Index of

Last updated : Thu Apr 27 02:27:22 JST 2017
Total : 60 (48) in this page
016578136.b3lyp_6-31g(d).inp

016578136.b3lyp_6-31g(d).qchem.inp (generated)

016578136.b3lyp_6-31g(d).gjf (generated)

016578136.b3lyp_6-31g(d).firefly.inp (generated)

016578136.b3lyp_6-31g(d).smash.inp (generated)

016578136.b3lyp_6-31g(d).nwchem.inp (generated) 016578136.b3lyp_6-31g(d).log.xz 016578136.td-b3lyp_6-31g+(d).inp 016578136.td-b3lyp_6-31g+(d).log.xz

016578136.td-b3lyp_6-31+g(d).qchem.inp (generated)

016578136.td-b3lyp_6-31+g(d).gjf (generated)

016578136.td-b3lyp_6-31+g(d).firefly.inp (generated)

016578136.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016578136.mol 016578136.PUBCHEM 016578136.mol (via Jmol)
016578254.b3lyp_6-31g(d).inp

016578254.b3lyp_6-31g(d).qchem.inp (generated)

016578254.b3lyp_6-31g(d).gjf (generated)

016578254.b3lyp_6-31g(d).firefly.inp (generated)

016578254.b3lyp_6-31g(d).smash.inp (generated)

016578254.b3lyp_6-31g(d).nwchem.inp (generated) 016578254.b3lyp_6-31g(d).log.xz 016578254.td-b3lyp_6-31g+(d).inp 016578254.td-b3lyp_6-31g+(d).log.xz

016578254.td-b3lyp_6-31+g(d).qchem.inp (generated)

016578254.td-b3lyp_6-31+g(d).gjf (generated)

016578254.td-b3lyp_6-31+g(d).firefly.inp (generated)

016578254.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016578254.mol 016578254.PUBCHEM 016578254.mol (via Jmol)
016579706.b3lyp_6-31g(d).inp

016579706.b3lyp_6-31g(d).qchem.inp (generated)

016579706.b3lyp_6-31g(d).gjf (generated)

016579706.b3lyp_6-31g(d).firefly.inp (generated)

016579706.b3lyp_6-31g(d).smash.inp (generated)

016579706.b3lyp_6-31g(d).nwchem.inp (generated) 016579706.b3lyp_6-31g(d).log.xz 016579706.mol 016579706.PUBCHEM 016579706.mol (via Jmol)
016579712.b3lyp_6-31g(d).inp

016579712.b3lyp_6-31g(d).qchem.inp (generated)

016579712.b3lyp_6-31g(d).gjf (generated)

016579712.b3lyp_6-31g(d).firefly.inp (generated)

016579712.b3lyp_6-31g(d).smash.inp (generated)

016579712.b3lyp_6-31g(d).nwchem.inp (generated) 016579712.b3lyp_6-31g(d).log.xz 016579712.td-b3lyp_6-31g+(d).inp 016579712.td-b3lyp_6-31g+(d).log.xz

016579712.td-b3lyp_6-31+g(d).qchem.inp (generated)

016579712.td-b3lyp_6-31+g(d).gjf (generated)

016579712.td-b3lyp_6-31+g(d).firefly.inp (generated)

016579712.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016579712.mol 016579712.PUBCHEM 016579712.mol (via Jmol)
016580102.b3lyp_6-31g(d).inp

016580102.b3lyp_6-31g(d).qchem.inp (generated)

016580102.b3lyp_6-31g(d).gjf (generated)

016580102.b3lyp_6-31g(d).firefly.inp (generated)

016580102.b3lyp_6-31g(d).smash.inp (generated)

016580102.b3lyp_6-31g(d).nwchem.inp (generated) 016580102.b3lyp_6-31g(d).log.xz 016580102.td-b3lyp_6-31g+(d).inp 016580102.td-b3lyp_6-31g+(d).log.xz

016580102.td-b3lyp_6-31+g(d).qchem.inp (generated)

016580102.td-b3lyp_6-31+g(d).gjf (generated)

016580102.td-b3lyp_6-31+g(d).firefly.inp (generated)

016580102.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016580102.mol 016580102.PUBCHEM 016580102.mol (via Jmol)
016580108.b3lyp_6-31g(d).inp

016580108.b3lyp_6-31g(d).qchem.inp (generated)

016580108.b3lyp_6-31g(d).gjf (generated)

016580108.b3lyp_6-31g(d).firefly.inp (generated)

016580108.b3lyp_6-31g(d).smash.inp (generated)

016580108.b3lyp_6-31g(d).nwchem.inp (generated) 016580108.b3lyp_6-31g(d).log.xz 016580108.td-b3lyp_6-31g+(d).inp 016580108.td-b3lyp_6-31g+(d).log.xz

016580108.td-b3lyp_6-31+g(d).qchem.inp (generated)

016580108.td-b3lyp_6-31+g(d).gjf (generated)

016580108.td-b3lyp_6-31+g(d).firefly.inp (generated)

016580108.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016580108.mol 016580108.PUBCHEM 016580108.mol (via Jmol)
016580742.b3lyp_6-31g(d).inp

016580742.b3lyp_6-31g(d).qchem.inp (generated)

016580742.b3lyp_6-31g(d).gjf (generated)

016580742.b3lyp_6-31g(d).firefly.inp (generated)

016580742.b3lyp_6-31g(d).smash.inp (generated)

016580742.b3lyp_6-31g(d).nwchem.inp (generated) 016580742.b3lyp_6-31g(d).log.xz 016580742.td-b3lyp_6-31g+(d).inp 016580742.td-b3lyp_6-31g+(d).log.xz

016580742.td-b3lyp_6-31+g(d).qchem.inp (generated)

016580742.td-b3lyp_6-31+g(d).gjf (generated)

016580742.td-b3lyp_6-31+g(d).firefly.inp (generated)

016580742.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016580742.mol 016580742.PUBCHEM 016580742.mol (via Jmol)
016581115.b3lyp_6-31g(d).inp

016581115.b3lyp_6-31g(d).qchem.inp (generated)

016581115.b3lyp_6-31g(d).gjf (generated)

016581115.b3lyp_6-31g(d).firefly.inp (generated)

016581115.b3lyp_6-31g(d).smash.inp (generated)

016581115.b3lyp_6-31g(d).nwchem.inp (generated) 016581115.b3lyp_6-31g(d).log.xz 016581115.td-b3lyp_6-31g+(d).inp 016581115.td-b3lyp_6-31g+(d).log.xz

016581115.td-b3lyp_6-31+g(d).qchem.inp (generated)

016581115.td-b3lyp_6-31+g(d).gjf (generated)

016581115.td-b3lyp_6-31+g(d).firefly.inp (generated)

016581115.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016581115.mol 016581115.PUBCHEM 016581115.mol (via Jmol)
016581979.b3lyp_6-31g(d).inp

016581979.b3lyp_6-31g(d).qchem.inp (generated)

016581979.b3lyp_6-31g(d).gjf (generated)

016581979.b3lyp_6-31g(d).firefly.inp (generated)

016581979.b3lyp_6-31g(d).smash.inp (generated)

016581979.b3lyp_6-31g(d).nwchem.inp (generated) 016581979.b3lyp_6-31g(d).log.xz 016581979.mol 016581979.PUBCHEM 016581979.mol (via Jmol)
016582306.b3lyp_6-31g(d).inp

016582306.b3lyp_6-31g(d).qchem.inp (generated)

016582306.b3lyp_6-31g(d).gjf (generated)

016582306.b3lyp_6-31g(d).firefly.inp (generated)

016582306.b3lyp_6-31g(d).smash.inp (generated)

016582306.b3lyp_6-31g(d).nwchem.inp (generated) 016582306.b3lyp_6-31g(d).log.xz 016582306.td-b3lyp_6-31g+(d).inp 016582306.td-b3lyp_6-31g+(d).log.xz

016582306.td-b3lyp_6-31+g(d).qchem.inp (generated)

016582306.td-b3lyp_6-31+g(d).gjf (generated)

016582306.td-b3lyp_6-31+g(d).firefly.inp (generated)

016582306.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016582306.mol 016582306.PUBCHEM 016582306.mol (via Jmol)
016582307.b3lyp_6-31g(d).inp

016582307.b3lyp_6-31g(d).qchem.inp (generated)

016582307.b3lyp_6-31g(d).gjf (generated)

016582307.b3lyp_6-31g(d).firefly.inp (generated)

016582307.b3lyp_6-31g(d).smash.inp (generated)

016582307.b3lyp_6-31g(d).nwchem.inp (generated) 016582307.b3lyp_6-31g(d).log.xz 016582307.td-b3lyp_6-31g+(d).inp 016582307.td-b3lyp_6-31g+(d).log.xz

016582307.td-b3lyp_6-31+g(d).qchem.inp (generated)

016582307.td-b3lyp_6-31+g(d).gjf (generated)

016582307.td-b3lyp_6-31+g(d).firefly.inp (generated)

016582307.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016582307.mol 016582307.PUBCHEM 016582307.mol (via Jmol)
016582309.b3lyp_6-31g(d).inp

016582309.b3lyp_6-31g(d).qchem.inp (generated)

016582309.b3lyp_6-31g(d).gjf (generated)

016582309.b3lyp_6-31g(d).firefly.inp (generated)

016582309.b3lyp_6-31g(d).smash.inp (generated)

016582309.b3lyp_6-31g(d).nwchem.inp (generated) 016582309.b3lyp_6-31g(d).log.xz 016582309.td-b3lyp_6-31g+(d).inp 016582309.td-b3lyp_6-31g+(d).log.xz

016582309.td-b3lyp_6-31+g(d).qchem.inp (generated)

016582309.td-b3lyp_6-31+g(d).gjf (generated)

016582309.td-b3lyp_6-31+g(d).firefly.inp (generated)

016582309.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016582309.mol 016582309.PUBCHEM 016582309.mol (via Jmol)
016582319.b3lyp_6-31g(d).inp

016582319.b3lyp_6-31g(d).qchem.inp (generated)

016582319.b3lyp_6-31g(d).gjf (generated)

016582319.b3lyp_6-31g(d).firefly.inp (generated)

016582319.b3lyp_6-31g(d).smash.inp (generated)

016582319.b3lyp_6-31g(d).nwchem.inp (generated) 016582319.b3lyp_6-31g(d).log.xz 016582319.td-b3lyp_6-31g+(d).inp 016582319.td-b3lyp_6-31g+(d).log.xz

016582319.td-b3lyp_6-31+g(d).qchem.inp (generated)

016582319.td-b3lyp_6-31+g(d).gjf (generated)

016582319.td-b3lyp_6-31+g(d).firefly.inp (generated)

016582319.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016582319.mol 016582319.PUBCHEM 016582319.mol (via Jmol)
016582432.b3lyp_6-31g(d).inp

016582432.b3lyp_6-31g(d).qchem.inp (generated)

016582432.b3lyp_6-31g(d).gjf (generated)

016582432.b3lyp_6-31g(d).firefly.inp (generated)

016582432.b3lyp_6-31g(d).smash.inp (generated)

016582432.b3lyp_6-31g(d).nwchem.inp (generated) 016582432.b3lyp_6-31g(d).log.xz 016582432.td-b3lyp_6-31g+(d).inp 016582432.td-b3lyp_6-31g+(d).log.xz

016582432.td-b3lyp_6-31+g(d).qchem.inp (generated)

016582432.td-b3lyp_6-31+g(d).gjf (generated)

016582432.td-b3lyp_6-31+g(d).firefly.inp (generated)

016582432.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016582432.mol 016582432.PUBCHEM 016582432.mol (via Jmol)
016583103.b3lyp_6-31g(d).inp

016583103.b3lyp_6-31g(d).qchem.inp (generated)

016583103.b3lyp_6-31g(d).gjf (generated)

016583103.b3lyp_6-31g(d).firefly.inp (generated)

016583103.b3lyp_6-31g(d).smash.inp (generated)

016583103.b3lyp_6-31g(d).nwchem.inp (generated) 016583103.b3lyp_6-31g(d).log.xz 016583103.td-b3lyp_6-31g+(d).inp 016583103.td-b3lyp_6-31g+(d).log.xz

016583103.td-b3lyp_6-31+g(d).qchem.inp (generated)

016583103.td-b3lyp_6-31+g(d).gjf (generated)

016583103.td-b3lyp_6-31+g(d).firefly.inp (generated)

016583103.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016583103.mol 016583103.PUBCHEM 016583103.mol (via Jmol)
016583129.b3lyp_6-31g(d).inp

016583129.b3lyp_6-31g(d).qchem.inp (generated)

016583129.b3lyp_6-31g(d).gjf (generated)

016583129.b3lyp_6-31g(d).firefly.inp (generated)

016583129.b3lyp_6-31g(d).smash.inp (generated)

016583129.b3lyp_6-31g(d).nwchem.inp (generated) 016583129.b3lyp_6-31g(d).log.xz 016583129.td-b3lyp_6-31g+(d).inp 016583129.td-b3lyp_6-31g+(d).log.xz

016583129.td-b3lyp_6-31+g(d).qchem.inp (generated)

016583129.td-b3lyp_6-31+g(d).gjf (generated)

016583129.td-b3lyp_6-31+g(d).firefly.inp (generated)

016583129.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016583129.mol 016583129.PUBCHEM 016583129.mol (via Jmol)
016583500.b3lyp_6-31g(d).inp

016583500.b3lyp_6-31g(d).qchem.inp (generated)

016583500.b3lyp_6-31g(d).gjf (generated)

016583500.b3lyp_6-31g(d).firefly.inp (generated)

016583500.b3lyp_6-31g(d).smash.inp (generated)

016583500.b3lyp_6-31g(d).nwchem.inp (generated) 016583500.b3lyp_6-31g(d).log.xz 016583500.td-b3lyp_6-31g+(d).inp 016583500.td-b3lyp_6-31g+(d).log.xz

016583500.td-b3lyp_6-31+g(d).qchem.inp (generated)

016583500.td-b3lyp_6-31+g(d).gjf (generated)

016583500.td-b3lyp_6-31+g(d).firefly.inp (generated)

016583500.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016583500.mol 016583500.PUBCHEM 016583500.mol (via Jmol)
016583587.b3lyp_6-31g(d).inp

016583587.b3lyp_6-31g(d).qchem.inp (generated)

016583587.b3lyp_6-31g(d).gjf (generated)

016583587.b3lyp_6-31g(d).firefly.inp (generated)

016583587.b3lyp_6-31g(d).smash.inp (generated)

016583587.b3lyp_6-31g(d).nwchem.inp (generated) 016583587.b3lyp_6-31g(d).log.xz 016583587.td-b3lyp_6-31g+(d).inp 016583587.td-b3lyp_6-31g+(d).log.xz

016583587.td-b3lyp_6-31+g(d).qchem.inp (generated)

016583587.td-b3lyp_6-31+g(d).gjf (generated)

016583587.td-b3lyp_6-31+g(d).firefly.inp (generated)

016583587.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016583587.mol 016583587.PUBCHEM 016583587.mol (via Jmol)
016583595.b3lyp_6-31g(d).inp

016583595.b3lyp_6-31g(d).qchem.inp (generated)

016583595.b3lyp_6-31g(d).gjf (generated)

016583595.b3lyp_6-31g(d).firefly.inp (generated)

016583595.b3lyp_6-31g(d).smash.inp (generated)

016583595.b3lyp_6-31g(d).nwchem.inp (generated) 016583595.b3lyp_6-31g(d).log.xz 016583595.td-b3lyp_6-31g+(d).inp 016583595.td-b3lyp_6-31g+(d).log.xz

016583595.td-b3lyp_6-31+g(d).qchem.inp (generated)

016583595.td-b3lyp_6-31+g(d).gjf (generated)

016583595.td-b3lyp_6-31+g(d).firefly.inp (generated)

016583595.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016583595.mol 016583595.PUBCHEM 016583595.mol (via Jmol)
016583847.b3lyp_6-31g(d).inp

016583847.b3lyp_6-31g(d).qchem.inp (generated)

016583847.b3lyp_6-31g(d).gjf (generated)

016583847.b3lyp_6-31g(d).firefly.inp (generated)

016583847.b3lyp_6-31g(d).smash.inp (generated)

016583847.b3lyp_6-31g(d).nwchem.inp (generated) 016583847.b3lyp_6-31g(d).log.xz 016583847.mol 016583847.PUBCHEM 016583847.mol (via Jmol)
016583849.b3lyp_6-31g(d).inp

016583849.b3lyp_6-31g(d).qchem.inp (generated)

016583849.b3lyp_6-31g(d).gjf (generated)

016583849.b3lyp_6-31g(d).firefly.inp (generated)

016583849.b3lyp_6-31g(d).smash.inp (generated)

016583849.b3lyp_6-31g(d).nwchem.inp (generated) 016583849.b3lyp_6-31g(d).log.xz 016583849.td-b3lyp_6-31g+(d).inp 016583849.td-b3lyp_6-31g+(d).log.xz

016583849.td-b3lyp_6-31+g(d).qchem.inp (generated)

016583849.td-b3lyp_6-31+g(d).gjf (generated)

016583849.td-b3lyp_6-31+g(d).firefly.inp (generated)

016583849.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016583849.mol 016583849.PUBCHEM 016583849.mol (via Jmol)
016583856.b3lyp_6-31g(d).inp

016583856.b3lyp_6-31g(d).qchem.inp (generated)

016583856.b3lyp_6-31g(d).gjf (generated)

016583856.b3lyp_6-31g(d).firefly.inp (generated)

016583856.b3lyp_6-31g(d).smash.inp (generated)

016583856.b3lyp_6-31g(d).nwchem.inp (generated) 016583856.b3lyp_6-31g(d).log.xz 016583856.td-b3lyp_6-31g+(d).inp 016583856.td-b3lyp_6-31g+(d).log.xz

016583856.td-b3lyp_6-31+g(d).qchem.inp (generated)

016583856.td-b3lyp_6-31+g(d).gjf (generated)

016583856.td-b3lyp_6-31+g(d).firefly.inp (generated)

016583856.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016583856.mol 016583856.PUBCHEM 016583856.mol (via Jmol)
016583864.b3lyp_6-31g(d).inp

016583864.b3lyp_6-31g(d).qchem.inp (generated)

016583864.b3lyp_6-31g(d).gjf (generated)

016583864.b3lyp_6-31g(d).firefly.inp (generated)

016583864.b3lyp_6-31g(d).smash.inp (generated)

016583864.b3lyp_6-31g(d).nwchem.inp (generated) 016583864.b3lyp_6-31g(d).log.xz 016583864.td-b3lyp_6-31g+(d).inp 016583864.td-b3lyp_6-31g+(d).log.xz

016583864.td-b3lyp_6-31+g(d).qchem.inp (generated)

016583864.td-b3lyp_6-31+g(d).gjf (generated)

016583864.td-b3lyp_6-31+g(d).firefly.inp (generated)

016583864.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016583864.mol 016583864.PUBCHEM 016583864.mol (via Jmol)
016584070.b3lyp_6-31g(d).inp

016584070.b3lyp_6-31g(d).qchem.inp (generated)

016584070.b3lyp_6-31g(d).gjf (generated)

016584070.b3lyp_6-31g(d).firefly.inp (generated)

016584070.b3lyp_6-31g(d).smash.inp (generated)

016584070.b3lyp_6-31g(d).nwchem.inp (generated) 016584070.b3lyp_6-31g(d).log.xz 016584070.mol 016584070.PUBCHEM 016584070.mol (via Jmol)
016584072.b3lyp_6-31g(d).inp

016584072.b3lyp_6-31g(d).qchem.inp (generated)

016584072.b3lyp_6-31g(d).gjf (generated)

016584072.b3lyp_6-31g(d).firefly.inp (generated)

016584072.b3lyp_6-31g(d).smash.inp (generated)

016584072.b3lyp_6-31g(d).nwchem.inp (generated) 016584072.b3lyp_6-31g(d).log.xz 016584072.mol 016584072.PUBCHEM 016584072.mol (via Jmol)
016584075.b3lyp_6-31g(d).inp

016584075.b3lyp_6-31g(d).qchem.inp (generated)

016584075.b3lyp_6-31g(d).gjf (generated)

016584075.b3lyp_6-31g(d).firefly.inp (generated)

016584075.b3lyp_6-31g(d).smash.inp (generated)

016584075.b3lyp_6-31g(d).nwchem.inp (generated) 016584075.b3lyp_6-31g(d).log.xz 016584075.td-b3lyp_6-31g+(d).inp 016584075.td-b3lyp_6-31g+(d).log.xz

016584075.td-b3lyp_6-31+g(d).qchem.inp (generated)

016584075.td-b3lyp_6-31+g(d).gjf (generated)

016584075.td-b3lyp_6-31+g(d).firefly.inp (generated)

016584075.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016584075.mol 016584075.PUBCHEM 016584075.mol (via Jmol)
016584204.b3lyp_6-31g(d).inp

016584204.b3lyp_6-31g(d).qchem.inp (generated)

016584204.b3lyp_6-31g(d).gjf (generated)

016584204.b3lyp_6-31g(d).firefly.inp (generated)

016584204.b3lyp_6-31g(d).smash.inp (generated)

016584204.b3lyp_6-31g(d).nwchem.inp (generated) 016584204.b3lyp_6-31g(d).log.xz 016584204.td-b3lyp_6-31g+(d).inp 016584204.td-b3lyp_6-31g+(d).log.xz

016584204.td-b3lyp_6-31+g(d).qchem.inp (generated)

016584204.td-b3lyp_6-31+g(d).gjf (generated)

016584204.td-b3lyp_6-31+g(d).firefly.inp (generated)

016584204.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016584204.mol 016584204.PUBCHEM 016584204.mol (via Jmol)
016584426.b3lyp_6-31g(d).inp

016584426.b3lyp_6-31g(d).qchem.inp (generated)

016584426.b3lyp_6-31g(d).gjf (generated)

016584426.b3lyp_6-31g(d).firefly.inp (generated)

016584426.b3lyp_6-31g(d).smash.inp (generated)

016584426.b3lyp_6-31g(d).nwchem.inp (generated) 016584426.b3lyp_6-31g(d).log.xz 016584426.td-b3lyp_6-31g+(d).inp 016584426.td-b3lyp_6-31g+(d).log.xz

016584426.td-b3lyp_6-31+g(d).qchem.inp (generated)

016584426.td-b3lyp_6-31+g(d).gjf (generated)

016584426.td-b3lyp_6-31+g(d).firefly.inp (generated)

016584426.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016584426.mol 016584426.PUBCHEM 016584426.mol (via Jmol)
016584443.b3lyp_6-31g(d).inp

016584443.b3lyp_6-31g(d).qchem.inp (generated)

016584443.b3lyp_6-31g(d).gjf (generated)

016584443.b3lyp_6-31g(d).firefly.inp (generated)

016584443.b3lyp_6-31g(d).smash.inp (generated)

016584443.b3lyp_6-31g(d).nwchem.inp (generated) 016584443.b3lyp_6-31g(d).log.xz 016584443.td-b3lyp_6-31g+(d).inp 016584443.td-b3lyp_6-31g+(d).log.xz

016584443.td-b3lyp_6-31+g(d).qchem.inp (generated)

016584443.td-b3lyp_6-31+g(d).gjf (generated)

016584443.td-b3lyp_6-31+g(d).firefly.inp (generated)

016584443.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016584443.mol 016584443.PUBCHEM 016584443.mol (via Jmol)
016584448.b3lyp_6-31g(d).inp

016584448.b3lyp_6-31g(d).qchem.inp (generated)

016584448.b3lyp_6-31g(d).gjf (generated)

016584448.b3lyp_6-31g(d).firefly.inp (generated)

016584448.b3lyp_6-31g(d).smash.inp (generated)

016584448.b3lyp_6-31g(d).nwchem.inp (generated) 016584448.b3lyp_6-31g(d).log.xz 016584448.mol 016584448.PUBCHEM 016584448.mol (via Jmol)
016584456.b3lyp_6-31g(d).inp

016584456.b3lyp_6-31g(d).qchem.inp (generated)

016584456.b3lyp_6-31g(d).gjf (generated)

016584456.b3lyp_6-31g(d).firefly.inp (generated)

016584456.b3lyp_6-31g(d).smash.inp (generated)

016584456.b3lyp_6-31g(d).nwchem.inp (generated) 016584456.b3lyp_6-31g(d).log.xz 016584456.td-b3lyp_6-31g+(d).inp 016584456.td-b3lyp_6-31g+(d).log.xz

016584456.td-b3lyp_6-31+g(d).qchem.inp (generated)

016584456.td-b3lyp_6-31+g(d).gjf (generated)

016584456.td-b3lyp_6-31+g(d).firefly.inp (generated)

016584456.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016584456.mol 016584456.PUBCHEM 016584456.mol (via Jmol)
016584457.b3lyp_6-31g(d).inp

016584457.b3lyp_6-31g(d).qchem.inp (generated)

016584457.b3lyp_6-31g(d).gjf (generated)

016584457.b3lyp_6-31g(d).firefly.inp (generated)

016584457.b3lyp_6-31g(d).smash.inp (generated)

016584457.b3lyp_6-31g(d).nwchem.inp (generated) 016584457.b3lyp_6-31g(d).log.xz 016584457.td-b3lyp_6-31g+(d).inp 016584457.td-b3lyp_6-31g+(d).log.xz

016584457.td-b3lyp_6-31+g(d).qchem.inp (generated)

016584457.td-b3lyp_6-31+g(d).gjf (generated)

016584457.td-b3lyp_6-31+g(d).firefly.inp (generated)

016584457.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016584457.mol 016584457.PUBCHEM 016584457.mol (via Jmol)
016584461.b3lyp_6-31g(d).inp

016584461.b3lyp_6-31g(d).qchem.inp (generated)

016584461.b3lyp_6-31g(d).gjf (generated)

016584461.b3lyp_6-31g(d).firefly.inp (generated)

016584461.b3lyp_6-31g(d).smash.inp (generated)

016584461.b3lyp_6-31g(d).nwchem.inp (generated) 016584461.b3lyp_6-31g(d).log.xz 016584461.td-b3lyp_6-31g+(d).inp 016584461.td-b3lyp_6-31g+(d).log.xz

016584461.td-b3lyp_6-31+g(d).qchem.inp (generated)

016584461.td-b3lyp_6-31+g(d).gjf (generated)

016584461.td-b3lyp_6-31+g(d).firefly.inp (generated)

016584461.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016584461.mol 016584461.PUBCHEM 016584461.mol (via Jmol)
016584465.b3lyp_6-31g(d).inp

016584465.b3lyp_6-31g(d).qchem.inp (generated)

016584465.b3lyp_6-31g(d).gjf (generated)

016584465.b3lyp_6-31g(d).firefly.inp (generated)

016584465.b3lyp_6-31g(d).smash.inp (generated)

016584465.b3lyp_6-31g(d).nwchem.inp (generated) 016584465.b3lyp_6-31g(d).log.xz 016584465.mol 016584465.PUBCHEM 016584465.mol (via Jmol)
016584466.b3lyp_6-31g(d).inp

016584466.b3lyp_6-31g(d).qchem.inp (generated)

016584466.b3lyp_6-31g(d).gjf (generated)

016584466.b3lyp_6-31g(d).firefly.inp (generated)

016584466.b3lyp_6-31g(d).smash.inp (generated)

016584466.b3lyp_6-31g(d).nwchem.inp (generated) 016584466.b3lyp_6-31g(d).log.xz 016584466.td-b3lyp_6-31g+(d).inp 016584466.td-b3lyp_6-31g+(d).log.xz

016584466.td-b3lyp_6-31+g(d).qchem.inp (generated)

016584466.td-b3lyp_6-31+g(d).gjf (generated)

016584466.td-b3lyp_6-31+g(d).firefly.inp (generated)

016584466.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016584466.mol 016584466.PUBCHEM 016584466.mol (via Jmol)
016584476.b3lyp_6-31g(d).inp

016584476.b3lyp_6-31g(d).qchem.inp (generated)

016584476.b3lyp_6-31g(d).gjf (generated)

016584476.b3lyp_6-31g(d).firefly.inp (generated)

016584476.b3lyp_6-31g(d).smash.inp (generated)

016584476.b3lyp_6-31g(d).nwchem.inp (generated) 016584476.b3lyp_6-31g(d).log.xz 016584476.td-b3lyp_6-31g+(d).inp 016584476.td-b3lyp_6-31g+(d).log.xz

016584476.td-b3lyp_6-31+g(d).qchem.inp (generated)

016584476.td-b3lyp_6-31+g(d).gjf (generated)

016584476.td-b3lyp_6-31+g(d).firefly.inp (generated)

016584476.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016584476.mol 016584476.PUBCHEM 016584476.mol (via Jmol)
016584477.b3lyp_6-31g(d).inp

016584477.b3lyp_6-31g(d).qchem.inp (generated)

016584477.b3lyp_6-31g(d).gjf (generated)

016584477.b3lyp_6-31g(d).firefly.inp (generated)

016584477.b3lyp_6-31g(d).smash.inp (generated)

016584477.b3lyp_6-31g(d).nwchem.inp (generated) 016584477.b3lyp_6-31g(d).log.xz 016584477.td-b3lyp_6-31g+(d).inp 016584477.td-b3lyp_6-31g+(d).log.xz

016584477.td-b3lyp_6-31+g(d).qchem.inp (generated)

016584477.td-b3lyp_6-31+g(d).gjf (generated)

016584477.td-b3lyp_6-31+g(d).firefly.inp (generated)

016584477.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016584477.mol 016584477.PUBCHEM 016584477.mol (via Jmol)
016584481.b3lyp_6-31g(d).inp

016584481.b3lyp_6-31g(d).qchem.inp (generated)

016584481.b3lyp_6-31g(d).gjf (generated)

016584481.b3lyp_6-31g(d).firefly.inp (generated)

016584481.b3lyp_6-31g(d).smash.inp (generated)

016584481.b3lyp_6-31g(d).nwchem.inp (generated) 016584481.b3lyp_6-31g(d).log.xz 016584481.td-b3lyp_6-31g+(d).inp 016584481.td-b3lyp_6-31g+(d).log.xz

016584481.td-b3lyp_6-31+g(d).qchem.inp (generated)

016584481.td-b3lyp_6-31+g(d).gjf (generated)

016584481.td-b3lyp_6-31+g(d).firefly.inp (generated)

016584481.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016584481.mol 016584481.PUBCHEM 016584481.mol (via Jmol)
016584486.b3lyp_6-31g(d).inp

016584486.b3lyp_6-31g(d).qchem.inp (generated)

016584486.b3lyp_6-31g(d).gjf (generated)

016584486.b3lyp_6-31g(d).firefly.inp (generated)

016584486.b3lyp_6-31g(d).smash.inp (generated)

016584486.b3lyp_6-31g(d).nwchem.inp (generated) 016584486.b3lyp_6-31g(d).log.xz 016584486.mol 016584486.PUBCHEM 016584486.mol (via Jmol)
016584495.b3lyp_6-31g(d).inp

016584495.b3lyp_6-31g(d).qchem.inp (generated)

016584495.b3lyp_6-31g(d).gjf (generated)

016584495.b3lyp_6-31g(d).firefly.inp (generated)

016584495.b3lyp_6-31g(d).smash.inp (generated)

016584495.b3lyp_6-31g(d).nwchem.inp (generated) 016584495.b3lyp_6-31g(d).log.xz 016584495.td-b3lyp_6-31g+(d).inp 016584495.td-b3lyp_6-31g+(d).log.xz

016584495.td-b3lyp_6-31+g(d).qchem.inp (generated)

016584495.td-b3lyp_6-31+g(d).gjf (generated)

016584495.td-b3lyp_6-31+g(d).firefly.inp (generated)

016584495.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016584495.mol 016584495.PUBCHEM 016584495.mol (via Jmol)
016584496.b3lyp_6-31g(d).inp

016584496.b3lyp_6-31g(d).qchem.inp (generated)

016584496.b3lyp_6-31g(d).gjf (generated)

016584496.b3lyp_6-31g(d).firefly.inp (generated)

016584496.b3lyp_6-31g(d).smash.inp (generated)

016584496.b3lyp_6-31g(d).nwchem.inp (generated) 016584496.b3lyp_6-31g(d).log.xz 016584496.td-b3lyp_6-31g+(d).inp 016584496.td-b3lyp_6-31g+(d).log.xz

016584496.td-b3lyp_6-31+g(d).qchem.inp (generated)

016584496.td-b3lyp_6-31+g(d).gjf (generated)

016584496.td-b3lyp_6-31+g(d).firefly.inp (generated)

016584496.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016584496.mol 016584496.PUBCHEM 016584496.mol (via Jmol)
016584839.b3lyp_6-31g(d).inp

016584839.b3lyp_6-31g(d).qchem.inp (generated)

016584839.b3lyp_6-31g(d).gjf (generated)

016584839.b3lyp_6-31g(d).firefly.inp (generated)

016584839.b3lyp_6-31g(d).smash.inp (generated)

016584839.b3lyp_6-31g(d).nwchem.inp (generated) 016584839.b3lyp_6-31g(d).log.xz 016584839.mol 016584839.PUBCHEM 016584839.mol (via Jmol)
016584840.b3lyp_6-31g(d).inp

016584840.b3lyp_6-31g(d).qchem.inp (generated)

016584840.b3lyp_6-31g(d).gjf (generated)

016584840.b3lyp_6-31g(d).firefly.inp (generated)

016584840.b3lyp_6-31g(d).smash.inp (generated)

016584840.b3lyp_6-31g(d).nwchem.inp (generated) 016584840.b3lyp_6-31g(d).log.xz 016584840.td-b3lyp_6-31g+(d).inp 016584840.td-b3lyp_6-31g+(d).log.xz

016584840.td-b3lyp_6-31+g(d).qchem.inp (generated)

016584840.td-b3lyp_6-31+g(d).gjf (generated)

016584840.td-b3lyp_6-31+g(d).firefly.inp (generated)

016584840.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016584840.mol 016584840.PUBCHEM 016584840.mol (via Jmol)
016584850.b3lyp_6-31g(d).inp

016584850.b3lyp_6-31g(d).qchem.inp (generated)

016584850.b3lyp_6-31g(d).gjf (generated)

016584850.b3lyp_6-31g(d).firefly.inp (generated)

016584850.b3lyp_6-31g(d).smash.inp (generated)

016584850.b3lyp_6-31g(d).nwchem.inp (generated) 016584850.b3lyp_6-31g(d).log.xz 016584850.td-b3lyp_6-31g+(d).inp 016584850.td-b3lyp_6-31g+(d).log.xz

016584850.td-b3lyp_6-31+g(d).qchem.inp (generated)

016584850.td-b3lyp_6-31+g(d).gjf (generated)

016584850.td-b3lyp_6-31+g(d).firefly.inp (generated)

016584850.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016584850.mol 016584850.PUBCHEM 016584850.mol (via Jmol)
016584851.b3lyp_6-31g(d).inp

016584851.b3lyp_6-31g(d).qchem.inp (generated)

016584851.b3lyp_6-31g(d).gjf (generated)

016584851.b3lyp_6-31g(d).firefly.inp (generated)

016584851.b3lyp_6-31g(d).smash.inp (generated)

016584851.b3lyp_6-31g(d).nwchem.inp (generated) 016584851.b3lyp_6-31g(d).log.xz 016584851.mol 016584851.PUBCHEM 016584851.mol (via Jmol)
016584873.b3lyp_6-31g(d).inp

016584873.b3lyp_6-31g(d).qchem.inp (generated)

016584873.b3lyp_6-31g(d).gjf (generated)

016584873.b3lyp_6-31g(d).firefly.inp (generated)

016584873.b3lyp_6-31g(d).smash.inp (generated)

016584873.b3lyp_6-31g(d).nwchem.inp (generated) 016584873.b3lyp_6-31g(d).log.xz 016584873.td-b3lyp_6-31g+(d).inp 016584873.td-b3lyp_6-31g+(d).log.xz

016584873.td-b3lyp_6-31+g(d).qchem.inp (generated)

016584873.td-b3lyp_6-31+g(d).gjf (generated)

016584873.td-b3lyp_6-31+g(d).firefly.inp (generated)

016584873.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016584873.mol 016584873.PUBCHEM 016584873.mol (via Jmol)
016584911.b3lyp_6-31g(d).inp

016584911.b3lyp_6-31g(d).qchem.inp (generated)

016584911.b3lyp_6-31g(d).gjf (generated)

016584911.b3lyp_6-31g(d).firefly.inp (generated)

016584911.b3lyp_6-31g(d).smash.inp (generated)

016584911.b3lyp_6-31g(d).nwchem.inp (generated) 016584911.b3lyp_6-31g(d).log.xz 016584911.td-b3lyp_6-31g+(d).inp 016584911.td-b3lyp_6-31g+(d).log.xz

016584911.td-b3lyp_6-31+g(d).qchem.inp (generated)

016584911.td-b3lyp_6-31+g(d).gjf (generated)

016584911.td-b3lyp_6-31+g(d).firefly.inp (generated)

016584911.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016584911.mol 016584911.PUBCHEM 016584911.mol (via Jmol)
016585349.b3lyp_6-31g(d).inp

016585349.b3lyp_6-31g(d).qchem.inp (generated)

016585349.b3lyp_6-31g(d).gjf (generated)

016585349.b3lyp_6-31g(d).firefly.inp (generated)

016585349.b3lyp_6-31g(d).smash.inp (generated)

016585349.b3lyp_6-31g(d).nwchem.inp (generated) 016585349.b3lyp_6-31g(d).log.xz 016585349.td-b3lyp_6-31g+(d).inp 016585349.td-b3lyp_6-31g+(d).log.xz

016585349.td-b3lyp_6-31+g(d).qchem.inp (generated)

016585349.td-b3lyp_6-31+g(d).gjf (generated)

016585349.td-b3lyp_6-31+g(d).firefly.inp (generated)

016585349.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016585349.mol 016585349.PUBCHEM 016585349.mol (via Jmol)
016585382.b3lyp_6-31g(d).inp

016585382.b3lyp_6-31g(d).qchem.inp (generated)

016585382.b3lyp_6-31g(d).gjf (generated)

016585382.b3lyp_6-31g(d).firefly.inp (generated)

016585382.b3lyp_6-31g(d).smash.inp (generated)

016585382.b3lyp_6-31g(d).nwchem.inp (generated) 016585382.b3lyp_6-31g(d).log.xz 016585382.td-b3lyp_6-31g+(d).inp 016585382.td-b3lyp_6-31g+(d).log.xz

016585382.td-b3lyp_6-31+g(d).qchem.inp (generated)

016585382.td-b3lyp_6-31+g(d).gjf (generated)

016585382.td-b3lyp_6-31+g(d).firefly.inp (generated)

016585382.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016585382.mol 016585382.PUBCHEM 016585382.mol (via Jmol)
016585435.b3lyp_6-31g(d).inp

016585435.b3lyp_6-31g(d).qchem.inp (generated)

016585435.b3lyp_6-31g(d).gjf (generated)

016585435.b3lyp_6-31g(d).firefly.inp (generated)

016585435.b3lyp_6-31g(d).smash.inp (generated)

016585435.b3lyp_6-31g(d).nwchem.inp (generated) 016585435.b3lyp_6-31g(d).log.xz 016585435.td-b3lyp_6-31g+(d).inp 016585435.td-b3lyp_6-31g+(d).log.xz

016585435.td-b3lyp_6-31+g(d).qchem.inp (generated)

016585435.td-b3lyp_6-31+g(d).gjf (generated)

016585435.td-b3lyp_6-31+g(d).firefly.inp (generated)

016585435.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016585435.mol 016585435.PUBCHEM 016585435.mol (via Jmol)
016587150.b3lyp_6-31g(d).inp

016587150.b3lyp_6-31g(d).qchem.inp (generated)

016587150.b3lyp_6-31g(d).gjf (generated)

016587150.b3lyp_6-31g(d).firefly.inp (generated)

016587150.b3lyp_6-31g(d).smash.inp (generated)

016587150.b3lyp_6-31g(d).nwchem.inp (generated) 016587150.b3lyp_6-31g(d).log.xz 016587150.td-b3lyp_6-31g+(d).inp 016587150.td-b3lyp_6-31g+(d).log.xz

016587150.td-b3lyp_6-31+g(d).qchem.inp (generated)

016587150.td-b3lyp_6-31+g(d).gjf (generated)

016587150.td-b3lyp_6-31+g(d).firefly.inp (generated)

016587150.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016587150.mol 016587150.PUBCHEM 016587150.mol (via Jmol)
016587583.b3lyp_6-31g(d).inp

016587583.b3lyp_6-31g(d).qchem.inp (generated)

016587583.b3lyp_6-31g(d).gjf (generated)

016587583.b3lyp_6-31g(d).firefly.inp (generated)

016587583.b3lyp_6-31g(d).smash.inp (generated)

016587583.b3lyp_6-31g(d).nwchem.inp (generated) 016587583.b3lyp_6-31g(d).log.xz 016587583.td-b3lyp_6-31g+(d).inp 016587583.td-b3lyp_6-31g+(d).log.xz

016587583.td-b3lyp_6-31+g(d).qchem.inp (generated)

016587583.td-b3lyp_6-31+g(d).gjf (generated)

016587583.td-b3lyp_6-31+g(d).firefly.inp (generated)

016587583.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016587583.mol 016587583.PUBCHEM 016587583.mol (via Jmol)
016594757.b3lyp_6-31g(d).inp

016594757.b3lyp_6-31g(d).qchem.inp (generated)

016594757.b3lyp_6-31g(d).gjf (generated)

016594757.b3lyp_6-31g(d).firefly.inp (generated)

016594757.b3lyp_6-31g(d).smash.inp (generated)

016594757.b3lyp_6-31g(d).nwchem.inp (generated) 016594757.b3lyp_6-31g(d).log.xz 016594757.td-b3lyp_6-31g+(d).inp 016594757.td-b3lyp_6-31g+(d).log.xz

016594757.td-b3lyp_6-31+g(d).qchem.inp (generated)

016594757.td-b3lyp_6-31+g(d).gjf (generated)

016594757.td-b3lyp_6-31+g(d).firefly.inp (generated)

016594757.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016594757.mol 016594757.PUBCHEM 016594757.mol (via Jmol)
016595411.b3lyp_6-31g(d).inp

016595411.b3lyp_6-31g(d).qchem.inp (generated)

016595411.b3lyp_6-31g(d).gjf (generated)

016595411.b3lyp_6-31g(d).firefly.inp (generated)

016595411.b3lyp_6-31g(d).smash.inp (generated)

016595411.b3lyp_6-31g(d).nwchem.inp (generated) 016595411.b3lyp_6-31g(d).log.xz 016595411.td-b3lyp_6-31g+(d).inp 016595411.td-b3lyp_6-31g+(d).log.xz

016595411.td-b3lyp_6-31+g(d).qchem.inp (generated)

016595411.td-b3lyp_6-31+g(d).gjf (generated)

016595411.td-b3lyp_6-31+g(d).firefly.inp (generated)

016595411.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016595411.mol 016595411.PUBCHEM 016595411.mol (via Jmol)
016595694.b3lyp_6-31g(d).inp

016595694.b3lyp_6-31g(d).qchem.inp (generated)

016595694.b3lyp_6-31g(d).gjf (generated)

016595694.b3lyp_6-31g(d).firefly.inp (generated)

016595694.b3lyp_6-31g(d).smash.inp (generated)

016595694.b3lyp_6-31g(d).nwchem.inp (generated) 016595694.b3lyp_6-31g(d).log.xz 016595694.mol 016595694.PUBCHEM 016595694.mol (via Jmol)
016596041.b3lyp_6-31g(d).inp

016596041.b3lyp_6-31g(d).qchem.inp (generated)

016596041.b3lyp_6-31g(d).gjf (generated)

016596041.b3lyp_6-31g(d).firefly.inp (generated)

016596041.b3lyp_6-31g(d).smash.inp (generated)

016596041.b3lyp_6-31g(d).nwchem.inp (generated) 016596041.b3lyp_6-31g(d).log.xz 016596041.td-b3lyp_6-31g+(d).inp 016596041.td-b3lyp_6-31g+(d).log.xz

016596041.td-b3lyp_6-31+g(d).qchem.inp (generated)

016596041.td-b3lyp_6-31+g(d).gjf (generated)

016596041.td-b3lyp_6-31+g(d).firefly.inp (generated)

016596041.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016596041.mol 016596041.PUBCHEM 016596041.mol (via Jmol)
016596187.b3lyp_6-31g(d).inp

016596187.b3lyp_6-31g(d).qchem.inp (generated)

016596187.b3lyp_6-31g(d).gjf (generated)

016596187.b3lyp_6-31g(d).firefly.inp (generated)

016596187.b3lyp_6-31g(d).smash.inp (generated)

016596187.b3lyp_6-31g(d).nwchem.inp (generated) 016596187.b3lyp_6-31g(d).log.xz 016596187.td-b3lyp_6-31g+(d).inp 016596187.td-b3lyp_6-31g+(d).log.xz

016596187.td-b3lyp_6-31+g(d).qchem.inp (generated)

016596187.td-b3lyp_6-31+g(d).gjf (generated)

016596187.td-b3lyp_6-31+g(d).firefly.inp (generated)

016596187.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016596187.mol 016596187.PUBCHEM 016596187.mol (via Jmol)
016596336.b3lyp_6-31g(d).inp

016596336.b3lyp_6-31g(d).qchem.inp (generated)

016596336.b3lyp_6-31g(d).gjf (generated)

016596336.b3lyp_6-31g(d).firefly.inp (generated)

016596336.b3lyp_6-31g(d).smash.inp (generated)

016596336.b3lyp_6-31g(d).nwchem.inp (generated) 016596336.b3lyp_6-31g(d).log.xz 016596336.mol 016596336.PUBCHEM 016596336.mol (via Jmol)
016596338.b3lyp_6-31g(d).inp

016596338.b3lyp_6-31g(d).qchem.inp (generated)

016596338.b3lyp_6-31g(d).gjf (generated)

016596338.b3lyp_6-31g(d).firefly.inp (generated)

016596338.b3lyp_6-31g(d).smash.inp (generated)

016596338.b3lyp_6-31g(d).nwchem.inp (generated) 016596338.b3lyp_6-31g(d).log.xz 016596338.td-b3lyp_6-31g+(d).inp 016596338.td-b3lyp_6-31g+(d).log.xz

016596338.td-b3lyp_6-31+g(d).qchem.inp (generated)

016596338.td-b3lyp_6-31+g(d).gjf (generated)

016596338.td-b3lyp_6-31+g(d).firefly.inp (generated)

016596338.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016596338.mol 016596338.PUBCHEM 016596338.mol (via Jmol)
016598636.b3lyp_6-31g(d).inp

016598636.b3lyp_6-31g(d).qchem.inp (generated)

016598636.b3lyp_6-31g(d).gjf (generated)

016598636.b3lyp_6-31g(d).firefly.inp (generated)

016598636.b3lyp_6-31g(d).smash.inp (generated)

016598636.b3lyp_6-31g(d).nwchem.inp (generated) 016598636.b3lyp_6-31g(d).log.xz 016598636.td-b3lyp_6-31g+(d).inp 016598636.td-b3lyp_6-31g+(d).log.xz

016598636.td-b3lyp_6-31+g(d).qchem.inp (generated)

016598636.td-b3lyp_6-31+g(d).gjf (generated)

016598636.td-b3lyp_6-31+g(d).firefly.inp (generated)

016598636.td-b3lyp_6-31+g(d).nwchem.inp (generated) 016598636.mol 016598636.PUBCHEM 016598636.mol (via Jmol)


maho@riken.jp/maho.nakata@gmail.com