp_6-31g(d).firefly.inp (generated)

002937763.b3lyp_6-31g(d).smash.inp (generated)

002937763.b3lyp_6-31g(d).nwchem.inp (generated) 002937763.b3lyp_6-31g(d).log.xz 002937763.mol 002937763.PUBCHEM 002937763.mol (via Jmol)
002937782.b3lyp_6-31g(d).inp

002937782.b3lyp_6-31g(d).qchem.inp (generated)

002937782.b3lyp_6-31g(d).gjf (generated)

002937782.b3lyp_6-31g(d).firefly.inp (generated)

002937782.b3lyp_6-31g(d).smash.inp (generated)

002937782.b3lyp_6-31g(d).nwchem.inp (generated) 002937782.b3lyp_6-31g(d).log.xz 002937782.mol 002937782.PUBCHEM 002937782.mol (via Jmol)
002937822.b3lyp_6-31g(d).inp

002937822.b3lyp_6-31g(d).qchem.inp (generated)

002937822.b3lyp_6-31g(d).gjf (generated)

002937822.b3lyp_6-31g(d).firefly.inp (generated)

002937822.b3lyp_6-31g(d).smash.inp (generated)

002937822.b3lyp_6-31g(d).nwchem.inp (generated) 002937822.b3lyp_6-31g(d).log.xz 002937822.td-b3lyp_6-31g+(d).inp 002937822.td-b3lyp_6-31g+(d).log.xz

002937822.td-b3lyp_6-31+g(d).qchem.inp (generated)

002937822.td-b3lyp_6-31+g(d).gjf (generated)

002937822.td-b3lyp_6-31+g(d).firefly.inp (generated)

002937822.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002937822.mol 002937822.PUBCHEM 002937822.mol (via Jmol)
002937827.b3lyp_6-31g(d).inp

002937827.b3lyp_6-31g(d).qchem.inp (generated)

002937827.b3lyp_6-31g(d).gjf (generated)

002937827.b3lyp_6-31g(d).firefly.inp (generated)

002937827.b3lyp_6-31g(d).smash.inp (generated)

002937827.b3lyp_6-31g(d).nwchem.inp (generated) 002937827.b3lyp_6-31g(d).log.xz 002937827.td-b3lyp_6-31g+(d).inp 002937827.td-b3lyp_6-31g+(d).log.xz

002937827.td-b3lyp_6-31+g(d).qchem.inp (generated)

002937827.td-b3lyp_6-31+g(d).gjf (generated)

002937827.td-b3lyp_6-31+g(d).firefly.inp (generated)

002937827.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002937827.mol 002937827.PUBCHEM 002937827.mol (via Jmol)
002938038.b3lyp_6-31g(d).inp

002938038.b3lyp_6-31g(d).qchem.inp (generated)

002938038.b3lyp_6-31g(d).gjf (generated)

002938038.b3lyp_6-31g(d).firefly.inp (generated)

002938038.b3lyp_6-31g(d).smash.inp (generated)

002938038.b3lyp_6-31g(d).nwchem.inp (generated) 002938038.b3lyp_6-31g(d).log.xz 002938038.td-b3lyp_6-31g+(d).inp 002938038.td-b3lyp_6-31g+(d).log.xz

002938038.td-b3lyp_6-31+g(d).qchem.inp (generated)

002938038.td-b3lyp_6-31+g(d).gjf (generated)

002938038.td-b3lyp_6-31+g(d).firefly.inp (generated)

002938038.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002938038.mol 002938038.PUBCHEM 002938038.mol (via Jmol)
002938114.b3lyp_6-31g(d).inp

002938114.b3lyp_6-31g(d).qchem.inp (generated)

002938114.b3lyp_6-31g(d).gjf (generated)

002938114.b3lyp_6-31g(d).firefly.inp (generated)

002938114.b3lyp_6-31g(d).smash.inp (generated)

002938114.b3lyp_6-31g(d).nwchem.inp (generated) 002938114.b3lyp_6-31g(d).log.xz 002938114.td-b3lyp_6-31g+(d).inp 002938114.td-b3lyp_6-31g+(d).log.xz

002938114.td-b3lyp_6-31+g(d).qchem.inp (generated)

002938114.td-b3lyp_6-31+g(d).gjf (generated)

002938114.td-b3lyp_6-31+g(d).firefly.inp (generated)

002938114.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002938114.mol 002938114.PUBCHEM 002938114.mol (via Jmol)
002938222.b3lyp_6-31g(d).inp

002938222.b3lyp_6-31g(d).qchem.inp (generated)

002938222.b3lyp_6-31g(d).gjf (generated)

002938222.b3lyp_6-31g(d).firefly.inp (generated)

002938222.b3lyp_6-31g(d).smash.inp (generated)

002938222.b3lyp_6-31g(d).nwchem.inp (generated) 002938222.b3lyp_6-31g(d).log.xz 002938222.mol 002938222.PUBCHEM 002938222.mol (via Jmol)
002938579.b3lyp_6-31g(d).inp

002938579.b3lyp_6-31g(d).qchem.inp (generated)

002938579.b3lyp_6-31g(d).gjf (generated)

002938579.b3lyp_6-31g(d).firefly.inp (generated)

002938579.b3lyp_6-31g(d).smash.inp (generated)

002938579.b3lyp_6-31g(d).nwchem.inp (generated) 002938579.b3lyp_6-31g(d).log.xz 002938579.td-b3lyp_6-31g+(d).inp 002938579.td-b3lyp_6-31g+(d).log.xz

002938579.td-b3lyp_6-31+g(d).qchem.inp (generated)

002938579.td-b3lyp_6-31+g(d).gjf (generated)

002938579.td-b3lyp_6-31+g(d).firefly.inp (generated)

002938579.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002938579.mol 002938579.PUBCHEM 002938579.mol (via Jmol)
002938587.b3lyp_6-31g(d).inp

002938587.b3lyp_6-31g(d).qchem.inp (generated)

002938587.b3lyp_6-31g(d).gjf (generated)

002938587.b3lyp_6-31g(d).firefly.inp (generated)

002938587.b3lyp_6-31g(d).smash.inp (generated)

002938587.b3lyp_6-31g(d).nwchem.inp (generated) 002938587.b3lyp_6-31g(d).log.xz 002938587.td-b3lyp_6-31g+(d).inp 002938587.td-b3lyp_6-31g+(d).log.xz

002938587.td-b3lyp_6-31+g(d).qchem.inp (generated)

002938587.td-b3lyp_6-31+g(d).gjf (generated)

002938587.td-b3lyp_6-31+g(d).firefly.inp (generated)

002938587.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002938587.mol 002938587.PUBCHEM 002938587.mol (via Jmol)
002938648.b3lyp_6-31g(d).inp

002938648.b3lyp_6-31g(d).qchem.inp (generated)

002938648.b3lyp_6-31g(d).gjf (generated)

002938648.b3lyp_6-31g(d).firefly.inp (generated)

002938648.b3lyp_6-31g(d).smash.inp (generated)

002938648.b3lyp_6-31g(d).nwchem.inp (generated) 002938648.b3lyp_6-31g(d).log.xz 002938648.td-b3lyp_6-31g+(d).inp 002938648.td-b3lyp_6-31g+(d).log.xz

002938648.td-b3lyp_6-31+g(d).qchem.inp (generated)

002938648.td-b3lyp_6-31+g(d).gjf (generated)

002938648.td-b3lyp_6-31+g(d).firefly.inp (generated)

002938648.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002938648.mol 002938648.PUBCHEM 002938648.mol (via Jmol)
002938675.b3lyp_6-31g(d).inp

002938675.b3lyp_6-31g(d).qchem.inp (generated)

002938675.b3lyp_6-31g(d).gjf (generated)

002938675.b3lyp_6-31g(d).firefly.inp (generated)

002938675.b3lyp_6-31g(d).smash.inp (generated)

002938675.b3lyp_6-31g(d).nwchem.inp (generated) 002938675.b3lyp_6-31g(d).log.xz 002938675.td-b3lyp_6-31g+(d).inp 002938675.td-b3lyp_6-31g+(d).log.xz

002938675.td-b3lyp_6-31+g(d).qchem.inp (generated)

002938675.td-b3lyp_6-31+g(d).gjf (generated)

002938675.td-b3lyp_6-31+g(d).firefly.inp (generated)

002938675.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002938675.mol 002938675.PUBCHEM 002938675.mol (via Jmol)
002938945.b3lyp_6-31g(d).inp

002938945.b3lyp_6-31g(d).qchem.inp (generated)

002938945.b3lyp_6-31g(d).gjf (generated)

002938945.b3lyp_6-31g(d).firefly.inp (generated)

002938945.b3lyp_6-31g(d).smash.inp (generated)

002938945.b3lyp_6-31g(d).nwchem.inp (generated) 002938945.b3lyp_6-31g(d).log.xz 002938945.mol 002938945.PUBCHEM 002938945.mol (via Jmol)
002939003.b3lyp_6-31g(d).inp

002939003.b3lyp_6-31g(d).qchem.inp (generated)

002939003.b3lyp_6-31g(d).gjf (generated)

002939003.b3lyp_6-31g(d).firefly.inp (generated)

002939003.b3lyp_6-31g(d).smash.inp (generated)

002939003.b3lyp_6-31g(d).nwchem.inp (generated) 002939003.b3lyp_6-31g(d).log.xz 002939003.mol 002939003.PUBCHEM 002939003.mol (via Jmol)
002939091.b3lyp_6-31g(d).inp

002939091.b3lyp_6-31g(d).qchem.inp (generated)

002939091.b3lyp_6-31g(d).gjf (generated)

002939091.b3lyp_6-31g(d).firefly.inp (generated)

002939091.b3lyp_6-31g(d).smash.inp (generated)

002939091.b3lyp_6-31g(d).nwchem.inp (generated) 002939091.b3lyp_6-31g(d).log.xz 002939091.td-b3lyp_6-31g+(d).inp 002939091.td-b3lyp_6-31g+(d).log.xz

002939091.td-b3lyp_6-31+g(d).qchem.inp (generated)

002939091.td-b3lyp_6-31+g(d).gjf (generated)

002939091.td-b3lyp_6-31+g(d).firefly.inp (generated)

002939091.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002939091.mol 002939091.PUBCHEM 002939091.mol (via Jmol)
002939179.b3lyp_6-31g(d).inp

002939179.b3lyp_6-31g(d).qchem.inp (generated)

002939179.b3lyp_6-31g(d).gjf (generated)

002939179.b3lyp_6-31g(d).firefly.inp (generated)

002939179.b3lyp_6-31g(d).smash.inp (generated)

002939179.b3lyp_6-31g(d).nwchem.inp (generated) 002939179.b3lyp_6-31g(d).log.xz 002939179.td-b3lyp_6-31g+(d).inp 002939179.td-b3lyp_6-31g+(d).log.xz

002939179.td-b3lyp_6-31+g(d).qchem.inp (generated)

002939179.td-b3lyp_6-31+g(d).gjf (generated)

002939179.td-b3lyp_6-31+g(d).firefly.inp (generated)

002939179.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002939179.mol 002939179.PUBCHEM 002939179.mol (via Jmol)
002939283.b3lyp_6-31g(d).inp

002939283.b3lyp_6-31g(d).qchem.inp (generated)

002939283.b3lyp_6-31g(d).gjf (generated)

002939283.b3lyp_6-31g(d).firefly.inp (generated)

002939283.b3lyp_6-31g(d).smash.inp (generated)

002939283.b3lyp_6-31g(d).nwchem.inp (generated) 002939283.b3lyp_6-31g(d).log.xz 002939283.td-b3lyp_6-31g+(d).inp 002939283.td-b3lyp_6-31g+(d).log.xz

002939283.td-b3lyp_6-31+g(d).qchem.inp (generated)

002939283.td-b3lyp_6-31+g(d).gjf (generated)

002939283.td-b3lyp_6-31+g(d).firefly.inp (generated)

002939283.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002939283.mol 002939283.PUBCHEM 002939283.mol (via Jmol)
002939474.b3lyp_6-31g(d).inp

002939474.b3lyp_6-31g(d).qchem.inp (generated)

002939474.b3lyp_6-31g(d).gjf (generated)

002939474.b3lyp_6-31g(d).firefly.inp (generated)

002939474.b3lyp_6-31g(d).smash.inp (generated)

002939474.b3lyp_6-31g(d).nwchem.inp (generated) 002939474.b3lyp_6-31g(d).log.xz 002939474.mol 002939474.PUBCHEM 002939474.mol (via Jmol)
002939480.b3lyp_6-31g(d).inp

002939480.b3lyp_6-31g(d).qchem.inp (generated)

002939480.b3lyp_6-31g(d).gjf (generated)

002939480.b3lyp_6-31g(d).firefly.inp (generated)

002939480.b3lyp_6-31g(d).smash.inp (generated)

002939480.b3lyp_6-31g(d).nwchem.inp (generated) 002939480.b3lyp_6-31g(d).log.xz 002939480.td-b3lyp_6-31g+(d).inp 002939480.td-b3lyp_6-31g+(d).log.xz

002939480.td-b3lyp_6-31+g(d).qchem.inp (generated)

002939480.td-b3lyp_6-31+g(d).gjf (generated)

002939480.td-b3lyp_6-31+g(d).firefly.inp (generated)

002939480.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002939480.mol 002939480.PUBCHEM 002939480.mol (via Jmol)
002939484.b3lyp_6-31g(d).inp

002939484.b3lyp_6-31g(d).qchem.inp (generated)

002939484.b3lyp_6-31g(d).gjf (generated)

002939484.b3lyp_6-31g(d).firefly.inp (generated)

002939484.b3lyp_6-31g(d).smash.inp (generated)

002939484.b3lyp_6-31g(d).nwchem.inp (generated) 002939484.b3lyp_6-31g(d).log.xz 002939484.td-b3lyp_6-31g+(d).inp 002939484.td-b3lyp_6-31g+(d).log.xz

002939484.td-b3lyp_6-31+g(d).qchem.inp (generated)

002939484.td-b3lyp_6-31+g(d).gjf (generated)

002939484.td-b3lyp_6-31+g(d).firefly.inp (generated)

002939484.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002939484.mol 002939484.PUBCHEM 002939484.mol (via Jmol)
002939654.b3lyp_6-31g(d).inp

002939654.b3lyp_6-31g(d).qchem.inp (generated)

002939654.b3lyp_6-31g(d).gjf (generated)

002939654.b3lyp_6-31g(d).firefly.inp (generated)

002939654.b3lyp_6-31g(d).smash.inp (generated)

002939654.b3lyp_6-31g(d).nwchem.inp (generated) 002939654.b3lyp_6-31g(d).log.xz 002939654.td-b3lyp_6-31g+(d).inp 002939654.td-b3lyp_6-31g+(d).log.xz

002939654.td-b3lyp_6-31+g(d).qchem.inp (generated)

002939654.td-b3lyp_6-31+g(d).gjf (generated)

002939654.td-b3lyp_6-31+g(d).firefly.inp (generated)

002939654.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002939654.mol 002939654.PUBCHEM 002939654.mol (via Jmol)
002939753.b3lyp_6-31g(d).inp

002939753.b3lyp_6-31g(d).qchem.inp (generated)

002939753.b3lyp_6-31g(d).gjf (generated)

002939753.b3lyp_6-31g(d).firefly.inp (generated)

002939753.b3lyp_6-31g(d).smash.inp (generated)

002939753.b3lyp_6-31g(d).nwchem.inp (generated) 002939753.b3lyp_6-31g(d).log.xz 002939753.td-b3lyp_6-31g+(d).inp 002939753.td-b3lyp_6-31g+(d).log.xz

002939753.td-b3lyp_6-31+g(d).qchem.inp (generated)

002939753.td-b3lyp_6-31+g(d).gjf (generated)

002939753.td-b3lyp_6-31+g(d).firefly.inp (generated)

002939753.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002939753.mol 002939753.PUBCHEM 002939753.mol (via Jmol)
002940003.b3lyp_6-31g(d).inp

002940003.b3lyp_6-31g(d).qchem.inp (generated)

002940003.b3lyp_6-31g(d).gjf (generated)

002940003.b3lyp_6-31g(d).firefly.inp (generated)

002940003.b3lyp_6-31g(d).smash.inp (generated)

002940003.b3lyp_6-31g(d).nwchem.inp (generated) 002940003.b3lyp_6-31g(d).log.xz 002940003.td-b3lyp_6-31g+(d).inp 002940003.td-b3lyp_6-31g+(d).log.xz

002940003.td-b3lyp_6-31+g(d).qchem.inp (generated)

002940003.td-b3lyp_6-31+g(d).gjf (generated)

002940003.td-b3lyp_6-31+g(d).firefly.inp (generated)

002940003.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002940003.mol 002940003.PUBCHEM 002940003.mol (via Jmol)
002940074.b3lyp_6-31g(d).inp

002940074.b3lyp_6-31g(d).qchem.inp (generated)

002940074.b3lyp_6-31g(d).gjf (generated)

002940074.b3lyp_6-31g(d).firefly.inp (generated)

002940074.b3lyp_6-31g(d).smash.inp (generated)

002940074.b3lyp_6-31g(d).nwchem.inp (generated) 002940074.b3lyp_6-31g(d).log.xz 002940074.td-b3lyp_6-31g+(d).inp 002940074.td-b3lyp_6-31g+(d).log.xz

002940074.td-b3lyp_6-31+g(d).qchem.inp (generated)

002940074.td-b3lyp_6-31+g(d).gjf (generated)

002940074.td-b3lyp_6-31+g(d).firefly.inp (generated)

002940074.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002940074.mol 002940074.PUBCHEM 002940074.mol (via Jmol)
002940278.b3lyp_6-31g(d).inp

002940278.b3lyp_6-31g(d).qchem.inp (generated)

002940278.b3lyp_6-31g(d).gjf (generated)

002940278.b3lyp_6-31g(d).firefly.inp (generated)

002940278.b3lyp_6-31g(d).smash.inp (generated)

002940278.b3lyp_6-31g(d).nwchem.inp (generated) 002940278.b3lyp_6-31g(d).log.xz 002940278.td-b3lyp_6-31g+(d).inp 002940278.td-b3lyp_6-31g+(d).log.xz

002940278.td-b3lyp_6-31+g(d).qchem.inp (generated)

002940278.td-b3lyp_6-31+g(d).gjf (generated)

002940278.td-b3lyp_6-31+g(d).firefly.inp (generated)

002940278.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002940278.mol 002940278.PUBCHEM 002940278.mol (via Jmol)
002940283.b3lyp_6-31g(d).inp

002940283.b3lyp_6-31g(d).qchem.inp (generated)

002940283.b3lyp_6-31g(d).gjf (generated)

002940283.b3lyp_6-31g(d).firefly.inp (generated)

002940283.b3lyp_6-31g(d).smash.inp (generated)

002940283.b3lyp_6-31g(d).nwchem.inp (generated) 002940283.b3lyp_6-31g(d).log.xz 002940283.td-b3lyp_6-31g+(d).inp 002940283.td-b3lyp_6-31g+(d).log.xz

002940283.td-b3lyp_6-31+g(d).qchem.inp (generated)

002940283.td-b3lyp_6-31+g(d).gjf (generated)

002940283.td-b3lyp_6-31+g(d).firefly.inp (generated)

002940283.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002940283.mol 002940283.PUBCHEM 002940283.mol (via Jmol)
002940313.b3lyp_6-31g(d).inp

002940313.b3lyp_6-31g(d).qchem.inp (generated)

002940313.b3lyp_6-31g(d).gjf (generated)

002940313.b3lyp_6-31g(d).firefly.inp (generated)

002940313.b3lyp_6-31g(d).smash.inp (generated)

002940313.b3lyp_6-31g(d).nwchem.inp (generated) 002940313.b3lyp_6-31g(d).log.xz 002940313.td-b3lyp_6-31g+(d).inp 002940313.td-b3lyp_6-31g+(d).log.xz

002940313.td-b3lyp_6-31+g(d).qchem.inp (generated)

002940313.td-b3lyp_6-31+g(d).gjf (generated)

002940313.td-b3lyp_6-31+g(d).firefly.inp (generated)

002940313.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002940313.mol 002940313.PUBCHEM 002940313.mol (via Jmol)
002940331.b3lyp_6-31g(d).inp

002940331.b3lyp_6-31g(d).qchem.inp (generated)

002940331.b3lyp_6-31g(d).gjf (generated)

002940331.b3lyp_6-31g(d).firefly.inp (generated)

002940331.b3lyp_6-31g(d).smash.inp (generated)

002940331.b3lyp_6-31g(d).nwchem.inp (generated) 002940331.b3lyp_6-31g(d).log.xz 002940331.td-b3lyp_6-31g+(d).inp 002940331.td-b3lyp_6-31g+(d).log.xz

002940331.td-b3lyp_6-31+g(d).qchem.inp (generated)

002940331.td-b3lyp_6-31+g(d).gjf (generated)

002940331.td-b3lyp_6-31+g(d).firefly.inp (generated)

002940331.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002940331.mol 002940331.PUBCHEM 002940331.mol (via Jmol)
002940361.b3lyp_6-31g(d).inp

002940361.b3lyp_6-31g(d).qchem.inp (generated)

002940361.b3lyp_6-31g(d).gjf (generated)

002940361.b3lyp_6-31g(d).firefly.inp (generated)

002940361.b3lyp_6-31g(d).smash.inp (generated)

002940361.b3lyp_6-31g(d).nwchem.inp (generated) 002940361.b3lyp_6-31g(d).log.xz 002940361.td-b3lyp_6-31g+(d).inp 002940361.td-b3lyp_6-31g+(d).log.xz

002940361.td-b3lyp_6-31+g(d).qchem.inp (generated)

002940361.td-b3lyp_6-31+g(d).gjf (generated)

002940361.td-b3lyp_6-31+g(d).firefly.inp (generated)

002940361.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002940361.mol 002940361.PUBCHEM 002940361.mol (via Jmol)
002940445.b3lyp_6-31g(d).inp

002940445.b3lyp_6-31g(d).qchem.inp (generated)

002940445.b3lyp_6-31g(d).gjf (generated)

002940445.b3lyp_6-31g(d).firefly.inp (generated)

002940445.b3lyp_6-31g(d).smash.inp (generated)

002940445.b3lyp_6-31g(d).nwchem.inp (generated) 002940445.b3lyp_6-31g(d).log.xz 002940445.td-b3lyp_6-31g+(d).inp 002940445.td-b3lyp_6-31g+(d).log.xz

002940445.td-b3lyp_6-31+g(d).qchem.inp (generated)

002940445.td-b3lyp_6-31+g(d).gjf (generated)

002940445.td-b3lyp_6-31+g(d).firefly.inp (generated)

002940445.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002940445.mol 002940445.PUBCHEM 002940445.mol (via Jmol)
002940485.b3lyp_6-31g(d).inp

002940485.b3lyp_6-31g(d).qchem.inp (generated)

002940485.b3lyp_6-31g(d).gjf (generated)

002940485.b3lyp_6-31g(d).firefly.inp (generated)

002940485.b3lyp_6-31g(d).smash.inp (generated)

002940485.b3lyp_6-31g(d).nwchem.inp (generated) 002940485.b3lyp_6-31g(d).log.xz 002940485.td-b3lyp_6-31g+(d).inp 002940485.td-b3lyp_6-31g+(d).log.xz

002940485.td-b3lyp_6-31+g(d).qchem.inp (generated)

002940485.td-b3lyp_6-31+g(d).gjf (generated)

002940485.td-b3lyp_6-31+g(d).firefly.inp (generated)

002940485.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002940485.mol 002940485.PUBCHEM 002940485.mol (via Jmol)
002940917.b3lyp_6-31g(d).inp

002940917.b3lyp_6-31g(d).qchem.inp (generated)

002940917.b3lyp_6-31g(d).gjf (generated)

002940917.b3lyp_6-31g(d).firefly.inp (generated)

002940917.b3lyp_6-31g(d).smash.inp (generated)

002940917.b3lyp_6-31g(d).nwchem.inp (generated) 002940917.b3lyp_6-31g(d).log.xz 002940917.mol 002940917.PUBCHEM 002940917.mol (via Jmol)
002940922.b3lyp_6-31g(d).inp

002940922.b3lyp_6-31g(d).qchem.inp (generated)

002940922.b3lyp_6-31g(d).gjf (generated)

002940922.b3lyp_6-31g(d).firefly.inp (generated)

002940922.b3lyp_6-31g(d).smash.inp (generated)

002940922.b3lyp_6-31g(d).nwchem.inp (generated) 002940922.b3lyp_6-31g(d).log.xz 002940922.td-b3lyp_6-31g+(d).inp 002940922.td-b3lyp_6-31g+(d).log.xz

002940922.td-b3lyp_6-31+g(d).qchem.inp (generated)

002940922.td-b3lyp_6-31+g(d).gjf (generated)

002940922.td-b3lyp_6-31+g(d).firefly.inp (generated)

002940922.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002940922.mol 002940922.PUBCHEM 002940922.mol (via Jmol)
002941143.b3lyp_6-31g(d).inp

002941143.b3lyp_6-31g(d).qchem.inp (generated)

002941143.b3lyp_6-31g(d).gjf (generated)

002941143.b3lyp_6-31g(d).firefly.inp (generated)

002941143.b3lyp_6-31g(d).smash.inp (generated)

002941143.b3lyp_6-31g(d).nwchem.inp (generated) 002941143.b3lyp_6-31g(d).log.xz 002941143.mol 002941143.PUBCHEM 002941143.mol (via Jmol)
002941346.b3lyp_6-31g(d).inp

002941346.b3lyp_6-31g(d).qchem.inp (generated)

002941346.b3lyp_6-31g(d).gjf (generated)

002941346.b3lyp_6-31g(d).firefly.inp (generated)

002941346.b3lyp_6-31g(d).smash.inp (generated)

002941346.b3lyp_6-31g(d).nwchem.inp (generated) 002941346.b3lyp_6-31g(d).log.xz 002941346.td-b3lyp_6-31g+(d).inp 002941346.td-b3lyp_6-31g+(d).log.xz

002941346.td-b3lyp_6-31+g(d).qchem.inp (generated)

002941346.td-b3lyp_6-31+g(d).gjf (generated)

002941346.td-b3lyp_6-31+g(d).firefly.inp (generated)

002941346.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002941346.mol 002941346.PUBCHEM 002941346.mol (via Jmol)
002941389.b3lyp_6-31g(d).inp

002941389.b3lyp_6-31g(d).qchem.inp (generated)

002941389.b3lyp_6-31g(d).gjf (generated)

002941389.b3lyp_6-31g(d).firefly.inp (generated)

002941389.b3lyp_6-31g(d).smash.inp (generated)

002941389.b3lyp_6-31g(d).nwchem.inp (generated) 002941389.b3lyp_6-31g(d).log.xz 002941389.mol 002941389.PUBCHEM 002941389.mol (via Jmol)
002941431.b3lyp_6-31g(d).inp

002941431.b3lyp_6-31g(d).qchem.inp (generated)

002941431.b3lyp_6-31g(d).gjf (generated)

002941431.b3lyp_6-31g(d).firefly.inp (generated)

002941431.b3lyp_6-31g(d).smash.inp (generated)

002941431.b3lyp_6-31g(d).nwchem.inp (generated) 002941431.b3lyp_6-31g(d).log.xz 002941431.td-b3lyp_6-31g+(d).inp 002941431.td-b3lyp_6-31g+(d).log.xz

002941431.td-b3lyp_6-31+g(d).qchem.inp (generated)

002941431.td-b3lyp_6-31+g(d).gjf (generated)

002941431.td-b3lyp_6-31+g(d).firefly.inp (generated)

002941431.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002941431.mol 002941431.PUBCHEM 002941431.mol (via Jmol)
002941514.b3lyp_6-31g(d).inp

002941514.b3lyp_6-31g(d).qchem.inp (generated)

002941514.b3lyp_6-31g(d).gjf (generated)

002941514.b3lyp_6-31g(d).firefly.inp (generated)

002941514.b3lyp_6-31g(d).smash.inp (generated)

002941514.b3lyp_6-31g(d).nwchem.inp (generated) 002941514.b3lyp_6-31g(d).log.xz 002941514.td-b3lyp_6-31g+(d).inp 002941514.td-b3lyp_6-31g+(d).log.xz

002941514.td-b3lyp_6-31+g(d).qchem.inp (generated)

002941514.td-b3lyp_6-31+g(d).gjf (generated)

002941514.td-b3lyp_6-31+g(d).firefly.inp (generated)

002941514.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002941514.mol 002941514.PUBCHEM 002941514.mol (via Jmol)
002941515.b3lyp_6-31g(d).inp

002941515.b3lyp_6-31g(d).qchem.inp (generated)

002941515.b3lyp_6-31g(d).gjf (generated)

002941515.b3lyp_6-31g(d).firefly.inp (generated)

002941515.b3lyp_6-31g(d).smash.inp (generated)

002941515.b3lyp_6-31g(d).nwchem.inp (generated) 002941515.b3lyp_6-31g(d).log.xz 002941515.td-b3lyp_6-31g+(d).inp 002941515.td-b3lyp_6-31g+(d).log.xz

002941515.td-b3lyp_6-31+g(d).qchem.inp (generated)

002941515.td-b3lyp_6-31+g(d).gjf (generated)

002941515.td-b3lyp_6-31+g(d).firefly.inp (generated)

002941515.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002941515.mol 002941515.PUBCHEM 002941515.mol (via Jmol)
002941651.b3lyp_6-31g(d).inp

002941651.b3lyp_6-31g(d).qchem.inp (generated)

002941651.b3lyp_6-31g(d).gjf (generated)

002941651.b3lyp_6-31g(d).firefly.inp (generated)

002941651.b3lyp_6-31g(d).smash.inp (generated)

002941651.b3lyp_6-31g(d).nwchem.inp (generated) 002941651.b3lyp_6-31g(d).log.xz 002941651.td-b3lyp_6-31g+(d).inp 002941651.td-b3lyp_6-31g+(d).log.xz

002941651.td-b3lyp_6-31+g(d).qchem.inp (generated)

002941651.td-b3lyp_6-31+g(d).gjf (generated)

002941651.td-b3lyp_6-31+g(d).firefly.inp (generated)

002941651.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002941651.mol 002941651.PUBCHEM 002941651.mol (via Jmol)
002941673.b3lyp_6-31g(d).inp

002941673.b3lyp_6-31g(d).qchem.inp (generated)

002941673.b3lyp_6-31g(d).gjf (generated)

002941673.b3lyp_6-31g(d).firefly.inp (generated)

002941673.b3lyp_6-31g(d).smash.inp (generated)

002941673.b3lyp_6-31g(d).nwchem.inp (generated) 002941673.b3lyp_6-31g(d).log.xz 002941673.td-b3lyp_6-31g+(d).inp 002941673.td-b3lyp_6-31g+(d).log.xz

002941673.td-b3lyp_6-31+g(d).qchem.inp (generated)

002941673.td-b3lyp_6-31+g(d).gjf (generated)

002941673.td-b3lyp_6-31+g(d).firefly.inp (generated)

002941673.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002941673.mol 002941673.PUBCHEM 002941673.mol (via Jmol)
002941691.b3lyp_6-31g(d).inp

002941691.b3lyp_6-31g(d).qchem.inp (generated)

002941691.b3lyp_6-31g(d).gjf (generated)

002941691.b3lyp_6-31g(d).firefly.inp (generated)

002941691.b3lyp_6-31g(d).smash.inp (generated)

002941691.b3lyp_6-31g(d).nwchem.inp (generated) 002941691.b3lyp_6-31g(d).log.xz 002941691.td-b3lyp_6-31g+(d).inp 002941691.td-b3lyp_6-31g+(d).log.xz

002941691.td-b3lyp_6-31+g(d).qchem.inp (generated)

002941691.td-b3lyp_6-31+g(d).gjf (generated)

002941691.td-b3lyp_6-31+g(d).firefly.inp (generated)

002941691.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002941691.mol 002941691.PUBCHEM 002941691.mol (via Jmol)
002941787.b3lyp_6-31g(d).inp

002941787.b3lyp_6-31g(d).qchem.inp (generated)

002941787.b3lyp_6-31g(d).gjf (generated)

002941787.b3lyp_6-31g(d).firefly.inp (generated)

002941787.b3lyp_6-31g(d).smash.inp (generated)

002941787.b3lyp_6-31g(d).nwchem.inp (generated) 002941787.b3lyp_6-31g(d).log.xz 002941787.td-b3lyp_6-31g+(d).inp 002941787.td-b3lyp_6-31g+(d).log.xz

002941787.td-b3lyp_6-31+g(d).qchem.inp (generated)

002941787.td-b3lyp_6-31+g(d).gjf (generated)

002941787.td-b3lyp_6-31+g(d).firefly.inp (generated)

002941787.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002941787.mol 002941787.PUBCHEM 002941787.mol (via Jmol)
002941796.b3lyp_6-31g(d).inp

002941796.b3lyp_6-31g(d).qchem.inp (generated)

002941796.b3lyp_6-31g(d).gjf (generated)

002941796.b3lyp_6-31g(d).firefly.inp (generated)

002941796.b3lyp_6-31g(d).smash.inp (generated)

002941796.b3lyp_6-31g(d).nwchem.inp (generated) 002941796.b3lyp_6-31g(d).log.xz 002941796.td-b3lyp_6-31g+(d).inp 002941796.td-b3lyp_6-31g+(d).log.xz

002941796.td-b3lyp_6-31+g(d).qchem.inp (generated)

002941796.td-b3lyp_6-31+g(d).gjf (generated)

002941796.td-b3lyp_6-31+g(d).firefly.inp (generated)

002941796.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002941796.mol 002941796.PUBCHEM 002941796.mol (via Jmol)
002941839.b3lyp_6-31g(d).inp

002941839.b3lyp_6-31g(d).qchem.inp (generated)

002941839.b3lyp_6-31g(d).gjf (generated)

002941839.b3lyp_6-31g(d).firefly.inp (generated)

002941839.b3lyp_6-31g(d).smash.inp (generated)

002941839.b3lyp_6-31g(d).nwchem.inp (generated) 002941839.b3lyp_6-31g(d).log.xz 002941839.td-b3lyp_6-31g+(d).inp 002941839.td-b3lyp_6-31g+(d).log.xz

002941839.td-b3lyp_6-31+g(d).qchem.inp (generated)

002941839.td-b3lyp_6-31+g(d).gjf (generated)

002941839.td-b3lyp_6-31+g(d).firefly.inp (generated)

002941839.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002941839.mol 002941839.PUBCHEM 002941839.mol (via Jmol)
002941895.b3lyp_6-31g(d).inp

002941895.b3lyp_6-31g(d).qchem.inp (generated)

002941895.b3lyp_6-31g(d).gjf (generated)

002941895.b3lyp_6-31g(d).firefly.inp (generated)

002941895.b3lyp_6-31g(d).smash.inp (generated)

002941895.b3lyp_6-31g(d).nwchem.inp (generated) 002941895.b3lyp_6-31g(d).log.xz 002941895.mol 002941895.PUBCHEM 002941895.mol (via Jmol)
002941939.b3lyp_6-31g(d).inp

002941939.b3lyp_6-31g(d).qchem.inp (generated)

002941939.b3lyp_6-31g(d).gjf (generated)

002941939.b3lyp_6-31g(d).firefly.inp (generated)

002941939.b3lyp_6-31g(d).smash.inp (generated)

002941939.b3lyp_6-31g(d).nwchem.inp (generated) 002941939.b3lyp_6-31g(d).log.xz 002941939.mol 002941939.PUBCHEM 002941939.mol (via Jmol)
002941962.b3lyp_6-31g(d).inp

002941962.b3lyp_6-31g(d).qchem.inp (generated)

002941962.b3lyp_6-31g(d).gjf (generated)

002941962.b3lyp_6-31g(d).firefly.inp (generated)

002941962.b3lyp_6-31g(d).smash.inp (generated)

002941962.b3lyp_6-31g(d).nwchem.inp (generated) 002941962.b3lyp_6-31g(d).log.xz 002941962.td-b3lyp_6-31g+(d).inp 002941962.td-b3lyp_6-31g+(d).log.xz

002941962.td-b3lyp_6-31+g(d).qchem.inp (generated)

002941962.td-b3lyp_6-31+g(d).gjf (generated)

002941962.td-b3lyp_6-31+g(d).firefly.inp (generated)

002941962.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002941962.mol 002941962.PUBCHEM 002941962.mol (via Jmol)
002942084.b3lyp_6-31g(d).inp

002942084.b3lyp_6-31g(d).qchem.inp (generated)

002942084.b3lyp_6-31g(d).gjf (generated)

002942084.b3lyp_6-31g(d).firefly.inp (generated)

002942084.b3lyp_6-31g(d).smash.inp (generated)

002942084.b3lyp_6-31g(d).nwchem.inp (generated) 002942084.b3lyp_6-31g(d).log.xz 002942084.td-b3lyp_6-31g+(d).inp 002942084.td-b3lyp_6-31g+(d).log.xz

002942084.td-b3lyp_6-31+g(d).qchem.inp (generated)

002942084.td-b3lyp_6-31+g(d).gjf (generated)

002942084.td-b3lyp_6-31+g(d).firefly.inp (generated)

002942084.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002942084.mol 002942084.PUBCHEM 002942084.mol (via Jmol)
002942133.b3lyp_6-31g(d).inp

002942133.b3lyp_6-31g(d).qchem.inp (generated)

002942133.b3lyp_6-31g(d).gjf (generated)

002942133.b3lyp_6-31g(d).firefly.inp (generated)

002942133.b3lyp_6-31g(d).smash.inp (generated)

002942133.b3lyp_6-31g(d).nwchem.inp (generated) 002942133.b3lyp_6-31g(d).log.xz 002942133.td-b3lyp_6-31g+(d).inp 002942133.td-b3lyp_6-31g+(d).log.xz

002942133.td-b3lyp_6-31+g(d).qchem.inp (generated)

002942133.td-b3lyp_6-31+g(d).gjf (generated)

002942133.td-b3lyp_6-31+g(d).firefly.inp (generated)

002942133.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002942133.mol 002942133.PUBCHEM 002942133.mol (via Jmol)
002942152.b3lyp_6-31g(d).inp

002942152.b3lyp_6-31g(d).qchem.inp (generated)

002942152.b3lyp_6-31g(d).gjf (generated)

002942152.b3lyp_6-31g(d).firefly.inp (generated)

002942152.b3lyp_6-31g(d).smash.inp (generated)

002942152.b3lyp_6-31g(d).nwchem.inp (generated) 002942152.b3lyp_6-31g(d).log.xz 002942152.td-b3lyp_6-31g+(d).inp 002942152.td-b3lyp_6-31g+(d).log.xz

002942152.td-b3lyp_6-31+g(d).qchem.inp (generated)

002942152.td-b3lyp_6-31+g(d).gjf (generated)

002942152.td-b3lyp_6-31+g(d).firefly.inp (generated)

002942152.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002942152.mol 002942152.PUBCHEM 002942152.mol (via Jmol)
002942239.b3lyp_6-31g(d).inp

002942239.b3lyp_6-31g(d).qchem.inp (generated)

002942239.b3lyp_6-31g(d).gjf (generated)

002942239.b3lyp_6-31g(d).firefly.inp (generated)

002942239.b3lyp_6-31g(d).smash.inp (generated)

002942239.b3lyp_6-31g(d).nwchem.inp (generated) 002942239.b3lyp_6-31g(d).log.xz 002942239.td-b3lyp_6-31g+(d).inp 002942239.td-b3lyp_6-31g+(d).log.xz

002942239.td-b3lyp_6-31+g(d).qchem.inp (generated)

002942239.td-b3lyp_6-31+g(d).gjf (generated)

002942239.td-b3lyp_6-31+g(d).firefly.inp (generated)

002942239.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002942239.mol 002942239.PUBCHEM 002942239.mol (via Jmol)
002942265.b3lyp_6-31g(d).inp

002942265.b3lyp_6-31g(d).qchem.inp (generated)

002942265.b3lyp_6-31g(d).gjf (generated)

002942265.b3lyp_6-31g(d).firefly.inp (generated)

002942265.b3lyp_6-31g(d).smash.inp (generated)

002942265.b3lyp_6-31g(d).nwchem.inp (generated) 002942265.b3lyp_6-31g(d).log.xz 002942265.mol 002942265.PUBCHEM 002942265.mol (via Jmol)
002942382.b3lyp_6-31g(d).inp

002942382.b3lyp_6-31g(d).qchem.inp (generated)

002942382.b3lyp_6-31g(d).gjf (generated)

002942382.b3lyp_6-31g(d).firefly.inp (generated)

002942382.b3lyp_6-31g(d).smash.inp (generated)

002942382.b3lyp_6-31g(d).nwchem.inp (generated) 002942382.b3lyp_6-31g(d).log.xz 002942382.td-b3lyp_6-31g+(d).inp 002942382.td-b3lyp_6-31g+(d).log.xz

002942382.td-b3lyp_6-31+g(d).qchem.inp (generated)

002942382.td-b3lyp_6-31+g(d).gjf (generated)

002942382.td-b3lyp_6-31+g(d).firefly.inp (generated)

002942382.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002942382.mol 002942382.PUBCHEM 002942382.mol (via Jmol)
002942390.b3lyp_6-31g(d).inp

002942390.b3lyp_6-31g(d).qchem.inp (generated)

002942390.b3lyp_6-31g(d).gjf (generated)

002942390.b3lyp_6-31g(d).firefly.inp (generated)

002942390.b3lyp_6-31g(d).smash.inp (generated)

002942390.b3lyp_6-31g(d).nwchem.inp (generated) 002942390.b3lyp_6-31g(d).log.xz 002942390.td-b3lyp_6-31g+(d).inp 002942390.td-b3lyp_6-31g+(d).log.xz

002942390.td-b3lyp_6-31+g(d).qchem.inp (generated)

002942390.td-b3lyp_6-31+g(d).gjf (generated)

002942390.td-b3lyp_6-31+g(d).firefly.inp (generated)

002942390.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002942390.mol 002942390.PUBCHEM 002942390.mol (via Jmol)
002942476.b3lyp_6-31g(d).inp

002942476.b3lyp_6-31g(d).qchem.inp (generated)

002942476.b3lyp_6-31g(d).gjf (generated)

002942476.b3lyp_6-31g(d).firefly.inp (generated)

002942476.b3lyp_6-31g(d).smash.inp (generated)

002942476.b3lyp_6-31g(d).nwchem.inp (generated) 002942476.b3lyp_6-31g(d).log.xz 002942476.td-b3lyp_6-31g+(d).inp 002942476.td-b3lyp_6-31g+(d).log.xz

002942476.td-b3lyp_6-31+g(d).qchem.inp (generated)

002942476.td-b3lyp_6-31+g(d).gjf (generated)

002942476.td-b3lyp_6-31+g(d).firefly.inp (generated)

002942476.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002942476.mol 002942476.PUBCHEM 002942476.mol (via Jmol)
002942759.b3lyp_6-31g(d).inp

002942759.b3lyp_6-31g(d).qchem.inp (generated)

002942759.b3lyp_6-31g(d).gjf (generated)

002942759.b3lyp_6-31g(d).firefly.inp (generated)

002942759.b3lyp_6-31g(d).smash.inp (generated)

002942759.b3lyp_6-31g(d).nwchem.inp (generated) 002942759.b3lyp_6-31g(d).log.xz 002942759.td-b3lyp_6-31g+(d).inp 002942759.td-b3lyp_6-31g+(d).log.xz

002942759.td-b3lyp_6-31+g(d).qchem.inp (generated)

002942759.td-b3lyp_6-31+g(d).gjf (generated)

002942759.td-b3lyp_6-31+g(d).firefly.inp (generated)

002942759.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002942759.mol 002942759.PUBCHEM 002942759.mol (via Jmol)
002942837.b3lyp_6-31g(d).inp

002942837.b3lyp_6-31g(d).qchem.inp (generated)

002942837.b3lyp_6-31g(d).gjf (generated)

002942837.b3lyp_6-31g(d).firefly.inp (generated)

002942837.b3lyp_6-31g(d).smash.inp (generated)

002942837.b3lyp_6-31g(d).nwchem.inp (generated) 002942837.b3lyp_6-31g(d).log.xz 002942837.td-b3lyp_6-31g+(d).inp 002942837.td-b3lyp_6-31g+(d).log.xz

002942837.td-b3lyp_6-31+g(d).qchem.inp (generated)

002942837.td-b3lyp_6-31+g(d).gjf (generated)

002942837.td-b3lyp_6-31+g(d).firefly.inp (generated)

002942837.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002942837.mol 002942837.PUBCHEM 002942837.mol (via Jmol)
002942907.b3lyp_6-31g(d).inp

002942907.b3lyp_6-31g(d).qchem.inp (generated)

002942907.b3lyp_6-31g(d).gjf (generated)

002942907.b3lyp_6-31g(d).firefly.inp (generated)

002942907.b3lyp_6-31g(d).smash.inp (generated)

002942907.b3lyp_6-31g(d).nwchem.inp (generated) 002942907.b3lyp_6-31g(d).log.xz 002942907.td-b3lyp_6-31g+(d).inp 002942907.td-b3lyp_6-31g+(d).log.xz

002942907.td-b3lyp_6-31+g(d).qchem.inp (generated)

002942907.td-b3lyp_6-31+g(d).gjf (generated)

002942907.td-b3lyp_6-31+g(d).firefly.inp (generated)

002942907.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002942907.mol 002942907.PUBCHEM 002942907.mol (via Jmol)
002943033.b3lyp_6-31g(d).inp

002943033.b3lyp_6-31g(d).qchem.inp (generated)

002943033.b3lyp_6-31g(d).gjf (generated)

002943033.b3lyp_6-31g(d).firefly.inp (generated)

002943033.b3lyp_6-31g(d).smash.inp (generated)

002943033.b3lyp_6-31g(d).nwchem.inp (generated) 002943033.b3lyp_6-31g(d).log.xz 002943033.td-b3lyp_6-31g+(d).inp 002943033.td-b3lyp_6-31g+(d).log.xz

002943033.td-b3lyp_6-31+g(d).qchem.inp (generated)

002943033.td-b3lyp_6-31+g(d).gjf (generated)

002943033.td-b3lyp_6-31+g(d).firefly.inp (generated)

002943033.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002943033.mol 002943033.PUBCHEM 002943033.mol (via Jmol)
002943054.b3lyp_6-31g(d).inp

002943054.b3lyp_6-31g(d).qchem.inp (generated)

002943054.b3lyp_6-31g(d).gjf (generated)

002943054.b3lyp_6-31g(d).firefly.inp (generated)

002943054.b3lyp_6-31g(d).smash.inp (generated)

002943054.b3lyp_6-31g(d).nwchem.inp (generated) 002943054.b3lyp_6-31g(d).log.xz 002943054.mol 002943054.PUBCHEM 002943054.mol (via Jmol)
002943065.b3lyp_6-31g(d).inp

002943065.b3lyp_6-31g(d).qchem.inp (generated)

002943065.b3lyp_6-31g(d).gjf (generated)

002943065.b3lyp_6-31g(d).firefly.inp (generated)

002943065.b3lyp_6-31g(d).smash.inp (generated)

002943065.b3lyp_6-31g(d).nwchem.inp (generated) 002943065.b3lyp_6-31g(d).log.xz 002943065.td-b3lyp_6-31g+(d).inp 002943065.td-b3lyp_6-31g+(d).log.xz

002943065.td-b3lyp_6-31+g(d).qchem.inp (generated)

002943065.td-b3lyp_6-31+g(d).gjf (generated)

002943065.td-b3lyp_6-31+g(d).firefly.inp (generated)

002943065.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002943065.mol 002943065.PUBCHEM 002943065.mol (via Jmol)
002943069.b3lyp_6-31g(d).inp

002943069.b3lyp_6-31g(d).qchem.inp (generated)

002943069.b3lyp_6-31g(d).gjf (generated)

002943069.b3lyp_6-31g(d).firefly.inp (generated)

002943069.b3lyp_6-31g(d).smash.inp (generated)

002943069.b3lyp_6-31g(d).nwchem.inp (generated) 002943069.b3lyp_6-31g(d).log.xz 002943069.mol 002943069.PUBCHEM 002943069.mol (via Jmol)
002943155.b3lyp_6-31g(d).inp

002943155.b3lyp_6-31g(d).qchem.inp (generated)

002943155.b3lyp_6-31g(d).gjf (generated)

002943155.b3lyp_6-31g(d).firefly.inp (generated)

002943155.b3lyp_6-31g(d).smash.inp (generated)

002943155.b3lyp_6-31g(d).nwchem.inp (generated) 002943155.b3lyp_6-31g(d).log.xz 002943155.td-b3lyp_6-31g+(d).inp 002943155.td-b3lyp_6-31g+(d).log.xz

002943155.td-b3lyp_6-31+g(d).qchem.inp (generated)

002943155.td-b3lyp_6-31+g(d).gjf (generated)

002943155.td-b3lyp_6-31+g(d).firefly.inp (generated)

002943155.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002943155.mol 002943155.PUBCHEM 002943155.mol (via Jmol)
002943181.b3lyp_6-31g(d).inp

002943181.b3lyp_6-31g(d).qchem.inp (generated)

002943181.b3lyp_6-31g(d).gjf (generated)

002943181.b3lyp_6-31g(d).firefly.inp (generated)

002943181.b3lyp_6-31g(d).smash.inp (generated)

002943181.b3lyp_6-31g(d).nwchem.inp (generated) 002943181.b3lyp_6-31g(d).log.xz 002943181.mol 002943181.PUBCHEM 002943181.mol (via Jmol)
002943190.b3lyp_6-31g(d).inp

002943190.b3lyp_6-31g(d).qchem.inp (generated)

002943190.b3lyp_6-31g(d).gjf (generated)

002943190.b3lyp_6-31g(d).firefly.inp (generated)

002943190.b3lyp_6-31g(d).smash.inp (generated)

002943190.b3lyp_6-31g(d).nwchem.inp (generated) 002943190.b3lyp_6-31g(d).log.xz 002943190.td-b3lyp_6-31g+(d).inp 002943190.td-b3lyp_6-31g+(d).log.xz

002943190.td-b3lyp_6-31+g(d).qchem.inp (generated)

002943190.td-b3lyp_6-31+g(d).gjf (generated)

002943190.td-b3lyp_6-31+g(d).firefly.inp (generated)

002943190.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002943190.mol 002943190.PUBCHEM 002943190.mol (via Jmol)
002943205.b3lyp_6-31g(d).inp

002943205.b3lyp_6-31g(d).qchem.inp (generated)

002943205.b3lyp_6-31g(d).gjf (generated)

002943205.b3lyp_6-31g(d).firefly.inp (generated)

002943205.b3lyp_6-31g(d).smash.inp (generated)

002943205.b3lyp_6-31g(d).nwchem.inp (generated) 002943205.b3lyp_6-31g(d).log.xz 002943205.td-b3lyp_6-31g+(d).inp 002943205.td-b3lyp_6-31g+(d).log.xz

002943205.td-b3lyp_6-31+g(d).qchem.inp (generated)

002943205.td-b3lyp_6-31+g(d).gjf (generated)

002943205.td-b3lyp_6-31+g(d).firefly.inp (generated)

002943205.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002943205.mol 002943205.PUBCHEM 002943205.mol (via Jmol)
002943285.b3lyp_6-31g(d).inp

002943285.b3lyp_6-31g(d).qchem.inp (generated)

002943285.b3lyp_6-31g(d).gjf (generated)

002943285.b3lyp_6-31g(d).firefly.inp (generated)

002943285.b3lyp_6-31g(d).smash.inp (generated)

002943285.b3lyp_6-31g(d).nwchem.inp (generated) 002943285.b3lyp_6-31g(d).log.xz 002943285.td-b3lyp_6-31g+(d).inp 002943285.td-b3lyp_6-31g+(d).log.xz

002943285.td-b3lyp_6-31+g(d).qchem.inp (generated)

002943285.td-b3lyp_6-31+g(d).gjf (generated)

002943285.td-b3lyp_6-31+g(d).firefly.inp (generated)

002943285.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002943285.mol 002943285.PUBCHEM 002943285.mol (via Jmol)
002943445.b3lyp_6-31g(d).inp

002943445.b3lyp_6-31g(d).qchem.inp (generated)

002943445.b3lyp_6-31g(d).gjf (generated)

002943445.b3lyp_6-31g(d).firefly.inp (generated)

002943445.b3lyp_6-31g(d).smash.inp (generated)

002943445.b3lyp_6-31g(d).nwchem.inp (generated) 002943445.b3lyp_6-31g(d).log.xz 002943445.td-b3lyp_6-31g+(d).inp 002943445.td-b3lyp_6-31g+(d).log.xz

002943445.td-b3lyp_6-31+g(d).qchem.inp (generated)

002943445.td-b3lyp_6-31+g(d).gjf (generated)

002943445.td-b3lyp_6-31+g(d).firefly.inp (generated)

002943445.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002943445.mol 002943445.PUBCHEM 002943445.mol (via Jmol)
002943640.b3lyp_6-31g(d).inp

002943640.b3lyp_6-31g(d).qchem.inp (generated)

002943640.b3lyp_6-31g(d).gjf (generated)

002943640.b3lyp_6-31g(d).firefly.inp (generated)

002943640.b3lyp_6-31g(d).smash.inp (generated)

002943640.b3lyp_6-31g(d).nwchem.inp (generated) 002943640.b3lyp_6-31g(d).log.xz 002943640.td-b3lyp_6-31g+(d).inp 002943640.td-b3lyp_6-31g+(d).log.xz

002943640.td-b3lyp_6-31+g(d).qchem.inp (generated)

002943640.td-b3lyp_6-31+g(d).gjf (generated)

002943640.td-b3lyp_6-31+g(d).firefly.inp (generated)

002943640.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002943640.mol 002943640.PUBCHEM 002943640.mol (via Jmol)
002944111.b3lyp_6-31g(d).inp

002944111.b3lyp_6-31g(d).qchem.inp (generated)

002944111.b3lyp_6-31g(d).gjf (generated)

002944111.b3lyp_6-31g(d).firefly.inp (generated)

002944111.b3lyp_6-31g(d).smash.inp (generated)

002944111.b3lyp_6-31g(d).nwchem.inp (generated) 002944111.b3lyp_6-31g(d).log.xz 002944111.mol 002944111.PUBCHEM 002944111.mol (via Jmol)
002944170.b3lyp_6-31g(d).inp

002944170.b3lyp_6-31g(d).qchem.inp (generated)

002944170.b3lyp_6-31g(d).gjf (generated)

002944170.b3lyp_6-31g(d).firefly.inp (generated)

002944170.b3lyp_6-31g(d).smash.inp (generated)

002944170.b3lyp_6-31g(d).nwchem.inp (generated) 002944170.b3lyp_6-31g(d).log.xz 002944170.td-b3lyp_6-31g+(d).inp 002944170.td-b3lyp_6-31g+(d).log.xz

002944170.td-b3lyp_6-31+g(d).qchem.inp (generated)

002944170.td-b3lyp_6-31+g(d).gjf (generated)

002944170.td-b3lyp_6-31+g(d).firefly.inp (generated)

002944170.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002944170.mol 002944170.PUBCHEM 002944170.mol (via Jmol)
002944176.b3lyp_6-31g(d).inp

002944176.b3lyp_6-31g(d).qchem.inp (generated)

002944176.b3lyp_6-31g(d).gjf (generated)

002944176.b3lyp_6-31g(d).firefly.inp (generated)

002944176.b3lyp_6-31g(d).smash.inp (generated)

002944176.b3lyp_6-31g(d).nwchem.inp (generated) 002944176.b3lyp_6-31g(d).log.xz 002944176.td-b3lyp_6-31g+(d).inp 002944176.td-b3lyp_6-31g+(d).log.xz

002944176.td-b3lyp_6-31+g(d).qchem.inp (generated)

002944176.td-b3lyp_6-31+g(d).gjf (generated)

002944176.td-b3lyp_6-31+g(d).firefly.inp (generated)

002944176.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002944176.mol 002944176.PUBCHEM 002944176.mol (via Jmol)
002944250.b3lyp_6-31g(d).inp

002944250.b3lyp_6-31g(d).qchem.inp (generated)

002944250.b3lyp_6-31g(d).gjf (generated)

002944250.b3lyp_6-31g(d).firefly.inp (generated)

002944250.b3lyp_6-31g(d).smash.inp (generated)

002944250.b3lyp_6-31g(d).nwchem.inp (generated) 002944250.b3lyp_6-31g(d).log.xz 002944250.td-b3lyp_6-31g+(d).inp 002944250.td-b3lyp_6-31g+(d).log.xz

002944250.td-b3lyp_6-31+g(d).qchem.inp (generated)

002944250.td-b3lyp_6-31+g(d).gjf (generated)

002944250.td-b3lyp_6-31+g(d).firefly.inp (generated)

002944250.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002944250.mol 002944250.PUBCHEM 002944250.mol (via Jmol)
002944256.b3lyp_6-31g(d).inp

002944256.b3lyp_6-31g(d).qchem.inp (generated)

002944256.b3lyp_6-31g(d).gjf (generated)

002944256.b3lyp_6-31g(d).firefly.inp (generated)

002944256.b3lyp_6-31g(d).smash.inp (generated)

002944256.b3lyp_6-31g(d).nwchem.inp (generated) 002944256.b3lyp_6-31g(d).log.xz 002944256.td-b3lyp_6-31g+(d).inp 002944256.td-b3lyp_6-31g+(d).log.xz

002944256.td-b3lyp_6-31+g(d).qchem.inp (generated)

002944256.td-b3lyp_6-31+g(d).gjf (generated)

002944256.td-b3lyp_6-31+g(d).firefly.inp (generated)

002944256.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002944256.mol 002944256.PUBCHEM 002944256.mol (via Jmol)
002944322.b3lyp_6-31g(d).inp

002944322.b3lyp_6-31g(d).qchem.inp (generated)

002944322.b3lyp_6-31g(d).gjf (generated)

002944322.b3lyp_6-31g(d).firefly.inp (generated)

002944322.b3lyp_6-31g(d).smash.inp (generated)

002944322.b3lyp_6-31g(d).nwchem.inp (generated) 002944322.b3lyp_6-31g(d).log.xz 002944322.td-b3lyp_6-31g+(d).inp 002944322.td-b3lyp_6-31g+(d).log.xz

002944322.td-b3lyp_6-31+g(d).qchem.inp (generated)

002944322.td-b3lyp_6-31+g(d).gjf (generated)

002944322.td-b3lyp_6-31+g(d).firefly.inp (generated)

002944322.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002944322.mol 002944322.PUBCHEM 002944322.mol (via Jmol)
002944584.b3lyp_6-31g(d).inp

002944584.b3lyp_6-31g(d).qchem.inp (generated)

002944584.b3lyp_6-31g(d).gjf (generated)

002944584.b3lyp_6-31g(d).firefly.inp (generated)

002944584.b3lyp_6-31g(d).smash.inp (generated)

002944584.b3lyp_6-31g(d).nwchem.inp (generated) 002944584.b3lyp_6-31g(d).log.xz 002944584.td-b3lyp_6-31g+(d).inp 002944584.td-b3lyp_6-31g+(d).log.xz

002944584.td-b3lyp_6-31+g(d).qchem.inp (generated)

002944584.td-b3lyp_6-31+g(d).gjf (generated)

002944584.td-b3lyp_6-31+g(d).firefly.inp (generated)

002944584.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002944584.mol 002944584.PUBCHEM 002944584.mol (via Jmol)
002944651.b3lyp_6-31g(d).inp

002944651.b3lyp_6-31g(d).qchem.inp (generated)

002944651.b3lyp_6-31g(d).gjf (generated)

002944651.b3lyp_6-31g(d).firefly.inp (generated)

002944651.b3lyp_6-31g(d).smash.inp (generated)

002944651.b3lyp_6-31g(d).nwchem.inp (generated) 002944651.b3lyp_6-31g(d).log.xz 002944651.td-b3lyp_6-31g+(d).inp 002944651.td-b3lyp_6-31g+(d).log.xz

002944651.td-b3lyp_6-31+g(d).qchem.inp (generated)

002944651.td-b3lyp_6-31+g(d).gjf (generated)

002944651.td-b3lyp_6-31+g(d).firefly.inp (generated)

002944651.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002944651.mol 002944651.PUBCHEM 002944651.mol (via Jmol)
002944809.b3lyp_6-31g(d).inp

002944809.b3lyp_6-31g(d).qchem.inp (generated)

002944809.b3lyp_6-31g(d).gjf (generated)

002944809.b3lyp_6-31g(d).firefly.inp (generated)

002944809.b3lyp_6-31g(d).smash.inp (generated)

002944809.b3lyp_6-31g(d).nwchem.inp (generated) 002944809.b3lyp_6-31g(d).log.xz 002944809.td-b3lyp_6-31g+(d).inp 002944809.td-b3lyp_6-31g+(d).log.xz

002944809.td-b3lyp_6-31+g(d).qchem.inp (generated)

002944809.td-b3lyp_6-31+g(d).gjf (generated)

002944809.td-b3lyp_6-31+g(d).firefly.inp (generated)

002944809.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002944809.mol 002944809.PUBCHEM 002944809.mol (via Jmol)
002944844.b3lyp_6-31g(d).inp

002944844.b3lyp_6-31g(d).qchem.inp (generated)

002944844.b3lyp_6-31g(d).gjf (generated)

002944844.b3lyp_6-31g(d).firefly.inp (generated)

002944844.b3lyp_6-31g(d).smash.inp (generated)

002944844.b3lyp_6-31g(d).nwchem.inp (generated) 002944844.b3lyp_6-31g(d).log.xz 002944844.td-b3lyp_6-31g+(d).inp 002944844.td-b3lyp_6-31g+(d).log.xz

002944844.td-b3lyp_6-31+g(d).qchem.inp (generated)

002944844.td-b3lyp_6-31+g(d).gjf (generated)

002944844.td-b3lyp_6-31+g(d).firefly.inp (generated)

002944844.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002944844.mol 002944844.PUBCHEM 002944844.mol (via Jmol)
002945041.b3lyp_6-31g(d).inp

002945041.b3lyp_6-31g(d).qchem.inp (generated)

002945041.b3lyp_6-31g(d).gjf (generated)

002945041.b3lyp_6-31g(d).firefly.inp (generated)

002945041.b3lyp_6-31g(d).smash.inp (generated)

002945041.b3lyp_6-31g(d).nwchem.inp (generated) 002945041.b3lyp_6-31g(d).log.xz 002945041.td-b3lyp_6-31g+(d).inp 002945041.td-b3lyp_6-31g+(d).log.xz

002945041.td-b3lyp_6-31+g(d).qchem.inp (generated)

002945041.td-b3lyp_6-31+g(d).gjf (generated)

002945041.td-b3lyp_6-31+g(d).firefly.inp (generated)

002945041.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002945041.mol 002945041.PUBCHEM 002945041.mol (via Jmol)
002945296.b3lyp_6-31g(d).inp

002945296.b3lyp_6-31g(d).qchem.inp (generated)

002945296.b3lyp_6-31g(d).gjf (generated)

002945296.b3lyp_6-31g(d).firefly.inp (generated)

002945296.b3lyp_6-31g(d).smash.inp (generated)

002945296.b3lyp_6-31g(d).nwchem.inp (generated) 002945296.b3lyp_6-31g(d).log.xz 002945296.td-b3lyp_6-31g+(d).inp 002945296.td-b3lyp_6-31g+(d).log.xz

002945296.td-b3lyp_6-31+g(d).qchem.inp (generated)

002945296.td-b3lyp_6-31+g(d).gjf (generated)

002945296.td-b3lyp_6-31+g(d).firefly.inp (generated)

002945296.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002945296.mol 002945296.PUBCHEM 002945296.mol (via Jmol)
002945422.b3lyp_6-31g(d).inp

002945422.b3lyp_6-31g(d).qchem.inp (generated)

002945422.b3lyp_6-31g(d).gjf (generated)

002945422.b3lyp_6-31g(d).firefly.inp (generated)

002945422.b3lyp_6-31g(d).smash.inp (generated)

002945422.b3lyp_6-31g(d).nwchem.inp (generated) 002945422.b3lyp_6-31g(d).log.xz 002945422.td-b3lyp_6-31g+(d).inp 002945422.td-b3lyp_6-31g+(d).log.xz

002945422.td-b3lyp_6-31+g(d).qchem.inp (generated)

002945422.td-b3lyp_6-31+g(d).gjf (generated)

002945422.td-b3lyp_6-31+g(d).firefly.inp (generated)

002945422.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002945422.mol 002945422.PUBCHEM 002945422.mol (via Jmol)
002945575.b3lyp_6-31g(d).inp

002945575.b3lyp_6-31g(d).qchem.inp (generated)

002945575.b3lyp_6-31g(d).gjf (generated)

002945575.b3lyp_6-31g(d).firefly.inp (generated)

002945575.b3lyp_6-31g(d).smash.inp (generated)

002945575.b3lyp_6-31g(d).nwchem.inp (generated) 002945575.b3lyp_6-31g(d).log.xz 002945575.mol 002945575.PUBCHEM 002945575.mol (via Jmol)
002945627.b3lyp_6-31g(d).inp

002945627.b3lyp_6-31g(d).qchem.inp (generated)

002945627.b3lyp_6-31g(d).gjf (generated)

002945627.b3lyp_6-31g(d).firefly.inp (generated)

002945627.b3lyp_6-31g(d).smash.inp (generated)

002945627.b3lyp_6-31g(d).nwchem.inp (generated) 002945627.b3lyp_6-31g(d).log.xz 002945627.td-b3lyp_6-31g+(d).inp 002945627.td-b3lyp_6-31g+(d).log.xz

002945627.td-b3lyp_6-31+g(d).qchem.inp (generated)

002945627.td-b3lyp_6-31+g(d).gjf (generated)

002945627.td-b3lyp_6-31+g(d).firefly.inp (generated)

002945627.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002945627.mol 002945627.PUBCHEM 002945627.mol (via Jmol)
002945698.b3lyp_6-31g(d).inp

002945698.b3lyp_6-31g(d).qchem.inp (generated)

002945698.b3lyp_6-31g(d).gjf (generated)

002945698.b3lyp_6-31g(d).firefly.inp (generated)

002945698.b3lyp_6-31g(d).smash.inp (generated)

002945698.b3lyp_6-31g(d).nwchem.inp (generated) 002945698.b3lyp_6-31g(d).log.xz 002945698.td-b3lyp_6-31g+(d).inp 002945698.td-b3lyp_6-31g+(d).log.xz

002945698.td-b3lyp_6-31+g(d).qchem.inp (generated)

002945698.td-b3lyp_6-31+g(d).gjf (generated)

002945698.td-b3lyp_6-31+g(d).firefly.inp (generated)

002945698.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002945698.mol 002945698.PUBCHEM 002945698.mol (via Jmol)
002945743.b3lyp_6-31g(d).inp

002945743.b3lyp_6-31g(d).qchem.inp (generated)

002945743.b3lyp_6-31g(d).gjf (generated)

002945743.b3lyp_6-31g(d).firefly.inp (generated)

002945743.b3lyp_6-31g(d).smash.inp (generated)

002945743.b3lyp_6-31g(d).nwchem.inp (generated) 002945743.b3lyp_6-31g(d).log.xz 002945743.td-b3lyp_6-31g+(d).inp 002945743.td-b3lyp_6-31g+(d).log.xz

002945743.td-b3lyp_6-31+g(d).qchem.inp (generated)

002945743.td-b3lyp_6-31+g(d).gjf (generated)

002945743.td-b3lyp_6-31+g(d).firefly.inp (generated)

002945743.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002945743.mol 002945743.PUBCHEM 002945743.mol (via Jmol)
002945868.b3lyp_6-31g(d).inp

002945868.b3lyp_6-31g(d).qchem.inp (generated)

002945868.b3lyp_6-31g(d).gjf (generated)

002945868.b3lyp_6-31g(d).firefly.inp (generated)

002945868.b3lyp_6-31g(d).smash.inp (generated)

002945868.b3lyp_6-31g(d).nwchem.inp (generated) 002945868.b3lyp_6-31g(d).log.xz 002945868.td-b3lyp_6-31g+(d).inp 002945868.td-b3lyp_6-31g+(d).log.xz

002945868.td-b3lyp_6-31+g(d).qchem.inp (generated)

002945868.td-b3lyp_6-31+g(d).gjf (generated)

002945868.td-b3lyp_6-31+g(d).firefly.inp (generated)

002945868.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002945868.mol 002945868.PUBCHEM 002945868.mol (via Jmol)
002946062.b3lyp_6-31g(d).inp

002946062.b3lyp_6-31g(d).qchem.inp (generated)

002946062.b3lyp_6-31g(d).gjf (generated)

002946062.b3lyp_6-31g(d).firefly.inp (generated)

002946062.b3lyp_6-31g(d).smash.inp (generated)

002946062.b3lyp_6-31g(d).nwchem.inp (generated) 002946062.b3lyp_6-31g(d).log.xz 002946062.td-b3lyp_6-31g+(d).inp 002946062.td-b3lyp_6-31g+(d).log.xz

002946062.td-b3lyp_6-31+g(d).qchem.inp (generated)

002946062.td-b3lyp_6-31+g(d).gjf (generated)

002946062.td-b3lyp_6-31+g(d).firefly.inp (generated)

002946062.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002946062.mol 002946062.PUBCHEM 002946062.mol (via Jmol)
002946092.b3lyp_6-31g(d).inp

002946092.b3lyp_6-31g(d).qchem.inp (generated)

002946092.b3lyp_6-31g(d).gjf (generated)

002946092.b3lyp_6-31g(d).firefly.inp (generated)

002946092.b3lyp_6-31g(d).smash.inp (generated)

002946092.b3lyp_6-31g(d).nwchem.inp (generated) 002946092.b3lyp_6-31g(d).log.xz 002946092.td-b3lyp_6-31g+(d).inp 002946092.td-b3lyp_6-31g+(d).log.xz

002946092.td-b3lyp_6-31+g(d).qchem.inp (generated)

002946092.td-b3lyp_6-31+g(d).gjf (generated)

002946092.td-b3lyp_6-31+g(d).firefly.inp (generated)

002946092.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002946092.mol 002946092.PUBCHEM 002946092.mol (via Jmol)
002946203.b3lyp_6-31g(d).inp

002946203.b3lyp_6-31g(d).qchem.inp (generated)

002946203.b3lyp_6-31g(d).gjf (generated)

002946203.b3lyp_6-31g(d).firefly.inp (generated)

002946203.b3lyp_6-31g(d).smash.inp (generated)

002946203.b3lyp_6-31g(d).nwchem.inp (generated) 002946203.b3lyp_6-31g(d).log.xz 002946203.td-b3lyp_6-31g+(d).inp 002946203.td-b3lyp_6-31g+(d).log.xz

002946203.td-b3lyp_6-31+g(d).qchem.inp (generated)

002946203.td-b3lyp_6-31+g(d).gjf (generated)

002946203.td-b3lyp_6-31+g(d).firefly.inp (generated)

002946203.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002946203.mol 002946203.PUBCHEM 002946203.mol (via Jmol)
002946377.b3lyp_6-31g(d).inp

002946377.b3lyp_6-31g(d).qchem.inp (generated)

002946377.b3lyp_6-31g(d).gjf (generated)

002946377.b3lyp_6-31g(d).firefly.inp (generated)

002946377.b3lyp_6-31g(d).smash.inp (generated)

002946377.b3lyp_6-31g(d).nwchem.inp (generated) 002946377.b3lyp_6-31g(d).log.xz 002946377.td-b3lyp_6-31g+(d).inp 002946377.td-b3lyp_6-31g+(d).log.xz

002946377.td-b3lyp_6-31+g(d).qchem.inp (generated)

002946377.td-b3lyp_6-31+g(d).gjf (generated)

002946377.td-b3lyp_6-31+g(d).firefly.inp (generated)

002946377.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002946377.mol 002946377.PUBCHEM 002946377.mol (via Jmol)
002946408.b3lyp_6-31g(d).inp

002946408.b3lyp_6-31g(d).qchem.inp (generated)

002946408.b3lyp_6-31g(d).gjf (generated)

002946408.b3lyp_6-31g(d).firefly.inp (generated)

002946408.b3lyp_6-31g(d).smash.inp (generated)

002946408.b3lyp_6-31g(d).nwchem.inp (generated) 002946408.b3lyp_6-31g(d).log.xz 002946408.td-b3lyp_6-31g+(d).inp 002946408.td-b3lyp_6-31g+(d).log.xz

002946408.td-b3lyp_6-31+g(d).qchem.inp (generated)

002946408.td-b3lyp_6-31+g(d).gjf (generated)

002946408.td-b3lyp_6-31+g(d).firefly.inp (generated)

002946408.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002946408.mol 002946408.PUBCHEM 002946408.mol (via Jmol)
002946441.b3lyp_6-31g(d).inp

002946441.b3lyp_6-31g(d).qchem.inp (generated)

002946441.b3lyp_6-31g(d).gjf (generated)

002946441.b3lyp_6-31g(d).firefly.inp (generated)

002946441.b3lyp_6-31g(d).smash.inp (generated)

002946441.b3lyp_6-31g(d).nwchem.inp (generated) 002946441.b3lyp_6-31g(d).log.xz 002946441.td-b3lyp_6-31g+(d).inp 002946441.td-b3lyp_6-31g+(d).log.xz

002946441.td-b3lyp_6-31+g(d).qchem.inp (generated)

002946441.td-b3lyp_6-31+g(d).gjf (generated)

002946441.td-b3lyp_6-31+g(d).firefly.inp (generated)

002946441.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002946441.mol 002946441.PUBCHEM 002946441.mol (via Jmol)
002946459.b3lyp_6-31g(d).inp

002946459.b3lyp_6-31g(d).qchem.inp (generated)

002946459.b3lyp_6-31g(d).gjf (generated)

002946459.b3lyp_6-31g(d).firefly.inp (generated)

002946459.b3lyp_6-31g(d).smash.inp (generated)

002946459.b3lyp_6-31g(d).nwchem.inp (generated) 002946459.b3lyp_6-31g(d).log.xz 002946459.td-b3lyp_6-31g+(d).inp 002946459.td-b3lyp_6-31g+(d).log.xz

002946459.td-b3lyp_6-31+g(d).qchem.inp (generated)

002946459.td-b3lyp_6-31+g(d).gjf (generated)

002946459.td-b3lyp_6-31+g(d).firefly.inp (generated)

002946459.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002946459.mol 002946459.PUBCHEM 002946459.mol (via Jmol)
002946587.b3lyp_6-31g(d).inp

002946587.b3lyp_6-31g(d).qchem.inp (generated)

002946587.b3lyp_6-31g(d).gjf (generated)

002946587.b3lyp_6-31g(d).firefly.inp (generated)

002946587.b3lyp_6-31g(d).smash.inp (generated)

002946587.b3lyp_6-31g(d).nwchem.inp (generated) 002946587.b3lyp_6-31g(d).log.xz 002946587.mol 002946587.PUBCHEM 002946587.mol (via Jmol)
002946591.b3lyp_6-31g(d).inp

002946591.b3lyp_6-31g(d).qchem.inp (generated)

002946591.b3lyp_6-31g(d).gjf (generated)

002946591.b3lyp_6-31g(d).firefly.inp (generated)

002946591.b3lyp_6-31g(d).smash.inp (generated)

002946591.b3lyp_6-31g(d).nwchem.inp (generated) 002946591.b3lyp_6-31g(d).log.xz 002946591.mol 002946591.PUBCHEM 002946591.mol (via Jmol)
002946652.b3lyp_6-31g(d).inp

002946652.b3lyp_6-31g(d).qchem.inp (generated)

002946652.b3lyp_6-31g(d).gjf (generated)

002946652.b3lyp_6-31g(d).firefly.inp (generated)

002946652.b3lyp_6-31g(d).smash.inp (generated)

002946652.b3lyp_6-31g(d).nwchem.inp (generated) 002946652.b3lyp_6-31g(d).log.xz 002946652.td-b3lyp_6-31g+(d).inp 002946652.td-b3lyp_6-31g+(d).log.xz

002946652.td-b3lyp_6-31+g(d).qchem.inp (generated)

002946652.td-b3lyp_6-31+g(d).gjf (generated)

002946652.td-b3lyp_6-31+g(d).firefly.inp (generated)

002946652.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002946652.mol 002946652.PUBCHEM 002946652.mol (via Jmol)
002946726.b3lyp_6-31g(d).inp

002946726.b3lyp_6-31g(d).qchem.inp (generated)

002946726.b3lyp_6-31g(d).gjf (generated)

002946726.b3lyp_6-31g(d).firefly.inp (generated)

002946726.b3lyp_6-31g(d).smash.inp (generated)

002946726.b3lyp_6-31g(d).nwchem.inp (generated) 002946726.b3lyp_6-31g(d).log.xz 002946726.td-b3lyp_6-31g+(d).inp 002946726.td-b3lyp_6-31g+(d).log.xz

002946726.td-b3lyp_6-31+g(d).qchem.inp (generated)

002946726.td-b3lyp_6-31+g(d).gjf (generated)

002946726.td-b3lyp_6-31+g(d).firefly.inp (generated)

002946726.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002946726.mol 002946726.PUBCHEM 002946726.mol (via Jmol)
002946785.b3lyp_6-31g(d).inp

002946785.b3lyp_6-31g(d).qchem.inp (generated)

002946785.b3lyp_6-31g(d).gjf (generated)

002946785.b3lyp_6-31g(d).firefly.inp (generated)

002946785.b3lyp_6-31g(d).smash.inp (generated)

002946785.b3lyp_6-31g(d).nwchem.inp (generated) 002946785.b3lyp_6-31g(d).log.xz 002946785.td-b3lyp_6-31g+(d).inp 002946785.td-b3lyp_6-31g+(d).log.xz

002946785.td-b3lyp_6-31+g(d).qchem.inp (generated)

002946785.td-b3lyp_6-31+g(d).gjf (generated)

002946785.td-b3lyp_6-31+g(d).firefly.inp (generated)

002946785.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002946785.mol 002946785.PUBCHEM 002946785.mol (via Jmol)
002946810.b3lyp_6-31g(d).inp

002946810.b3lyp_6-31g(d).qchem.inp (generated)

002946810.b3lyp_6-31g(d).gjf (generated)

002946810.b3lyp_6-31g(d).firefly.inp (generated)

002946810.b3lyp_6-31g(d).smash.inp (generated)

002946810.b3lyp_6-31g(d).nwchem.inp (generated) 002946810.b3lyp_6-31g(d).log.xz 002946810.mol 002946810.PUBCHEM 002946810.mol (via Jmol)
002946842.b3lyp_6-31g(d).inp

002946842.b3lyp_6-31g(d).qchem.inp (generated)

002946842.b3lyp_6-31g(d).gjf (generated)

002946842.b3lyp_6-31g(d).firefly.inp (generated)

002946842.b3lyp_6-31g(d).smash.inp (generated)

002946842.b3lyp_6-31g(d).nwchem.inp (generated) 002946842.b3lyp_6-31g(d).log.xz 002946842.td-b3lyp_6-31g+(d).inp 002946842.td-b3lyp_6-31g+(d).log.xz

002946842.td-b3lyp_6-31+g(d).qchem.inp (generated)

002946842.td-b3lyp_6-31+g(d).gjf (generated)

002946842.td-b3lyp_6-31+g(d).firefly.inp (generated)

002946842.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002946842.mol 002946842.PUBCHEM 002946842.mol (via Jmol)
002947255.b3lyp_6-31g(d).inp

002947255.b3lyp_6-31g(d).qchem.inp (generated)

002947255.b3lyp_6-31g(d).gjf (generated)

002947255.b3lyp_6-31g(d).firefly.inp (generated)

002947255.b3lyp_6-31g(d).smash.inp (generated)

002947255.b3lyp_6-31g(d).nwchem.inp (generated) 002947255.b3lyp_6-31g(d).log.xz 002947255.mol 002947255.PUBCHEM 002947255.mol (via Jmol)
002947334.b3lyp_6-31g(d).inp

002947334.b3lyp_6-31g(d).qchem.inp (generated)

002947334.b3lyp_6-31g(d).gjf (generated)

002947334.b3lyp_6-31g(d).firefly.inp (generated)

002947334.b3lyp_6-31g(d).smash.inp (generated)

002947334.b3lyp_6-31g(d).nwchem.inp (generated) 002947334.b3lyp_6-31g(d).log.xz 002947334.td-b3lyp_6-31g+(d).inp 002947334.td-b3lyp_6-31g+(d).log.xz

002947334.td-b3lyp_6-31+g(d).qchem.inp (generated)

002947334.td-b3lyp_6-31+g(d).gjf (generated)

002947334.td-b3lyp_6-31+g(d).firefly.inp (generated)

002947334.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002947334.mol 002947334.PUBCHEM 002947334.mol (via Jmol)
002947453.b3lyp_6-31g(d).inp

002947453.b3lyp_6-31g(d).qchem.inp (generated)

002947453.b3lyp_6-31g(d).gjf (generated)

002947453.b3lyp_6-31g(d).firefly.inp (generated)

002947453.b3lyp_6-31g(d).smash.inp (generated)

002947453.b3lyp_6-31g(d).nwchem.inp (generated) 002947453.b3lyp_6-31g(d).log.xz 002947453.mol 002947453.PUBCHEM 002947453.mol (via Jmol)
002947466.b3lyp_6-31g(d).inp

002947466.b3lyp_6-31g(d).qchem.inp (generated)

002947466.b3lyp_6-31g(d).gjf (generated)

002947466.b3lyp_6-31g(d).firefly.inp (generated)

002947466.b3lyp_6-31g(d).smash.inp (generated)

002947466.b3lyp_6-31g(d).nwchem.inp (generated) 002947466.b3lyp_6-31g(d).log.xz 002947466.td-b3lyp_6-31g+(d).inp 002947466.td-b3lyp_6-31g+(d).log.xz

002947466.td-b3lyp_6-31+g(d).qchem.inp (generated)

002947466.td-b3lyp_6-31+g(d).gjf (generated)

002947466.td-b3lyp_6-31+g(d).firefly.inp (generated)

002947466.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002947466.mol 002947466.PUBCHEM 002947466.mol (via Jmol)
002947589.b3lyp_6-31g(d).inp

002947589.b3lyp_6-31g(d).qchem.inp (generated)

002947589.b3lyp_6-31g(d).gjf (generated)

002947589.b3lyp_6-31g(d).firefly.inp (generated)

002947589.b3lyp_6-31g(d).smash.inp (generated)

002947589.b3lyp_6-31g(d).nwchem.inp (generated) 002947589.b3lyp_6-31g(d).log.xz 002947589.mol 002947589.PUBCHEM 002947589.mol (via Jmol)
002947675.b3lyp_6-31g(d).inp

002947675.b3lyp_6-31g(d).qchem.inp (generated)

002947675.b3lyp_6-31g(d).gjf (generated)

002947675.b3lyp_6-31g(d).firefly.inp (generated)

002947675.b3lyp_6-31g(d).smash.inp (generated)

002947675.b3lyp_6-31g(d).nwchem.inp (generated) 002947675.b3lyp_6-31g(d).log.xz 002947675.td-b3lyp_6-31g+(d).inp 002947675.td-b3lyp_6-31g+(d).log.xz

002947675.td-b3lyp_6-31+g(d).qchem.inp (generated)

002947675.td-b3lyp_6-31+g(d).gjf (generated)

002947675.td-b3lyp_6-31+g(d).firefly.inp (generated)

002947675.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002947675.mol 002947675.PUBCHEM 002947675.mol (via Jmol)
002947697.b3lyp_6-31g(d).inp

002947697.b3lyp_6-31g(d).qchem.inp (generated)

002947697.b3lyp_6-31g(d).gjf (generated)

002947697.b3lyp_6-31g(d).firefly.inp (generated)

002947697.b3lyp_6-31g(d).smash.inp (generated)

002947697.b3lyp_6-31g(d).nwchem.inp (generated) 002947697.b3lyp_6-31g(d).log.xz 002947697.td-b3lyp_6-31g+(d).inp 002947697.td-b3lyp_6-31g+(d).log.xz

002947697.td-b3lyp_6-31+g(d).qchem.inp (generated)

002947697.td-b3lyp_6-31+g(d).gjf (generated)

002947697.td-b3lyp_6-31+g(d).firefly.inp (generated)

002947697.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002947697.mol 002947697.PUBCHEM 002947697.mol (via Jmol)
002947730.b3lyp_6-31g(d).inp

002947730.b3lyp_6-31g(d).qchem.inp (generated)

002947730.b3lyp_6-31g(d).gjf (generated)

002947730.b3lyp_6-31g(d).firefly.inp (generated)

002947730.b3lyp_6-31g(d).smash.inp (generated)

002947730.b3lyp_6-31g(d).nwchem.inp (generated) 002947730.b3lyp_6-31g(d).log.xz 002947730.mol 002947730.PUBCHEM 002947730.mol (via Jmol)
002947764.b3lyp_6-31g(d).inp

002947764.b3lyp_6-31g(d).qchem.inp (generated)

002947764.b3lyp_6-31g(d).gjf (generated)

002947764.b3lyp_6-31g(d).firefly.inp (generated)

002947764.b3lyp_6-31g(d).smash.inp (generated)

002947764.b3lyp_6-31g(d).nwchem.inp (generated) 002947764.b3lyp_6-31g(d).log.xz 002947764.td-b3lyp_6-31g+(d).inp 002947764.td-b3lyp_6-31g+(d).log.xz

002947764.td-b3lyp_6-31+g(d).qchem.inp (generated)

002947764.td-b3lyp_6-31+g(d).gjf (generated)

002947764.td-b3lyp_6-31+g(d).firefly.inp (generated)

002947764.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002947764.mol 002947764.PUBCHEM 002947764.mol (via Jmol)
002947838.b3lyp_6-31g(d).inp

002947838.b3lyp_6-31g(d).qchem.inp (generated)

002947838.b3lyp_6-31g(d).gjf (generated)

002947838.b3lyp_6-31g(d).firefly.inp (generated)

002947838.b3lyp_6-31g(d).smash.inp (generated)

002947838.b3lyp_6-31g(d).nwchem.inp (generated) 002947838.b3lyp_6-31g(d).log.xz 002947838.td-b3lyp_6-31g+(d).inp 002947838.td-b3lyp_6-31g+(d).log.xz

002947838.td-b3lyp_6-31+g(d).qchem.inp (generated)

002947838.td-b3lyp_6-31+g(d).gjf (generated)

002947838.td-b3lyp_6-31+g(d).firefly.inp (generated)

002947838.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002947838.mol 002947838.PUBCHEM 002947838.mol (via Jmol)
002947886.b3lyp_6-31g(d).inp

002947886.b3lyp_6-31g(d).qchem.inp (generated)

002947886.b3lyp_6-31g(d).gjf (generated)

002947886.b3lyp_6-31g(d).firefly.inp (generated)

002947886.b3lyp_6-31g(d).smash.inp (generated)

002947886.b3lyp_6-31g(d).nwchem.inp (generated) 002947886.b3lyp_6-31g(d).log.xz 002947886.td-b3lyp_6-31g+(d).inp 002947886.td-b3lyp_6-31g+(d).log.xz

002947886.td-b3lyp_6-31+g(d).qchem.inp (generated)

002947886.td-b3lyp_6-31+g(d).gjf (generated)

002947886.td-b3lyp_6-31+g(d).firefly.inp (generated)

002947886.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002947886.mol 002947886.PUBCHEM 002947886.mol (via Jmol)
002947946.b3lyp_6-31g(d).inp

002947946.b3lyp_6-31g(d).qchem.inp (generated)

002947946.b3lyp_6-31g(d).gjf (generated)

002947946.b3lyp_6-31g(d).firefly.inp (generated)

002947946.b3lyp_6-31g(d).smash.inp (generated)

002947946.b3lyp_6-31g(d).nwchem.inp (generated) 002947946.b3lyp_6-31g(d).log.xz 002947946.td-b3lyp_6-31g+(d).inp 002947946.td-b3lyp_6-31g+(d).log.xz

002947946.td-b3lyp_6-31+g(d).qchem.inp (generated)

002947946.td-b3lyp_6-31+g(d).gjf (generated)

002947946.td-b3lyp_6-31+g(d).firefly.inp (generated)

002947946.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002947946.mol 002947946.PUBCHEM 002947946.mol (via Jmol)
002947957.b3lyp_6-31g(d).inp

002947957.b3lyp_6-31g(d).qchem.inp (generated)

002947957.b3lyp_6-31g(d).gjf (generated)

002947957.b3lyp_6-31g(d).firefly.inp (generated)

002947957.b3lyp_6-31g(d).smash.inp (generated)

002947957.b3lyp_6-31g(d).nwchem.inp (generated) 002947957.b3lyp_6-31g(d).log.xz 002947957.td-b3lyp_6-31g+(d).inp 002947957.td-b3lyp_6-31g+(d).log.xz

002947957.td-b3lyp_6-31+g(d).qchem.inp (generated)

002947957.td-b3lyp_6-31+g(d).gjf (generated)

002947957.td-b3lyp_6-31+g(d).firefly.inp (generated)

002947957.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002947957.mol 002947957.PUBCHEM 002947957.mol (via Jmol)
002947967.b3lyp_6-31g(d).inp

002947967.b3lyp_6-31g(d).qchem.inp (generated)

002947967.b3lyp_6-31g(d).gjf (generated)

002947967.b3lyp_6-31g(d).firefly.inp (generated)

002947967.b3lyp_6-31g(d).smash.inp (generated)

002947967.b3lyp_6-31g(d).nwchem.inp (generated) 002947967.b3lyp_6-31g(d).log.xz 002947967.td-b3lyp_6-31g+(d).inp 002947967.td-b3lyp_6-31g+(d).log.xz

002947967.td-b3lyp_6-31+g(d).qchem.inp (generated)

002947967.td-b3lyp_6-31+g(d).gjf (generated)

002947967.td-b3lyp_6-31+g(d).firefly.inp (generated)

002947967.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002947967.mol 002947967.PUBCHEM 002947967.mol (via Jmol)
002948027.b3lyp_6-31g(d).inp

002948027.b3lyp_6-31g(d).qchem.inp (generated)

002948027.b3lyp_6-31g(d).gjf (generated)

002948027.b3lyp_6-31g(d).firefly.inp (generated)

002948027.b3lyp_6-31g(d).smash.inp (generated)

002948027.b3lyp_6-31g(d).nwchem.inp (generated) 002948027.b3lyp_6-31g(d).log.xz 002948027.td-b3lyp_6-31g+(d).inp 002948027.td-b3lyp_6-31g+(d).log.xz

002948027.td-b3lyp_6-31+g(d).qchem.inp (generated)

002948027.td-b3lyp_6-31+g(d).gjf (generated)

002948027.td-b3lyp_6-31+g(d).firefly.inp (generated)

002948027.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002948027.mol 002948027.PUBCHEM 002948027.mol (via Jmol)
002948307.b3lyp_6-31g(d).inp

002948307.b3lyp_6-31g(d).qchem.inp (generated)

002948307.b3lyp_6-31g(d).gjf (generated)

002948307.b3lyp_6-31g(d).firefly.inp (generated)

002948307.b3lyp_6-31g(d).smash.inp (generated)

002948307.b3lyp_6-31g(d).nwchem.inp (generated) 002948307.b3lyp_6-31g(d).log.xz 002948307.td-b3lyp_6-31g+(d).inp 002948307.td-b3lyp_6-31g+(d).log.xz

002948307.td-b3lyp_6-31+g(d).qchem.inp (generated)

002948307.td-b3lyp_6-31+g(d).gjf (generated)

002948307.td-b3lyp_6-31+g(d).firefly.inp (generated)

002948307.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002948307.mol 002948307.PUBCHEM 002948307.mol (via Jmol)
002948350.b3lyp_6-31g(d).inp

002948350.b3lyp_6-31g(d).qchem.inp (generated)

002948350.b3lyp_6-31g(d).gjf (generated)

002948350.b3lyp_6-31g(d).firefly.inp (generated)

002948350.b3lyp_6-31g(d).smash.inp (generated)

002948350.b3lyp_6-31g(d).nwchem.inp (generated) 002948350.b3lyp_6-31g(d).log.xz 002948350.td-b3lyp_6-31g+(d).inp 002948350.td-b3lyp_6-31g+(d).log.xz

002948350.td-b3lyp_6-31+g(d).qchem.inp (generated)

002948350.td-b3lyp_6-31+g(d).gjf (generated)

002948350.td-b3lyp_6-31+g(d).firefly.inp (generated)

002948350.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002948350.mol 002948350.PUBCHEM 002948350.mol (via Jmol)
002948377.b3lyp_6-31g(d).inp

002948377.b3lyp_6-31g(d).qchem.inp (generated)

002948377.b3lyp_6-31g(d).gjf (generated)

002948377.b3lyp_6-31g(d).firefly.inp (generated)

002948377.b3lyp_6-31g(d).smash.inp (generated)

002948377.b3lyp_6-31g(d).nwchem.inp (generated) 002948377.b3lyp_6-31g(d).log.xz 002948377.td-b3lyp_6-31g+(d).inp 002948377.td-b3lyp_6-31g+(d).log.xz

002948377.td-b3lyp_6-31+g(d).qchem.inp (generated)

002948377.td-b3lyp_6-31+g(d).gjf (generated)

002948377.td-b3lyp_6-31+g(d).firefly.inp (generated)

002948377.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002948377.mol 002948377.PUBCHEM 002948377.mol (via Jmol)
002948414.b3lyp_6-31g(d).inp

002948414.b3lyp_6-31g(d).qchem.inp (generated)

002948414.b3lyp_6-31g(d).gjf (generated)

002948414.b3lyp_6-31g(d).firefly.inp (generated)

002948414.b3lyp_6-31g(d).smash.inp (generated)

002948414.b3lyp_6-31g(d).nwchem.inp (generated) 002948414.b3lyp_6-31g(d).log.xz 002948414.mol 002948414.PUBCHEM 002948414.mol (via Jmol)
002948463.b3lyp_6-31g(d).inp

002948463.b3lyp_6-31g(d).qchem.inp (generated)

002948463.b3lyp_6-31g(d).gjf (generated)

002948463.b3lyp_6-31g(d).firefly.inp (generated)

002948463.b3lyp_6-31g(d).smash.inp (generated)

002948463.b3lyp_6-31g(d).nwchem.inp (generated) 002948463.b3lyp_6-31g(d).log.xz 002948463.td-b3lyp_6-31g+(d).inp 002948463.td-b3lyp_6-31g+(d).log.xz

002948463.td-b3lyp_6-31+g(d).qchem.inp (generated)

002948463.td-b3lyp_6-31+g(d).gjf (generated)

002948463.td-b3lyp_6-31+g(d).firefly.inp (generated)

002948463.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002948463.mol 002948463.PUBCHEM 002948463.mol (via Jmol)
002948482.b3lyp_6-31g(d).inp

002948482.b3lyp_6-31g(d).qchem.inp (generated)

002948482.b3lyp_6-31g(d).gjf (generated)

002948482.b3lyp_6-31g(d).firefly.inp (generated)

002948482.b3lyp_6-31g(d).smash.inp (generated)

002948482.b3lyp_6-31g(d).nwchem.inp (generated) 002948482.b3lyp_6-31g(d).log.xz 002948482.td-b3lyp_6-31g+(d).inp 002948482.td-b3lyp_6-31g+(d).log.xz

002948482.td-b3lyp_6-31+g(d).qchem.inp (generated)

002948482.td-b3lyp_6-31+g(d).gjf (generated)

002948482.td-b3lyp_6-31+g(d).firefly.inp (generated)

002948482.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002948482.mol 002948482.PUBCHEM 002948482.mol (via Jmol)
002948515.b3lyp_6-31g(d).inp

002948515.b3lyp_6-31g(d).qchem.inp (generated)

002948515.b3lyp_6-31g(d).gjf (generated)

002948515.b3lyp_6-31g(d).firefly.inp (generated)

002948515.b3lyp_6-31g(d).smash.inp (generated)

002948515.b3lyp_6-31g(d).nwchem.inp (generated) 002948515.b3lyp_6-31g(d).log.xz 002948515.td-b3lyp_6-31g+(d).inp 002948515.td-b3lyp_6-31g+(d).log.xz

002948515.td-b3lyp_6-31+g(d).qchem.inp (generated)

002948515.td-b3lyp_6-31+g(d).gjf (generated)

002948515.td-b3lyp_6-31+g(d).firefly.inp (generated)

002948515.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002948515.mol 002948515.PUBCHEM 002948515.mol (via Jmol)
002948558.b3lyp_6-31g(d).inp

002948558.b3lyp_6-31g(d).qchem.inp (generated)

002948558.b3lyp_6-31g(d).gjf (generated)

002948558.b3lyp_6-31g(d).firefly.inp (generated)

002948558.b3lyp_6-31g(d).smash.inp (generated)

002948558.b3lyp_6-31g(d).nwchem.inp (generated) 002948558.b3lyp_6-31g(d).log.xz 002948558.td-b3lyp_6-31g+(d).inp 002948558.td-b3lyp_6-31g+(d).log.xz

002948558.td-b3lyp_6-31+g(d).qchem.inp (generated)

002948558.td-b3lyp_6-31+g(d).gjf (generated)

002948558.td-b3lyp_6-31+g(d).firefly.inp (generated)

002948558.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002948558.mol 002948558.PUBCHEM 002948558.mol (via Jmol)
002948559.b3lyp_6-31g(d).inp

002948559.b3lyp_6-31g(d).qchem.inp (generated)

002948559.b3lyp_6-31g(d).gjf (generated)

002948559.b3lyp_6-31g(d).firefly.inp (generated)

002948559.b3lyp_6-31g(d).smash.inp (generated)

002948559.b3lyp_6-31g(d).nwchem.inp (generated) 002948559.b3lyp_6-31g(d).log.xz 002948559.mol 002948559.PUBCHEM 002948559.mol (via Jmol)
002948565.b3lyp_6-31g(d).inp

002948565.b3lyp_6-31g(d).qchem.inp (generated)

002948565.b3lyp_6-31g(d).gjf (generated)

002948565.b3lyp_6-31g(d).firefly.inp (generated)

002948565.b3lyp_6-31g(d).smash.inp (generated)

002948565.b3lyp_6-31g(d).nwchem.inp (generated) 002948565.b3lyp_6-31g(d).log.xz 002948565.td-b3lyp_6-31g+(d).inp 002948565.td-b3lyp_6-31g+(d).log.xz

002948565.td-b3lyp_6-31+g(d).qchem.inp (generated)

002948565.td-b3lyp_6-31+g(d).gjf (generated)

002948565.td-b3lyp_6-31+g(d).firefly.inp (generated)

002948565.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002948565.mol 002948565.PUBCHEM 002948565.mol (via Jmol)
002948640.b3lyp_6-31g(d).inp

002948640.b3lyp_6-31g(d).qchem.inp (generated)

002948640.b3lyp_6-31g(d).gjf (generated)

002948640.b3lyp_6-31g(d).firefly.inp (generated)

002948640.b3lyp_6-31g(d).smash.inp (generated)

002948640.b3lyp_6-31g(d).nwchem.inp (generated) 002948640.b3lyp_6-31g(d).log.xz 002948640.td-b3lyp_6-31g+(d).inp 002948640.td-b3lyp_6-31g+(d).log.xz

002948640.td-b3lyp_6-31+g(d).qchem.inp (generated)

002948640.td-b3lyp_6-31+g(d).gjf (generated)

002948640.td-b3lyp_6-31+g(d).firefly.inp (generated)

002948640.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002948640.mol 002948640.PUBCHEM 002948640.mol (via Jmol)
002948848.b3lyp_6-31g(d).inp

002948848.b3lyp_6-31g(d).qchem.inp (generated)

002948848.b3lyp_6-31g(d).gjf (generated)

002948848.b3lyp_6-31g(d).firefly.inp (generated)

002948848.b3lyp_6-31g(d).smash.inp (generated)

002948848.b3lyp_6-31g(d).nwchem.inp (generated) 002948848.b3lyp_6-31g(d).log.xz 002948848.mol 002948848.PUBCHEM 002948848.mol (via Jmol)
002948875.b3lyp_6-31g(d).inp

002948875.b3lyp_6-31g(d).qchem.inp (generated)

002948875.b3lyp_6-31g(d).gjf (generated)

002948875.b3lyp_6-31g(d).firefly.inp (generated)

002948875.b3lyp_6-31g(d).smash.inp (generated)

002948875.b3lyp_6-31g(d).nwchem.inp (generated) 002948875.b3lyp_6-31g(d).log.xz 002948875.td-b3lyp_6-31g+(d).inp 002948875.td-b3lyp_6-31g+(d).log.xz

002948875.td-b3lyp_6-31+g(d).qchem.inp (generated)

002948875.td-b3lyp_6-31+g(d).gjf (generated)

002948875.td-b3lyp_6-31+g(d).firefly.inp (generated)

002948875.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002948875.mol 002948875.PUBCHEM 002948875.mol (via Jmol)
002948887.b3lyp_6-31g(d).inp

002948887.b3lyp_6-31g(d).qchem.inp (generated)

002948887.b3lyp_6-31g(d).gjf (generated)

002948887.b3lyp_6-31g(d).firefly.inp (generated)

002948887.b3lyp_6-31g(d).smash.inp (generated)

002948887.b3lyp_6-31g(d).nwchem.inp (generated) 002948887.b3lyp_6-31g(d).log.xz 002948887.td-b3lyp_6-31g+(d).inp 002948887.td-b3lyp_6-31g+(d).log.xz

002948887.td-b3lyp_6-31+g(d).qchem.inp (generated)

002948887.td-b3lyp_6-31+g(d).gjf (generated)

002948887.td-b3lyp_6-31+g(d).firefly.inp (generated)

002948887.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002948887.mol 002948887.PUBCHEM 002948887.mol (via Jmol)
002948929.b3lyp_6-31g(d).inp

002948929.b3lyp_6-31g(d).qchem.inp (generated)

002948929.b3lyp_6-31g(d).gjf (generated)

002948929.b3lyp_6-31g(d).firefly.inp (generated)

002948929.b3lyp_6-31g(d).smash.inp (generated)

002948929.b3lyp_6-31g(d).nwchem.inp (generated) 002948929.b3lyp_6-31g(d).log.xz 002948929.td-b3lyp_6-31g+(d).inp 002948929.td-b3lyp_6-31g+(d).log.xz

002948929.td-b3lyp_6-31+g(d).qchem.inp (generated)

002948929.td-b3lyp_6-31+g(d).gjf (generated)

002948929.td-b3lyp_6-31+g(d).firefly.inp (generated)

002948929.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002948929.mol 002948929.PUBCHEM 002948929.mol (via Jmol)
002948941.b3lyp_6-31g(d).inp

002948941.b3lyp_6-31g(d).qchem.inp (generated)

002948941.b3lyp_6-31g(d).gjf (generated)

002948941.b3lyp_6-31g(d).firefly.inp (generated)

002948941.b3lyp_6-31g(d).smash.inp (generated)

002948941.b3lyp_6-31g(d).nwchem.inp (generated) 002948941.b3lyp_6-31g(d).log.xz 002948941.mol 002948941.PUBCHEM 002948941.mol (via Jmol)
002948975.b3lyp_6-31g(d).inp

002948975.b3lyp_6-31g(d).qchem.inp (generated)

002948975.b3lyp_6-31g(d).gjf (generated)

002948975.b3lyp_6-31g(d).firefly.inp (generated)

002948975.b3lyp_6-31g(d).smash.inp (generated)

002948975.b3lyp_6-31g(d).nwchem.inp (generated) 002948975.b3lyp_6-31g(d).log.xz 002948975.td-b3lyp_6-31g+(d).inp 002948975.td-b3lyp_6-31g+(d).log.xz

002948975.td-b3lyp_6-31+g(d).qchem.inp (generated)

002948975.td-b3lyp_6-31+g(d).gjf (generated)

002948975.td-b3lyp_6-31+g(d).firefly.inp (generated)

002948975.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002948975.mol 002948975.PUBCHEM 002948975.mol (via Jmol)
002948994.b3lyp_6-31g(d).inp

002948994.b3lyp_6-31g(d).qchem.inp (generated)

002948994.b3lyp_6-31g(d).gjf (generated)

002948994.b3lyp_6-31g(d).firefly.inp (generated)

002948994.b3lyp_6-31g(d).smash.inp (generated)

002948994.b3lyp_6-31g(d).nwchem.inp (generated) 002948994.b3lyp_6-31g(d).log.xz 002948994.mol 002948994.PUBCHEM 002948994.mol (via Jmol)
002949029.b3lyp_6-31g(d).inp

002949029.b3lyp_6-31g(d).qchem.inp (generated)

002949029.b3lyp_6-31g(d).gjf (generated)

002949029.b3lyp_6-31g(d).firefly.inp (generated)

002949029.b3lyp_6-31g(d).smash.inp (generated)

002949029.b3lyp_6-31g(d).nwchem.inp (generated) 002949029.b3lyp_6-31g(d).log.xz 002949029.td-b3lyp_6-31g+(d).inp 002949029.td-b3lyp_6-31g+(d).log.xz

002949029.td-b3lyp_6-31+g(d).qchem.inp (generated)

002949029.td-b3lyp_6-31+g(d).gjf (generated)

002949029.td-b3lyp_6-31+g(d).firefly.inp (generated)

002949029.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002949029.mol 002949029.PUBCHEM 002949029.mol (via Jmol)
002949213.b3lyp_6-31g(d).inp

002949213.b3lyp_6-31g(d).qchem.inp (generated)

002949213.b3lyp_6-31g(d).gjf (generated)

002949213.b3lyp_6-31g(d).firefly.inp (generated)

002949213.b3lyp_6-31g(d).smash.inp (generated)

002949213.b3lyp_6-31g(d).nwchem.inp (generated) 002949213.b3lyp_6-31g(d).log.xz 002949213.mol 002949213.PUBCHEM 002949213.mol (via Jmol)
002949326.b3lyp_6-31g(d).inp

002949326.b3lyp_6-31g(d).qchem.inp (generated)

002949326.b3lyp_6-31g(d).gjf (generated)

002949326.b3lyp_6-31g(d).firefly.inp (generated)

002949326.b3lyp_6-31g(d).smash.inp (generated)

002949326.b3lyp_6-31g(d).nwchem.inp (generated) 002949326.b3lyp_6-31g(d).log.xz 002949326.td-b3lyp_6-31g+(d).inp 002949326.td-b3lyp_6-31g+(d).log.xz

002949326.td-b3lyp_6-31+g(d).qchem.inp (generated)

002949326.td-b3lyp_6-31+g(d).gjf (generated)

002949326.td-b3lyp_6-31+g(d).firefly.inp (generated)

002949326.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002949326.mol 002949326.PUBCHEM 002949326.mol (via Jmol)
002949386.b3lyp_6-31g(d).inp

002949386.b3lyp_6-31g(d).qchem.inp (generated)

002949386.b3lyp_6-31g(d).gjf (generated)

002949386.b3lyp_6-31g(d).firefly.inp (generated)

002949386.b3lyp_6-31g(d).smash.inp (generated)

002949386.b3lyp_6-31g(d).nwchem.inp (generated) 002949386.b3lyp_6-31g(d).log.xz 002949386.mol 002949386.PUBCHEM 002949386.mol (via Jmol)
002949398.b3lyp_6-31g(d).inp

002949398.b3lyp_6-31g(d).qchem.inp (generated)

002949398.b3lyp_6-31g(d).gjf (generated)

002949398.b3lyp_6-31g(d).firefly.inp (generated)

002949398.b3lyp_6-31g(d).smash.inp (generated)

002949398.b3lyp_6-31g(d).nwchem.inp (generated) 002949398.b3lyp_6-31g(d).log.xz 002949398.mol 002949398.PUBCHEM 002949398.mol (via Jmol)
002949621.b3lyp_6-31g(d).inp

002949621.b3lyp_6-31g(d).qchem.inp (generated)

002949621.b3lyp_6-31g(d).gjf (generated)

002949621.b3lyp_6-31g(d).firefly.inp (generated)

002949621.b3lyp_6-31g(d).smash.inp (generated)

002949621.b3lyp_6-31g(d).nwchem.inp (generated) 002949621.b3lyp_6-31g(d).log.xz 002949621.td-b3lyp_6-31g+(d).inp 002949621.td-b3lyp_6-31g+(d).log.xz

002949621.td-b3lyp_6-31+g(d).qchem.inp (generated)

002949621.td-b3lyp_6-31+g(d).gjf (generated)

002949621.td-b3lyp_6-31+g(d).firefly.inp (generated)

002949621.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002949621.mol 002949621.PUBCHEM 002949621.mol (via Jmol)
002949724.b3lyp_6-31g(d).inp

002949724.b3lyp_6-31g(d).qchem.inp (generated)

002949724.b3lyp_6-31g(d).gjf (generated)

002949724.b3lyp_6-31g(d).firefly.inp (generated)

002949724.b3lyp_6-31g(d).smash.inp (generated)

002949724.b3lyp_6-31g(d).nwchem.inp (generated) 002949724.b3lyp_6-31g(d).log.xz 002949724.mol 002949724.PUBCHEM 002949724.mol (via Jmol)


maho@riken.jp/maho.nakata@gmail.com