Index of

Last updated : Thu Jun 22 02:29:55 JST 2017
Total : 1185 (969) in this page
000925020.b3lyp_6-31g(d).inp

000925020.b3lyp_6-31g(d).qchem.inp (generated)

000925020.b3lyp_6-31g(d).gjf (generated)

000925020.b3lyp_6-31g(d).firefly.inp (generated)

000925020.b3lyp_6-31g(d).smash.inp (generated)

000925020.b3lyp_6-31g(d).nwchem.inp (generated) 000925020.b3lyp_6-31g(d).log.xz 000925020.td-b3lyp_6-31g+(d).inp 000925020.td-b3lyp_6-31g+(d).log.xz

000925020.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925020.td-b3lyp_6-31+g(d).gjf (generated)

000925020.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925020.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925020.mol 000925020.PUBCHEM 000925020.mol (via Jmol)
000925021.b3lyp_6-31g(d).inp

000925021.b3lyp_6-31g(d).qchem.inp (generated)

000925021.b3lyp_6-31g(d).gjf (generated)

000925021.b3lyp_6-31g(d).firefly.inp (generated)

000925021.b3lyp_6-31g(d).smash.inp (generated)

000925021.b3lyp_6-31g(d).nwchem.inp (generated) 000925021.b3lyp_6-31g(d).log.xz 000925021.td-b3lyp_6-31g+(d).inp 000925021.td-b3lyp_6-31g+(d).log.xz

000925021.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925021.td-b3lyp_6-31+g(d).gjf (generated)

000925021.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925021.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925021.mol 000925021.PUBCHEM 000925021.mol (via Jmol)
000925022.b3lyp_6-31g(d).inp

000925022.b3lyp_6-31g(d).qchem.inp (generated)

000925022.b3lyp_6-31g(d).gjf (generated)

000925022.b3lyp_6-31g(d).firefly.inp (generated)

000925022.b3lyp_6-31g(d).smash.inp (generated)

000925022.b3lyp_6-31g(d).nwchem.inp (generated) 000925022.b3lyp_6-31g(d).log.xz 000925022.td-b3lyp_6-31g+(d).inp 000925022.td-b3lyp_6-31g+(d).log.xz

000925022.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925022.td-b3lyp_6-31+g(d).gjf (generated)

000925022.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925022.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925022.mol 000925022.PUBCHEM 000925022.mol (via Jmol)
000925075.b3lyp_6-31g(d).inp

000925075.b3lyp_6-31g(d).qchem.inp (generated)

000925075.b3lyp_6-31g(d).gjf (generated)

000925075.b3lyp_6-31g(d).firefly.inp (generated)

000925075.b3lyp_6-31g(d).smash.inp (generated)

000925075.b3lyp_6-31g(d).nwchem.inp (generated) 000925075.b3lyp_6-31g(d).log.xz 000925075.td-b3lyp_6-31g+(d).inp 000925075.td-b3lyp_6-31g+(d).log.xz

000925075.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925075.td-b3lyp_6-31+g(d).gjf (generated)

000925075.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925075.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925075.mol 000925075.PUBCHEM 000925075.mol (via Jmol)
000925167.b3lyp_6-31g(d).inp

000925167.b3lyp_6-31g(d).qchem.inp (generated)

000925167.b3lyp_6-31g(d).gjf (generated)

000925167.b3lyp_6-31g(d).firefly.inp (generated)

000925167.b3lyp_6-31g(d).smash.inp (generated)

000925167.b3lyp_6-31g(d).nwchem.inp (generated) 000925167.b3lyp_6-31g(d).log.xz 000925167.td-b3lyp_6-31g+(d).inp 000925167.td-b3lyp_6-31g+(d).log.xz

000925167.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925167.td-b3lyp_6-31+g(d).gjf (generated)

000925167.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925167.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925167.mol 000925167.PUBCHEM 000925167.mol (via Jmol)
000925168.b3lyp_6-31g(d).inp

000925168.b3lyp_6-31g(d).qchem.inp (generated)

000925168.b3lyp_6-31g(d).gjf (generated)

000925168.b3lyp_6-31g(d).firefly.inp (generated)

000925168.b3lyp_6-31g(d).smash.inp (generated)

000925168.b3lyp_6-31g(d).nwchem.inp (generated) 000925168.b3lyp_6-31g(d).log.xz 000925168.td-b3lyp_6-31g+(d).inp 000925168.td-b3lyp_6-31g+(d).log.xz

000925168.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925168.td-b3lyp_6-31+g(d).gjf (generated)

000925168.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925168.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925168.mol 000925168.PUBCHEM 000925168.mol (via Jmol)
000925272.b3lyp_6-31g(d).inp

000925272.b3lyp_6-31g(d).qchem.inp (generated)

000925272.b3lyp_6-31g(d).gjf (generated)

000925272.b3lyp_6-31g(d).firefly.inp (generated)

000925272.b3lyp_6-31g(d).smash.inp (generated)

000925272.b3lyp_6-31g(d).nwchem.inp (generated) 000925272.b3lyp_6-31g(d).log.xz 000925272.td-b3lyp_6-31g+(d).inp 000925272.td-b3lyp_6-31g+(d).log.xz

000925272.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925272.td-b3lyp_6-31+g(d).gjf (generated)

000925272.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925272.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925272.mol 000925272.PUBCHEM 000925272.mol (via Jmol)
000925278.b3lyp_6-31g(d).inp

000925278.b3lyp_6-31g(d).qchem.inp (generated)

000925278.b3lyp_6-31g(d).gjf (generated)

000925278.b3lyp_6-31g(d).firefly.inp (generated)

000925278.b3lyp_6-31g(d).smash.inp (generated)

000925278.b3lyp_6-31g(d).nwchem.inp (generated) 000925278.b3lyp_6-31g(d).log.xz 000925278.td-b3lyp_6-31g+(d).inp 000925278.td-b3lyp_6-31g+(d).log.xz

000925278.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925278.td-b3lyp_6-31+g(d).gjf (generated)

000925278.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925278.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925278.mol 000925278.PUBCHEM 000925278.mol (via Jmol)
000925294.b3lyp_6-31g(d).inp

000925294.b3lyp_6-31g(d).qchem.inp (generated)

000925294.b3lyp_6-31g(d).gjf (generated)

000925294.b3lyp_6-31g(d).firefly.inp (generated)

000925294.b3lyp_6-31g(d).smash.inp (generated)

000925294.b3lyp_6-31g(d).nwchem.inp (generated) 000925294.b3lyp_6-31g(d).log.xz 000925294.mol 000925294.PUBCHEM 000925294.mol (via Jmol)
000925295.b3lyp_6-31g(d).inp

000925295.b3lyp_6-31g(d).qchem.inp (generated)

000925295.b3lyp_6-31g(d).gjf (generated)

000925295.b3lyp_6-31g(d).firefly.inp (generated)

000925295.b3lyp_6-31g(d).smash.inp (generated)

000925295.b3lyp_6-31g(d).nwchem.inp (generated) 000925295.b3lyp_6-31g(d).log.xz 000925295.mol 000925295.PUBCHEM 000925295.mol (via Jmol)
000925303.b3lyp_6-31g(d).inp

000925303.b3lyp_6-31g(d).qchem.inp (generated)

000925303.b3lyp_6-31g(d).gjf (generated)

000925303.b3lyp_6-31g(d).firefly.inp (generated)

000925303.b3lyp_6-31g(d).smash.inp (generated)

000925303.b3lyp_6-31g(d).nwchem.inp (generated) 000925303.b3lyp_6-31g(d).log.xz 000925303.td-b3lyp_6-31g+(d).inp 000925303.td-b3lyp_6-31g+(d).log.xz

000925303.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925303.td-b3lyp_6-31+g(d).gjf (generated)

000925303.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925303.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925303.mol 000925303.PUBCHEM 000925303.mol (via Jmol)
000925307.b3lyp_6-31g(d).inp

000925307.b3lyp_6-31g(d).qchem.inp (generated)

000925307.b3lyp_6-31g(d).gjf (generated)

000925307.b3lyp_6-31g(d).firefly.inp (generated)

000925307.b3lyp_6-31g(d).smash.inp (generated)

000925307.b3lyp_6-31g(d).nwchem.inp (generated) 000925307.b3lyp_6-31g(d).log.xz 000925307.td-b3lyp_6-31g+(d).inp 000925307.td-b3lyp_6-31g+(d).log.xz

000925307.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925307.td-b3lyp_6-31+g(d).gjf (generated)

000925307.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925307.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925307.mol 000925307.PUBCHEM 000925307.mol (via Jmol)
000925313.b3lyp_6-31g(d).inp

000925313.b3lyp_6-31g(d).qchem.inp (generated)

000925313.b3lyp_6-31g(d).gjf (generated)

000925313.b3lyp_6-31g(d).firefly.inp (generated)

000925313.b3lyp_6-31g(d).smash.inp (generated)

000925313.b3lyp_6-31g(d).nwchem.inp (generated) 000925313.b3lyp_6-31g(d).log.xz 000925313.td-b3lyp_6-31g+(d).inp 000925313.td-b3lyp_6-31g+(d).log.xz

000925313.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925313.td-b3lyp_6-31+g(d).gjf (generated)

000925313.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925313.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925313.mol 000925313.PUBCHEM 000925313.mol (via Jmol)
000925317.b3lyp_6-31g(d).inp

000925317.b3lyp_6-31g(d).qchem.inp (generated)

000925317.b3lyp_6-31g(d).gjf (generated)

000925317.b3lyp_6-31g(d).firefly.inp (generated)

000925317.b3lyp_6-31g(d).smash.inp (generated)

000925317.b3lyp_6-31g(d).nwchem.inp (generated) 000925317.b3lyp_6-31g(d).log.xz 000925317.td-b3lyp_6-31g+(d).inp 000925317.td-b3lyp_6-31g+(d).log.xz

000925317.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925317.td-b3lyp_6-31+g(d).gjf (generated)

000925317.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925317.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925317.mol 000925317.PUBCHEM 000925317.mol (via Jmol)
000925318.b3lyp_6-31g(d).inp

000925318.b3lyp_6-31g(d).qchem.inp (generated)

000925318.b3lyp_6-31g(d).gjf (generated)

000925318.b3lyp_6-31g(d).firefly.inp (generated)

000925318.b3lyp_6-31g(d).smash.inp (generated)

000925318.b3lyp_6-31g(d).nwchem.inp (generated) 000925318.b3lyp_6-31g(d).log.xz 000925318.mol 000925318.PUBCHEM 000925318.mol (via Jmol)
000925319.b3lyp_6-31g(d).inp

000925319.b3lyp_6-31g(d).qchem.inp (generated)

000925319.b3lyp_6-31g(d).gjf (generated)

000925319.b3lyp_6-31g(d).firefly.inp (generated)

000925319.b3lyp_6-31g(d).smash.inp (generated)

000925319.b3lyp_6-31g(d).nwchem.inp (generated) 000925319.b3lyp_6-31g(d).log.xz 000925319.mol 000925319.PUBCHEM 000925319.mol (via Jmol)
000925320.b3lyp_6-31g(d).inp

000925320.b3lyp_6-31g(d).qchem.inp (generated)

000925320.b3lyp_6-31g(d).gjf (generated)

000925320.b3lyp_6-31g(d).firefly.inp (generated)

000925320.b3lyp_6-31g(d).smash.inp (generated)

000925320.b3lyp_6-31g(d).nwchem.inp (generated) 000925320.b3lyp_6-31g(d).log.xz 000925320.td-b3lyp_6-31g+(d).inp 000925320.td-b3lyp_6-31g+(d).log.xz

000925320.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925320.td-b3lyp_6-31+g(d).gjf (generated)

000925320.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925320.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925320.mol 000925320.PUBCHEM 000925320.mol (via Jmol)
000925348.b3lyp_6-31g(d).inp

000925348.b3lyp_6-31g(d).qchem.inp (generated)

000925348.b3lyp_6-31g(d).gjf (generated)

000925348.b3lyp_6-31g(d).firefly.inp (generated)

000925348.b3lyp_6-31g(d).smash.inp (generated)

000925348.b3lyp_6-31g(d).nwchem.inp (generated) 000925348.b3lyp_6-31g(d).log.xz 000925348.td-b3lyp_6-31g+(d).inp 000925348.td-b3lyp_6-31g+(d).log.xz

000925348.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925348.td-b3lyp_6-31+g(d).gjf (generated)

000925348.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925348.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925348.mol 000925348.PUBCHEM 000925348.mol (via Jmol)
000925354.b3lyp_6-31g(d).inp

000925354.b3lyp_6-31g(d).qchem.inp (generated)

000925354.b3lyp_6-31g(d).gjf (generated)

000925354.b3lyp_6-31g(d).firefly.inp (generated)

000925354.b3lyp_6-31g(d).smash.inp (generated)

000925354.b3lyp_6-31g(d).nwchem.inp (generated) 000925354.b3lyp_6-31g(d).log.xz 000925354.td-b3lyp_6-31g+(d).inp 000925354.td-b3lyp_6-31g+(d).log.xz

000925354.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925354.td-b3lyp_6-31+g(d).gjf (generated)

000925354.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925354.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925354.mol 000925354.PUBCHEM 000925354.mol (via Jmol)
000925355.b3lyp_6-31g(d).inp

000925355.b3lyp_6-31g(d).qchem.inp (generated)

000925355.b3lyp_6-31g(d).gjf (generated)

000925355.b3lyp_6-31g(d).firefly.inp (generated)

000925355.b3lyp_6-31g(d).smash.inp (generated)

000925355.b3lyp_6-31g(d).nwchem.inp (generated) 000925355.b3lyp_6-31g(d).log.xz 000925355.mol 000925355.PUBCHEM 000925355.mol (via Jmol)
000925357.b3lyp_6-31g(d).inp

000925357.b3lyp_6-31g(d).qchem.inp (generated)

000925357.b3lyp_6-31g(d).gjf (generated)

000925357.b3lyp_6-31g(d).firefly.inp (generated)

000925357.b3lyp_6-31g(d).smash.inp (generated)

000925357.b3lyp_6-31g(d).nwchem.inp (generated) 000925357.b3lyp_6-31g(d).log.xz 000925357.td-b3lyp_6-31g+(d).inp 000925357.td-b3lyp_6-31g+(d).log.xz

000925357.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925357.td-b3lyp_6-31+g(d).gjf (generated)

000925357.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925357.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925357.mol 000925357.PUBCHEM 000925357.mol (via Jmol)
000925378.b3lyp_6-31g(d).inp

000925378.b3lyp_6-31g(d).qchem.inp (generated)

000925378.b3lyp_6-31g(d).gjf (generated)

000925378.b3lyp_6-31g(d).firefly.inp (generated)

000925378.b3lyp_6-31g(d).smash.inp (generated)

000925378.b3lyp_6-31g(d).nwchem.inp (generated) 000925378.b3lyp_6-31g(d).log.xz 000925378.td-b3lyp_6-31g+(d).inp 000925378.td-b3lyp_6-31g+(d).log.xz

000925378.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925378.td-b3lyp_6-31+g(d).gjf (generated)

000925378.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925378.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925378.mol 000925378.PUBCHEM 000925378.mol (via Jmol)
000925379.b3lyp_6-31g(d).inp

000925379.b3lyp_6-31g(d).qchem.inp (generated)

000925379.b3lyp_6-31g(d).gjf (generated)

000925379.b3lyp_6-31g(d).firefly.inp (generated)

000925379.b3lyp_6-31g(d).smash.inp (generated)

000925379.b3lyp_6-31g(d).nwchem.inp (generated) 000925379.b3lyp_6-31g(d).log.xz 000925379.td-b3lyp_6-31g+(d).inp 000925379.td-b3lyp_6-31g+(d).log.xz

000925379.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925379.td-b3lyp_6-31+g(d).gjf (generated)

000925379.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925379.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925379.mol 000925379.PUBCHEM 000925379.mol (via Jmol)
000925381.b3lyp_6-31g(d).inp

000925381.b3lyp_6-31g(d).qchem.inp (generated)

000925381.b3lyp_6-31g(d).gjf (generated)

000925381.b3lyp_6-31g(d).firefly.inp (generated)

000925381.b3lyp_6-31g(d).smash.inp (generated)

000925381.b3lyp_6-31g(d).nwchem.inp (generated) 000925381.b3lyp_6-31g(d).log.xz 000925381.td-b3lyp_6-31g+(d).inp 000925381.td-b3lyp_6-31g+(d).log.xz

000925381.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925381.td-b3lyp_6-31+g(d).gjf (generated)

000925381.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925381.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925381.mol 000925381.PUBCHEM 000925381.mol (via Jmol)
000925387.b3lyp_6-31g(d).inp

000925387.b3lyp_6-31g(d).qchem.inp (generated)

000925387.b3lyp_6-31g(d).gjf (generated)

000925387.b3lyp_6-31g(d).firefly.inp (generated)

000925387.b3lyp_6-31g(d).smash.inp (generated)

000925387.b3lyp_6-31g(d).nwchem.inp (generated) 000925387.b3lyp_6-31g(d).log.xz 000925387.td-b3lyp_6-31g+(d).inp 000925387.td-b3lyp_6-31g+(d).log.xz

000925387.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925387.td-b3lyp_6-31+g(d).gjf (generated)

000925387.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925387.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925387.mol 000925387.PUBCHEM 000925387.mol (via Jmol)
000925388.b3lyp_6-31g(d).inp

000925388.b3lyp_6-31g(d).qchem.inp (generated)

000925388.b3lyp_6-31g(d).gjf (generated)

000925388.b3lyp_6-31g(d).firefly.inp (generated)

000925388.b3lyp_6-31g(d).smash.inp (generated)

000925388.b3lyp_6-31g(d).nwchem.inp (generated) 000925388.b3lyp_6-31g(d).log.xz 000925388.mol 000925388.PUBCHEM 000925388.mol (via Jmol)
000925390.b3lyp_6-31g(d).inp

000925390.b3lyp_6-31g(d).qchem.inp (generated)

000925390.b3lyp_6-31g(d).gjf (generated)

000925390.b3lyp_6-31g(d).firefly.inp (generated)

000925390.b3lyp_6-31g(d).smash.inp (generated)

000925390.b3lyp_6-31g(d).nwchem.inp (generated) 000925390.b3lyp_6-31g(d).log.xz 000925390.td-b3lyp_6-31g+(d).inp 000925390.td-b3lyp_6-31g+(d).log.xz

000925390.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925390.td-b3lyp_6-31+g(d).gjf (generated)

000925390.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925390.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925390.mol 000925390.PUBCHEM 000925390.mol (via Jmol)
000925391.b3lyp_6-31g(d).inp

000925391.b3lyp_6-31g(d).qchem.inp (generated)

000925391.b3lyp_6-31g(d).gjf (generated)

000925391.b3lyp_6-31g(d).firefly.inp (generated)

000925391.b3lyp_6-31g(d).smash.inp (generated)

000925391.b3lyp_6-31g(d).nwchem.inp (generated) 000925391.b3lyp_6-31g(d).log.xz 000925391.td-b3lyp_6-31g+(d).inp 000925391.td-b3lyp_6-31g+(d).log.xz

000925391.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925391.td-b3lyp_6-31+g(d).gjf (generated)

000925391.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925391.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925391.mol 000925391.PUBCHEM 000925391.mol (via Jmol)
000925426.b3lyp_6-31g(d).inp

000925426.b3lyp_6-31g(d).qchem.inp (generated)

000925426.b3lyp_6-31g(d).gjf (generated)

000925426.b3lyp_6-31g(d).firefly.inp (generated)

000925426.b3lyp_6-31g(d).smash.inp (generated)

000925426.b3lyp_6-31g(d).nwchem.inp (generated) 000925426.b3lyp_6-31g(d).log.xz 000925426.td-b3lyp_6-31g+(d).inp 000925426.td-b3lyp_6-31g+(d).log.xz

000925426.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925426.td-b3lyp_6-31+g(d).gjf (generated)

000925426.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925426.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925426.mol 000925426.PUBCHEM 000925426.mol (via Jmol)
000925427.b3lyp_6-31g(d).inp

000925427.b3lyp_6-31g(d).qchem.inp (generated)

000925427.b3lyp_6-31g(d).gjf (generated)

000925427.b3lyp_6-31g(d).firefly.inp (generated)

000925427.b3lyp_6-31g(d).smash.inp (generated)

000925427.b3lyp_6-31g(d).nwchem.inp (generated) 000925427.b3lyp_6-31g(d).log.xz 000925427.td-b3lyp_6-31g+(d).inp 000925427.td-b3lyp_6-31g+(d).log.xz

000925427.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925427.td-b3lyp_6-31+g(d).gjf (generated)

000925427.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925427.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925427.mol 000925427.PUBCHEM 000925427.mol (via Jmol)
000925429.b3lyp_6-31g(d).inp

000925429.b3lyp_6-31g(d).qchem.inp (generated)

000925429.b3lyp_6-31g(d).gjf (generated)

000925429.b3lyp_6-31g(d).firefly.inp (generated)

000925429.b3lyp_6-31g(d).smash.inp (generated)

000925429.b3lyp_6-31g(d).nwchem.inp (generated) 000925429.b3lyp_6-31g(d).log.xz 000925429.td-b3lyp_6-31g+(d).inp 000925429.td-b3lyp_6-31g+(d).log.xz

000925429.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925429.td-b3lyp_6-31+g(d).gjf (generated)

000925429.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925429.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925429.mol 000925429.PUBCHEM 000925429.mol (via Jmol)
000925432.b3lyp_6-31g(d).inp

000925432.b3lyp_6-31g(d).qchem.inp (generated)

000925432.b3lyp_6-31g(d).gjf (generated)

000925432.b3lyp_6-31g(d).firefly.inp (generated)

000925432.b3lyp_6-31g(d).smash.inp (generated)

000925432.b3lyp_6-31g(d).nwchem.inp (generated) 000925432.b3lyp_6-31g(d).log.xz 000925432.td-b3lyp_6-31g+(d).inp 000925432.td-b3lyp_6-31g+(d).log.xz

000925432.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925432.td-b3lyp_6-31+g(d).gjf (generated)

000925432.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925432.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925432.mol 000925432.PUBCHEM 000925432.mol (via Jmol)
000925433.b3lyp_6-31g(d).inp

000925433.b3lyp_6-31g(d).qchem.inp (generated)

000925433.b3lyp_6-31g(d).gjf (generated)

000925433.b3lyp_6-31g(d).firefly.inp (generated)

000925433.b3lyp_6-31g(d).smash.inp (generated)

000925433.b3lyp_6-31g(d).nwchem.inp (generated) 000925433.b3lyp_6-31g(d).log.xz 000925433.td-b3lyp_6-31g+(d).inp 000925433.td-b3lyp_6-31g+(d).log.xz

000925433.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925433.td-b3lyp_6-31+g(d).gjf (generated)

000925433.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925433.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925433.mol 000925433.PUBCHEM 000925433.mol (via Jmol)
000925438.b3lyp_6-31g(d).inp

000925438.b3lyp_6-31g(d).qchem.inp (generated)

000925438.b3lyp_6-31g(d).gjf (generated)

000925438.b3lyp_6-31g(d).firefly.inp (generated)

000925438.b3lyp_6-31g(d).smash.inp (generated)

000925438.b3lyp_6-31g(d).nwchem.inp (generated) 000925438.b3lyp_6-31g(d).log.xz 000925438.mol 000925438.PUBCHEM 000925438.mol (via Jmol)
000925443.b3lyp_6-31g(d).inp

000925443.b3lyp_6-31g(d).qchem.inp (generated)

000925443.b3lyp_6-31g(d).gjf (generated)

000925443.b3lyp_6-31g(d).firefly.inp (generated)

000925443.b3lyp_6-31g(d).smash.inp (generated)

000925443.b3lyp_6-31g(d).nwchem.inp (generated) 000925443.b3lyp_6-31g(d).log.xz 000925443.mol 000925443.PUBCHEM 000925443.mol (via Jmol)
000925458.b3lyp_6-31g(d).inp

000925458.b3lyp_6-31g(d).qchem.inp (generated)

000925458.b3lyp_6-31g(d).gjf (generated)

000925458.b3lyp_6-31g(d).firefly.inp (generated)

000925458.b3lyp_6-31g(d).smash.inp (generated)

000925458.b3lyp_6-31g(d).nwchem.inp (generated) 000925458.b3lyp_6-31g(d).log.xz 000925458.td-b3lyp_6-31g+(d).inp 000925458.td-b3lyp_6-31g+(d).log.xz

000925458.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925458.td-b3lyp_6-31+g(d).gjf (generated)

000925458.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925458.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925458.mol 000925458.PUBCHEM 000925458.mol (via Jmol)
000925459.b3lyp_6-31g(d).inp

000925459.b3lyp_6-31g(d).qchem.inp (generated)

000925459.b3lyp_6-31g(d).gjf (generated)

000925459.b3lyp_6-31g(d).firefly.inp (generated)

000925459.b3lyp_6-31g(d).smash.inp (generated)

000925459.b3lyp_6-31g(d).nwchem.inp (generated) 000925459.b3lyp_6-31g(d).log.xz 000925459.td-b3lyp_6-31g+(d).inp 000925459.td-b3lyp_6-31g+(d).log.xz

000925459.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925459.td-b3lyp_6-31+g(d).gjf (generated)

000925459.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925459.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925459.mol 000925459.PUBCHEM 000925459.mol (via Jmol)
000925460.b3lyp_6-31g(d).inp

000925460.b3lyp_6-31g(d).qchem.inp (generated)

000925460.b3lyp_6-31g(d).gjf (generated)

000925460.b3lyp_6-31g(d).firefly.inp (generated)

000925460.b3lyp_6-31g(d).smash.inp (generated)

000925460.b3lyp_6-31g(d).nwchem.inp (generated) 000925460.b3lyp_6-31g(d).log.xz 000925460.mol 000925460.PUBCHEM 000925460.mol (via Jmol)
000925461.b3lyp_6-31g(d).inp

000925461.b3lyp_6-31g(d).qchem.inp (generated)

000925461.b3lyp_6-31g(d).gjf (generated)

000925461.b3lyp_6-31g(d).firefly.inp (generated)

000925461.b3lyp_6-31g(d).smash.inp (generated)

000925461.b3lyp_6-31g(d).nwchem.inp (generated) 000925461.b3lyp_6-31g(d).log.xz 000925461.td-b3lyp_6-31g+(d).inp 000925461.td-b3lyp_6-31g+(d).log.xz

000925461.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925461.td-b3lyp_6-31+g(d).gjf (generated)

000925461.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925461.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925461.mol 000925461.PUBCHEM 000925461.mol (via Jmol)
000925462.b3lyp_6-31g(d).inp

000925462.b3lyp_6-31g(d).qchem.inp (generated)

000925462.b3lyp_6-31g(d).gjf (generated)

000925462.b3lyp_6-31g(d).firefly.inp (generated)

000925462.b3lyp_6-31g(d).smash.inp (generated)

000925462.b3lyp_6-31g(d).nwchem.inp (generated) 000925462.b3lyp_6-31g(d).log.xz 000925462.td-b3lyp_6-31g+(d).inp 000925462.td-b3lyp_6-31g+(d).log.xz

000925462.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925462.td-b3lyp_6-31+g(d).gjf (generated)

000925462.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925462.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925462.mol 000925462.PUBCHEM 000925462.mol (via Jmol)
000925463.b3lyp_6-31g(d).inp

000925463.b3lyp_6-31g(d).qchem.inp (generated)

000925463.b3lyp_6-31g(d).gjf (generated)

000925463.b3lyp_6-31g(d).firefly.inp (generated)

000925463.b3lyp_6-31g(d).smash.inp (generated)

000925463.b3lyp_6-31g(d).nwchem.inp (generated) 000925463.b3lyp_6-31g(d).log.xz 000925463.mol 000925463.PUBCHEM 000925463.mol (via Jmol)
000925473.b3lyp_6-31g(d).inp

000925473.b3lyp_6-31g(d).qchem.inp (generated)

000925473.b3lyp_6-31g(d).gjf (generated)

000925473.b3lyp_6-31g(d).firefly.inp (generated)

000925473.b3lyp_6-31g(d).smash.inp (generated)

000925473.b3lyp_6-31g(d).nwchem.inp (generated) 000925473.b3lyp_6-31g(d).log.xz 000925473.mol 000925473.PUBCHEM 000925473.mol (via Jmol)
000925481.b3lyp_6-31g(d).inp

000925481.b3lyp_6-31g(d).qchem.inp (generated)

000925481.b3lyp_6-31g(d).gjf (generated)

000925481.b3lyp_6-31g(d).firefly.inp (generated)

000925481.b3lyp_6-31g(d).smash.inp (generated)

000925481.b3lyp_6-31g(d).nwchem.inp (generated) 000925481.b3lyp_6-31g(d).log.xz 000925481.td-b3lyp_6-31g+(d).inp 000925481.td-b3lyp_6-31g+(d).log.xz

000925481.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925481.td-b3lyp_6-31+g(d).gjf (generated)

000925481.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925481.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925481.mol 000925481.PUBCHEM 000925481.mol (via Jmol)
000925484.b3lyp_6-31g(d).inp

000925484.b3lyp_6-31g(d).qchem.inp (generated)

000925484.b3lyp_6-31g(d).gjf (generated)

000925484.b3lyp_6-31g(d).firefly.inp (generated)

000925484.b3lyp_6-31g(d).smash.inp (generated)

000925484.b3lyp_6-31g(d).nwchem.inp (generated) 000925484.b3lyp_6-31g(d).log.xz 000925484.td-b3lyp_6-31g+(d).inp 000925484.td-b3lyp_6-31g+(d).log.xz

000925484.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925484.td-b3lyp_6-31+g(d).gjf (generated)

000925484.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925484.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925484.mol 000925484.PUBCHEM 000925484.mol (via Jmol)
000925499.b3lyp_6-31g(d).inp

000925499.b3lyp_6-31g(d).qchem.inp (generated)

000925499.b3lyp_6-31g(d).gjf (generated)

000925499.b3lyp_6-31g(d).firefly.inp (generated)

000925499.b3lyp_6-31g(d).smash.inp (generated)

000925499.b3lyp_6-31g(d).nwchem.inp (generated) 000925499.b3lyp_6-31g(d).log.xz 000925499.td-b3lyp_6-31g+(d).inp 000925499.td-b3lyp_6-31g+(d).log.xz

000925499.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925499.td-b3lyp_6-31+g(d).gjf (generated)

000925499.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925499.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925499.mol 000925499.PUBCHEM 000925499.mol (via Jmol)
000925503.b3lyp_6-31g(d).inp

000925503.b3lyp_6-31g(d).qchem.inp (generated)

000925503.b3lyp_6-31g(d).gjf (generated)

000925503.b3lyp_6-31g(d).firefly.inp (generated)

000925503.b3lyp_6-31g(d).smash.inp (generated)

000925503.b3lyp_6-31g(d).nwchem.inp (generated) 000925503.b3lyp_6-31g(d).log.xz 000925503.mol 000925503.PUBCHEM 000925503.mol (via Jmol)
000925508.b3lyp_6-31g(d).inp

000925508.b3lyp_6-31g(d).qchem.inp (generated)

000925508.b3lyp_6-31g(d).gjf (generated)

000925508.b3lyp_6-31g(d).firefly.inp (generated)

000925508.b3lyp_6-31g(d).smash.inp (generated)

000925508.b3lyp_6-31g(d).nwchem.inp (generated) 000925508.b3lyp_6-31g(d).log.xz 000925508.mol 000925508.PUBCHEM 000925508.mol (via Jmol)
000925510.b3lyp_6-31g(d).inp

000925510.b3lyp_6-31g(d).qchem.inp (generated)

000925510.b3lyp_6-31g(d).gjf (generated)

000925510.b3lyp_6-31g(d).firefly.inp (generated)

000925510.b3lyp_6-31g(d).smash.inp (generated)

000925510.b3lyp_6-31g(d).nwchem.inp (generated) 000925510.b3lyp_6-31g(d).log.xz 000925510.td-b3lyp_6-31g+(d).inp 000925510.td-b3lyp_6-31g+(d).log.xz

000925510.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925510.td-b3lyp_6-31+g(d).gjf (generated)

000925510.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925510.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925510.mol 000925510.PUBCHEM 000925510.mol (via Jmol)
000925512.b3lyp_6-31g(d).inp

000925512.b3lyp_6-31g(d).qchem.inp (generated)

000925512.b3lyp_6-31g(d).gjf (generated)

000925512.b3lyp_6-31g(d).firefly.inp (generated)

000925512.b3lyp_6-31g(d).smash.inp (generated)

000925512.b3lyp_6-31g(d).nwchem.inp (generated) 000925512.b3lyp_6-31g(d).log.xz 000925512.td-b3lyp_6-31g+(d).inp 000925512.td-b3lyp_6-31g+(d).log.xz

000925512.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925512.td-b3lyp_6-31+g(d).gjf (generated)

000925512.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925512.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925512.mol 000925512.PUBCHEM 000925512.mol (via Jmol)
000925607.b3lyp_6-31g(d).inp

000925607.b3lyp_6-31g(d).qchem.inp (generated)

000925607.b3lyp_6-31g(d).gjf (generated)

000925607.b3lyp_6-31g(d).firefly.inp (generated)

000925607.b3lyp_6-31g(d).smash.inp (generated)

000925607.b3lyp_6-31g(d).nwchem.inp (generated) 000925607.b3lyp_6-31g(d).log.xz 000925607.td-b3lyp_6-31g+(d).inp 000925607.td-b3lyp_6-31g+(d).log.xz

000925607.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925607.td-b3lyp_6-31+g(d).gjf (generated)

000925607.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925607.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925607.mol 000925607.PUBCHEM 000925607.mol (via Jmol)
000925640.b3lyp_6-31g(d).inp

000925640.b3lyp_6-31g(d).qchem.inp (generated)

000925640.b3lyp_6-31g(d).gjf (generated)

000925640.b3lyp_6-31g(d).firefly.inp (generated)

000925640.b3lyp_6-31g(d).smash.inp (generated)

000925640.b3lyp_6-31g(d).nwchem.inp (generated) 000925640.b3lyp_6-31g(d).log.xz 000925640.td-b3lyp_6-31g+(d).inp 000925640.td-b3lyp_6-31g+(d).log.xz

000925640.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925640.td-b3lyp_6-31+g(d).gjf (generated)

000925640.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925640.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925640.mol 000925640.PUBCHEM 000925640.mol (via Jmol)
000925641.b3lyp_6-31g(d).inp

000925641.b3lyp_6-31g(d).qchem.inp (generated)

000925641.b3lyp_6-31g(d).gjf (generated)

000925641.b3lyp_6-31g(d).firefly.inp (generated)

000925641.b3lyp_6-31g(d).smash.inp (generated)

000925641.b3lyp_6-31g(d).nwchem.inp (generated) 000925641.b3lyp_6-31g(d).log.xz 000925641.td-b3lyp_6-31g+(d).inp 000925641.td-b3lyp_6-31g+(d).log.xz

000925641.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925641.td-b3lyp_6-31+g(d).gjf (generated)

000925641.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925641.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925641.mol 000925641.PUBCHEM 000925641.mol (via Jmol)
000925642.b3lyp_6-31g(d).inp

000925642.b3lyp_6-31g(d).qchem.inp (generated)

000925642.b3lyp_6-31g(d).gjf (generated)

000925642.b3lyp_6-31g(d).firefly.inp (generated)

000925642.b3lyp_6-31g(d).smash.inp (generated)

000925642.b3lyp_6-31g(d).nwchem.inp (generated) 000925642.b3lyp_6-31g(d).log.xz 000925642.td-b3lyp_6-31g+(d).inp 000925642.td-b3lyp_6-31g+(d).log.xz

000925642.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925642.td-b3lyp_6-31+g(d).gjf (generated)

000925642.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925642.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925642.mol 000925642.PUBCHEM 000925642.mol (via Jmol)
000925645.b3lyp_6-31g(d).inp

000925645.b3lyp_6-31g(d).qchem.inp (generated)

000925645.b3lyp_6-31g(d).gjf (generated)

000925645.b3lyp_6-31g(d).firefly.inp (generated)

000925645.b3lyp_6-31g(d).smash.inp (generated)

000925645.b3lyp_6-31g(d).nwchem.inp (generated) 000925645.b3lyp_6-31g(d).log.xz 000925645.td-b3lyp_6-31g+(d).inp 000925645.td-b3lyp_6-31g+(d).log.xz

000925645.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925645.td-b3lyp_6-31+g(d).gjf (generated)

000925645.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925645.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925645.mol 000925645.PUBCHEM 000925645.mol (via Jmol)
000925646.b3lyp_6-31g(d).inp

000925646.b3lyp_6-31g(d).qchem.inp (generated)

000925646.b3lyp_6-31g(d).gjf (generated)

000925646.b3lyp_6-31g(d).firefly.inp (generated)

000925646.b3lyp_6-31g(d).smash.inp (generated)

000925646.b3lyp_6-31g(d).nwchem.inp (generated) 000925646.b3lyp_6-31g(d).log.xz 000925646.td-b3lyp_6-31g+(d).inp 000925646.td-b3lyp_6-31g+(d).log.xz

000925646.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925646.td-b3lyp_6-31+g(d).gjf (generated)

000925646.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925646.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925646.mol 000925646.PUBCHEM 000925646.mol (via Jmol)
000925648.b3lyp_6-31g(d).inp

000925648.b3lyp_6-31g(d).qchem.inp (generated)

000925648.b3lyp_6-31g(d).gjf (generated)

000925648.b3lyp_6-31g(d).firefly.inp (generated)

000925648.b3lyp_6-31g(d).smash.inp (generated)

000925648.b3lyp_6-31g(d).nwchem.inp (generated) 000925648.b3lyp_6-31g(d).log.xz 000925648.mol 000925648.PUBCHEM 000925648.mol (via Jmol)
000925651.b3lyp_6-31g(d).inp

000925651.b3lyp_6-31g(d).qchem.inp (generated)

000925651.b3lyp_6-31g(d).gjf (generated)

000925651.b3lyp_6-31g(d).firefly.inp (generated)

000925651.b3lyp_6-31g(d).smash.inp (generated)

000925651.b3lyp_6-31g(d).nwchem.inp (generated) 000925651.b3lyp_6-31g(d).log.xz 000925651.td-b3lyp_6-31g+(d).inp 000925651.td-b3lyp_6-31g+(d).log.xz

000925651.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925651.td-b3lyp_6-31+g(d).gjf (generated)

000925651.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925651.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925651.mol 000925651.PUBCHEM 000925651.mol (via Jmol)
000925655.b3lyp_6-31g(d).inp

000925655.b3lyp_6-31g(d).qchem.inp (generated)

000925655.b3lyp_6-31g(d).gjf (generated)

000925655.b3lyp_6-31g(d).firefly.inp (generated)

000925655.b3lyp_6-31g(d).smash.inp (generated)

000925655.b3lyp_6-31g(d).nwchem.inp (generated) 000925655.b3lyp_6-31g(d).log.xz 000925655.td-b3lyp_6-31g+(d).inp 000925655.td-b3lyp_6-31g+(d).log.xz

000925655.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925655.td-b3lyp_6-31+g(d).gjf (generated)

000925655.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925655.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925655.mol 000925655.PUBCHEM 000925655.mol (via Jmol)
000925660.b3lyp_6-31g(d).inp

000925660.b3lyp_6-31g(d).qchem.inp (generated)

000925660.b3lyp_6-31g(d).gjf (generated)

000925660.b3lyp_6-31g(d).firefly.inp (generated)

000925660.b3lyp_6-31g(d).smash.inp (generated)

000925660.b3lyp_6-31g(d).nwchem.inp (generated) 000925660.b3lyp_6-31g(d).log.xz 000925660.td-b3lyp_6-31g+(d).inp 000925660.td-b3lyp_6-31g+(d).log.xz

000925660.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925660.td-b3lyp_6-31+g(d).gjf (generated)

000925660.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925660.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925660.mol 000925660.PUBCHEM 000925660.mol (via Jmol)
000925704.b3lyp_6-31g(d).inp

000925704.b3lyp_6-31g(d).qchem.inp (generated)

000925704.b3lyp_6-31g(d).gjf (generated)

000925704.b3lyp_6-31g(d).firefly.inp (generated)

000925704.b3lyp_6-31g(d).smash.inp (generated)

000925704.b3lyp_6-31g(d).nwchem.inp (generated) 000925704.b3lyp_6-31g(d).log.xz 000925704.td-b3lyp_6-31g+(d).inp 000925704.td-b3lyp_6-31g+(d).log.xz

000925704.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925704.td-b3lyp_6-31+g(d).gjf (generated)

000925704.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925704.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925704.mol 000925704.PUBCHEM 000925704.mol (via Jmol)
000925933.b3lyp_6-31g(d).inp

000925933.b3lyp_6-31g(d).qchem.inp (generated)

000925933.b3lyp_6-31g(d).gjf (generated)

000925933.b3lyp_6-31g(d).firefly.inp (generated)

000925933.b3lyp_6-31g(d).smash.inp (generated)

000925933.b3lyp_6-31g(d).nwchem.inp (generated) 000925933.b3lyp_6-31g(d).log.xz 000925933.td-b3lyp_6-31g+(d).inp 000925933.td-b3lyp_6-31g+(d).log.xz

000925933.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925933.td-b3lyp_6-31+g(d).gjf (generated)

000925933.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925933.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925933.mol 000925933.PUBCHEM 000925933.mol (via Jmol)
000925973.b3lyp_6-31g(d).inp

000925973.b3lyp_6-31g(d).qchem.inp (generated)

000925973.b3lyp_6-31g(d).gjf (generated)

000925973.b3lyp_6-31g(d).firefly.inp (generated)

000925973.b3lyp_6-31g(d).smash.inp (generated)

000925973.b3lyp_6-31g(d).nwchem.inp (generated) 000925973.b3lyp_6-31g(d).log.xz 000925973.td-b3lyp_6-31g+(d).inp 000925973.td-b3lyp_6-31g+(d).log.xz

000925973.td-b3lyp_6-31+g(d).qchem.inp (generated)

000925973.td-b3lyp_6-31+g(d).gjf (generated)

000925973.td-b3lyp_6-31+g(d).firefly.inp (generated)

000925973.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000925973.mol 000925973.PUBCHEM 000925973.mol (via Jmol)
000926119.b3lyp_6-31g(d).inp

000926119.b3lyp_6-31g(d).qchem.inp (generated)

000926119.b3lyp_6-31g(d).gjf (generated)

000926119.b3lyp_6-31g(d).firefly.inp (generated)

000926119.b3lyp_6-31g(d).smash.inp (generated)

000926119.b3lyp_6-31g(d).nwchem.inp (generated) 000926119.b3lyp_6-31g(d).log.xz 000926119.td-b3lyp_6-31g+(d).inp 000926119.td-b3lyp_6-31g+(d).log.xz

000926119.td-b3lyp_6-31+g(d).qchem.inp (generated)

000926119.td-b3lyp_6-31+g(d).gjf (generated)

000926119.td-b3lyp_6-31+g(d).firefly.inp (generated)

000926119.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000926119.mol 000926119.PUBCHEM 000926119.mol (via Jmol)
000926121.b3lyp_6-31g(d).inp

000926121.b3lyp_6-31g(d).qchem.inp (generated)

000926121.b3lyp_6-31g(d).gjf (generated)

000926121.b3lyp_6-31g(d).firefly.inp (generated)

000926121.b3lyp_6-31g(d).smash.inp (generated)

000926121.b3lyp_6-31g(d).nwchem.inp (generated) 000926121.b3lyp_6-31g(d).log.xz 000926121.mol 000926121.PUBCHEM 000926121.mol (via Jmol)
000926141.b3lyp_6-31g(d).inp

000926141.b3lyp_6-31g(d).qchem.inp (generated)

000926141.b3lyp_6-31g(d).gjf (generated)

000926141.b3lyp_6-31g(d).firefly.inp (generated)

000926141.b3lyp_6-31g(d).smash.inp (generated)

000926141.b3lyp_6-31g(d).nwchem.inp (generated) 000926141.b3lyp_6-31g(d).log.xz 000926141.td-b3lyp_6-31g+(d).inp 000926141.td-b3lyp_6-31g+(d).log.xz

000926141.td-b3lyp_6-31+g(d).qchem.inp (generated)

000926141.td-b3lyp_6-31+g(d).gjf (generated)

000926141.td-b3lyp_6-31+g(d).firefly.inp (generated)

000926141.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000926141.mol 000926141.PUBCHEM 000926141.mol (via Jmol)
000926142.b3lyp_6-31g(d).inp

000926142.b3lyp_6-31g(d).qchem.inp (generated)

000926142.b3lyp_6-31g(d).gjf (generated)

000926142.b3lyp_6-31g(d).firefly.inp (generated)

000926142.b3lyp_6-31g(d).smash.inp (generated)

000926142.b3lyp_6-31g(d).nwchem.inp (generated) 000926142.b3lyp_6-31g(d).log.xz 000926142.mol 000926142.PUBCHEM 000926142.mol (via Jmol)
000926143.b3lyp_6-31g(d).inp

000926143.b3lyp_6-31g(d).qchem.inp (generated)

000926143.b3lyp_6-31g(d).gjf (generated)

000926143.b3lyp_6-31g(d).firefly.inp (generated)

000926143.b3lyp_6-31g(d).smash.inp (generated)

000926143.b3lyp_6-31g(d).nwchem.inp (generated) 000926143.b3lyp_6-31g(d).log.xz 000926143.td-b3lyp_6-31g+(d).inp 000926143.td-b3lyp_6-31g+(d).log.xz

000926143.td-b3lyp_6-31+g(d).qchem.inp (generated)

000926143.td-b3lyp_6-31+g(d).gjf (generated)

000926143.td-b3lyp_6-31+g(d).firefly.inp (generated)

000926143.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000926143.mol 000926143.PUBCHEM 000926143.mol (via Jmol)
000926144.b3lyp_6-31g(d).inp

000926144.b3lyp_6-31g(d).qchem.inp (generated)

000926144.b3lyp_6-31g(d).gjf (generated)

000926144.b3lyp_6-31g(d).firefly.inp (generated)

000926144.b3lyp_6-31g(d).smash.inp (generated)

000926144.b3lyp_6-31g(d).nwchem.inp (generated) 000926144.b3lyp_6-31g(d).log.xz 000926144.td-b3lyp_6-31g+(d).inp 000926144.td-b3lyp_6-31g+(d).log.xz

000926144.td-b3lyp_6-31+g(d).qchem.inp (generated)

000926144.td-b3lyp_6-31+g(d).gjf (generated)

000926144.td-b3lyp_6-31+g(d).firefly.inp (generated)

000926144.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000926144.mol 000926144.PUBCHEM 000926144.mol (via Jmol)
000926145.b3lyp_6-31g(d).inp

000926145.b3lyp_6-31g(d).qchem.inp (generated)

000926145.b3lyp_6-31g(d).gjf (generated)

000926145.b3lyp_6-31g(d).firefly.inp (generated)

000926145.b3lyp_6-31g(d).smash.inp (generated)

000926145.b3lyp_6-31g(d).nwchem.inp (generated) 000926145.b3lyp_6-31g(d).log.xz 000926145.td-b3lyp_6-31g+(d).inp 000926145.td-b3lyp_6-31g+(d).log.xz

000926145.td-b3lyp_6-31+g(d).qchem.inp (generated)

000926145.td-b3lyp_6-31+g(d).gjf (generated)

000926145.td-b3lyp_6-31+g(d).firefly.inp (generated)

000926145.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000926145.mol 000926145.PUBCHEM 000926145.mol (via Jmol)
000926170.b3lyp_6-31g(d).inp

000926170.b3lyp_6-31g(d).qchem.inp (generated)

000926170.b3lyp_6-31g(d).gjf (generated)

000926170.b3lyp_6-31g(d).firefly.inp (generated)

000926170.b3lyp_6-31g(d).smash.inp (generated)

000926170.b3lyp_6-31g(d).nwchem.inp (generated) 000926170.b3lyp_6-31g(d).log.xz 000926170.mol 000926170.PUBCHEM 000926170.mol (via Jmol)
000926173.b3lyp_6-31g(d).inp

000926173.b3lyp_6-31g(d).qchem.inp (generated)

000926173.b3lyp_6-31g(d).gjf (generated)

000926173.b3lyp_6-31g(d).firefly.inp (generated)

000926173.b3lyp_6-31g(d).smash.inp (generated)

000926173.b3lyp_6-31g(d).nwchem.inp (generated) 000926173.b3lyp_6-31g(d).log.xz 000926173.td-b3lyp_6-31g+(d).inp 000926173.td-b3lyp_6-31g+(d).log.xz

000926173.td-b3lyp_6-31+g(d).qchem.inp (generated)

000926173.td-b3lyp_6-31+g(d).gjf (generated)

000926173.td-b3lyp_6-31+g(d).firefly.inp (generated)

000926173.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000926173.mol 000926173.PUBCHEM 000926173.mol (via Jmol)
000926858.b3lyp_6-31g(d).inp

000926858.b3lyp_6-31g(d).qchem.inp (generated)

000926858.b3lyp_6-31g(d).gjf (generated)

000926858.b3lyp_6-31g(d).firefly.inp (generated)

000926858.b3lyp_6-31g(d).smash.inp (generated)

000926858.b3lyp_6-31g(d).nwchem.inp (generated) 000926858.b3lyp_6-31g(d).log.xz 000926858.td-b3lyp_6-31g+(d).inp 000926858.td-b3lyp_6-31g+(d).log.xz

000926858.td-b3lyp_6-31+g(d).qchem.inp (generated)

000926858.td-b3lyp_6-31+g(d).gjf (generated)

000926858.td-b3lyp_6-31+g(d).firefly.inp (generated)

000926858.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000926858.mol 000926858.PUBCHEM 000926858.mol (via Jmol)
000926859.b3lyp_6-31g(d).inp

000926859.b3lyp_6-31g(d).qchem.inp (generated)

000926859.b3lyp_6-31g(d).gjf (generated)

000926859.b3lyp_6-31g(d).firefly.inp (generated)

000926859.b3lyp_6-31g(d).smash.inp (generated)

000926859.b3lyp_6-31g(d).nwchem.inp (generated) 000926859.b3lyp_6-31g(d).log.xz 000926859.td-b3lyp_6-31g+(d).inp 000926859.td-b3lyp_6-31g+(d).log.xz

000926859.td-b3lyp_6-31+g(d).qchem.inp (generated)

000926859.td-b3lyp_6-31+g(d).gjf (generated)

000926859.td-b3lyp_6-31+g(d).firefly.inp (generated)

000926859.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000926859.mol 000926859.PUBCHEM 000926859.mol (via Jmol)
000926867.b3lyp_6-31g(d).inp

000926867.b3lyp_6-31g(d).qchem.inp (generated)

000926867.b3lyp_6-31g(d).gjf (generated)

000926867.b3lyp_6-31g(d).firefly.inp (generated)

000926867.b3lyp_6-31g(d).smash.inp (generated)

000926867.b3lyp_6-31g(d).nwchem.inp (generated) 000926867.b3lyp_6-31g(d).log.xz 000926867.td-b3lyp_6-31g+(d).inp 000926867.td-b3lyp_6-31g+(d).log.xz

000926867.td-b3lyp_6-31+g(d).qchem.inp (generated)

000926867.td-b3lyp_6-31+g(d).gjf (generated)

000926867.td-b3lyp_6-31+g(d).firefly.inp (generated)

000926867.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000926867.mol 000926867.PUBCHEM 000926867.mol (via Jmol)
000926882.b3lyp_6-31g(d).inp

000926882.b3lyp_6-31g(d).qchem.inp (generated)

000926882.b3lyp_6-31g(d).gjf (generated)

000926882.b3lyp_6-31g(d).firefly.inp (generated)

000926882.b3lyp_6-31g(d).smash.inp (generated)

000926882.b3lyp_6-31g(d).nwchem.inp (generated) 000926882.b3lyp_6-31g(d).log.xz 000926882.td-b3lyp_6-31g+(d).inp 000926882.td-b3lyp_6-31g+(d).log.xz

000926882.td-b3lyp_6-31+g(d).qchem.inp (generated)

000926882.td-b3lyp_6-31+g(d).gjf (generated)

000926882.td-b3lyp_6-31+g(d).firefly.inp (generated)

000926882.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000926882.mol 000926882.PUBCHEM 000926882.mol (via Jmol)
000926885.b3lyp_6-31g(d).inp

000926885.b3lyp_6-31g(d).qchem.inp (generated)

000926885.b3lyp_6-31g(d).gjf (generated)

000926885.b3lyp_6-31g(d).firefly.inp (generated)

000926885.b3lyp_6-31g(d).smash.inp (generated)

000926885.b3lyp_6-31g(d).nwchem.inp (generated) 000926885.b3lyp_6-31g(d).log.xz 000926885.td-b3lyp_6-31g+(d).inp 000926885.td-b3lyp_6-31g+(d).log.xz

000926885.td-b3lyp_6-31+g(d).qchem.inp (generated)

000926885.td-b3lyp_6-31+g(d).gjf (generated)

000926885.td-b3lyp_6-31+g(d).firefly.inp (generated)

000926885.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000926885.mol 000926885.PUBCHEM 000926885.mol (via Jmol)
000927075.b3lyp_6-31g(d).inp

000927075.b3lyp_6-31g(d).qchem.inp (generated)

000927075.b3lyp_6-31g(d).gjf (generated)

000927075.b3lyp_6-31g(d).firefly.inp (generated)

000927075.b3lyp_6-31g(d).smash.inp (generated)

000927075.b3lyp_6-31g(d).nwchem.inp (generated) 000927075.b3lyp_6-31g(d).log.xz 000927075.td-b3lyp_6-31g+(d).inp 000927075.td-b3lyp_6-31g+(d).log.xz

000927075.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927075.td-b3lyp_6-31+g(d).gjf (generated)

000927075.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927075.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927075.mol 000927075.PUBCHEM 000927075.mol (via Jmol)
000927078.b3lyp_6-31g(d).inp

000927078.b3lyp_6-31g(d).qchem.inp (generated)

000927078.b3lyp_6-31g(d).gjf (generated)

000927078.b3lyp_6-31g(d).firefly.inp (generated)

000927078.b3lyp_6-31g(d).smash.inp (generated)

000927078.b3lyp_6-31g(d).nwchem.inp (generated) 000927078.b3lyp_6-31g(d).log.xz 000927078.td-b3lyp_6-31g+(d).inp 000927078.td-b3lyp_6-31g+(d).log.xz

000927078.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927078.td-b3lyp_6-31+g(d).gjf (generated)

000927078.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927078.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927078.mol 000927078.PUBCHEM 000927078.mol (via Jmol)
000927081.b3lyp_6-31g(d).inp

000927081.b3lyp_6-31g(d).qchem.inp (generated)

000927081.b3lyp_6-31g(d).gjf (generated)

000927081.b3lyp_6-31g(d).firefly.inp (generated)

000927081.b3lyp_6-31g(d).smash.inp (generated)

000927081.b3lyp_6-31g(d).nwchem.inp (generated) 000927081.b3lyp_6-31g(d).log.xz 000927081.td-b3lyp_6-31g+(d).inp 000927081.td-b3lyp_6-31g+(d).log.xz

000927081.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927081.td-b3lyp_6-31+g(d).gjf (generated)

000927081.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927081.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927081.mol 000927081.PUBCHEM 000927081.mol (via Jmol)
000927096.b3lyp_6-31g(d).inp

000927096.b3lyp_6-31g(d).qchem.inp (generated)

000927096.b3lyp_6-31g(d).gjf (generated)

000927096.b3lyp_6-31g(d).firefly.inp (generated)

000927096.b3lyp_6-31g(d).smash.inp (generated)

000927096.b3lyp_6-31g(d).nwchem.inp (generated) 000927096.b3lyp_6-31g(d).log.xz 000927096.td-b3lyp_6-31g+(d).inp 000927096.td-b3lyp_6-31g+(d).log.xz

000927096.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927096.td-b3lyp_6-31+g(d).gjf (generated)

000927096.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927096.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927096.mol 000927096.PUBCHEM 000927096.mol (via Jmol)
000927097.b3lyp_6-31g(d).inp

000927097.b3lyp_6-31g(d).qchem.inp (generated)

000927097.b3lyp_6-31g(d).gjf (generated)

000927097.b3lyp_6-31g(d).firefly.inp (generated)

000927097.b3lyp_6-31g(d).smash.inp (generated)

000927097.b3lyp_6-31g(d).nwchem.inp (generated) 000927097.b3lyp_6-31g(d).log.xz 000927097.td-b3lyp_6-31g+(d).inp 000927097.td-b3lyp_6-31g+(d).log.xz

000927097.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927097.td-b3lyp_6-31+g(d).gjf (generated)

000927097.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927097.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927097.mol 000927097.PUBCHEM 000927097.mol (via Jmol)
000927109.b3lyp_6-31g(d).inp

000927109.b3lyp_6-31g(d).qchem.inp (generated)

000927109.b3lyp_6-31g(d).gjf (generated)

000927109.b3lyp_6-31g(d).firefly.inp (generated)

000927109.b3lyp_6-31g(d).smash.inp (generated)

000927109.b3lyp_6-31g(d).nwchem.inp (generated) 000927109.b3lyp_6-31g(d).log.xz 000927109.td-b3lyp_6-31g+(d).inp 000927109.td-b3lyp_6-31g+(d).log.xz

000927109.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927109.td-b3lyp_6-31+g(d).gjf (generated)

000927109.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927109.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927109.mol 000927109.PUBCHEM 000927109.mol (via Jmol)
000927112.b3lyp_6-31g(d).inp

000927112.b3lyp_6-31g(d).qchem.inp (generated)

000927112.b3lyp_6-31g(d).gjf (generated)

000927112.b3lyp_6-31g(d).firefly.inp (generated)

000927112.b3lyp_6-31g(d).smash.inp (generated)

000927112.b3lyp_6-31g(d).nwchem.inp (generated) 000927112.b3lyp_6-31g(d).log.xz 000927112.td-b3lyp_6-31g+(d).inp 000927112.td-b3lyp_6-31g+(d).log.xz

000927112.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927112.td-b3lyp_6-31+g(d).gjf (generated)

000927112.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927112.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927112.mol 000927112.PUBCHEM 000927112.mol (via Jmol)
000927123.b3lyp_6-31g(d).inp

000927123.b3lyp_6-31g(d).qchem.inp (generated)

000927123.b3lyp_6-31g(d).gjf (generated)

000927123.b3lyp_6-31g(d).firefly.inp (generated)

000927123.b3lyp_6-31g(d).smash.inp (generated)

000927123.b3lyp_6-31g(d).nwchem.inp (generated) 000927123.b3lyp_6-31g(d).log.xz 000927123.td-b3lyp_6-31g+(d).inp 000927123.td-b3lyp_6-31g+(d).log.xz

000927123.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927123.td-b3lyp_6-31+g(d).gjf (generated)

000927123.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927123.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927123.mol 000927123.PUBCHEM 000927123.mol (via Jmol)
000927129.b3lyp_6-31g(d).inp

000927129.b3lyp_6-31g(d).qchem.inp (generated)

000927129.b3lyp_6-31g(d).gjf (generated)

000927129.b3lyp_6-31g(d).firefly.inp (generated)

000927129.b3lyp_6-31g(d).smash.inp (generated)

000927129.b3lyp_6-31g(d).nwchem.inp (generated) 000927129.b3lyp_6-31g(d).log.xz 000927129.mol 000927129.PUBCHEM 000927129.mol (via Jmol)
000927226.b3lyp_6-31g(d).inp

000927226.b3lyp_6-31g(d).qchem.inp (generated)

000927226.b3lyp_6-31g(d).gjf (generated)

000927226.b3lyp_6-31g(d).firefly.inp (generated)

000927226.b3lyp_6-31g(d).smash.inp (generated)

000927226.b3lyp_6-31g(d).nwchem.inp (generated) 000927226.b3lyp_6-31g(d).log.xz 000927226.td-b3lyp_6-31g+(d).inp 000927226.td-b3lyp_6-31g+(d).log.xz

000927226.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927226.td-b3lyp_6-31+g(d).gjf (generated)

000927226.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927226.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927226.mol 000927226.PUBCHEM 000927226.mol (via Jmol)
000927238.b3lyp_6-31g(d).inp

000927238.b3lyp_6-31g(d).qchem.inp (generated)

000927238.b3lyp_6-31g(d).gjf (generated)

000927238.b3lyp_6-31g(d).firefly.inp (generated)

000927238.b3lyp_6-31g(d).smash.inp (generated)

000927238.b3lyp_6-31g(d).nwchem.inp (generated) 000927238.b3lyp_6-31g(d).log.xz 000927238.td-b3lyp_6-31g+(d).inp 000927238.td-b3lyp_6-31g+(d).log.xz

000927238.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927238.td-b3lyp_6-31+g(d).gjf (generated)

000927238.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927238.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927238.mol 000927238.PUBCHEM 000927238.mol (via Jmol)
000927240.b3lyp_6-31g(d).inp

000927240.b3lyp_6-31g(d).qchem.inp (generated)

000927240.b3lyp_6-31g(d).gjf (generated)

000927240.b3lyp_6-31g(d).firefly.inp (generated)

000927240.b3lyp_6-31g(d).smash.inp (generated)

000927240.b3lyp_6-31g(d).nwchem.inp (generated) 000927240.b3lyp_6-31g(d).log.xz 000927240.td-b3lyp_6-31g+(d).inp 000927240.td-b3lyp_6-31g+(d).log.xz

000927240.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927240.td-b3lyp_6-31+g(d).gjf (generated)

000927240.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927240.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927240.mol 000927240.PUBCHEM 000927240.mol (via Jmol)
000927241.b3lyp_6-31g(d).inp

000927241.b3lyp_6-31g(d).qchem.inp (generated)

000927241.b3lyp_6-31g(d).gjf (generated)

000927241.b3lyp_6-31g(d).firefly.inp (generated)

000927241.b3lyp_6-31g(d).smash.inp (generated)

000927241.b3lyp_6-31g(d).nwchem.inp (generated) 000927241.b3lyp_6-31g(d).log.xz 000927241.td-b3lyp_6-31g+(d).inp 000927241.td-b3lyp_6-31g+(d).log.xz

000927241.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927241.td-b3lyp_6-31+g(d).gjf (generated)

000927241.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927241.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927241.mol 000927241.PUBCHEM 000927241.mol (via Jmol)
000927245.b3lyp_6-31g(d).inp

000927245.b3lyp_6-31g(d).qchem.inp (generated)

000927245.b3lyp_6-31g(d).gjf (generated)

000927245.b3lyp_6-31g(d).firefly.inp (generated)

000927245.b3lyp_6-31g(d).smash.inp (generated)

000927245.b3lyp_6-31g(d).nwchem.inp (generated) 000927245.b3lyp_6-31g(d).log.xz 000927245.td-b3lyp_6-31g+(d).inp 000927245.td-b3lyp_6-31g+(d).log.xz

000927245.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927245.td-b3lyp_6-31+g(d).gjf (generated)

000927245.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927245.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927245.mol 000927245.PUBCHEM 000927245.mol (via Jmol)
000927247.b3lyp_6-31g(d).inp

000927247.b3lyp_6-31g(d).qchem.inp (generated)

000927247.b3lyp_6-31g(d).gjf (generated)

000927247.b3lyp_6-31g(d).firefly.inp (generated)

000927247.b3lyp_6-31g(d).smash.inp (generated)

000927247.b3lyp_6-31g(d).nwchem.inp (generated) 000927247.b3lyp_6-31g(d).log.xz 000927247.td-b3lyp_6-31g+(d).inp 000927247.td-b3lyp_6-31g+(d).log.xz

000927247.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927247.td-b3lyp_6-31+g(d).gjf (generated)

000927247.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927247.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927247.mol 000927247.PUBCHEM 000927247.mol (via Jmol)
000927252.b3lyp_6-31g(d).inp

000927252.b3lyp_6-31g(d).qchem.inp (generated)

000927252.b3lyp_6-31g(d).gjf (generated)

000927252.b3lyp_6-31g(d).firefly.inp (generated)

000927252.b3lyp_6-31g(d).smash.inp (generated)

000927252.b3lyp_6-31g(d).nwchem.inp (generated) 000927252.b3lyp_6-31g(d).log.xz 000927252.mol 000927252.PUBCHEM 000927252.mol (via Jmol)
000927256.b3lyp_6-31g(d).inp

000927256.b3lyp_6-31g(d).qchem.inp (generated)

000927256.b3lyp_6-31g(d).gjf (generated)

000927256.b3lyp_6-31g(d).firefly.inp (generated)

000927256.b3lyp_6-31g(d).smash.inp (generated)

000927256.b3lyp_6-31g(d).nwchem.inp (generated) 000927256.b3lyp_6-31g(d).log.xz 000927256.td-b3lyp_6-31g+(d).inp 000927256.td-b3lyp_6-31g+(d).log.xz

000927256.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927256.td-b3lyp_6-31+g(d).gjf (generated)

000927256.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927256.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927256.mol 000927256.PUBCHEM 000927256.mol (via Jmol)
000927257.b3lyp_6-31g(d).inp

000927257.b3lyp_6-31g(d).qchem.inp (generated)

000927257.b3lyp_6-31g(d).gjf (generated)

000927257.b3lyp_6-31g(d).firefly.inp (generated)

000927257.b3lyp_6-31g(d).smash.inp (generated)

000927257.b3lyp_6-31g(d).nwchem.inp (generated) 000927257.b3lyp_6-31g(d).log.xz 000927257.mol 000927257.PUBCHEM 000927257.mol (via Jmol)
000927276.b3lyp_6-31g(d).inp

000927276.b3lyp_6-31g(d).qchem.inp (generated)

000927276.b3lyp_6-31g(d).gjf (generated)

000927276.b3lyp_6-31g(d).firefly.inp (generated)

000927276.b3lyp_6-31g(d).smash.inp (generated)

000927276.b3lyp_6-31g(d).nwchem.inp (generated) 000927276.b3lyp_6-31g(d).log.xz 000927276.td-b3lyp_6-31g+(d).inp 000927276.td-b3lyp_6-31g+(d).log.xz

000927276.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927276.td-b3lyp_6-31+g(d).gjf (generated)

000927276.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927276.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927276.mol 000927276.PUBCHEM 000927276.mol (via Jmol)
000927277.b3lyp_6-31g(d).inp

000927277.b3lyp_6-31g(d).qchem.inp (generated)

000927277.b3lyp_6-31g(d).gjf (generated)

000927277.b3lyp_6-31g(d).firefly.inp (generated)

000927277.b3lyp_6-31g(d).smash.inp (generated)

000927277.b3lyp_6-31g(d).nwchem.inp (generated) 000927277.b3lyp_6-31g(d).log.xz 000927277.td-b3lyp_6-31g+(d).inp 000927277.td-b3lyp_6-31g+(d).log.xz

000927277.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927277.td-b3lyp_6-31+g(d).gjf (generated)

000927277.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927277.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927277.mol 000927277.PUBCHEM 000927277.mol (via Jmol)
000927305.b3lyp_6-31g(d).inp

000927305.b3lyp_6-31g(d).qchem.inp (generated)

000927305.b3lyp_6-31g(d).gjf (generated)

000927305.b3lyp_6-31g(d).firefly.inp (generated)

000927305.b3lyp_6-31g(d).smash.inp (generated)

000927305.b3lyp_6-31g(d).nwchem.inp (generated) 000927305.b3lyp_6-31g(d).log.xz 000927305.td-b3lyp_6-31g+(d).inp 000927305.td-b3lyp_6-31g+(d).log.xz

000927305.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927305.td-b3lyp_6-31+g(d).gjf (generated)

000927305.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927305.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927305.mol 000927305.PUBCHEM 000927305.mol (via Jmol)
000927306.b3lyp_6-31g(d).inp

000927306.b3lyp_6-31g(d).qchem.inp (generated)

000927306.b3lyp_6-31g(d).gjf (generated)

000927306.b3lyp_6-31g(d).firefly.inp (generated)

000927306.b3lyp_6-31g(d).smash.inp (generated)

000927306.b3lyp_6-31g(d).nwchem.inp (generated) 000927306.b3lyp_6-31g(d).log.xz 000927306.td-b3lyp_6-31g+(d).inp 000927306.td-b3lyp_6-31g+(d).log.xz

000927306.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927306.td-b3lyp_6-31+g(d).gjf (generated)

000927306.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927306.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927306.mol 000927306.PUBCHEM 000927306.mol (via Jmol)
000927308.b3lyp_6-31g(d).inp

000927308.b3lyp_6-31g(d).qchem.inp (generated)

000927308.b3lyp_6-31g(d).gjf (generated)

000927308.b3lyp_6-31g(d).firefly.inp (generated)

000927308.b3lyp_6-31g(d).smash.inp (generated)

000927308.b3lyp_6-31g(d).nwchem.inp (generated) 000927308.b3lyp_6-31g(d).log.xz 000927308.td-b3lyp_6-31g+(d).inp 000927308.td-b3lyp_6-31g+(d).log.xz

000927308.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927308.td-b3lyp_6-31+g(d).gjf (generated)

000927308.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927308.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927308.mol 000927308.PUBCHEM 000927308.mol (via Jmol)
000927314.b3lyp_6-31g(d).inp

000927314.b3lyp_6-31g(d).qchem.inp (generated)

000927314.b3lyp_6-31g(d).gjf (generated)

000927314.b3lyp_6-31g(d).firefly.inp (generated)

000927314.b3lyp_6-31g(d).smash.inp (generated)

000927314.b3lyp_6-31g(d).nwchem.inp (generated) 000927314.b3lyp_6-31g(d).log.xz 000927314.td-b3lyp_6-31g+(d).inp 000927314.td-b3lyp_6-31g+(d).log.xz

000927314.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927314.td-b3lyp_6-31+g(d).gjf (generated)

000927314.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927314.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927314.mol 000927314.PUBCHEM 000927314.mol (via Jmol)
000927317.b3lyp_6-31g(d).inp

000927317.b3lyp_6-31g(d).qchem.inp (generated)

000927317.b3lyp_6-31g(d).gjf (generated)

000927317.b3lyp_6-31g(d).firefly.inp (generated)

000927317.b3lyp_6-31g(d).smash.inp (generated)

000927317.b3lyp_6-31g(d).nwchem.inp (generated) 000927317.b3lyp_6-31g(d).log.xz 000927317.td-b3lyp_6-31g+(d).inp 000927317.td-b3lyp_6-31g+(d).log.xz

000927317.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927317.td-b3lyp_6-31+g(d).gjf (generated)

000927317.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927317.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927317.mol 000927317.PUBCHEM 000927317.mol (via Jmol)
000927318.b3lyp_6-31g(d).inp

000927318.b3lyp_6-31g(d).qchem.inp (generated)

000927318.b3lyp_6-31g(d).gjf (generated)

000927318.b3lyp_6-31g(d).firefly.inp (generated)

000927318.b3lyp_6-31g(d).smash.inp (generated)

000927318.b3lyp_6-31g(d).nwchem.inp (generated) 000927318.b3lyp_6-31g(d).log.xz 000927318.td-b3lyp_6-31g+(d).inp 000927318.td-b3lyp_6-31g+(d).log.xz

000927318.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927318.td-b3lyp_6-31+g(d).gjf (generated)

000927318.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927318.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927318.mol 000927318.PUBCHEM 000927318.mol (via Jmol)
000927319.b3lyp_6-31g(d).inp

000927319.b3lyp_6-31g(d).qchem.inp (generated)

000927319.b3lyp_6-31g(d).gjf (generated)

000927319.b3lyp_6-31g(d).firefly.inp (generated)

000927319.b3lyp_6-31g(d).smash.inp (generated)

000927319.b3lyp_6-31g(d).nwchem.inp (generated) 000927319.b3lyp_6-31g(d).log.xz 000927319.td-b3lyp_6-31g+(d).inp 000927319.td-b3lyp_6-31g+(d).log.xz

000927319.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927319.td-b3lyp_6-31+g(d).gjf (generated)

000927319.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927319.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927319.mol 000927319.PUBCHEM 000927319.mol (via Jmol)
000927322.b3lyp_6-31g(d).inp

000927322.b3lyp_6-31g(d).qchem.inp (generated)

000927322.b3lyp_6-31g(d).gjf (generated)

000927322.b3lyp_6-31g(d).firefly.inp (generated)

000927322.b3lyp_6-31g(d).smash.inp (generated)

000927322.b3lyp_6-31g(d).nwchem.inp (generated) 000927322.b3lyp_6-31g(d).log.xz 000927322.mol 000927322.PUBCHEM 000927322.mol (via Jmol)
000927336.b3lyp_6-31g(d).inp

000927336.b3lyp_6-31g(d).qchem.inp (generated)

000927336.b3lyp_6-31g(d).gjf (generated)

000927336.b3lyp_6-31g(d).firefly.inp (generated)

000927336.b3lyp_6-31g(d).smash.inp (generated)

000927336.b3lyp_6-31g(d).nwchem.inp (generated) 000927336.b3lyp_6-31g(d).log.xz 000927336.td-b3lyp_6-31g+(d).inp 000927336.td-b3lyp_6-31g+(d).log.xz

000927336.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927336.td-b3lyp_6-31+g(d).gjf (generated)

000927336.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927336.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927336.mol 000927336.PUBCHEM 000927336.mol (via Jmol)
000927345.b3lyp_6-31g(d).inp

000927345.b3lyp_6-31g(d).qchem.inp (generated)

000927345.b3lyp_6-31g(d).gjf (generated)

000927345.b3lyp_6-31g(d).firefly.inp (generated)

000927345.b3lyp_6-31g(d).smash.inp (generated)

000927345.b3lyp_6-31g(d).nwchem.inp (generated) 000927345.b3lyp_6-31g(d).log.xz 000927345.mol 000927345.PUBCHEM 000927345.mol (via Jmol)
000927388.b3lyp_6-31g(d).inp

000927388.b3lyp_6-31g(d).qchem.inp (generated)

000927388.b3lyp_6-31g(d).gjf (generated)

000927388.b3lyp_6-31g(d).firefly.inp (generated)

000927388.b3lyp_6-31g(d).smash.inp (generated)

000927388.b3lyp_6-31g(d).nwchem.inp (generated) 000927388.b3lyp_6-31g(d).log.xz 000927388.td-b3lyp_6-31g+(d).inp 000927388.td-b3lyp_6-31g+(d).log.xz

000927388.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927388.td-b3lyp_6-31+g(d).gjf (generated)

000927388.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927388.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927388.mol 000927388.PUBCHEM 000927388.mol (via Jmol)
000927399.b3lyp_6-31g(d).inp

000927399.b3lyp_6-31g(d).qchem.inp (generated)

000927399.b3lyp_6-31g(d).gjf (generated)

000927399.b3lyp_6-31g(d).firefly.inp (generated)

000927399.b3lyp_6-31g(d).smash.inp (generated)

000927399.b3lyp_6-31g(d).nwchem.inp (generated) 000927399.b3lyp_6-31g(d).log.xz 000927399.td-b3lyp_6-31g+(d).inp 000927399.td-b3lyp_6-31g+(d).log.xz

000927399.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927399.td-b3lyp_6-31+g(d).gjf (generated)

000927399.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927399.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927399.mol 000927399.PUBCHEM 000927399.mol (via Jmol)
000927405.b3lyp_6-31g(d).inp

000927405.b3lyp_6-31g(d).qchem.inp (generated)

000927405.b3lyp_6-31g(d).gjf (generated)

000927405.b3lyp_6-31g(d).firefly.inp (generated)

000927405.b3lyp_6-31g(d).smash.inp (generated)

000927405.b3lyp_6-31g(d).nwchem.inp (generated) 000927405.b3lyp_6-31g(d).log.xz 000927405.td-b3lyp_6-31g+(d).inp 000927405.td-b3lyp_6-31g+(d).log.xz

000927405.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927405.td-b3lyp_6-31+g(d).gjf (generated)

000927405.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927405.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927405.mol 000927405.PUBCHEM 000927405.mol (via Jmol)
000927429.b3lyp_6-31g(d).inp

000927429.b3lyp_6-31g(d).qchem.inp (generated)

000927429.b3lyp_6-31g(d).gjf (generated)

000927429.b3lyp_6-31g(d).firefly.inp (generated)

000927429.b3lyp_6-31g(d).smash.inp (generated)

000927429.b3lyp_6-31g(d).nwchem.inp (generated) 000927429.b3lyp_6-31g(d).log.xz 000927429.mol 000927429.PUBCHEM 000927429.mol (via Jmol)
000927431.b3lyp_6-31g(d).inp

000927431.b3lyp_6-31g(d).qchem.inp (generated)

000927431.b3lyp_6-31g(d).gjf (generated)

000927431.b3lyp_6-31g(d).firefly.inp (generated)

000927431.b3lyp_6-31g(d).smash.inp (generated)

000927431.b3lyp_6-31g(d).nwchem.inp (generated) 000927431.b3lyp_6-31g(d).log.xz 000927431.td-b3lyp_6-31g+(d).inp 000927431.td-b3lyp_6-31g+(d).log.xz

000927431.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927431.td-b3lyp_6-31+g(d).gjf (generated)

000927431.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927431.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927431.mol 000927431.PUBCHEM 000927431.mol (via Jmol)
000927434.b3lyp_6-31g(d).inp

000927434.b3lyp_6-31g(d).qchem.inp (generated)

000927434.b3lyp_6-31g(d).gjf (generated)

000927434.b3lyp_6-31g(d).firefly.inp (generated)

000927434.b3lyp_6-31g(d).smash.inp (generated)

000927434.b3lyp_6-31g(d).nwchem.inp (generated) 000927434.b3lyp_6-31g(d).log.xz 000927434.td-b3lyp_6-31g+(d).inp 000927434.td-b3lyp_6-31g+(d).log.xz

000927434.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927434.td-b3lyp_6-31+g(d).gjf (generated)

000927434.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927434.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927434.mol 000927434.PUBCHEM 000927434.mol (via Jmol)
000927438.b3lyp_6-31g(d).inp

000927438.b3lyp_6-31g(d).qchem.inp (generated)

000927438.b3lyp_6-31g(d).gjf (generated)

000927438.b3lyp_6-31g(d).firefly.inp (generated)

000927438.b3lyp_6-31g(d).smash.inp (generated)

000927438.b3lyp_6-31g(d).nwchem.inp (generated) 000927438.b3lyp_6-31g(d).log.xz 000927438.td-b3lyp_6-31g+(d).inp 000927438.td-b3lyp_6-31g+(d).log.xz

000927438.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927438.td-b3lyp_6-31+g(d).gjf (generated)

000927438.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927438.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927438.mol 000927438.PUBCHEM 000927438.mol (via Jmol)
000927440.b3lyp_6-31g(d).inp

000927440.b3lyp_6-31g(d).qchem.inp (generated)

000927440.b3lyp_6-31g(d).gjf (generated)

000927440.b3lyp_6-31g(d).firefly.inp (generated)

000927440.b3lyp_6-31g(d).smash.inp (generated)

000927440.b3lyp_6-31g(d).nwchem.inp (generated) 000927440.b3lyp_6-31g(d).log.xz 000927440.td-b3lyp_6-31g+(d).inp 000927440.td-b3lyp_6-31g+(d).log.xz

000927440.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927440.td-b3lyp_6-31+g(d).gjf (generated)

000927440.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927440.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927440.mol 000927440.PUBCHEM 000927440.mol (via Jmol)
000927443.b3lyp_6-31g(d).inp

000927443.b3lyp_6-31g(d).qchem.inp (generated)

000927443.b3lyp_6-31g(d).gjf (generated)

000927443.b3lyp_6-31g(d).firefly.inp (generated)

000927443.b3lyp_6-31g(d).smash.inp (generated)

000927443.b3lyp_6-31g(d).nwchem.inp (generated) 000927443.b3lyp_6-31g(d).log.xz 000927443.td-b3lyp_6-31g+(d).inp 000927443.td-b3lyp_6-31g+(d).log.xz

000927443.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927443.td-b3lyp_6-31+g(d).gjf (generated)

000927443.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927443.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927443.mol 000927443.PUBCHEM 000927443.mol (via Jmol)
000927456.b3lyp_6-31g(d).inp

000927456.b3lyp_6-31g(d).qchem.inp (generated)

000927456.b3lyp_6-31g(d).gjf (generated)

000927456.b3lyp_6-31g(d).firefly.inp (generated)

000927456.b3lyp_6-31g(d).smash.inp (generated)

000927456.b3lyp_6-31g(d).nwchem.inp (generated) 000927456.b3lyp_6-31g(d).log.xz 000927456.td-b3lyp_6-31g+(d).inp 000927456.td-b3lyp_6-31g+(d).log.xz

000927456.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927456.td-b3lyp_6-31+g(d).gjf (generated)

000927456.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927456.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927456.mol 000927456.PUBCHEM 000927456.mol (via Jmol)
000927457.b3lyp_6-31g(d).inp

000927457.b3lyp_6-31g(d).qchem.inp (generated)

000927457.b3lyp_6-31g(d).gjf (generated)

000927457.b3lyp_6-31g(d).firefly.inp (generated)

000927457.b3lyp_6-31g(d).smash.inp (generated)

000927457.b3lyp_6-31g(d).nwchem.inp (generated) 000927457.b3lyp_6-31g(d).log.xz 000927457.td-b3lyp_6-31g+(d).inp 000927457.td-b3lyp_6-31g+(d).log.xz

000927457.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927457.td-b3lyp_6-31+g(d).gjf (generated)

000927457.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927457.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927457.mol 000927457.PUBCHEM 000927457.mol (via Jmol)
000927458.b3lyp_6-31g(d).inp

000927458.b3lyp_6-31g(d).qchem.inp (generated)

000927458.b3lyp_6-31g(d).gjf (generated)

000927458.b3lyp_6-31g(d).firefly.inp (generated)

000927458.b3lyp_6-31g(d).smash.inp (generated)

000927458.b3lyp_6-31g(d).nwchem.inp (generated) 000927458.b3lyp_6-31g(d).log.xz 000927458.td-b3lyp_6-31g+(d).inp 000927458.td-b3lyp_6-31g+(d).log.xz

000927458.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927458.td-b3lyp_6-31+g(d).gjf (generated)

000927458.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927458.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927458.mol 000927458.PUBCHEM 000927458.mol (via Jmol)
000927464.b3lyp_6-31g(d).inp

000927464.b3lyp_6-31g(d).qchem.inp (generated)

000927464.b3lyp_6-31g(d).gjf (generated)

000927464.b3lyp_6-31g(d).firefly.inp (generated)

000927464.b3lyp_6-31g(d).smash.inp (generated)

000927464.b3lyp_6-31g(d).nwchem.inp (generated) 000927464.b3lyp_6-31g(d).log.xz 000927464.td-b3lyp_6-31g+(d).inp 000927464.td-b3lyp_6-31g+(d).log.xz

000927464.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927464.td-b3lyp_6-31+g(d).gjf (generated)

000927464.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927464.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927464.mol 000927464.PUBCHEM 000927464.mol (via Jmol)
000927465.b3lyp_6-31g(d).inp

000927465.b3lyp_6-31g(d).qchem.inp (generated)

000927465.b3lyp_6-31g(d).gjf (generated)

000927465.b3lyp_6-31g(d).firefly.inp (generated)

000927465.b3lyp_6-31g(d).smash.inp (generated)

000927465.b3lyp_6-31g(d).nwchem.inp (generated) 000927465.b3lyp_6-31g(d).log.xz 000927465.td-b3lyp_6-31g+(d).inp 000927465.td-b3lyp_6-31g+(d).log.xz

000927465.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927465.td-b3lyp_6-31+g(d).gjf (generated)

000927465.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927465.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927465.mol 000927465.PUBCHEM 000927465.mol (via Jmol)
000927487.b3lyp_6-31g(d).inp

000927487.b3lyp_6-31g(d).qchem.inp (generated)

000927487.b3lyp_6-31g(d).gjf (generated)

000927487.b3lyp_6-31g(d).firefly.inp (generated)

000927487.b3lyp_6-31g(d).smash.inp (generated)

000927487.b3lyp_6-31g(d).nwchem.inp (generated) 000927487.b3lyp_6-31g(d).log.xz 000927487.td-b3lyp_6-31g+(d).inp 000927487.td-b3lyp_6-31g+(d).log.xz

000927487.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927487.td-b3lyp_6-31+g(d).gjf (generated)

000927487.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927487.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927487.mol 000927487.PUBCHEM 000927487.mol (via Jmol)
000927500.b3lyp_6-31g(d).inp

000927500.b3lyp_6-31g(d).qchem.inp (generated)

000927500.b3lyp_6-31g(d).gjf (generated)

000927500.b3lyp_6-31g(d).firefly.inp (generated)

000927500.b3lyp_6-31g(d).smash.inp (generated)

000927500.b3lyp_6-31g(d).nwchem.inp (generated) 000927500.b3lyp_6-31g(d).log.xz 000927500.td-b3lyp_6-31g+(d).inp 000927500.td-b3lyp_6-31g+(d).log.xz

000927500.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927500.td-b3lyp_6-31+g(d).gjf (generated)

000927500.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927500.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927500.mol 000927500.PUBCHEM 000927500.mol (via Jmol)
000927507.b3lyp_6-31g(d).inp

000927507.b3lyp_6-31g(d).qchem.inp (generated)

000927507.b3lyp_6-31g(d).gjf (generated)

000927507.b3lyp_6-31g(d).firefly.inp (generated)

000927507.b3lyp_6-31g(d).smash.inp (generated)

000927507.b3lyp_6-31g(d).nwchem.inp (generated) 000927507.b3lyp_6-31g(d).log.xz 000927507.td-b3lyp_6-31g+(d).inp 000927507.td-b3lyp_6-31g+(d).log.xz

000927507.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927507.td-b3lyp_6-31+g(d).gjf (generated)

000927507.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927507.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927507.mol 000927507.PUBCHEM 000927507.mol (via Jmol)
000927508.b3lyp_6-31g(d).inp

000927508.b3lyp_6-31g(d).qchem.inp (generated)

000927508.b3lyp_6-31g(d).gjf (generated)

000927508.b3lyp_6-31g(d).firefly.inp (generated)

000927508.b3lyp_6-31g(d).smash.inp (generated)

000927508.b3lyp_6-31g(d).nwchem.inp (generated) 000927508.b3lyp_6-31g(d).log.xz 000927508.td-b3lyp_6-31g+(d).inp 000927508.td-b3lyp_6-31g+(d).log.xz

000927508.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927508.td-b3lyp_6-31+g(d).gjf (generated)

000927508.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927508.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927508.mol 000927508.PUBCHEM 000927508.mol (via Jmol)
000927516.b3lyp_6-31g(d).inp

000927516.b3lyp_6-31g(d).qchem.inp (generated)

000927516.b3lyp_6-31g(d).gjf (generated)

000927516.b3lyp_6-31g(d).firefly.inp (generated)

000927516.b3lyp_6-31g(d).smash.inp (generated)

000927516.b3lyp_6-31g(d).nwchem.inp (generated) 000927516.b3lyp_6-31g(d).log.xz 000927516.td-b3lyp_6-31g+(d).inp 000927516.td-b3lyp_6-31g+(d).log.xz

000927516.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927516.td-b3lyp_6-31+g(d).gjf (generated)

000927516.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927516.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927516.mol 000927516.PUBCHEM 000927516.mol (via Jmol)
000927517.b3lyp_6-31g(d).inp

000927517.b3lyp_6-31g(d).qchem.inp (generated)

000927517.b3lyp_6-31g(d).gjf (generated)

000927517.b3lyp_6-31g(d).firefly.inp (generated)

000927517.b3lyp_6-31g(d).smash.inp (generated)

000927517.b3lyp_6-31g(d).nwchem.inp (generated) 000927517.b3lyp_6-31g(d).log.xz 000927517.td-b3lyp_6-31g+(d).inp 000927517.td-b3lyp_6-31g+(d).log.xz

000927517.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927517.td-b3lyp_6-31+g(d).gjf (generated)

000927517.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927517.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927517.mol 000927517.PUBCHEM 000927517.mol (via Jmol)
000927546.b3lyp_6-31g(d).inp

000927546.b3lyp_6-31g(d).qchem.inp (generated)

000927546.b3lyp_6-31g(d).gjf (generated)

000927546.b3lyp_6-31g(d).firefly.inp (generated)

000927546.b3lyp_6-31g(d).smash.inp (generated)

000927546.b3lyp_6-31g(d).nwchem.inp (generated) 000927546.b3lyp_6-31g(d).log.xz 000927546.mol 000927546.PUBCHEM 000927546.mol (via Jmol)
000927554.b3lyp_6-31g(d).inp

000927554.b3lyp_6-31g(d).qchem.inp (generated)

000927554.b3lyp_6-31g(d).gjf (generated)

000927554.b3lyp_6-31g(d).firefly.inp (generated)

000927554.b3lyp_6-31g(d).smash.inp (generated)

000927554.b3lyp_6-31g(d).nwchem.inp (generated) 000927554.b3lyp_6-31g(d).log.xz 000927554.td-b3lyp_6-31g+(d).inp 000927554.td-b3lyp_6-31g+(d).log.xz

000927554.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927554.td-b3lyp_6-31+g(d).gjf (generated)

000927554.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927554.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927554.mol 000927554.PUBCHEM 000927554.mol (via Jmol)
000927555.b3lyp_6-31g(d).inp

000927555.b3lyp_6-31g(d).qchem.inp (generated)

000927555.b3lyp_6-31g(d).gjf (generated)

000927555.b3lyp_6-31g(d).firefly.inp (generated)

000927555.b3lyp_6-31g(d).smash.inp (generated)

000927555.b3lyp_6-31g(d).nwchem.inp (generated) 000927555.b3lyp_6-31g(d).log.xz 000927555.td-b3lyp_6-31g+(d).inp 000927555.td-b3lyp_6-31g+(d).log.xz

000927555.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927555.td-b3lyp_6-31+g(d).gjf (generated)

000927555.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927555.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927555.mol 000927555.PUBCHEM 000927555.mol (via Jmol)
000927560.b3lyp_6-31g(d).inp

000927560.b3lyp_6-31g(d).qchem.inp (generated)

000927560.b3lyp_6-31g(d).gjf (generated)

000927560.b3lyp_6-31g(d).firefly.inp (generated)

000927560.b3lyp_6-31g(d).smash.inp (generated)

000927560.b3lyp_6-31g(d).nwchem.inp (generated) 000927560.b3lyp_6-31g(d).log.xz 000927560.td-b3lyp_6-31g+(d).inp 000927560.td-b3lyp_6-31g+(d).log.xz

000927560.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927560.td-b3lyp_6-31+g(d).gjf (generated)

000927560.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927560.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927560.mol 000927560.PUBCHEM 000927560.mol (via Jmol)
000927561.b3lyp_6-31g(d).inp

000927561.b3lyp_6-31g(d).qchem.inp (generated)

000927561.b3lyp_6-31g(d).gjf (generated)

000927561.b3lyp_6-31g(d).firefly.inp (generated)

000927561.b3lyp_6-31g(d).smash.inp (generated)

000927561.b3lyp_6-31g(d).nwchem.inp (generated) 000927561.b3lyp_6-31g(d).log.xz 000927561.td-b3lyp_6-31g+(d).inp 000927561.td-b3lyp_6-31g+(d).log.xz

000927561.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927561.td-b3lyp_6-31+g(d).gjf (generated)

000927561.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927561.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927561.mol 000927561.PUBCHEM 000927561.mol (via Jmol)
000927562.b3lyp_6-31g(d).inp

000927562.b3lyp_6-31g(d).qchem.inp (generated)

000927562.b3lyp_6-31g(d).gjf (generated)

000927562.b3lyp_6-31g(d).firefly.inp (generated)

000927562.b3lyp_6-31g(d).smash.inp (generated)

000927562.b3lyp_6-31g(d).nwchem.inp (generated) 000927562.b3lyp_6-31g(d).log.xz 000927562.td-b3lyp_6-31g+(d).inp 000927562.td-b3lyp_6-31g+(d).log.xz

000927562.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927562.td-b3lyp_6-31+g(d).gjf (generated)

000927562.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927562.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927562.mol 000927562.PUBCHEM 000927562.mol (via Jmol)
000927565.b3lyp_6-31g(d).inp

000927565.b3lyp_6-31g(d).qchem.inp (generated)

000927565.b3lyp_6-31g(d).gjf (generated)

000927565.b3lyp_6-31g(d).firefly.inp (generated)

000927565.b3lyp_6-31g(d).smash.inp (generated)

000927565.b3lyp_6-31g(d).nwchem.inp (generated) 000927565.b3lyp_6-31g(d).log.xz 000927565.td-b3lyp_6-31g+(d).inp 000927565.td-b3lyp_6-31g+(d).log.xz

000927565.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927565.td-b3lyp_6-31+g(d).gjf (generated)

000927565.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927565.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927565.mol 000927565.PUBCHEM 000927565.mol (via Jmol)
000927567.b3lyp_6-31g(d).inp

000927567.b3lyp_6-31g(d).qchem.inp (generated)

000927567.b3lyp_6-31g(d).gjf (generated)

000927567.b3lyp_6-31g(d).firefly.inp (generated)

000927567.b3lyp_6-31g(d).smash.inp (generated)

000927567.b3lyp_6-31g(d).nwchem.inp (generated) 000927567.b3lyp_6-31g(d).log.xz 000927567.td-b3lyp_6-31g+(d).inp 000927567.td-b3lyp_6-31g+(d).log.xz

000927567.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927567.td-b3lyp_6-31+g(d).gjf (generated)

000927567.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927567.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927567.mol 000927567.PUBCHEM 000927567.mol (via Jmol)
000927586.b3lyp_6-31g(d).inp

000927586.b3lyp_6-31g(d).qchem.inp (generated)

000927586.b3lyp_6-31g(d).gjf (generated)

000927586.b3lyp_6-31g(d).firefly.inp (generated)

000927586.b3lyp_6-31g(d).smash.inp (generated)

000927586.b3lyp_6-31g(d).nwchem.inp (generated) 000927586.b3lyp_6-31g(d).log.xz 000927586.mol 000927586.PUBCHEM 000927586.mol (via Jmol)
000927589.b3lyp_6-31g(d).inp

000927589.b3lyp_6-31g(d).qchem.inp (generated)

000927589.b3lyp_6-31g(d).gjf (generated)

000927589.b3lyp_6-31g(d).firefly.inp (generated)

000927589.b3lyp_6-31g(d).smash.inp (generated)

000927589.b3lyp_6-31g(d).nwchem.inp (generated) 000927589.b3lyp_6-31g(d).log.xz 000927589.td-b3lyp_6-31g+(d).inp 000927589.td-b3lyp_6-31g+(d).log.xz

000927589.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927589.td-b3lyp_6-31+g(d).gjf (generated)

000927589.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927589.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927589.mol 000927589.PUBCHEM 000927589.mol (via Jmol)
000927590.b3lyp_6-31g(d).inp

000927590.b3lyp_6-31g(d).qchem.inp (generated)

000927590.b3lyp_6-31g(d).gjf (generated)

000927590.b3lyp_6-31g(d).firefly.inp (generated)

000927590.b3lyp_6-31g(d).smash.inp (generated)

000927590.b3lyp_6-31g(d).nwchem.inp (generated) 000927590.b3lyp_6-31g(d).log.xz 000927590.td-b3lyp_6-31g+(d).inp 000927590.td-b3lyp_6-31g+(d).log.xz

000927590.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927590.td-b3lyp_6-31+g(d).gjf (generated)

000927590.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927590.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927590.mol 000927590.PUBCHEM 000927590.mol (via Jmol)
000927591.b3lyp_6-31g(d).inp

000927591.b3lyp_6-31g(d).qchem.inp (generated)

000927591.b3lyp_6-31g(d).gjf (generated)

000927591.b3lyp_6-31g(d).firefly.inp (generated)

000927591.b3lyp_6-31g(d).smash.inp (generated)

000927591.b3lyp_6-31g(d).nwchem.inp (generated) 000927591.b3lyp_6-31g(d).log.xz 000927591.td-b3lyp_6-31g+(d).inp 000927591.td-b3lyp_6-31g+(d).log.xz

000927591.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927591.td-b3lyp_6-31+g(d).gjf (generated)

000927591.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927591.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927591.mol 000927591.PUBCHEM 000927591.mol (via Jmol)
000927592.b3lyp_6-31g(d).inp

000927592.b3lyp_6-31g(d).qchem.inp (generated)

000927592.b3lyp_6-31g(d).gjf (generated)

000927592.b3lyp_6-31g(d).firefly.inp (generated)

000927592.b3lyp_6-31g(d).smash.inp (generated)

000927592.b3lyp_6-31g(d).nwchem.inp (generated) 000927592.b3lyp_6-31g(d).log.xz 000927592.td-b3lyp_6-31g+(d).inp 000927592.td-b3lyp_6-31g+(d).log.xz

000927592.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927592.td-b3lyp_6-31+g(d).gjf (generated)

000927592.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927592.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927592.mol 000927592.PUBCHEM 000927592.mol (via Jmol)
000927606.b3lyp_6-31g(d).inp

000927606.b3lyp_6-31g(d).qchem.inp (generated)

000927606.b3lyp_6-31g(d).gjf (generated)

000927606.b3lyp_6-31g(d).firefly.inp (generated)

000927606.b3lyp_6-31g(d).smash.inp (generated)

000927606.b3lyp_6-31g(d).nwchem.inp (generated) 000927606.b3lyp_6-31g(d).log.xz 000927606.td-b3lyp_6-31g+(d).inp 000927606.td-b3lyp_6-31g+(d).log.xz

000927606.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927606.td-b3lyp_6-31+g(d).gjf (generated)

000927606.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927606.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927606.mol 000927606.PUBCHEM 000927606.mol (via Jmol)
000927609.b3lyp_6-31g(d).inp

000927609.b3lyp_6-31g(d).qchem.inp (generated)

000927609.b3lyp_6-31g(d).gjf (generated)

000927609.b3lyp_6-31g(d).firefly.inp (generated)

000927609.b3lyp_6-31g(d).smash.inp (generated)

000927609.b3lyp_6-31g(d).nwchem.inp (generated) 000927609.b3lyp_6-31g(d).log.xz 000927609.td-b3lyp_6-31g+(d).inp 000927609.td-b3lyp_6-31g+(d).log.xz

000927609.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927609.td-b3lyp_6-31+g(d).gjf (generated)

000927609.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927609.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927609.mol 000927609.PUBCHEM 000927609.mol (via Jmol)
000927622.b3lyp_6-31g(d).inp

000927622.b3lyp_6-31g(d).qchem.inp (generated)

000927622.b3lyp_6-31g(d).gjf (generated)

000927622.b3lyp_6-31g(d).firefly.inp (generated)

000927622.b3lyp_6-31g(d).smash.inp (generated)

000927622.b3lyp_6-31g(d).nwchem.inp (generated) 000927622.b3lyp_6-31g(d).log.xz 000927622.td-b3lyp_6-31g+(d).inp 000927622.td-b3lyp_6-31g+(d).log.xz

000927622.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927622.td-b3lyp_6-31+g(d).gjf (generated)

000927622.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927622.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927622.mol 000927622.PUBCHEM 000927622.mol (via Jmol)
000927633.b3lyp_6-31g(d).inp

000927633.b3lyp_6-31g(d).qchem.inp (generated)

000927633.b3lyp_6-31g(d).gjf (generated)

000927633.b3lyp_6-31g(d).firefly.inp (generated)

000927633.b3lyp_6-31g(d).smash.inp (generated)

000927633.b3lyp_6-31g(d).nwchem.inp (generated) 000927633.b3lyp_6-31g(d).log.xz 000927633.td-b3lyp_6-31g+(d).inp 000927633.td-b3lyp_6-31g+(d).log.xz

000927633.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927633.td-b3lyp_6-31+g(d).gjf (generated)

000927633.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927633.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927633.mol 000927633.PUBCHEM 000927633.mol (via Jmol)
000927635.b3lyp_6-31g(d).inp

000927635.b3lyp_6-31g(d).qchem.inp (generated)

000927635.b3lyp_6-31g(d).gjf (generated)

000927635.b3lyp_6-31g(d).firefly.inp (generated)

000927635.b3lyp_6-31g(d).smash.inp (generated)

000927635.b3lyp_6-31g(d).nwchem.inp (generated) 000927635.b3lyp_6-31g(d).log.xz 000927635.td-b3lyp_6-31g+(d).inp 000927635.td-b3lyp_6-31g+(d).log.xz

000927635.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927635.td-b3lyp_6-31+g(d).gjf (generated)

000927635.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927635.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927635.mol 000927635.PUBCHEM 000927635.mol (via Jmol)
000927636.b3lyp_6-31g(d).inp

000927636.b3lyp_6-31g(d).qchem.inp (generated)

000927636.b3lyp_6-31g(d).gjf (generated)

000927636.b3lyp_6-31g(d).firefly.inp (generated)

000927636.b3lyp_6-31g(d).smash.inp (generated)

000927636.b3lyp_6-31g(d).nwchem.inp (generated) 000927636.b3lyp_6-31g(d).log.xz 000927636.td-b3lyp_6-31g+(d).inp 000927636.td-b3lyp_6-31g+(d).log.xz

000927636.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927636.td-b3lyp_6-31+g(d).gjf (generated)

000927636.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927636.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927636.mol 000927636.PUBCHEM 000927636.mol (via Jmol)
000927638.b3lyp_6-31g(d).inp

000927638.b3lyp_6-31g(d).qchem.inp (generated)

000927638.b3lyp_6-31g(d).gjf (generated)

000927638.b3lyp_6-31g(d).firefly.inp (generated)

000927638.b3lyp_6-31g(d).smash.inp (generated)

000927638.b3lyp_6-31g(d).nwchem.inp (generated) 000927638.b3lyp_6-31g(d).log.xz 000927638.td-b3lyp_6-31g+(d).inp 000927638.td-b3lyp_6-31g+(d).log.xz

000927638.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927638.td-b3lyp_6-31+g(d).gjf (generated)

000927638.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927638.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927638.mol 000927638.PUBCHEM 000927638.mol (via Jmol)
000927646.b3lyp_6-31g(d).inp

000927646.b3lyp_6-31g(d).qchem.inp (generated)

000927646.b3lyp_6-31g(d).gjf (generated)

000927646.b3lyp_6-31g(d).firefly.inp (generated)

000927646.b3lyp_6-31g(d).smash.inp (generated)

000927646.b3lyp_6-31g(d).nwchem.inp (generated) 000927646.b3lyp_6-31g(d).log.xz 000927646.td-b3lyp_6-31g+(d).inp 000927646.td-b3lyp_6-31g+(d).log.xz

000927646.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927646.td-b3lyp_6-31+g(d).gjf (generated)

000927646.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927646.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927646.mol 000927646.PUBCHEM 000927646.mol (via Jmol)
000927669.b3lyp_6-31g(d).inp

000927669.b3lyp_6-31g(d).qchem.inp (generated)

000927669.b3lyp_6-31g(d).gjf (generated)

000927669.b3lyp_6-31g(d).firefly.inp (generated)

000927669.b3lyp_6-31g(d).smash.inp (generated)

000927669.b3lyp_6-31g(d).nwchem.inp (generated) 000927669.b3lyp_6-31g(d).log.xz 000927669.td-b3lyp_6-31g+(d).inp 000927669.td-b3lyp_6-31g+(d).log.xz

000927669.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927669.td-b3lyp_6-31+g(d).gjf (generated)

000927669.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927669.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927669.mol 000927669.PUBCHEM 000927669.mol (via Jmol)
000927673.b3lyp_6-31g(d).inp

000927673.b3lyp_6-31g(d).qchem.inp (generated)

000927673.b3lyp_6-31g(d).gjf (generated)

000927673.b3lyp_6-31g(d).firefly.inp (generated)

000927673.b3lyp_6-31g(d).smash.inp (generated)

000927673.b3lyp_6-31g(d).nwchem.inp (generated) 000927673.b3lyp_6-31g(d).log.xz 000927673.td-b3lyp_6-31g+(d).inp 000927673.td-b3lyp_6-31g+(d).log.xz

000927673.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927673.td-b3lyp_6-31+g(d).gjf (generated)

000927673.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927673.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927673.mol 000927673.PUBCHEM 000927673.mol (via Jmol)
000927674.b3lyp_6-31g(d).inp

000927674.b3lyp_6-31g(d).qchem.inp (generated)

000927674.b3lyp_6-31g(d).gjf (generated)

000927674.b3lyp_6-31g(d).firefly.inp (generated)

000927674.b3lyp_6-31g(d).smash.inp (generated)

000927674.b3lyp_6-31g(d).nwchem.inp (generated) 000927674.b3lyp_6-31g(d).log.xz 000927674.td-b3lyp_6-31g+(d).inp 000927674.td-b3lyp_6-31g+(d).log.xz

000927674.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927674.td-b3lyp_6-31+g(d).gjf (generated)

000927674.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927674.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927674.mol 000927674.PUBCHEM 000927674.mol (via Jmol)
000927707.b3lyp_6-31g(d).inp

000927707.b3lyp_6-31g(d).qchem.inp (generated)

000927707.b3lyp_6-31g(d).gjf (generated)

000927707.b3lyp_6-31g(d).firefly.inp (generated)

000927707.b3lyp_6-31g(d).smash.inp (generated)

000927707.b3lyp_6-31g(d).nwchem.inp (generated) 000927707.b3lyp_6-31g(d).log.xz 000927707.td-b3lyp_6-31g+(d).inp 000927707.td-b3lyp_6-31g+(d).log.xz

000927707.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927707.td-b3lyp_6-31+g(d).gjf (generated)

000927707.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927707.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927707.mol 000927707.PUBCHEM 000927707.mol (via Jmol)
000927708.b3lyp_6-31g(d).inp

000927708.b3lyp_6-31g(d).qchem.inp (generated)

000927708.b3lyp_6-31g(d).gjf (generated)

000927708.b3lyp_6-31g(d).firefly.inp (generated)

000927708.b3lyp_6-31g(d).smash.inp (generated)

000927708.b3lyp_6-31g(d).nwchem.inp (generated) 000927708.b3lyp_6-31g(d).log.xz 000927708.td-b3lyp_6-31g+(d).inp 000927708.td-b3lyp_6-31g+(d).log.xz

000927708.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927708.td-b3lyp_6-31+g(d).gjf (generated)

000927708.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927708.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927708.mol 000927708.PUBCHEM 000927708.mol (via Jmol)
000927719.b3lyp_6-31g(d).inp

000927719.b3lyp_6-31g(d).qchem.inp (generated)

000927719.b3lyp_6-31g(d).gjf (generated)

000927719.b3lyp_6-31g(d).firefly.inp (generated)

000927719.b3lyp_6-31g(d).smash.inp (generated)

000927719.b3lyp_6-31g(d).nwchem.inp (generated) 000927719.b3lyp_6-31g(d).log.xz 000927719.td-b3lyp_6-31g+(d).inp 000927719.td-b3lyp_6-31g+(d).log.xz

000927719.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927719.td-b3lyp_6-31+g(d).gjf (generated)

000927719.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927719.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927719.mol 000927719.PUBCHEM 000927719.mol (via Jmol)
000927724.b3lyp_6-31g(d).inp

000927724.b3lyp_6-31g(d).qchem.inp (generated)

000927724.b3lyp_6-31g(d).gjf (generated)

000927724.b3lyp_6-31g(d).firefly.inp (generated)

000927724.b3lyp_6-31g(d).smash.inp (generated)

000927724.b3lyp_6-31g(d).nwchem.inp (generated) 000927724.b3lyp_6-31g(d).log.xz 000927724.td-b3lyp_6-31g+(d).inp 000927724.td-b3lyp_6-31g+(d).log.xz

000927724.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927724.td-b3lyp_6-31+g(d).gjf (generated)

000927724.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927724.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927724.mol 000927724.PUBCHEM 000927724.mol (via Jmol)
000927754.b3lyp_6-31g(d).inp

000927754.b3lyp_6-31g(d).qchem.inp (generated)

000927754.b3lyp_6-31g(d).gjf (generated)

000927754.b3lyp_6-31g(d).firefly.inp (generated)

000927754.b3lyp_6-31g(d).smash.inp (generated)

000927754.b3lyp_6-31g(d).nwchem.inp (generated) 000927754.b3lyp_6-31g(d).log.xz 000927754.td-b3lyp_6-31g+(d).inp 000927754.td-b3lyp_6-31g+(d).log.xz

000927754.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927754.td-b3lyp_6-31+g(d).gjf (generated)

000927754.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927754.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927754.mol 000927754.PUBCHEM 000927754.mol (via Jmol)
000927760.b3lyp_6-31g(d).inp

000927760.b3lyp_6-31g(d).qchem.inp (generated)

000927760.b3lyp_6-31g(d).gjf (generated)

000927760.b3lyp_6-31g(d).firefly.inp (generated)

000927760.b3lyp_6-31g(d).smash.inp (generated)

000927760.b3lyp_6-31g(d).nwchem.inp (generated) 000927760.b3lyp_6-31g(d).log.xz 000927760.td-b3lyp_6-31g+(d).inp 000927760.td-b3lyp_6-31g+(d).log.xz

000927760.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927760.td-b3lyp_6-31+g(d).gjf (generated)

000927760.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927760.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927760.mol 000927760.PUBCHEM 000927760.mol (via Jmol)
000927772.b3lyp_6-31g(d).inp

000927772.b3lyp_6-31g(d).qchem.inp (generated)

000927772.b3lyp_6-31g(d).gjf (generated)

000927772.b3lyp_6-31g(d).firefly.inp (generated)

000927772.b3lyp_6-31g(d).smash.inp (generated)

000927772.b3lyp_6-31g(d).nwchem.inp (generated) 000927772.b3lyp_6-31g(d).log.xz 000927772.td-b3lyp_6-31g+(d).inp 000927772.td-b3lyp_6-31g+(d).log.xz

000927772.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927772.td-b3lyp_6-31+g(d).gjf (generated)

000927772.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927772.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927772.mol 000927772.PUBCHEM 000927772.mol (via Jmol)
000927793.b3lyp_6-31g(d).inp

000927793.b3lyp_6-31g(d).qchem.inp (generated)

000927793.b3lyp_6-31g(d).gjf (generated)

000927793.b3lyp_6-31g(d).firefly.inp (generated)

000927793.b3lyp_6-31g(d).smash.inp (generated)

000927793.b3lyp_6-31g(d).nwchem.inp (generated) 000927793.b3lyp_6-31g(d).log.xz 000927793.td-b3lyp_6-31g+(d).inp 000927793.td-b3lyp_6-31g+(d).log.xz

000927793.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927793.td-b3lyp_6-31+g(d).gjf (generated)

000927793.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927793.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927793.mol 000927793.PUBCHEM 000927793.mol (via Jmol)
000927794.b3lyp_6-31g(d).inp

000927794.b3lyp_6-31g(d).qchem.inp (generated)

000927794.b3lyp_6-31g(d).gjf (generated)

000927794.b3lyp_6-31g(d).firefly.inp (generated)

000927794.b3lyp_6-31g(d).smash.inp (generated)

000927794.b3lyp_6-31g(d).nwchem.inp (generated) 000927794.b3lyp_6-31g(d).log.xz 000927794.td-b3lyp_6-31g+(d).inp 000927794.td-b3lyp_6-31g+(d).log.xz

000927794.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927794.td-b3lyp_6-31+g(d).gjf (generated)

000927794.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927794.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927794.mol 000927794.PUBCHEM 000927794.mol (via Jmol)
000927805.b3lyp_6-31g(d).inp

000927805.b3lyp_6-31g(d).qchem.inp (generated)

000927805.b3lyp_6-31g(d).gjf (generated)

000927805.b3lyp_6-31g(d).firefly.inp (generated)

000927805.b3lyp_6-31g(d).smash.inp (generated)

000927805.b3lyp_6-31g(d).nwchem.inp (generated) 000927805.b3lyp_6-31g(d).log.xz 000927805.td-b3lyp_6-31g+(d).inp 000927805.td-b3lyp_6-31g+(d).log.xz

000927805.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927805.td-b3lyp_6-31+g(d).gjf (generated)

000927805.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927805.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927805.mol 000927805.PUBCHEM 000927805.mol (via Jmol)
000927814.b3lyp_6-31g(d).inp

000927814.b3lyp_6-31g(d).qchem.inp (generated)

000927814.b3lyp_6-31g(d).gjf (generated)

000927814.b3lyp_6-31g(d).firefly.inp (generated)

000927814.b3lyp_6-31g(d).smash.inp (generated)

000927814.b3lyp_6-31g(d).nwchem.inp (generated) 000927814.b3lyp_6-31g(d).log.xz 000927814.mol 000927814.PUBCHEM 000927814.mol (via Jmol)
000927848.b3lyp_6-31g(d).inp

000927848.b3lyp_6-31g(d).qchem.inp (generated)

000927848.b3lyp_6-31g(d).gjf (generated)

000927848.b3lyp_6-31g(d).firefly.inp (generated)

000927848.b3lyp_6-31g(d).smash.inp (generated)

000927848.b3lyp_6-31g(d).nwchem.inp (generated) 000927848.b3lyp_6-31g(d).log.xz 000927848.td-b3lyp_6-31g+(d).inp 000927848.td-b3lyp_6-31g+(d).log.xz

000927848.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927848.td-b3lyp_6-31+g(d).gjf (generated)

000927848.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927848.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927848.mol 000927848.PUBCHEM 000927848.mol (via Jmol)
000927854.b3lyp_6-31g(d).inp

000927854.b3lyp_6-31g(d).qchem.inp (generated)

000927854.b3lyp_6-31g(d).gjf (generated)

000927854.b3lyp_6-31g(d).firefly.inp (generated)

000927854.b3lyp_6-31g(d).smash.inp (generated)

000927854.b3lyp_6-31g(d).nwchem.inp (generated) 000927854.b3lyp_6-31g(d).log.xz 000927854.td-b3lyp_6-31g+(d).inp 000927854.td-b3lyp_6-31g+(d).log.xz

000927854.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927854.td-b3lyp_6-31+g(d).gjf (generated)

000927854.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927854.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927854.mol 000927854.PUBCHEM 000927854.mol (via Jmol)
000927864.b3lyp_6-31g(d).inp

000927864.b3lyp_6-31g(d).qchem.inp (generated)

000927864.b3lyp_6-31g(d).gjf (generated)

000927864.b3lyp_6-31g(d).firefly.inp (generated)

000927864.b3lyp_6-31g(d).smash.inp (generated)

000927864.b3lyp_6-31g(d).nwchem.inp (generated) 000927864.b3lyp_6-31g(d).log.xz 000927864.td-b3lyp_6-31g+(d).inp 000927864.td-b3lyp_6-31g+(d).log.xz

000927864.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927864.td-b3lyp_6-31+g(d).gjf (generated)

000927864.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927864.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927864.mol 000927864.PUBCHEM 000927864.mol (via Jmol)
000927865.b3lyp_6-31g(d).inp

000927865.b3lyp_6-31g(d).qchem.inp (generated)

000927865.b3lyp_6-31g(d).gjf (generated)

000927865.b3lyp_6-31g(d).firefly.inp (generated)

000927865.b3lyp_6-31g(d).smash.inp (generated)

000927865.b3lyp_6-31g(d).nwchem.inp (generated) 000927865.b3lyp_6-31g(d).log.xz 000927865.td-b3lyp_6-31g+(d).inp 000927865.td-b3lyp_6-31g+(d).log.xz

000927865.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927865.td-b3lyp_6-31+g(d).gjf (generated)

000927865.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927865.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927865.mol 000927865.PUBCHEM 000927865.mol (via Jmol)
000927866.b3lyp_6-31g(d).inp

000927866.b3lyp_6-31g(d).qchem.inp (generated)

000927866.b3lyp_6-31g(d).gjf (generated)

000927866.b3lyp_6-31g(d).firefly.inp (generated)

000927866.b3lyp_6-31g(d).smash.inp (generated)

000927866.b3lyp_6-31g(d).nwchem.inp (generated) 000927866.b3lyp_6-31g(d).log.xz 000927866.td-b3lyp_6-31g+(d).inp 000927866.td-b3lyp_6-31g+(d).log.xz

000927866.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927866.td-b3lyp_6-31+g(d).gjf (generated)

000927866.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927866.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927866.mol 000927866.PUBCHEM 000927866.mol (via Jmol)
000927877.b3lyp_6-31g(d).inp

000927877.b3lyp_6-31g(d).qchem.inp (generated)

000927877.b3lyp_6-31g(d).gjf (generated)

000927877.b3lyp_6-31g(d).firefly.inp (generated)

000927877.b3lyp_6-31g(d).smash.inp (generated)

000927877.b3lyp_6-31g(d).nwchem.inp (generated) 000927877.b3lyp_6-31g(d).log.xz 000927877.td-b3lyp_6-31g+(d).inp 000927877.td-b3lyp_6-31g+(d).log.xz

000927877.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927877.td-b3lyp_6-31+g(d).gjf (generated)

000927877.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927877.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927877.mol 000927877.PUBCHEM 000927877.mol (via Jmol)
000927911.b3lyp_6-31g(d).inp

000927911.b3lyp_6-31g(d).qchem.inp (generated)

000927911.b3lyp_6-31g(d).gjf (generated)

000927911.b3lyp_6-31g(d).firefly.inp (generated)

000927911.b3lyp_6-31g(d).smash.inp (generated)

000927911.b3lyp_6-31g(d).nwchem.inp (generated) 000927911.b3lyp_6-31g(d).log.xz 000927911.td-b3lyp_6-31g+(d).inp 000927911.td-b3lyp_6-31g+(d).log.xz

000927911.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927911.td-b3lyp_6-31+g(d).gjf (generated)

000927911.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927911.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927911.mol 000927911.PUBCHEM 000927911.mol (via Jmol)
000927912.b3lyp_6-31g(d).inp

000927912.b3lyp_6-31g(d).qchem.inp (generated)

000927912.b3lyp_6-31g(d).gjf (generated)

000927912.b3lyp_6-31g(d).firefly.inp (generated)

000927912.b3lyp_6-31g(d).smash.inp (generated)

000927912.b3lyp_6-31g(d).nwchem.inp (generated) 000927912.b3lyp_6-31g(d).log.xz 000927912.td-b3lyp_6-31g+(d).inp 000927912.td-b3lyp_6-31g+(d).log.xz

000927912.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927912.td-b3lyp_6-31+g(d).gjf (generated)

000927912.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927912.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927912.mol 000927912.PUBCHEM 000927912.mol (via Jmol)
000927938.b3lyp_6-31g(d).inp

000927938.b3lyp_6-31g(d).qchem.inp (generated)

000927938.b3lyp_6-31g(d).gjf (generated)

000927938.b3lyp_6-31g(d).firefly.inp (generated)

000927938.b3lyp_6-31g(d).smash.inp (generated)

000927938.b3lyp_6-31g(d).nwchem.inp (generated) 000927938.b3lyp_6-31g(d).log.xz 000927938.td-b3lyp_6-31g+(d).inp 000927938.td-b3lyp_6-31g+(d).log.xz

000927938.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927938.td-b3lyp_6-31+g(d).gjf (generated)

000927938.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927938.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927938.mol 000927938.PUBCHEM 000927938.mol (via Jmol)
000927942.b3lyp_6-31g(d).inp

000927942.b3lyp_6-31g(d).qchem.inp (generated)

000927942.b3lyp_6-31g(d).gjf (generated)

000927942.b3lyp_6-31g(d).firefly.inp (generated)

000927942.b3lyp_6-31g(d).smash.inp (generated)

000927942.b3lyp_6-31g(d).nwchem.inp (generated) 000927942.b3lyp_6-31g(d).log.xz 000927942.mol 000927942.PUBCHEM 000927942.mol (via Jmol)
000927947.b3lyp_6-31g(d).inp

000927947.b3lyp_6-31g(d).qchem.inp (generated)

000927947.b3lyp_6-31g(d).gjf (generated)

000927947.b3lyp_6-31g(d).firefly.inp (generated)

000927947.b3lyp_6-31g(d).smash.inp (generated)

000927947.b3lyp_6-31g(d).nwchem.inp (generated) 000927947.b3lyp_6-31g(d).log.xz 000927947.td-b3lyp_6-31g+(d).inp 000927947.td-b3lyp_6-31g+(d).log.xz

000927947.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927947.td-b3lyp_6-31+g(d).gjf (generated)

000927947.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927947.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927947.mol 000927947.PUBCHEM 000927947.mol (via Jmol)
000927949.b3lyp_6-31g(d).inp

000927949.b3lyp_6-31g(d).qchem.inp (generated)

000927949.b3lyp_6-31g(d).gjf (generated)

000927949.b3lyp_6-31g(d).firefly.inp (generated)

000927949.b3lyp_6-31g(d).smash.inp (generated)

000927949.b3lyp_6-31g(d).nwchem.inp (generated) 000927949.b3lyp_6-31g(d).log.xz 000927949.mol 000927949.PUBCHEM 000927949.mol (via Jmol)
000927970.b3lyp_6-31g(d).inp

000927970.b3lyp_6-31g(d).qchem.inp (generated)

000927970.b3lyp_6-31g(d).gjf (generated)

000927970.b3lyp_6-31g(d).firefly.inp (generated)

000927970.b3lyp_6-31g(d).smash.inp (generated)

000927970.b3lyp_6-31g(d).nwchem.inp (generated) 000927970.b3lyp_6-31g(d).log.xz 000927970.td-b3lyp_6-31g+(d).inp 000927970.td-b3lyp_6-31g+(d).log.xz

000927970.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927970.td-b3lyp_6-31+g(d).gjf (generated)

000927970.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927970.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927970.mol 000927970.PUBCHEM 000927970.mol (via Jmol)
000927971.b3lyp_6-31g(d).inp

000927971.b3lyp_6-31g(d).qchem.inp (generated)

000927971.b3lyp_6-31g(d).gjf (generated)

000927971.b3lyp_6-31g(d).firefly.inp (generated)

000927971.b3lyp_6-31g(d).smash.inp (generated)

000927971.b3lyp_6-31g(d).nwchem.inp (generated) 000927971.b3lyp_6-31g(d).log.xz 000927971.td-b3lyp_6-31g+(d).inp 000927971.td-b3lyp_6-31g+(d).log.xz

000927971.td-b3lyp_6-31+g(d).qchem.inp (generated)

000927971.td-b3lyp_6-31+g(d).gjf (generated)

000927971.td-b3lyp_6-31+g(d).firefly.inp (generated)

000927971.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000927971.mol 000927971.PUBCHEM 000927971.mol (via Jmol)
000927972.b3lyp_6-31g(d).inp

000927972.b3lyp_6-31g(d).qchem.inp (generated)

000927972.b3lyp_6-31g(d).gjf (generated)

000927972.b3lyp_6-31g(d).firefly.inp (generated)

000927972.b3lyp_6-31g(d).smash.inp (generated)

000927972.b3lyp_6-31g(d).nwchem.inp (generated) 000927972.b3lyp_6-31g(d).log.xz 000927972.mol 000927972.PUBCHEM 000927972.mol (via Jmol)
000927999.b3lyp_6-31g(d).inp

000927999.b3lyp_6-31g(d).qchem.inp (generated)

000927999.b3lyp_6-31g(d).gjf (generated)

000927999.b3lyp_6-31g(d).firefly.inp (generated)

000927999.b3lyp_6-31g(d).smash.inp (generated)

000927999.b3lyp_6-31g(d).nwchem.inp (generated) 000927999.b3lyp_6-31g(d).log.xz 000927999.mol 000927999.PUBCHEM 000927999.mol (via Jmol)
000928015.b3lyp_6-31g(d).inp

000928015.b3lyp_6-31g(d).qchem.inp (generated)

000928015.b3lyp_6-31g(d).gjf (generated)

000928015.b3lyp_6-31g(d).firefly.inp (generated)

000928015.b3lyp_6-31g(d).smash.inp (generated)

000928015.b3lyp_6-31g(d).nwchem.inp (generated) 000928015.b3lyp_6-31g(d).log.xz 000928015.td-b3lyp_6-31g+(d).inp 000928015.td-b3lyp_6-31g+(d).log.xz

000928015.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928015.td-b3lyp_6-31+g(d).gjf (generated)

000928015.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928015.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928015.mol 000928015.PUBCHEM 000928015.mol (via Jmol)
000928034.b3lyp_6-31g(d).inp

000928034.b3lyp_6-31g(d).qchem.inp (generated)

000928034.b3lyp_6-31g(d).gjf (generated)

000928034.b3lyp_6-31g(d).firefly.inp (generated)

000928034.b3lyp_6-31g(d).smash.inp (generated)

000928034.b3lyp_6-31g(d).nwchem.inp (generated) 000928034.b3lyp_6-31g(d).log.xz 000928034.td-b3lyp_6-31g+(d).inp 000928034.td-b3lyp_6-31g+(d).log.xz

000928034.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928034.td-b3lyp_6-31+g(d).gjf (generated)

000928034.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928034.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928034.mol 000928034.PUBCHEM 000928034.mol (via Jmol)
000928036.b3lyp_6-31g(d).inp

000928036.b3lyp_6-31g(d).qchem.inp (generated)

000928036.b3lyp_6-31g(d).gjf (generated)

000928036.b3lyp_6-31g(d).firefly.inp (generated)

000928036.b3lyp_6-31g(d).smash.inp (generated)

000928036.b3lyp_6-31g(d).nwchem.inp (generated) 000928036.b3lyp_6-31g(d).log.xz 000928036.td-b3lyp_6-31g+(d).inp 000928036.td-b3lyp_6-31g+(d).log.xz

000928036.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928036.td-b3lyp_6-31+g(d).gjf (generated)

000928036.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928036.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928036.mol 000928036.PUBCHEM 000928036.mol (via Jmol)
000928037.b3lyp_6-31g(d).inp

000928037.b3lyp_6-31g(d).qchem.inp (generated)

000928037.b3lyp_6-31g(d).gjf (generated)

000928037.b3lyp_6-31g(d).firefly.inp (generated)

000928037.b3lyp_6-31g(d).smash.inp (generated)

000928037.b3lyp_6-31g(d).nwchem.inp (generated) 000928037.b3lyp_6-31g(d).log.xz 000928037.td-b3lyp_6-31g+(d).inp 000928037.td-b3lyp_6-31g+(d).log.xz

000928037.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928037.td-b3lyp_6-31+g(d).gjf (generated)

000928037.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928037.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928037.mol 000928037.PUBCHEM 000928037.mol (via Jmol)
000928059.b3lyp_6-31g(d).inp

000928059.b3lyp_6-31g(d).qchem.inp (generated)

000928059.b3lyp_6-31g(d).gjf (generated)

000928059.b3lyp_6-31g(d).firefly.inp (generated)

000928059.b3lyp_6-31g(d).smash.inp (generated)

000928059.b3lyp_6-31g(d).nwchem.inp (generated) 000928059.b3lyp_6-31g(d).log.xz 000928059.td-b3lyp_6-31g+(d).inp 000928059.td-b3lyp_6-31g+(d).log.xz

000928059.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928059.td-b3lyp_6-31+g(d).gjf (generated)

000928059.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928059.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928059.mol 000928059.PUBCHEM 000928059.mol (via Jmol)
000928060.b3lyp_6-31g(d).inp

000928060.b3lyp_6-31g(d).qchem.inp (generated)

000928060.b3lyp_6-31g(d).gjf (generated)

000928060.b3lyp_6-31g(d).firefly.inp (generated)

000928060.b3lyp_6-31g(d).smash.inp (generated)

000928060.b3lyp_6-31g(d).nwchem.inp (generated) 000928060.b3lyp_6-31g(d).log.xz 000928060.td-b3lyp_6-31g+(d).inp 000928060.td-b3lyp_6-31g+(d).log.xz

000928060.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928060.td-b3lyp_6-31+g(d).gjf (generated)

000928060.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928060.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928060.mol 000928060.PUBCHEM 000928060.mol (via Jmol)
000928081.b3lyp_6-31g(d).inp

000928081.b3lyp_6-31g(d).qchem.inp (generated)

000928081.b3lyp_6-31g(d).gjf (generated)

000928081.b3lyp_6-31g(d).firefly.inp (generated)

000928081.b3lyp_6-31g(d).smash.inp (generated)

000928081.b3lyp_6-31g(d).nwchem.inp (generated) 000928081.b3lyp_6-31g(d).log.xz 000928081.td-b3lyp_6-31g+(d).inp 000928081.td-b3lyp_6-31g+(d).log.xz

000928081.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928081.td-b3lyp_6-31+g(d).gjf (generated)

000928081.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928081.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928081.mol 000928081.PUBCHEM 000928081.mol (via Jmol)
000928088.b3lyp_6-31g(d).inp

000928088.b3lyp_6-31g(d).qchem.inp (generated)

000928088.b3lyp_6-31g(d).gjf (generated)

000928088.b3lyp_6-31g(d).firefly.inp (generated)

000928088.b3lyp_6-31g(d).smash.inp (generated)

000928088.b3lyp_6-31g(d).nwchem.inp (generated) 000928088.b3lyp_6-31g(d).log.xz 000928088.td-b3lyp_6-31g+(d).inp 000928088.td-b3lyp_6-31g+(d).log.xz

000928088.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928088.td-b3lyp_6-31+g(d).gjf (generated)

000928088.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928088.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928088.mol 000928088.PUBCHEM 000928088.mol (via Jmol)
000928104.b3lyp_6-31g(d).inp

000928104.b3lyp_6-31g(d).qchem.inp (generated)

000928104.b3lyp_6-31g(d).gjf (generated)

000928104.b3lyp_6-31g(d).firefly.inp (generated)

000928104.b3lyp_6-31g(d).smash.inp (generated)

000928104.b3lyp_6-31g(d).nwchem.inp (generated) 000928104.b3lyp_6-31g(d).log.xz 000928104.td-b3lyp_6-31g+(d).inp 000928104.td-b3lyp_6-31g+(d).log.xz

000928104.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928104.td-b3lyp_6-31+g(d).gjf (generated)

000928104.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928104.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928104.mol 000928104.PUBCHEM 000928104.mol (via Jmol)
000928111.b3lyp_6-31g(d).inp

000928111.b3lyp_6-31g(d).qchem.inp (generated)

000928111.b3lyp_6-31g(d).gjf (generated)

000928111.b3lyp_6-31g(d).firefly.inp (generated)

000928111.b3lyp_6-31g(d).smash.inp (generated)

000928111.b3lyp_6-31g(d).nwchem.inp (generated) 000928111.b3lyp_6-31g(d).log.xz 000928111.td-b3lyp_6-31g+(d).inp 000928111.td-b3lyp_6-31g+(d).log.xz

000928111.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928111.td-b3lyp_6-31+g(d).gjf (generated)

000928111.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928111.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928111.mol 000928111.PUBCHEM 000928111.mol (via Jmol)
000928112.b3lyp_6-31g(d).inp

000928112.b3lyp_6-31g(d).qchem.inp (generated)

000928112.b3lyp_6-31g(d).gjf (generated)

000928112.b3lyp_6-31g(d).firefly.inp (generated)

000928112.b3lyp_6-31g(d).smash.inp (generated)

000928112.b3lyp_6-31g(d).nwchem.inp (generated) 000928112.b3lyp_6-31g(d).log.xz 000928112.td-b3lyp_6-31g+(d).inp 000928112.td-b3lyp_6-31g+(d).log.xz

000928112.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928112.td-b3lyp_6-31+g(d).gjf (generated)

000928112.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928112.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928112.mol 000928112.PUBCHEM 000928112.mol (via Jmol)
000928114.b3lyp_6-31g(d).inp

000928114.b3lyp_6-31g(d).qchem.inp (generated)

000928114.b3lyp_6-31g(d).gjf (generated)

000928114.b3lyp_6-31g(d).firefly.inp (generated)

000928114.b3lyp_6-31g(d).smash.inp (generated)

000928114.b3lyp_6-31g(d).nwchem.inp (generated) 000928114.b3lyp_6-31g(d).log.xz 000928114.mol 000928114.PUBCHEM 000928114.mol (via Jmol)
000928116.b3lyp_6-31g(d).inp

000928116.b3lyp_6-31g(d).qchem.inp (generated)

000928116.b3lyp_6-31g(d).gjf (generated)

000928116.b3lyp_6-31g(d).firefly.inp (generated)

000928116.b3lyp_6-31g(d).smash.inp (generated)

000928116.b3lyp_6-31g(d).nwchem.inp (generated) 000928116.b3lyp_6-31g(d).log.xz 000928116.mol 000928116.PUBCHEM 000928116.mol (via Jmol)
000928135.b3lyp_6-31g(d).inp

000928135.b3lyp_6-31g(d).qchem.inp (generated)

000928135.b3lyp_6-31g(d).gjf (generated)

000928135.b3lyp_6-31g(d).firefly.inp (generated)

000928135.b3lyp_6-31g(d).smash.inp (generated)

000928135.b3lyp_6-31g(d).nwchem.inp (generated) 000928135.b3lyp_6-31g(d).log.xz 000928135.td-b3lyp_6-31g+(d).inp 000928135.td-b3lyp_6-31g+(d).log.xz

000928135.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928135.td-b3lyp_6-31+g(d).gjf (generated)

000928135.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928135.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928135.mol 000928135.PUBCHEM 000928135.mol (via Jmol)
000928138.b3lyp_6-31g(d).inp

000928138.b3lyp_6-31g(d).qchem.inp (generated)

000928138.b3lyp_6-31g(d).gjf (generated)

000928138.b3lyp_6-31g(d).firefly.inp (generated)

000928138.b3lyp_6-31g(d).smash.inp (generated)

000928138.b3lyp_6-31g(d).nwchem.inp (generated) 000928138.b3lyp_6-31g(d).log.xz 000928138.td-b3lyp_6-31g+(d).inp 000928138.td-b3lyp_6-31g+(d).log.xz

000928138.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928138.td-b3lyp_6-31+g(d).gjf (generated)

000928138.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928138.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928138.mol 000928138.PUBCHEM 000928138.mol (via Jmol)
000928140.b3lyp_6-31g(d).inp

000928140.b3lyp_6-31g(d).qchem.inp (generated)

000928140.b3lyp_6-31g(d).gjf (generated)

000928140.b3lyp_6-31g(d).firefly.inp (generated)

000928140.b3lyp_6-31g(d).smash.inp (generated)

000928140.b3lyp_6-31g(d).nwchem.inp (generated) 000928140.b3lyp_6-31g(d).log.xz 000928140.td-b3lyp_6-31g+(d).inp 000928140.td-b3lyp_6-31g+(d).log.xz

000928140.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928140.td-b3lyp_6-31+g(d).gjf (generated)

000928140.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928140.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928140.mol 000928140.PUBCHEM 000928140.mol (via Jmol)
000928141.b3lyp_6-31g(d).inp

000928141.b3lyp_6-31g(d).qchem.inp (generated)

000928141.b3lyp_6-31g(d).gjf (generated)

000928141.b3lyp_6-31g(d).firefly.inp (generated)

000928141.b3lyp_6-31g(d).smash.inp (generated)

000928141.b3lyp_6-31g(d).nwchem.inp (generated) 000928141.b3lyp_6-31g(d).log.xz 000928141.td-b3lyp_6-31g+(d).inp 000928141.td-b3lyp_6-31g+(d).log.xz

000928141.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928141.td-b3lyp_6-31+g(d).gjf (generated)

000928141.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928141.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928141.mol 000928141.PUBCHEM 000928141.mol (via Jmol)
000928148.b3lyp_6-31g(d).inp

000928148.b3lyp_6-31g(d).qchem.inp (generated)

000928148.b3lyp_6-31g(d).gjf (generated)

000928148.b3lyp_6-31g(d).firefly.inp (generated)

000928148.b3lyp_6-31g(d).smash.inp (generated)

000928148.b3lyp_6-31g(d).nwchem.inp (generated) 000928148.b3lyp_6-31g(d).log.xz 000928148.td-b3lyp_6-31g+(d).inp 000928148.td-b3lyp_6-31g+(d).log.xz

000928148.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928148.td-b3lyp_6-31+g(d).gjf (generated)

000928148.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928148.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928148.mol 000928148.PUBCHEM 000928148.mol (via Jmol)
000928153.b3lyp_6-31g(d).inp

000928153.b3lyp_6-31g(d).qchem.inp (generated)

000928153.b3lyp_6-31g(d).gjf (generated)

000928153.b3lyp_6-31g(d).firefly.inp (generated)

000928153.b3lyp_6-31g(d).smash.inp (generated)

000928153.b3lyp_6-31g(d).nwchem.inp (generated) 000928153.b3lyp_6-31g(d).log.xz 000928153.td-b3lyp_6-31g+(d).inp 000928153.td-b3lyp_6-31g+(d).log.xz

000928153.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928153.td-b3lyp_6-31+g(d).gjf (generated)

000928153.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928153.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928153.mol 000928153.PUBCHEM 000928153.mol (via Jmol)
000928191.b3lyp_6-31g(d).inp

000928191.b3lyp_6-31g(d).qchem.inp (generated)

000928191.b3lyp_6-31g(d).gjf (generated)

000928191.b3lyp_6-31g(d).firefly.inp (generated)

000928191.b3lyp_6-31g(d).smash.inp (generated)

000928191.b3lyp_6-31g(d).nwchem.inp (generated) 000928191.b3lyp_6-31g(d).log.xz 000928191.td-b3lyp_6-31g+(d).inp 000928191.td-b3lyp_6-31g+(d).log.xz

000928191.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928191.td-b3lyp_6-31+g(d).gjf (generated)

000928191.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928191.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928191.mol 000928191.PUBCHEM 000928191.mol (via Jmol)
000928192.b3lyp_6-31g(d).inp

000928192.b3lyp_6-31g(d).qchem.inp (generated)

000928192.b3lyp_6-31g(d).gjf (generated)

000928192.b3lyp_6-31g(d).firefly.inp (generated)

000928192.b3lyp_6-31g(d).smash.inp (generated)

000928192.b3lyp_6-31g(d).nwchem.inp (generated) 000928192.b3lyp_6-31g(d).log.xz 000928192.td-b3lyp_6-31g+(d).inp 000928192.td-b3lyp_6-31g+(d).log.xz

000928192.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928192.td-b3lyp_6-31+g(d).gjf (generated)

000928192.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928192.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928192.mol 000928192.PUBCHEM 000928192.mol (via Jmol)
000928193.b3lyp_6-31g(d).inp

000928193.b3lyp_6-31g(d).qchem.inp (generated)

000928193.b3lyp_6-31g(d).gjf (generated)

000928193.b3lyp_6-31g(d).firefly.inp (generated)

000928193.b3lyp_6-31g(d).smash.inp (generated)

000928193.b3lyp_6-31g(d).nwchem.inp (generated) 000928193.b3lyp_6-31g(d).log.xz 000928193.td-b3lyp_6-31g+(d).inp 000928193.td-b3lyp_6-31g+(d).log.xz

000928193.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928193.td-b3lyp_6-31+g(d).gjf (generated)

000928193.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928193.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928193.mol 000928193.PUBCHEM 000928193.mol (via Jmol)
000928194.b3lyp_6-31g(d).inp

000928194.b3lyp_6-31g(d).qchem.inp (generated)

000928194.b3lyp_6-31g(d).gjf (generated)

000928194.b3lyp_6-31g(d).firefly.inp (generated)

000928194.b3lyp_6-31g(d).smash.inp (generated)

000928194.b3lyp_6-31g(d).nwchem.inp (generated) 000928194.b3lyp_6-31g(d).log.xz 000928194.td-b3lyp_6-31g+(d).inp 000928194.td-b3lyp_6-31g+(d).log.xz

000928194.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928194.td-b3lyp_6-31+g(d).gjf (generated)

000928194.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928194.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928194.mol 000928194.PUBCHEM 000928194.mol (via Jmol)
000928207.b3lyp_6-31g(d).inp

000928207.b3lyp_6-31g(d).qchem.inp (generated)

000928207.b3lyp_6-31g(d).gjf (generated)

000928207.b3lyp_6-31g(d).firefly.inp (generated)

000928207.b3lyp_6-31g(d).smash.inp (generated)

000928207.b3lyp_6-31g(d).nwchem.inp (generated) 000928207.b3lyp_6-31g(d).log.xz 000928207.td-b3lyp_6-31g+(d).inp 000928207.td-b3lyp_6-31g+(d).log.xz

000928207.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928207.td-b3lyp_6-31+g(d).gjf (generated)

000928207.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928207.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928207.mol 000928207.PUBCHEM 000928207.mol (via Jmol)
000928208.b3lyp_6-31g(d).inp

000928208.b3lyp_6-31g(d).qchem.inp (generated)

000928208.b3lyp_6-31g(d).gjf (generated)

000928208.b3lyp_6-31g(d).firefly.inp (generated)

000928208.b3lyp_6-31g(d).smash.inp (generated)

000928208.b3lyp_6-31g(d).nwchem.inp (generated) 000928208.b3lyp_6-31g(d).log.xz 000928208.td-b3lyp_6-31g+(d).inp 000928208.td-b3lyp_6-31g+(d).log.xz

000928208.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928208.td-b3lyp_6-31+g(d).gjf (generated)

000928208.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928208.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928208.mol 000928208.PUBCHEM 000928208.mol (via Jmol)
000928219.b3lyp_6-31g(d).inp

000928219.b3lyp_6-31g(d).qchem.inp (generated)

000928219.b3lyp_6-31g(d).gjf (generated)

000928219.b3lyp_6-31g(d).firefly.inp (generated)

000928219.b3lyp_6-31g(d).smash.inp (generated)

000928219.b3lyp_6-31g(d).nwchem.inp (generated) 000928219.b3lyp_6-31g(d).log.xz 000928219.td-b3lyp_6-31g+(d).inp 000928219.td-b3lyp_6-31g+(d).log.xz

000928219.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928219.td-b3lyp_6-31+g(d).gjf (generated)

000928219.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928219.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928219.mol 000928219.PUBCHEM 000928219.mol (via Jmol)
000928223.b3lyp_6-31g(d).inp

000928223.b3lyp_6-31g(d).qchem.inp (generated)

000928223.b3lyp_6-31g(d).gjf (generated)

000928223.b3lyp_6-31g(d).firefly.inp (generated)

000928223.b3lyp_6-31g(d).smash.inp (generated)

000928223.b3lyp_6-31g(d).nwchem.inp (generated) 000928223.b3lyp_6-31g(d).log.xz 000928223.td-b3lyp_6-31g+(d).inp 000928223.td-b3lyp_6-31g+(d).log.xz

000928223.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928223.td-b3lyp_6-31+g(d).gjf (generated)

000928223.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928223.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928223.mol 000928223.PUBCHEM 000928223.mol (via Jmol)
000928226.b3lyp_6-31g(d).inp

000928226.b3lyp_6-31g(d).qchem.inp (generated)

000928226.b3lyp_6-31g(d).gjf (generated)

000928226.b3lyp_6-31g(d).firefly.inp (generated)

000928226.b3lyp_6-31g(d).smash.inp (generated)

000928226.b3lyp_6-31g(d).nwchem.inp (generated) 000928226.b3lyp_6-31g(d).log.xz 000928226.td-b3lyp_6-31g+(d).inp 000928226.td-b3lyp_6-31g+(d).log.xz

000928226.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928226.td-b3lyp_6-31+g(d).gjf (generated)

000928226.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928226.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928226.mol 000928226.PUBCHEM 000928226.mol (via Jmol)
000928227.b3lyp_6-31g(d).inp

000928227.b3lyp_6-31g(d).qchem.inp (generated)

000928227.b3lyp_6-31g(d).gjf (generated)

000928227.b3lyp_6-31g(d).firefly.inp (generated)

000928227.b3lyp_6-31g(d).smash.inp (generated)

000928227.b3lyp_6-31g(d).nwchem.inp (generated) 000928227.b3lyp_6-31g(d).log.xz 000928227.td-b3lyp_6-31g+(d).inp 000928227.td-b3lyp_6-31g+(d).log.xz

000928227.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928227.td-b3lyp_6-31+g(d).gjf (generated)

000928227.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928227.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928227.mol 000928227.PUBCHEM 000928227.mol (via Jmol)
000928228.b3lyp_6-31g(d).inp

000928228.b3lyp_6-31g(d).qchem.inp (generated)

000928228.b3lyp_6-31g(d).gjf (generated)

000928228.b3lyp_6-31g(d).firefly.inp (generated)

000928228.b3lyp_6-31g(d).smash.inp (generated)

000928228.b3lyp_6-31g(d).nwchem.inp (generated) 000928228.b3lyp_6-31g(d).log.xz 000928228.td-b3lyp_6-31g+(d).inp 000928228.td-b3lyp_6-31g+(d).log.xz

000928228.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928228.td-b3lyp_6-31+g(d).gjf (generated)

000928228.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928228.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928228.mol 000928228.PUBCHEM 000928228.mol (via Jmol)
000928236.b3lyp_6-31g(d).inp

000928236.b3lyp_6-31g(d).qchem.inp (generated)

000928236.b3lyp_6-31g(d).gjf (generated)

000928236.b3lyp_6-31g(d).firefly.inp (generated)

000928236.b3lyp_6-31g(d).smash.inp (generated)

000928236.b3lyp_6-31g(d).nwchem.inp (generated) 000928236.b3lyp_6-31g(d).log.xz 000928236.td-b3lyp_6-31g+(d).inp 000928236.td-b3lyp_6-31g+(d).log.xz

000928236.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928236.td-b3lyp_6-31+g(d).gjf (generated)

000928236.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928236.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928236.mol 000928236.PUBCHEM 000928236.mol (via Jmol)
000928238.b3lyp_6-31g(d).inp

000928238.b3lyp_6-31g(d).qchem.inp (generated)

000928238.b3lyp_6-31g(d).gjf (generated)

000928238.b3lyp_6-31g(d).firefly.inp (generated)

000928238.b3lyp_6-31g(d).smash.inp (generated)

000928238.b3lyp_6-31g(d).nwchem.inp (generated) 000928238.b3lyp_6-31g(d).log.xz 000928238.td-b3lyp_6-31g+(d).inp 000928238.td-b3lyp_6-31g+(d).log.xz

000928238.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928238.td-b3lyp_6-31+g(d).gjf (generated)

000928238.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928238.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928238.mol 000928238.PUBCHEM 000928238.mol (via Jmol)
000928239.b3lyp_6-31g(d).inp

000928239.b3lyp_6-31g(d).qchem.inp (generated)

000928239.b3lyp_6-31g(d).gjf (generated)

000928239.b3lyp_6-31g(d).firefly.inp (generated)

000928239.b3lyp_6-31g(d).smash.inp (generated)

000928239.b3lyp_6-31g(d).nwchem.inp (generated) 000928239.b3lyp_6-31g(d).log.xz 000928239.td-b3lyp_6-31g+(d).inp 000928239.td-b3lyp_6-31g+(d).log.xz

000928239.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928239.td-b3lyp_6-31+g(d).gjf (generated)

000928239.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928239.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928239.mol 000928239.PUBCHEM 000928239.mol (via Jmol)
000928241.b3lyp_6-31g(d).inp

000928241.b3lyp_6-31g(d).qchem.inp (generated)

000928241.b3lyp_6-31g(d).gjf (generated)

000928241.b3lyp_6-31g(d).firefly.inp (generated)

000928241.b3lyp_6-31g(d).smash.inp (generated)

000928241.b3lyp_6-31g(d).nwchem.inp (generated) 000928241.b3lyp_6-31g(d).log.xz 000928241.td-b3lyp_6-31g+(d).inp 000928241.td-b3lyp_6-31g+(d).log.xz

000928241.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928241.td-b3lyp_6-31+g(d).gjf (generated)

000928241.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928241.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928241.mol 000928241.PUBCHEM 000928241.mol (via Jmol)
000928242.b3lyp_6-31g(d).inp

000928242.b3lyp_6-31g(d).qchem.inp (generated)

000928242.b3lyp_6-31g(d).gjf (generated)

000928242.b3lyp_6-31g(d).firefly.inp (generated)

000928242.b3lyp_6-31g(d).smash.inp (generated)

000928242.b3lyp_6-31g(d).nwchem.inp (generated) 000928242.b3lyp_6-31g(d).log.xz 000928242.td-b3lyp_6-31g+(d).inp 000928242.td-b3lyp_6-31g+(d).log.xz

000928242.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928242.td-b3lyp_6-31+g(d).gjf (generated)

000928242.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928242.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928242.mol 000928242.PUBCHEM 000928242.mol (via Jmol)
000928243.b3lyp_6-31g(d).inp

000928243.b3lyp_6-31g(d).qchem.inp (generated)

000928243.b3lyp_6-31g(d).gjf (generated)

000928243.b3lyp_6-31g(d).firefly.inp (generated)

000928243.b3lyp_6-31g(d).smash.inp (generated)

000928243.b3lyp_6-31g(d).nwchem.inp (generated) 000928243.b3lyp_6-31g(d).log.xz 000928243.td-b3lyp_6-31g+(d).inp 000928243.td-b3lyp_6-31g+(d).log.xz

000928243.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928243.td-b3lyp_6-31+g(d).gjf (generated)

000928243.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928243.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928243.mol 000928243.PUBCHEM 000928243.mol (via Jmol)
000928244.b3lyp_6-31g(d).inp

000928244.b3lyp_6-31g(d).qchem.inp (generated)

000928244.b3lyp_6-31g(d).gjf (generated)

000928244.b3lyp_6-31g(d).firefly.inp (generated)

000928244.b3lyp_6-31g(d).smash.inp (generated)

000928244.b3lyp_6-31g(d).nwchem.inp (generated) 000928244.b3lyp_6-31g(d).log.xz 000928244.td-b3lyp_6-31g+(d).inp 000928244.td-b3lyp_6-31g+(d).log.xz

000928244.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928244.td-b3lyp_6-31+g(d).gjf (generated)

000928244.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928244.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928244.mol 000928244.PUBCHEM 000928244.mol (via Jmol)
000928245.b3lyp_6-31g(d).inp

000928245.b3lyp_6-31g(d).qchem.inp (generated)

000928245.b3lyp_6-31g(d).gjf (generated)

000928245.b3lyp_6-31g(d).firefly.inp (generated)

000928245.b3lyp_6-31g(d).smash.inp (generated)

000928245.b3lyp_6-31g(d).nwchem.inp (generated) 000928245.b3lyp_6-31g(d).log.xz 000928245.td-b3lyp_6-31g+(d).inp 000928245.td-b3lyp_6-31g+(d).log.xz

000928245.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928245.td-b3lyp_6-31+g(d).gjf (generated)

000928245.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928245.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928245.mol 000928245.PUBCHEM 000928245.mol (via Jmol)
000928246.b3lyp_6-31g(d).inp

000928246.b3lyp_6-31g(d).qchem.inp (generated)

000928246.b3lyp_6-31g(d).gjf (generated)

000928246.b3lyp_6-31g(d).firefly.inp (generated)

000928246.b3lyp_6-31g(d).smash.inp (generated)

000928246.b3lyp_6-31g(d).nwchem.inp (generated) 000928246.b3lyp_6-31g(d).log.xz 000928246.td-b3lyp_6-31g+(d).inp 000928246.td-b3lyp_6-31g+(d).log.xz

000928246.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928246.td-b3lyp_6-31+g(d).gjf (generated)

000928246.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928246.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928246.mol 000928246.PUBCHEM 000928246.mol (via Jmol)
000928247.b3lyp_6-31g(d).inp

000928247.b3lyp_6-31g(d).qchem.inp (generated)

000928247.b3lyp_6-31g(d).gjf (generated)

000928247.b3lyp_6-31g(d).firefly.inp (generated)

000928247.b3lyp_6-31g(d).smash.inp (generated)

000928247.b3lyp_6-31g(d).nwchem.inp (generated) 000928247.b3lyp_6-31g(d).log.xz 000928247.td-b3lyp_6-31g+(d).inp 000928247.td-b3lyp_6-31g+(d).log.xz

000928247.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928247.td-b3lyp_6-31+g(d).gjf (generated)

000928247.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928247.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928247.mol 000928247.PUBCHEM 000928247.mol (via Jmol)
000928248.b3lyp_6-31g(d).inp

000928248.b3lyp_6-31g(d).qchem.inp (generated)

000928248.b3lyp_6-31g(d).gjf (generated)

000928248.b3lyp_6-31g(d).firefly.inp (generated)

000928248.b3lyp_6-31g(d).smash.inp (generated)

000928248.b3lyp_6-31g(d).nwchem.inp (generated) 000928248.b3lyp_6-31g(d).log.xz 000928248.mol 000928248.PUBCHEM 000928248.mol (via Jmol)
000928271.b3lyp_6-31g(d).inp

000928271.b3lyp_6-31g(d).qchem.inp (generated)

000928271.b3lyp_6-31g(d).gjf (generated)

000928271.b3lyp_6-31g(d).firefly.inp (generated)

000928271.b3lyp_6-31g(d).smash.inp (generated)

000928271.b3lyp_6-31g(d).nwchem.inp (generated) 000928271.b3lyp_6-31g(d).log.xz 000928271.td-b3lyp_6-31g+(d).inp 000928271.td-b3lyp_6-31g+(d).log.xz

000928271.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928271.td-b3lyp_6-31+g(d).gjf (generated)

000928271.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928271.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928271.mol 000928271.PUBCHEM 000928271.mol (via Jmol)
000928272.b3lyp_6-31g(d).inp

000928272.b3lyp_6-31g(d).qchem.inp (generated)

000928272.b3lyp_6-31g(d).gjf (generated)

000928272.b3lyp_6-31g(d).firefly.inp (generated)

000928272.b3lyp_6-31g(d).smash.inp (generated)

000928272.b3lyp_6-31g(d).nwchem.inp (generated) 000928272.b3lyp_6-31g(d).log.xz 000928272.td-b3lyp_6-31g+(d).inp 000928272.td-b3lyp_6-31g+(d).log.xz

000928272.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928272.td-b3lyp_6-31+g(d).gjf (generated)

000928272.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928272.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928272.mol 000928272.PUBCHEM 000928272.mol (via Jmol)
000928274.b3lyp_6-31g(d).inp

000928274.b3lyp_6-31g(d).qchem.inp (generated)

000928274.b3lyp_6-31g(d).gjf (generated)

000928274.b3lyp_6-31g(d).firefly.inp (generated)

000928274.b3lyp_6-31g(d).smash.inp (generated)

000928274.b3lyp_6-31g(d).nwchem.inp (generated) 000928274.b3lyp_6-31g(d).log.xz 000928274.td-b3lyp_6-31g+(d).inp 000928274.td-b3lyp_6-31g+(d).log.xz

000928274.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928274.td-b3lyp_6-31+g(d).gjf (generated)

000928274.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928274.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928274.mol 000928274.PUBCHEM 000928274.mol (via Jmol)
000928283.b3lyp_6-31g(d).inp

000928283.b3lyp_6-31g(d).qchem.inp (generated)

000928283.b3lyp_6-31g(d).gjf (generated)

000928283.b3lyp_6-31g(d).firefly.inp (generated)

000928283.b3lyp_6-31g(d).smash.inp (generated)

000928283.b3lyp_6-31g(d).nwchem.inp (generated) 000928283.b3lyp_6-31g(d).log.xz 000928283.mol 000928283.PUBCHEM 000928283.mol (via Jmol)
000928292.b3lyp_6-31g(d).inp

000928292.b3lyp_6-31g(d).qchem.inp (generated)

000928292.b3lyp_6-31g(d).gjf (generated)

000928292.b3lyp_6-31g(d).firefly.inp (generated)

000928292.b3lyp_6-31g(d).smash.inp (generated)

000928292.b3lyp_6-31g(d).nwchem.inp (generated) 000928292.b3lyp_6-31g(d).log.xz 000928292.td-b3lyp_6-31g+(d).inp 000928292.td-b3lyp_6-31g+(d).log.xz

000928292.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928292.td-b3lyp_6-31+g(d).gjf (generated)

000928292.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928292.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928292.mol 000928292.PUBCHEM 000928292.mol (via Jmol)
000928297.b3lyp_6-31g(d).inp

000928297.b3lyp_6-31g(d).qchem.inp (generated)

000928297.b3lyp_6-31g(d).gjf (generated)

000928297.b3lyp_6-31g(d).firefly.inp (generated)

000928297.b3lyp_6-31g(d).smash.inp (generated)

000928297.b3lyp_6-31g(d).nwchem.inp (generated) 000928297.b3lyp_6-31g(d).log.xz 000928297.td-b3lyp_6-31g+(d).inp 000928297.td-b3lyp_6-31g+(d).log.xz

000928297.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928297.td-b3lyp_6-31+g(d).gjf (generated)

000928297.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928297.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928297.mol 000928297.PUBCHEM 000928297.mol (via Jmol)
000928331.b3lyp_6-31g(d).inp

000928331.b3lyp_6-31g(d).qchem.inp (generated)

000928331.b3lyp_6-31g(d).gjf (generated)

000928331.b3lyp_6-31g(d).firefly.inp (generated)

000928331.b3lyp_6-31g(d).smash.inp (generated)

000928331.b3lyp_6-31g(d).nwchem.inp (generated) 000928331.b3lyp_6-31g(d).log.xz 000928331.td-b3lyp_6-31g+(d).inp 000928331.td-b3lyp_6-31g+(d).log.xz

000928331.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928331.td-b3lyp_6-31+g(d).gjf (generated)

000928331.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928331.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928331.mol 000928331.PUBCHEM 000928331.mol (via Jmol)
000928332.b3lyp_6-31g(d).inp

000928332.b3lyp_6-31g(d).qchem.inp (generated)

000928332.b3lyp_6-31g(d).gjf (generated)

000928332.b3lyp_6-31g(d).firefly.inp (generated)

000928332.b3lyp_6-31g(d).smash.inp (generated)

000928332.b3lyp_6-31g(d).nwchem.inp (generated) 000928332.b3lyp_6-31g(d).log.xz 000928332.td-b3lyp_6-31g+(d).inp 000928332.td-b3lyp_6-31g+(d).log.xz

000928332.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928332.td-b3lyp_6-31+g(d).gjf (generated)

000928332.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928332.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928332.mol 000928332.PUBCHEM 000928332.mol (via Jmol)
000928358.b3lyp_6-31g(d).inp

000928358.b3lyp_6-31g(d).qchem.inp (generated)

000928358.b3lyp_6-31g(d).gjf (generated)

000928358.b3lyp_6-31g(d).firefly.inp (generated)

000928358.b3lyp_6-31g(d).smash.inp (generated)

000928358.b3lyp_6-31g(d).nwchem.inp (generated) 000928358.b3lyp_6-31g(d).log.xz 000928358.td-b3lyp_6-31g+(d).inp 000928358.td-b3lyp_6-31g+(d).log.xz

000928358.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928358.td-b3lyp_6-31+g(d).gjf (generated)

000928358.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928358.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928358.mol 000928358.PUBCHEM 000928358.mol (via Jmol)
000928361.b3lyp_6-31g(d).inp

000928361.b3lyp_6-31g(d).qchem.inp (generated)

000928361.b3lyp_6-31g(d).gjf (generated)

000928361.b3lyp_6-31g(d).firefly.inp (generated)

000928361.b3lyp_6-31g(d).smash.inp (generated)

000928361.b3lyp_6-31g(d).nwchem.inp (generated) 000928361.b3lyp_6-31g(d).log.xz 000928361.td-b3lyp_6-31g+(d).inp 000928361.td-b3lyp_6-31g+(d).log.xz

000928361.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928361.td-b3lyp_6-31+g(d).gjf (generated)

000928361.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928361.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928361.mol 000928361.PUBCHEM 000928361.mol (via Jmol)
000928367.b3lyp_6-31g(d).inp

000928367.b3lyp_6-31g(d).qchem.inp (generated)

000928367.b3lyp_6-31g(d).gjf (generated)

000928367.b3lyp_6-31g(d).firefly.inp (generated)

000928367.b3lyp_6-31g(d).smash.inp (generated)

000928367.b3lyp_6-31g(d).nwchem.inp (generated) 000928367.b3lyp_6-31g(d).log.xz 000928367.td-b3lyp_6-31g+(d).inp 000928367.td-b3lyp_6-31g+(d).log.xz

000928367.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928367.td-b3lyp_6-31+g(d).gjf (generated)

000928367.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928367.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928367.mol 000928367.PUBCHEM 000928367.mol (via Jmol)
000928372.b3lyp_6-31g(d).inp

000928372.b3lyp_6-31g(d).qchem.inp (generated)

000928372.b3lyp_6-31g(d).gjf (generated)

000928372.b3lyp_6-31g(d).firefly.inp (generated)

000928372.b3lyp_6-31g(d).smash.inp (generated)

000928372.b3lyp_6-31g(d).nwchem.inp (generated) 000928372.b3lyp_6-31g(d).log.xz 000928372.td-b3lyp_6-31g+(d).inp 000928372.td-b3lyp_6-31g+(d).log.xz

000928372.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928372.td-b3lyp_6-31+g(d).gjf (generated)

000928372.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928372.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928372.mol 000928372.PUBCHEM 000928372.mol (via Jmol)
000928377.b3lyp_6-31g(d).inp

000928377.b3lyp_6-31g(d).qchem.inp (generated)

000928377.b3lyp_6-31g(d).gjf (generated)

000928377.b3lyp_6-31g(d).firefly.inp (generated)

000928377.b3lyp_6-31g(d).smash.inp (generated)

000928377.b3lyp_6-31g(d).nwchem.inp (generated) 000928377.b3lyp_6-31g(d).log.xz 000928377.td-b3lyp_6-31g+(d).inp 000928377.td-b3lyp_6-31g+(d).log.xz

000928377.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928377.td-b3lyp_6-31+g(d).gjf (generated)

000928377.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928377.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928377.mol 000928377.PUBCHEM 000928377.mol (via Jmol)
000928378.b3lyp_6-31g(d).inp

000928378.b3lyp_6-31g(d).qchem.inp (generated)

000928378.b3lyp_6-31g(d).gjf (generated)

000928378.b3lyp_6-31g(d).firefly.inp (generated)

000928378.b3lyp_6-31g(d).smash.inp (generated)

000928378.b3lyp_6-31g(d).nwchem.inp (generated) 000928378.b3lyp_6-31g(d).log.xz 000928378.td-b3lyp_6-31g+(d).inp 000928378.td-b3lyp_6-31g+(d).log.xz

000928378.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928378.td-b3lyp_6-31+g(d).gjf (generated)

000928378.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928378.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928378.mol 000928378.PUBCHEM 000928378.mol (via Jmol)
000928379.b3lyp_6-31g(d).inp

000928379.b3lyp_6-31g(d).qchem.inp (generated)

000928379.b3lyp_6-31g(d).gjf (generated)

000928379.b3lyp_6-31g(d).firefly.inp (generated)

000928379.b3lyp_6-31g(d).smash.inp (generated)

000928379.b3lyp_6-31g(d).nwchem.inp (generated) 000928379.b3lyp_6-31g(d).log.xz 000928379.td-b3lyp_6-31g+(d).inp 000928379.td-b3lyp_6-31g+(d).log.xz

000928379.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928379.td-b3lyp_6-31+g(d).gjf (generated)

000928379.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928379.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928379.mol 000928379.PUBCHEM 000928379.mol (via Jmol)
000928380.b3lyp_6-31g(d).inp

000928380.b3lyp_6-31g(d).qchem.inp (generated)

000928380.b3lyp_6-31g(d).gjf (generated)

000928380.b3lyp_6-31g(d).firefly.inp (generated)

000928380.b3lyp_6-31g(d).smash.inp (generated)

000928380.b3lyp_6-31g(d).nwchem.inp (generated) 000928380.b3lyp_6-31g(d).log.xz 000928380.td-b3lyp_6-31g+(d).inp 000928380.td-b3lyp_6-31g+(d).log.xz

000928380.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928380.td-b3lyp_6-31+g(d).gjf (generated)

000928380.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928380.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928380.mol 000928380.PUBCHEM 000928380.mol (via Jmol)
000928382.b3lyp_6-31g(d).inp

000928382.b3lyp_6-31g(d).qchem.inp (generated)

000928382.b3lyp_6-31g(d).gjf (generated)

000928382.b3lyp_6-31g(d).firefly.inp (generated)

000928382.b3lyp_6-31g(d).smash.inp (generated)

000928382.b3lyp_6-31g(d).nwchem.inp (generated) 000928382.b3lyp_6-31g(d).log.xz 000928382.td-b3lyp_6-31g+(d).inp 000928382.td-b3lyp_6-31g+(d).log.xz

000928382.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928382.td-b3lyp_6-31+g(d).gjf (generated)

000928382.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928382.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928382.mol 000928382.PUBCHEM 000928382.mol (via Jmol)
000928383.b3lyp_6-31g(d).inp

000928383.b3lyp_6-31g(d).qchem.inp (generated)

000928383.b3lyp_6-31g(d).gjf (generated)

000928383.b3lyp_6-31g(d).firefly.inp (generated)

000928383.b3lyp_6-31g(d).smash.inp (generated)

000928383.b3lyp_6-31g(d).nwchem.inp (generated) 000928383.b3lyp_6-31g(d).log.xz 000928383.td-b3lyp_6-31g+(d).inp 000928383.td-b3lyp_6-31g+(d).log.xz

000928383.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928383.td-b3lyp_6-31+g(d).gjf (generated)

000928383.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928383.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928383.mol 000928383.PUBCHEM 000928383.mol (via Jmol)
000928398.b3lyp_6-31g(d).inp

000928398.b3lyp_6-31g(d).qchem.inp (generated)

000928398.b3lyp_6-31g(d).gjf (generated)

000928398.b3lyp_6-31g(d).firefly.inp (generated)

000928398.b3lyp_6-31g(d).smash.inp (generated)

000928398.b3lyp_6-31g(d).nwchem.inp (generated) 000928398.b3lyp_6-31g(d).log.xz 000928398.td-b3lyp_6-31g+(d).inp 000928398.td-b3lyp_6-31g+(d).log.xz

000928398.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928398.td-b3lyp_6-31+g(d).gjf (generated)

000928398.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928398.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928398.mol 000928398.PUBCHEM 000928398.mol (via Jmol)
000928401.b3lyp_6-31g(d).inp

000928401.b3lyp_6-31g(d).qchem.inp (generated)

000928401.b3lyp_6-31g(d).gjf (generated)

000928401.b3lyp_6-31g(d).firefly.inp (generated)

000928401.b3lyp_6-31g(d).smash.inp (generated)

000928401.b3lyp_6-31g(d).nwchem.inp (generated) 000928401.b3lyp_6-31g(d).log.xz 000928401.td-b3lyp_6-31g+(d).inp 000928401.td-b3lyp_6-31g+(d).log.xz

000928401.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928401.td-b3lyp_6-31+g(d).gjf (generated)

000928401.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928401.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928401.mol 000928401.PUBCHEM 000928401.mol (via Jmol)
000928412.b3lyp_6-31g(d).inp

000928412.b3lyp_6-31g(d).qchem.inp (generated)

000928412.b3lyp_6-31g(d).gjf (generated)

000928412.b3lyp_6-31g(d).firefly.inp (generated)

000928412.b3lyp_6-31g(d).smash.inp (generated)

000928412.b3lyp_6-31g(d).nwchem.inp (generated) 000928412.b3lyp_6-31g(d).log.xz 000928412.td-b3lyp_6-31g+(d).inp 000928412.td-b3lyp_6-31g+(d).log.xz

000928412.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928412.td-b3lyp_6-31+g(d).gjf (generated)

000928412.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928412.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928412.mol 000928412.PUBCHEM 000928412.mol (via Jmol)
000928433.b3lyp_6-31g(d).inp

000928433.b3lyp_6-31g(d).qchem.inp (generated)

000928433.b3lyp_6-31g(d).gjf (generated)

000928433.b3lyp_6-31g(d).firefly.inp (generated)

000928433.b3lyp_6-31g(d).smash.inp (generated)

000928433.b3lyp_6-31g(d).nwchem.inp (generated) 000928433.b3lyp_6-31g(d).log.xz 000928433.td-b3lyp_6-31g+(d).inp 000928433.td-b3lyp_6-31g+(d).log.xz

000928433.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928433.td-b3lyp_6-31+g(d).gjf (generated)

000928433.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928433.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928433.mol 000928433.PUBCHEM 000928433.mol (via Jmol)
000928434.b3lyp_6-31g(d).inp

000928434.b3lyp_6-31g(d).qchem.inp (generated)

000928434.b3lyp_6-31g(d).gjf (generated)

000928434.b3lyp_6-31g(d).firefly.inp (generated)

000928434.b3lyp_6-31g(d).smash.inp (generated)

000928434.b3lyp_6-31g(d).nwchem.inp (generated) 000928434.b3lyp_6-31g(d).log.xz 000928434.td-b3lyp_6-31g+(d).inp 000928434.td-b3lyp_6-31g+(d).log.xz

000928434.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928434.td-b3lyp_6-31+g(d).gjf (generated)

000928434.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928434.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928434.mol 000928434.PUBCHEM 000928434.mol (via Jmol)
000928447.b3lyp_6-31g(d).inp

000928447.b3lyp_6-31g(d).qchem.inp (generated)

000928447.b3lyp_6-31g(d).gjf (generated)

000928447.b3lyp_6-31g(d).firefly.inp (generated)

000928447.b3lyp_6-31g(d).smash.inp (generated)

000928447.b3lyp_6-31g(d).nwchem.inp (generated) 000928447.b3lyp_6-31g(d).log.xz 000928447.td-b3lyp_6-31g+(d).inp 000928447.td-b3lyp_6-31g+(d).log.xz

000928447.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928447.td-b3lyp_6-31+g(d).gjf (generated)

000928447.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928447.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928447.mol 000928447.PUBCHEM 000928447.mol (via Jmol)
000928457.b3lyp_6-31g(d).inp

000928457.b3lyp_6-31g(d).qchem.inp (generated)

000928457.b3lyp_6-31g(d).gjf (generated)

000928457.b3lyp_6-31g(d).firefly.inp (generated)

000928457.b3lyp_6-31g(d).smash.inp (generated)

000928457.b3lyp_6-31g(d).nwchem.inp (generated) 000928457.b3lyp_6-31g(d).log.xz 000928457.td-b3lyp_6-31g+(d).inp 000928457.td-b3lyp_6-31g+(d).log.xz

000928457.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928457.td-b3lyp_6-31+g(d).gjf (generated)

000928457.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928457.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928457.mol 000928457.PUBCHEM 000928457.mol (via Jmol)
000928458.b3lyp_6-31g(d).inp

000928458.b3lyp_6-31g(d).qchem.inp (generated)

000928458.b3lyp_6-31g(d).gjf (generated)

000928458.b3lyp_6-31g(d).firefly.inp (generated)

000928458.b3lyp_6-31g(d).smash.inp (generated)

000928458.b3lyp_6-31g(d).nwchem.inp (generated) 000928458.b3lyp_6-31g(d).log.xz 000928458.td-b3lyp_6-31g+(d).inp 000928458.td-b3lyp_6-31g+(d).log.xz

000928458.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928458.td-b3lyp_6-31+g(d).gjf (generated)

000928458.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928458.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928458.mol 000928458.PUBCHEM 000928458.mol (via Jmol)
000928468.b3lyp_6-31g(d).inp

000928468.b3lyp_6-31g(d).qchem.inp (generated)

000928468.b3lyp_6-31g(d).gjf (generated)

000928468.b3lyp_6-31g(d).firefly.inp (generated)

000928468.b3lyp_6-31g(d).smash.inp (generated)

000928468.b3lyp_6-31g(d).nwchem.inp (generated) 000928468.b3lyp_6-31g(d).log.xz 000928468.td-b3lyp_6-31g+(d).inp 000928468.td-b3lyp_6-31g+(d).log.xz

000928468.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928468.td-b3lyp_6-31+g(d).gjf (generated)

000928468.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928468.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928468.mol 000928468.PUBCHEM 000928468.mol (via Jmol)
000928469.b3lyp_6-31g(d).inp

000928469.b3lyp_6-31g(d).qchem.inp (generated)

000928469.b3lyp_6-31g(d).gjf (generated)

000928469.b3lyp_6-31g(d).firefly.inp (generated)

000928469.b3lyp_6-31g(d).smash.inp (generated)

000928469.b3lyp_6-31g(d).nwchem.inp (generated) 000928469.b3lyp_6-31g(d).log.xz 000928469.td-b3lyp_6-31g+(d).inp 000928469.td-b3lyp_6-31g+(d).log.xz

000928469.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928469.td-b3lyp_6-31+g(d).gjf (generated)

000928469.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928469.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928469.mol 000928469.PUBCHEM 000928469.mol (via Jmol)
000928470.b3lyp_6-31g(d).inp

000928470.b3lyp_6-31g(d).qchem.inp (generated)

000928470.b3lyp_6-31g(d).gjf (generated)

000928470.b3lyp_6-31g(d).firefly.inp (generated)

000928470.b3lyp_6-31g(d).smash.inp (generated)

000928470.b3lyp_6-31g(d).nwchem.inp (generated) 000928470.b3lyp_6-31g(d).log.xz 000928470.td-b3lyp_6-31g+(d).inp 000928470.td-b3lyp_6-31g+(d).log.xz

000928470.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928470.td-b3lyp_6-31+g(d).gjf (generated)

000928470.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928470.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928470.mol 000928470.PUBCHEM 000928470.mol (via Jmol)
000928475.b3lyp_6-31g(d).inp

000928475.b3lyp_6-31g(d).qchem.inp (generated)

000928475.b3lyp_6-31g(d).gjf (generated)

000928475.b3lyp_6-31g(d).firefly.inp (generated)

000928475.b3lyp_6-31g(d).smash.inp (generated)

000928475.b3lyp_6-31g(d).nwchem.inp (generated) 000928475.b3lyp_6-31g(d).log.xz 000928475.mol 000928475.PUBCHEM 000928475.mol (via Jmol)
000928493.b3lyp_6-31g(d).inp

000928493.b3lyp_6-31g(d).qchem.inp (generated)

000928493.b3lyp_6-31g(d).gjf (generated)

000928493.b3lyp_6-31g(d).firefly.inp (generated)

000928493.b3lyp_6-31g(d).smash.inp (generated)

000928493.b3lyp_6-31g(d).nwchem.inp (generated) 000928493.b3lyp_6-31g(d).log.xz 000928493.td-b3lyp_6-31g+(d).inp 000928493.td-b3lyp_6-31g+(d).log.xz

000928493.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928493.td-b3lyp_6-31+g(d).gjf (generated)

000928493.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928493.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928493.mol 000928493.PUBCHEM 000928493.mol (via Jmol)
000928494.b3lyp_6-31g(d).inp

000928494.b3lyp_6-31g(d).qchem.inp (generated)

000928494.b3lyp_6-31g(d).gjf (generated)

000928494.b3lyp_6-31g(d).firefly.inp (generated)

000928494.b3lyp_6-31g(d).smash.inp (generated)

000928494.b3lyp_6-31g(d).nwchem.inp (generated) 000928494.b3lyp_6-31g(d).log.xz 000928494.td-b3lyp_6-31g+(d).inp 000928494.td-b3lyp_6-31g+(d).log.xz

000928494.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928494.td-b3lyp_6-31+g(d).gjf (generated)

000928494.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928494.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928494.mol 000928494.PUBCHEM 000928494.mol (via Jmol)
000928500.b3lyp_6-31g(d).inp

000928500.b3lyp_6-31g(d).qchem.inp (generated)

000928500.b3lyp_6-31g(d).gjf (generated)

000928500.b3lyp_6-31g(d).firefly.inp (generated)

000928500.b3lyp_6-31g(d).smash.inp (generated)

000928500.b3lyp_6-31g(d).nwchem.inp (generated) 000928500.b3lyp_6-31g(d).log.xz 000928500.td-b3lyp_6-31g+(d).inp 000928500.td-b3lyp_6-31g+(d).log.xz

000928500.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928500.td-b3lyp_6-31+g(d).gjf (generated)

000928500.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928500.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928500.mol 000928500.PUBCHEM 000928500.mol (via Jmol)
000928503.b3lyp_6-31g(d).inp

000928503.b3lyp_6-31g(d).qchem.inp (generated)

000928503.b3lyp_6-31g(d).gjf (generated)

000928503.b3lyp_6-31g(d).firefly.inp (generated)

000928503.b3lyp_6-31g(d).smash.inp (generated)

000928503.b3lyp_6-31g(d).nwchem.inp (generated) 000928503.b3lyp_6-31g(d).log.xz 000928503.mol 000928503.PUBCHEM 000928503.mol (via Jmol)
000928504.b3lyp_6-31g(d).inp

000928504.b3lyp_6-31g(d).qchem.inp (generated)

000928504.b3lyp_6-31g(d).gjf (generated)

000928504.b3lyp_6-31g(d).firefly.inp (generated)

000928504.b3lyp_6-31g(d).smash.inp (generated)

000928504.b3lyp_6-31g(d).nwchem.inp (generated) 000928504.b3lyp_6-31g(d).log.xz 000928504.mol 000928504.PUBCHEM 000928504.mol (via Jmol)
000928523.b3lyp_6-31g(d).inp

000928523.b3lyp_6-31g(d).qchem.inp (generated)

000928523.b3lyp_6-31g(d).gjf (generated)

000928523.b3lyp_6-31g(d).firefly.inp (generated)

000928523.b3lyp_6-31g(d).smash.inp (generated)

000928523.b3lyp_6-31g(d).nwchem.inp (generated) 000928523.b3lyp_6-31g(d).log.xz 000928523.td-b3lyp_6-31g+(d).inp 000928523.td-b3lyp_6-31g+(d).log.xz

000928523.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928523.td-b3lyp_6-31+g(d).gjf (generated)

000928523.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928523.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928523.mol 000928523.PUBCHEM 000928523.mol (via Jmol)
000928524.b3lyp_6-31g(d).inp

000928524.b3lyp_6-31g(d).qchem.inp (generated)

000928524.b3lyp_6-31g(d).gjf (generated)

000928524.b3lyp_6-31g(d).firefly.inp (generated)

000928524.b3lyp_6-31g(d).smash.inp (generated)

000928524.b3lyp_6-31g(d).nwchem.inp (generated) 000928524.b3lyp_6-31g(d).log.xz 000928524.td-b3lyp_6-31g+(d).inp 000928524.td-b3lyp_6-31g+(d).log.xz

000928524.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928524.td-b3lyp_6-31+g(d).gjf (generated)

000928524.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928524.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928524.mol 000928524.PUBCHEM 000928524.mol (via Jmol)
000928525.b3lyp_6-31g(d).inp

000928525.b3lyp_6-31g(d).qchem.inp (generated)

000928525.b3lyp_6-31g(d).gjf (generated)

000928525.b3lyp_6-31g(d).firefly.inp (generated)

000928525.b3lyp_6-31g(d).smash.inp (generated)

000928525.b3lyp_6-31g(d).nwchem.inp (generated) 000928525.b3lyp_6-31g(d).log.xz 000928525.td-b3lyp_6-31g+(d).inp 000928525.td-b3lyp_6-31g+(d).log.xz

000928525.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928525.td-b3lyp_6-31+g(d).gjf (generated)

000928525.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928525.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928525.mol 000928525.PUBCHEM 000928525.mol (via Jmol)
000928526.b3lyp_6-31g(d).inp

000928526.b3lyp_6-31g(d).qchem.inp (generated)

000928526.b3lyp_6-31g(d).gjf (generated)

000928526.b3lyp_6-31g(d).firefly.inp (generated)

000928526.b3lyp_6-31g(d).smash.inp (generated)

000928526.b3lyp_6-31g(d).nwchem.inp (generated) 000928526.b3lyp_6-31g(d).log.xz 000928526.td-b3lyp_6-31g+(d).inp 000928526.td-b3lyp_6-31g+(d).log.xz

000928526.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928526.td-b3lyp_6-31+g(d).gjf (generated)

000928526.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928526.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928526.mol 000928526.PUBCHEM 000928526.mol (via Jmol)
000928540.b3lyp_6-31g(d).inp

000928540.b3lyp_6-31g(d).qchem.inp (generated)

000928540.b3lyp_6-31g(d).gjf (generated)

000928540.b3lyp_6-31g(d).firefly.inp (generated)

000928540.b3lyp_6-31g(d).smash.inp (generated)

000928540.b3lyp_6-31g(d).nwchem.inp (generated) 000928540.b3lyp_6-31g(d).log.xz 000928540.td-b3lyp_6-31g+(d).inp 000928540.td-b3lyp_6-31g+(d).log.xz

000928540.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928540.td-b3lyp_6-31+g(d).gjf (generated)

000928540.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928540.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928540.mol 000928540.PUBCHEM 000928540.mol (via Jmol)
000928546.b3lyp_6-31g(d).inp

000928546.b3lyp_6-31g(d).qchem.inp (generated)

000928546.b3lyp_6-31g(d).gjf (generated)

000928546.b3lyp_6-31g(d).firefly.inp (generated)

000928546.b3lyp_6-31g(d).smash.inp (generated)

000928546.b3lyp_6-31g(d).nwchem.inp (generated) 000928546.b3lyp_6-31g(d).log.xz 000928546.td-b3lyp_6-31g+(d).inp 000928546.td-b3lyp_6-31g+(d).log.xz

000928546.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928546.td-b3lyp_6-31+g(d).gjf (generated)

000928546.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928546.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928546.mol 000928546.PUBCHEM 000928546.mol (via Jmol)
000928555.b3lyp_6-31g(d).inp

000928555.b3lyp_6-31g(d).qchem.inp (generated)

000928555.b3lyp_6-31g(d).gjf (generated)

000928555.b3lyp_6-31g(d).firefly.inp (generated)

000928555.b3lyp_6-31g(d).smash.inp (generated)

000928555.b3lyp_6-31g(d).nwchem.inp (generated) 000928555.b3lyp_6-31g(d).log.xz 000928555.td-b3lyp_6-31g+(d).inp 000928555.td-b3lyp_6-31g+(d).log.xz

000928555.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928555.td-b3lyp_6-31+g(d).gjf (generated)

000928555.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928555.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928555.mol 000928555.PUBCHEM 000928555.mol (via Jmol)
000928556.b3lyp_6-31g(d).inp

000928556.b3lyp_6-31g(d).qchem.inp (generated)

000928556.b3lyp_6-31g(d).gjf (generated)

000928556.b3lyp_6-31g(d).firefly.inp (generated)

000928556.b3lyp_6-31g(d).smash.inp (generated)

000928556.b3lyp_6-31g(d).nwchem.inp (generated) 000928556.b3lyp_6-31g(d).log.xz 000928556.td-b3lyp_6-31g+(d).inp 000928556.td-b3lyp_6-31g+(d).log.xz

000928556.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928556.td-b3lyp_6-31+g(d).gjf (generated)

000928556.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928556.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928556.mol 000928556.PUBCHEM 000928556.mol (via Jmol)
000928557.b3lyp_6-31g(d).inp

000928557.b3lyp_6-31g(d).qchem.inp (generated)

000928557.b3lyp_6-31g(d).gjf (generated)

000928557.b3lyp_6-31g(d).firefly.inp (generated)

000928557.b3lyp_6-31g(d).smash.inp (generated)

000928557.b3lyp_6-31g(d).nwchem.inp (generated) 000928557.b3lyp_6-31g(d).log.xz 000928557.td-b3lyp_6-31g+(d).inp 000928557.td-b3lyp_6-31g+(d).log.xz

000928557.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928557.td-b3lyp_6-31+g(d).gjf (generated)

000928557.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928557.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928557.mol 000928557.PUBCHEM 000928557.mol (via Jmol)
000928558.b3lyp_6-31g(d).inp

000928558.b3lyp_6-31g(d).qchem.inp (generated)

000928558.b3lyp_6-31g(d).gjf (generated)

000928558.b3lyp_6-31g(d).firefly.inp (generated)

000928558.b3lyp_6-31g(d).smash.inp (generated)

000928558.b3lyp_6-31g(d).nwchem.inp (generated) 000928558.b3lyp_6-31g(d).log.xz 000928558.td-b3lyp_6-31g+(d).inp 000928558.td-b3lyp_6-31g+(d).log.xz

000928558.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928558.td-b3lyp_6-31+g(d).gjf (generated)

000928558.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928558.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928558.mol 000928558.PUBCHEM 000928558.mol (via Jmol)
000928564.b3lyp_6-31g(d).inp

000928564.b3lyp_6-31g(d).qchem.inp (generated)

000928564.b3lyp_6-31g(d).gjf (generated)

000928564.b3lyp_6-31g(d).firefly.inp (generated)

000928564.b3lyp_6-31g(d).smash.inp (generated)

000928564.b3lyp_6-31g(d).nwchem.inp (generated) 000928564.b3lyp_6-31g(d).log.xz 000928564.td-b3lyp_6-31g+(d).inp 000928564.td-b3lyp_6-31g+(d).log.xz

000928564.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928564.td-b3lyp_6-31+g(d).gjf (generated)

000928564.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928564.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928564.mol 000928564.PUBCHEM 000928564.mol (via Jmol)
000928572.b3lyp_6-31g(d).inp

000928572.b3lyp_6-31g(d).qchem.inp (generated)

000928572.b3lyp_6-31g(d).gjf (generated)

000928572.b3lyp_6-31g(d).firefly.inp (generated)

000928572.b3lyp_6-31g(d).smash.inp (generated)

000928572.b3lyp_6-31g(d).nwchem.inp (generated) 000928572.b3lyp_6-31g(d).log.xz 000928572.mol 000928572.PUBCHEM 000928572.mol (via Jmol)
000928574.b3lyp_6-31g(d).inp

000928574.b3lyp_6-31g(d).qchem.inp (generated)

000928574.b3lyp_6-31g(d).gjf (generated)

000928574.b3lyp_6-31g(d).firefly.inp (generated)

000928574.b3lyp_6-31g(d).smash.inp (generated)

000928574.b3lyp_6-31g(d).nwchem.inp (generated) 000928574.b3lyp_6-31g(d).log.xz 000928574.td-b3lyp_6-31g+(d).inp 000928574.td-b3lyp_6-31g+(d).log.xz

000928574.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928574.td-b3lyp_6-31+g(d).gjf (generated)

000928574.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928574.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928574.mol 000928574.PUBCHEM 000928574.mol (via Jmol)
000928575.b3lyp_6-31g(d).inp

000928575.b3lyp_6-31g(d).qchem.inp (generated)

000928575.b3lyp_6-31g(d).gjf (generated)

000928575.b3lyp_6-31g(d).firefly.inp (generated)

000928575.b3lyp_6-31g(d).smash.inp (generated)

000928575.b3lyp_6-31g(d).nwchem.inp (generated) 000928575.b3lyp_6-31g(d).log.xz 000928575.td-b3lyp_6-31g+(d).inp 000928575.td-b3lyp_6-31g+(d).log.xz

000928575.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928575.td-b3lyp_6-31+g(d).gjf (generated)

000928575.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928575.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928575.mol 000928575.PUBCHEM 000928575.mol (via Jmol)
000928576.b3lyp_6-31g(d).inp

000928576.b3lyp_6-31g(d).qchem.inp (generated)

000928576.b3lyp_6-31g(d).gjf (generated)

000928576.b3lyp_6-31g(d).firefly.inp (generated)

000928576.b3lyp_6-31g(d).smash.inp (generated)

000928576.b3lyp_6-31g(d).nwchem.inp (generated) 000928576.b3lyp_6-31g(d).log.xz 000928576.td-b3lyp_6-31g+(d).inp 000928576.td-b3lyp_6-31g+(d).log.xz

000928576.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928576.td-b3lyp_6-31+g(d).gjf (generated)

000928576.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928576.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928576.mol 000928576.PUBCHEM 000928576.mol (via Jmol)
000928577.b3lyp_6-31g(d).inp

000928577.b3lyp_6-31g(d).qchem.inp (generated)

000928577.b3lyp_6-31g(d).gjf (generated)

000928577.b3lyp_6-31g(d).firefly.inp (generated)

000928577.b3lyp_6-31g(d).smash.inp (generated)

000928577.b3lyp_6-31g(d).nwchem.inp (generated) 000928577.b3lyp_6-31g(d).log.xz 000928577.td-b3lyp_6-31g+(d).inp 000928577.td-b3lyp_6-31g+(d).log.xz

000928577.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928577.td-b3lyp_6-31+g(d).gjf (generated)

000928577.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928577.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928577.mol 000928577.PUBCHEM 000928577.mol (via Jmol)
000928583.b3lyp_6-31g(d).inp

000928583.b3lyp_6-31g(d).qchem.inp (generated)

000928583.b3lyp_6-31g(d).gjf (generated)

000928583.b3lyp_6-31g(d).firefly.inp (generated)

000928583.b3lyp_6-31g(d).smash.inp (generated)

000928583.b3lyp_6-31g(d).nwchem.inp (generated) 000928583.b3lyp_6-31g(d).log.xz 000928583.td-b3lyp_6-31g+(d).inp 000928583.td-b3lyp_6-31g+(d).log.xz

000928583.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928583.td-b3lyp_6-31+g(d).gjf (generated)

000928583.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928583.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928583.mol 000928583.PUBCHEM 000928583.mol (via Jmol)
000928584.b3lyp_6-31g(d).inp

000928584.b3lyp_6-31g(d).qchem.inp (generated)

000928584.b3lyp_6-31g(d).gjf (generated)

000928584.b3lyp_6-31g(d).firefly.inp (generated)

000928584.b3lyp_6-31g(d).smash.inp (generated)

000928584.b3lyp_6-31g(d).nwchem.inp (generated) 000928584.b3lyp_6-31g(d).log.xz 000928584.td-b3lyp_6-31g+(d).inp 000928584.td-b3lyp_6-31g+(d).log.xz

000928584.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928584.td-b3lyp_6-31+g(d).gjf (generated)

000928584.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928584.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928584.mol 000928584.PUBCHEM 000928584.mol (via Jmol)
000928585.b3lyp_6-31g(d).inp

000928585.b3lyp_6-31g(d).qchem.inp (generated)

000928585.b3lyp_6-31g(d).gjf (generated)

000928585.b3lyp_6-31g(d).firefly.inp (generated)

000928585.b3lyp_6-31g(d).smash.inp (generated)

000928585.b3lyp_6-31g(d).nwchem.inp (generated) 000928585.b3lyp_6-31g(d).log.xz 000928585.td-b3lyp_6-31g+(d).inp 000928585.td-b3lyp_6-31g+(d).log.xz

000928585.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928585.td-b3lyp_6-31+g(d).gjf (generated)

000928585.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928585.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928585.mol 000928585.PUBCHEM 000928585.mol (via Jmol)
000928586.b3lyp_6-31g(d).inp

000928586.b3lyp_6-31g(d).qchem.inp (generated)

000928586.b3lyp_6-31g(d).gjf (generated)

000928586.b3lyp_6-31g(d).firefly.inp (generated)

000928586.b3lyp_6-31g(d).smash.inp (generated)

000928586.b3lyp_6-31g(d).nwchem.inp (generated) 000928586.b3lyp_6-31g(d).log.xz 000928586.td-b3lyp_6-31g+(d).inp 000928586.td-b3lyp_6-31g+(d).log.xz

000928586.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928586.td-b3lyp_6-31+g(d).gjf (generated)

000928586.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928586.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928586.mol 000928586.PUBCHEM 000928586.mol (via Jmol)
000928594.b3lyp_6-31g(d).inp

000928594.b3lyp_6-31g(d).qchem.inp (generated)

000928594.b3lyp_6-31g(d).gjf (generated)

000928594.b3lyp_6-31g(d).firefly.inp (generated)

000928594.b3lyp_6-31g(d).smash.inp (generated)

000928594.b3lyp_6-31g(d).nwchem.inp (generated) 000928594.b3lyp_6-31g(d).log.xz 000928594.td-b3lyp_6-31g+(d).inp 000928594.td-b3lyp_6-31g+(d).log.xz

000928594.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928594.td-b3lyp_6-31+g(d).gjf (generated)

000928594.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928594.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928594.mol 000928594.PUBCHEM 000928594.mol (via Jmol)
000928595.b3lyp_6-31g(d).inp

000928595.b3lyp_6-31g(d).qchem.inp (generated)

000928595.b3lyp_6-31g(d).gjf (generated)

000928595.b3lyp_6-31g(d).firefly.inp (generated)

000928595.b3lyp_6-31g(d).smash.inp (generated)

000928595.b3lyp_6-31g(d).nwchem.inp (generated) 000928595.b3lyp_6-31g(d).log.xz 000928595.td-b3lyp_6-31g+(d).inp 000928595.td-b3lyp_6-31g+(d).log.xz

000928595.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928595.td-b3lyp_6-31+g(d).gjf (generated)

000928595.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928595.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928595.mol 000928595.PUBCHEM 000928595.mol (via Jmol)
000928597.b3lyp_6-31g(d).inp

000928597.b3lyp_6-31g(d).qchem.inp (generated)

000928597.b3lyp_6-31g(d).gjf (generated)

000928597.b3lyp_6-31g(d).firefly.inp (generated)

000928597.b3lyp_6-31g(d).smash.inp (generated)

000928597.b3lyp_6-31g(d).nwchem.inp (generated) 000928597.b3lyp_6-31g(d).log.xz 000928597.td-b3lyp_6-31g+(d).inp 000928597.td-b3lyp_6-31g+(d).log.xz

000928597.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928597.td-b3lyp_6-31+g(d).gjf (generated)

000928597.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928597.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928597.mol 000928597.PUBCHEM 000928597.mol (via Jmol)
000928598.b3lyp_6-31g(d).inp

000928598.b3lyp_6-31g(d).qchem.inp (generated)

000928598.b3lyp_6-31g(d).gjf (generated)

000928598.b3lyp_6-31g(d).firefly.inp (generated)

000928598.b3lyp_6-31g(d).smash.inp (generated)

000928598.b3lyp_6-31g(d).nwchem.inp (generated) 000928598.b3lyp_6-31g(d).log.xz 000928598.td-b3lyp_6-31g+(d).inp 000928598.td-b3lyp_6-31g+(d).log.xz

000928598.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928598.td-b3lyp_6-31+g(d).gjf (generated)

000928598.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928598.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928598.mol 000928598.PUBCHEM 000928598.mol (via Jmol)
000928637.b3lyp_6-31g(d).inp

000928637.b3lyp_6-31g(d).qchem.inp (generated)

000928637.b3lyp_6-31g(d).gjf (generated)

000928637.b3lyp_6-31g(d).firefly.inp (generated)

000928637.b3lyp_6-31g(d).smash.inp (generated)

000928637.b3lyp_6-31g(d).nwchem.inp (generated) 000928637.b3lyp_6-31g(d).log.xz 000928637.mol 000928637.PUBCHEM 000928637.mol (via Jmol)
000928642.b3lyp_6-31g(d).inp

000928642.b3lyp_6-31g(d).qchem.inp (generated)

000928642.b3lyp_6-31g(d).gjf (generated)

000928642.b3lyp_6-31g(d).firefly.inp (generated)

000928642.b3lyp_6-31g(d).smash.inp (generated)

000928642.b3lyp_6-31g(d).nwchem.inp (generated) 000928642.b3lyp_6-31g(d).log.xz 000928642.mol 000928642.PUBCHEM 000928642.mol (via Jmol)
000928643.b3lyp_6-31g(d).inp

000928643.b3lyp_6-31g(d).qchem.inp (generated)

000928643.b3lyp_6-31g(d).gjf (generated)

000928643.b3lyp_6-31g(d).firefly.inp (generated)

000928643.b3lyp_6-31g(d).smash.inp (generated)

000928643.b3lyp_6-31g(d).nwchem.inp (generated) 000928643.b3lyp_6-31g(d).log.xz 000928643.mol 000928643.PUBCHEM 000928643.mol (via Jmol)
000928645.b3lyp_6-31g(d).inp

000928645.b3lyp_6-31g(d).qchem.inp (generated)

000928645.b3lyp_6-31g(d).gjf (generated)

000928645.b3lyp_6-31g(d).firefly.inp (generated)

000928645.b3lyp_6-31g(d).smash.inp (generated)

000928645.b3lyp_6-31g(d).nwchem.inp (generated) 000928645.b3lyp_6-31g(d).log.xz 000928645.td-b3lyp_6-31g+(d).inp 000928645.td-b3lyp_6-31g+(d).log.xz

000928645.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928645.td-b3lyp_6-31+g(d).gjf (generated)

000928645.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928645.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928645.mol 000928645.PUBCHEM 000928645.mol (via Jmol)
000928646.b3lyp_6-31g(d).inp

000928646.b3lyp_6-31g(d).qchem.inp (generated)

000928646.b3lyp_6-31g(d).gjf (generated)

000928646.b3lyp_6-31g(d).firefly.inp (generated)

000928646.b3lyp_6-31g(d).smash.inp (generated)

000928646.b3lyp_6-31g(d).nwchem.inp (generated) 000928646.b3lyp_6-31g(d).log.xz 000928646.td-b3lyp_6-31g+(d).inp 000928646.td-b3lyp_6-31g+(d).log.xz

000928646.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928646.td-b3lyp_6-31+g(d).gjf (generated)

000928646.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928646.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928646.mol 000928646.PUBCHEM 000928646.mol (via Jmol)
000928654.b3lyp_6-31g(d).inp

000928654.b3lyp_6-31g(d).qchem.inp (generated)

000928654.b3lyp_6-31g(d).gjf (generated)

000928654.b3lyp_6-31g(d).firefly.inp (generated)

000928654.b3lyp_6-31g(d).smash.inp (generated)

000928654.b3lyp_6-31g(d).nwchem.inp (generated) 000928654.b3lyp_6-31g(d).log.xz 000928654.td-b3lyp_6-31g+(d).inp 000928654.td-b3lyp_6-31g+(d).log.xz

000928654.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928654.td-b3lyp_6-31+g(d).gjf (generated)

000928654.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928654.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928654.mol 000928654.PUBCHEM 000928654.mol (via Jmol)
000928659.b3lyp_6-31g(d).inp

000928659.b3lyp_6-31g(d).qchem.inp (generated)

000928659.b3lyp_6-31g(d).gjf (generated)

000928659.b3lyp_6-31g(d).firefly.inp (generated)

000928659.b3lyp_6-31g(d).smash.inp (generated)

000928659.b3lyp_6-31g(d).nwchem.inp (generated) 000928659.b3lyp_6-31g(d).log.xz 000928659.td-b3lyp_6-31g+(d).inp 000928659.td-b3lyp_6-31g+(d).log.xz

000928659.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928659.td-b3lyp_6-31+g(d).gjf (generated)

000928659.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928659.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928659.mol 000928659.PUBCHEM 000928659.mol (via Jmol)
000928660.b3lyp_6-31g(d).inp

000928660.b3lyp_6-31g(d).qchem.inp (generated)

000928660.b3lyp_6-31g(d).gjf (generated)

000928660.b3lyp_6-31g(d).firefly.inp (generated)

000928660.b3lyp_6-31g(d).smash.inp (generated)

000928660.b3lyp_6-31g(d).nwchem.inp (generated) 000928660.b3lyp_6-31g(d).log.xz 000928660.td-b3lyp_6-31g+(d).inp 000928660.td-b3lyp_6-31g+(d).log.xz

000928660.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928660.td-b3lyp_6-31+g(d).gjf (generated)

000928660.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928660.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928660.mol 000928660.PUBCHEM 000928660.mol (via Jmol)
000928669.b3lyp_6-31g(d).inp

000928669.b3lyp_6-31g(d).qchem.inp (generated)

000928669.b3lyp_6-31g(d).gjf (generated)

000928669.b3lyp_6-31g(d).firefly.inp (generated)

000928669.b3lyp_6-31g(d).smash.inp (generated)

000928669.b3lyp_6-31g(d).nwchem.inp (generated) 000928669.b3lyp_6-31g(d).log.xz 000928669.td-b3lyp_6-31g+(d).inp 000928669.td-b3lyp_6-31g+(d).log.xz

000928669.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928669.td-b3lyp_6-31+g(d).gjf (generated)

000928669.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928669.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928669.mol 000928669.PUBCHEM 000928669.mol (via Jmol)
000928675.b3lyp_6-31g(d).inp

000928675.b3lyp_6-31g(d).qchem.inp (generated)

000928675.b3lyp_6-31g(d).gjf (generated)

000928675.b3lyp_6-31g(d).firefly.inp (generated)

000928675.b3lyp_6-31g(d).smash.inp (generated)

000928675.b3lyp_6-31g(d).nwchem.inp (generated) 000928675.b3lyp_6-31g(d).log.xz 000928675.mol 000928675.PUBCHEM 000928675.mol (via Jmol)
000928682.b3lyp_6-31g(d).inp

000928682.b3lyp_6-31g(d).qchem.inp (generated)

000928682.b3lyp_6-31g(d).gjf (generated)

000928682.b3lyp_6-31g(d).firefly.inp (generated)

000928682.b3lyp_6-31g(d).smash.inp (generated)

000928682.b3lyp_6-31g(d).nwchem.inp (generated) 000928682.b3lyp_6-31g(d).log.xz 000928682.mol 000928682.PUBCHEM 000928682.mol (via Jmol)
000928683.b3lyp_6-31g(d).inp

000928683.b3lyp_6-31g(d).qchem.inp (generated)

000928683.b3lyp_6-31g(d).gjf (generated)

000928683.b3lyp_6-31g(d).firefly.inp (generated)

000928683.b3lyp_6-31g(d).smash.inp (generated)

000928683.b3lyp_6-31g(d).nwchem.inp (generated) 000928683.b3lyp_6-31g(d).log.xz 000928683.mol 000928683.PUBCHEM 000928683.mol (via Jmol)
000928691.b3lyp_6-31g(d).inp

000928691.b3lyp_6-31g(d).qchem.inp (generated)

000928691.b3lyp_6-31g(d).gjf (generated)

000928691.b3lyp_6-31g(d).firefly.inp (generated)

000928691.b3lyp_6-31g(d).smash.inp (generated)

000928691.b3lyp_6-31g(d).nwchem.inp (generated) 000928691.b3lyp_6-31g(d).log.xz 000928691.td-b3lyp_6-31g+(d).inp 000928691.td-b3lyp_6-31g+(d).log.xz

000928691.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928691.td-b3lyp_6-31+g(d).gjf (generated)

000928691.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928691.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928691.mol 000928691.PUBCHEM 000928691.mol (via Jmol)
000928711.b3lyp_6-31g(d).inp

000928711.b3lyp_6-31g(d).qchem.inp (generated)

000928711.b3lyp_6-31g(d).gjf (generated)

000928711.b3lyp_6-31g(d).firefly.inp (generated)

000928711.b3lyp_6-31g(d).smash.inp (generated)

000928711.b3lyp_6-31g(d).nwchem.inp (generated) 000928711.b3lyp_6-31g(d).log.xz 000928711.td-b3lyp_6-31g+(d).inp 000928711.td-b3lyp_6-31g+(d).log.xz

000928711.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928711.td-b3lyp_6-31+g(d).gjf (generated)

000928711.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928711.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928711.mol 000928711.PUBCHEM 000928711.mol (via Jmol)
000928728.b3lyp_6-31g(d).inp

000928728.b3lyp_6-31g(d).qchem.inp (generated)

000928728.b3lyp_6-31g(d).gjf (generated)

000928728.b3lyp_6-31g(d).firefly.inp (generated)

000928728.b3lyp_6-31g(d).smash.inp (generated)

000928728.b3lyp_6-31g(d).nwchem.inp (generated) 000928728.b3lyp_6-31g(d).log.xz 000928728.td-b3lyp_6-31g+(d).inp 000928728.td-b3lyp_6-31g+(d).log.xz

000928728.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928728.td-b3lyp_6-31+g(d).gjf (generated)

000928728.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928728.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928728.mol 000928728.PUBCHEM 000928728.mol (via Jmol)
000928734.b3lyp_6-31g(d).inp

000928734.b3lyp_6-31g(d).qchem.inp (generated)

000928734.b3lyp_6-31g(d).gjf (generated)

000928734.b3lyp_6-31g(d).firefly.inp (generated)

000928734.b3lyp_6-31g(d).smash.inp (generated)

000928734.b3lyp_6-31g(d).nwchem.inp (generated) 000928734.b3lyp_6-31g(d).log.xz 000928734.td-b3lyp_6-31g+(d).inp 000928734.td-b3lyp_6-31g+(d).log.xz

000928734.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928734.td-b3lyp_6-31+g(d).gjf (generated)

000928734.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928734.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928734.mol 000928734.PUBCHEM 000928734.mol (via Jmol)
000928758.b3lyp_6-31g(d).inp

000928758.b3lyp_6-31g(d).qchem.inp (generated)

000928758.b3lyp_6-31g(d).gjf (generated)

000928758.b3lyp_6-31g(d).firefly.inp (generated)

000928758.b3lyp_6-31g(d).smash.inp (generated)

000928758.b3lyp_6-31g(d).nwchem.inp (generated) 000928758.b3lyp_6-31g(d).log.xz 000928758.td-b3lyp_6-31g+(d).inp 000928758.td-b3lyp_6-31g+(d).log.xz

000928758.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928758.td-b3lyp_6-31+g(d).gjf (generated)

000928758.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928758.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928758.mol 000928758.PUBCHEM 000928758.mol (via Jmol)
000928763.b3lyp_6-31g(d).inp

000928763.b3lyp_6-31g(d).qchem.inp (generated)

000928763.b3lyp_6-31g(d).gjf (generated)

000928763.b3lyp_6-31g(d).firefly.inp (generated)

000928763.b3lyp_6-31g(d).smash.inp (generated)

000928763.b3lyp_6-31g(d).nwchem.inp (generated) 000928763.b3lyp_6-31g(d).log.xz 000928763.mol 000928763.PUBCHEM 000928763.mol (via Jmol)
000928764.b3lyp_6-31g(d).inp

000928764.b3lyp_6-31g(d).qchem.inp (generated)

000928764.b3lyp_6-31g(d).gjf (generated)

000928764.b3lyp_6-31g(d).firefly.inp (generated)

000928764.b3lyp_6-31g(d).smash.inp (generated)

000928764.b3lyp_6-31g(d).nwchem.inp (generated) 000928764.b3lyp_6-31g(d).log.xz 000928764.mol 000928764.PUBCHEM 000928764.mol (via Jmol)
000928784.b3lyp_6-31g(d).inp

000928784.b3lyp_6-31g(d).qchem.inp (generated)

000928784.b3lyp_6-31g(d).gjf (generated)

000928784.b3lyp_6-31g(d).firefly.inp (generated)

000928784.b3lyp_6-31g(d).smash.inp (generated)

000928784.b3lyp_6-31g(d).nwchem.inp (generated) 000928784.b3lyp_6-31g(d).log.xz 000928784.td-b3lyp_6-31g+(d).inp 000928784.td-b3lyp_6-31g+(d).log.xz

000928784.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928784.td-b3lyp_6-31+g(d).gjf (generated)

000928784.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928784.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928784.mol 000928784.PUBCHEM 000928784.mol (via Jmol)
000928795.b3lyp_6-31g(d).inp

000928795.b3lyp_6-31g(d).qchem.inp (generated)

000928795.b3lyp_6-31g(d).gjf (generated)

000928795.b3lyp_6-31g(d).firefly.inp (generated)

000928795.b3lyp_6-31g(d).smash.inp (generated)

000928795.b3lyp_6-31g(d).nwchem.inp (generated) 000928795.b3lyp_6-31g(d).log.xz 000928795.mol 000928795.PUBCHEM 000928795.mol (via Jmol)
000928799.b3lyp_6-31g(d).inp

000928799.b3lyp_6-31g(d).qchem.inp (generated)

000928799.b3lyp_6-31g(d).gjf (generated)

000928799.b3lyp_6-31g(d).firefly.inp (generated)

000928799.b3lyp_6-31g(d).smash.inp (generated)

000928799.b3lyp_6-31g(d).nwchem.inp (generated) 000928799.b3lyp_6-31g(d).log.xz 000928799.td-b3lyp_6-31g+(d).inp 000928799.td-b3lyp_6-31g+(d).log.xz

000928799.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928799.td-b3lyp_6-31+g(d).gjf (generated)

000928799.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928799.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928799.mol 000928799.PUBCHEM 000928799.mol (via Jmol)
000928800.b3lyp_6-31g(d).inp

000928800.b3lyp_6-31g(d).qchem.inp (generated)

000928800.b3lyp_6-31g(d).gjf (generated)

000928800.b3lyp_6-31g(d).firefly.inp (generated)

000928800.b3lyp_6-31g(d).smash.inp (generated)

000928800.b3lyp_6-31g(d).nwchem.inp (generated) 000928800.b3lyp_6-31g(d).log.xz 000928800.td-b3lyp_6-31g+(d).inp 000928800.td-b3lyp_6-31g+(d).log.xz

000928800.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928800.td-b3lyp_6-31+g(d).gjf (generated)

000928800.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928800.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928800.mol 000928800.PUBCHEM 000928800.mol (via Jmol)
000928801.b3lyp_6-31g(d).inp

000928801.b3lyp_6-31g(d).qchem.inp (generated)

000928801.b3lyp_6-31g(d).gjf (generated)

000928801.b3lyp_6-31g(d).firefly.inp (generated)

000928801.b3lyp_6-31g(d).smash.inp (generated)

000928801.b3lyp_6-31g(d).nwchem.inp (generated) 000928801.b3lyp_6-31g(d).log.xz 000928801.td-b3lyp_6-31g+(d).inp 000928801.td-b3lyp_6-31g+(d).log.xz

000928801.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928801.td-b3lyp_6-31+g(d).gjf (generated)

000928801.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928801.mol 000928801.PUBCHEM 000928801.mol (via Jmol)
000928802.b3lyp_6-31g(d).inp

000928802.b3lyp_6-31g(d).qchem.inp (generated)

000928802.b3lyp_6-31g(d).gjf (generated)

000928802.b3lyp_6-31g(d).firefly.inp (generated)

000928802.b3lyp_6-31g(d).smash.inp (generated)

000928802.b3lyp_6-31g(d).nwchem.inp (generated) 000928802.b3lyp_6-31g(d).log.xz 000928802.td-b3lyp_6-31g+(d).inp 000928802.td-b3lyp_6-31g+(d).log.xz

000928802.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928802.td-b3lyp_6-31+g(d).gjf (generated)

000928802.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928802.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928802.mol 000928802.PUBCHEM 000928802.mol (via Jmol)
000928813.b3lyp_6-31g(d).inp

000928813.b3lyp_6-31g(d).qchem.inp (generated)

000928813.b3lyp_6-31g(d).gjf (generated)

000928813.b3lyp_6-31g(d).firefly.inp (generated)

000928813.b3lyp_6-31g(d).smash.inp (generated)

000928813.b3lyp_6-31g(d).nwchem.inp (generated) 000928813.b3lyp_6-31g(d).log.xz 000928813.td-b3lyp_6-31g+(d).inp 000928813.td-b3lyp_6-31g+(d).log.xz

000928813.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928813.td-b3lyp_6-31+g(d).gjf (generated)

000928813.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928813.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928813.mol 000928813.PUBCHEM 000928813.mol (via Jmol)
000928816.b3lyp_6-31g(d).inp

000928816.b3lyp_6-31g(d).qchem.inp (generated)

000928816.b3lyp_6-31g(d).gjf (generated)

000928816.b3lyp_6-31g(d).firefly.inp (generated)

000928816.b3lyp_6-31g(d).smash.inp (generated)

000928816.b3lyp_6-31g(d).nwchem.inp (generated) 000928816.b3lyp_6-31g(d).log.xz 000928816.td-b3lyp_6-31g+(d).inp 000928816.td-b3lyp_6-31g+(d).log.xz

000928816.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928816.td-b3lyp_6-31+g(d).gjf (generated)

000928816.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928816.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928816.mol 000928816.PUBCHEM 000928816.mol (via Jmol)
000928820.b3lyp_6-31g(d).inp

000928820.b3lyp_6-31g(d).qchem.inp (generated)

000928820.b3lyp_6-31g(d).gjf (generated)

000928820.b3lyp_6-31g(d).firefly.inp (generated)

000928820.b3lyp_6-31g(d).smash.inp (generated)

000928820.b3lyp_6-31g(d).nwchem.inp (generated) 000928820.b3lyp_6-31g(d).log.xz 000928820.td-b3lyp_6-31g+(d).inp 000928820.td-b3lyp_6-31g+(d).log.xz

000928820.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928820.td-b3lyp_6-31+g(d).gjf (generated)

000928820.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928820.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928820.mol 000928820.PUBCHEM 000928820.mol (via Jmol)
000928831.b3lyp_6-31g(d).inp

000928831.b3lyp_6-31g(d).qchem.inp (generated)

000928831.b3lyp_6-31g(d).gjf (generated)

000928831.b3lyp_6-31g(d).firefly.inp (generated)

000928831.b3lyp_6-31g(d).smash.inp (generated)

000928831.b3lyp_6-31g(d).nwchem.inp (generated) 000928831.b3lyp_6-31g(d).log.xz 000928831.td-b3lyp_6-31g+(d).inp 000928831.td-b3lyp_6-31g+(d).log.xz

000928831.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928831.td-b3lyp_6-31+g(d).gjf (generated)

000928831.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928831.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928831.mol 000928831.PUBCHEM 000928831.mol (via Jmol)
000928838.b3lyp_6-31g(d).inp

000928838.b3lyp_6-31g(d).qchem.inp (generated)

000928838.b3lyp_6-31g(d).gjf (generated)

000928838.b3lyp_6-31g(d).firefly.inp (generated)

000928838.b3lyp_6-31g(d).smash.inp (generated)

000928838.b3lyp_6-31g(d).nwchem.inp (generated) 000928838.b3lyp_6-31g(d).log.xz 000928838.mol 000928838.PUBCHEM 000928838.mol (via Jmol)
000928857.b3lyp_6-31g(d).inp

000928857.b3lyp_6-31g(d).qchem.inp (generated)

000928857.b3lyp_6-31g(d).gjf (generated)

000928857.b3lyp_6-31g(d).firefly.inp (generated)

000928857.b3lyp_6-31g(d).smash.inp (generated)

000928857.b3lyp_6-31g(d).nwchem.inp (generated) 000928857.b3lyp_6-31g(d).log.xz 000928857.mol 000928857.PUBCHEM 000928857.mol (via Jmol)
000928879.b3lyp_6-31g(d).inp

000928879.b3lyp_6-31g(d).qchem.inp (generated)

000928879.b3lyp_6-31g(d).gjf (generated)

000928879.b3lyp_6-31g(d).firefly.inp (generated)

000928879.b3lyp_6-31g(d).smash.inp (generated)

000928879.b3lyp_6-31g(d).nwchem.inp (generated) 000928879.b3lyp_6-31g(d).log.xz 000928879.td-b3lyp_6-31g+(d).inp 000928879.td-b3lyp_6-31g+(d).log.xz

000928879.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928879.td-b3lyp_6-31+g(d).gjf (generated)

000928879.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928879.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928879.mol 000928879.PUBCHEM 000928879.mol (via Jmol)
000928949.b3lyp_6-31g(d).inp

000928949.b3lyp_6-31g(d).qchem.inp (generated)

000928949.b3lyp_6-31g(d).gjf (generated)

000928949.b3lyp_6-31g(d).firefly.inp (generated)

000928949.b3lyp_6-31g(d).smash.inp (generated)

000928949.b3lyp_6-31g(d).nwchem.inp (generated) 000928949.b3lyp_6-31g(d).log.xz 000928949.td-b3lyp_6-31g+(d).inp 000928949.td-b3lyp_6-31g+(d).log.xz

000928949.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928949.td-b3lyp_6-31+g(d).gjf (generated)

000928949.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928949.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928949.mol 000928949.PUBCHEM 000928949.mol (via Jmol)
000928995.b3lyp_6-31g(d).inp

000928995.b3lyp_6-31g(d).qchem.inp (generated)

000928995.b3lyp_6-31g(d).gjf (generated)

000928995.b3lyp_6-31g(d).firefly.inp (generated)

000928995.b3lyp_6-31g(d).smash.inp (generated)

000928995.b3lyp_6-31g(d).nwchem.inp (generated) 000928995.b3lyp_6-31g(d).log.xz 000928995.td-b3lyp_6-31g+(d).inp 000928995.td-b3lyp_6-31g+(d).log.xz

000928995.td-b3lyp_6-31+g(d).qchem.inp (generated)

000928995.td-b3lyp_6-31+g(d).gjf (generated)

000928995.td-b3lyp_6-31+g(d).firefly.inp (generated)

000928995.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000928995.mol 000928995.PUBCHEM 000928995.mol (via Jmol)
000929019.b3lyp_6-31g(d).inp

000929019.b3lyp_6-31g(d).qchem.inp (generated)

000929019.b3lyp_6-31g(d).gjf (generated)

000929019.b3lyp_6-31g(d).firefly.inp (generated)

000929019.b3lyp_6-31g(d).smash.inp (generated)

000929019.b3lyp_6-31g(d).nwchem.inp (generated) 000929019.b3lyp_6-31g(d).log.xz 000929019.td-b3lyp_6-31g+(d).inp 000929019.td-b3lyp_6-31g+(d).log.xz

000929019.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929019.td-b3lyp_6-31+g(d).gjf (generated)

000929019.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929019.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929019.mol 000929019.PUBCHEM 000929019.mol (via Jmol)
000929020.b3lyp_6-31g(d).inp

000929020.b3lyp_6-31g(d).qchem.inp (generated)

000929020.b3lyp_6-31g(d).gjf (generated)

000929020.b3lyp_6-31g(d).firefly.inp (generated)

000929020.b3lyp_6-31g(d).smash.inp (generated)

000929020.b3lyp_6-31g(d).nwchem.inp (generated) 000929020.b3lyp_6-31g(d).log.xz 000929020.mol 000929020.PUBCHEM 000929020.mol (via Jmol)
000929022.b3lyp_6-31g(d).inp

000929022.b3lyp_6-31g(d).qchem.inp (generated)

000929022.b3lyp_6-31g(d).gjf (generated)

000929022.b3lyp_6-31g(d).firefly.inp (generated)

000929022.b3lyp_6-31g(d).smash.inp (generated)

000929022.b3lyp_6-31g(d).nwchem.inp (generated) 000929022.b3lyp_6-31g(d).log.xz 000929022.td-b3lyp_6-31g+(d).inp 000929022.td-b3lyp_6-31g+(d).log.xz

000929022.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929022.td-b3lyp_6-31+g(d).gjf (generated)

000929022.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929022.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929022.mol 000929022.PUBCHEM 000929022.mol (via Jmol)
000929034.b3lyp_6-31g(d).inp

000929034.b3lyp_6-31g(d).qchem.inp (generated)

000929034.b3lyp_6-31g(d).gjf (generated)

000929034.b3lyp_6-31g(d).firefly.inp (generated)

000929034.b3lyp_6-31g(d).smash.inp (generated)

000929034.b3lyp_6-31g(d).nwchem.inp (generated) 000929034.b3lyp_6-31g(d).log.xz 000929034.td-b3lyp_6-31g+(d).inp 000929034.td-b3lyp_6-31g+(d).log.xz

000929034.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929034.td-b3lyp_6-31+g(d).gjf (generated)

000929034.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929034.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929034.mol 000929034.PUBCHEM 000929034.mol (via Jmol)
000929047.b3lyp_6-31g(d).inp

000929047.b3lyp_6-31g(d).qchem.inp (generated)

000929047.b3lyp_6-31g(d).gjf (generated)

000929047.b3lyp_6-31g(d).firefly.inp (generated)

000929047.b3lyp_6-31g(d).smash.inp (generated)

000929047.b3lyp_6-31g(d).nwchem.inp (generated) 000929047.b3lyp_6-31g(d).log.xz 000929047.td-b3lyp_6-31g+(d).inp 000929047.td-b3lyp_6-31g+(d).log.xz

000929047.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929047.td-b3lyp_6-31+g(d).gjf (generated)

000929047.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929047.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929047.mol 000929047.PUBCHEM 000929047.mol (via Jmol)
000929087.b3lyp_6-31g(d).inp

000929087.b3lyp_6-31g(d).qchem.inp (generated)

000929087.b3lyp_6-31g(d).gjf (generated)

000929087.b3lyp_6-31g(d).firefly.inp (generated)

000929087.b3lyp_6-31g(d).smash.inp (generated)

000929087.b3lyp_6-31g(d).nwchem.inp (generated) 000929087.b3lyp_6-31g(d).log.xz 000929087.td-b3lyp_6-31g+(d).inp 000929087.td-b3lyp_6-31g+(d).log.xz

000929087.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929087.td-b3lyp_6-31+g(d).gjf (generated)

000929087.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929087.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929087.mol 000929087.PUBCHEM 000929087.mol (via Jmol)
000929096.b3lyp_6-31g(d).inp

000929096.b3lyp_6-31g(d).qchem.inp (generated)

000929096.b3lyp_6-31g(d).gjf (generated)

000929096.b3lyp_6-31g(d).firefly.inp (generated)

000929096.b3lyp_6-31g(d).smash.inp (generated)

000929096.b3lyp_6-31g(d).nwchem.inp (generated) 000929096.b3lyp_6-31g(d).log.xz 000929096.td-b3lyp_6-31g+(d).inp 000929096.td-b3lyp_6-31g+(d).log.xz

000929096.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929096.td-b3lyp_6-31+g(d).gjf (generated)

000929096.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929096.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929096.mol 000929096.PUBCHEM 000929096.mol (via Jmol)
000929097.b3lyp_6-31g(d).inp

000929097.b3lyp_6-31g(d).qchem.inp (generated)

000929097.b3lyp_6-31g(d).gjf (generated)

000929097.b3lyp_6-31g(d).firefly.inp (generated)

000929097.b3lyp_6-31g(d).smash.inp (generated)

000929097.b3lyp_6-31g(d).nwchem.inp (generated) 000929097.b3lyp_6-31g(d).log.xz 000929097.td-b3lyp_6-31g+(d).inp 000929097.td-b3lyp_6-31g+(d).log.xz

000929097.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929097.td-b3lyp_6-31+g(d).gjf (generated)

000929097.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929097.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929097.mol 000929097.PUBCHEM 000929097.mol (via Jmol)
000929099.b3lyp_6-31g(d).inp

000929099.b3lyp_6-31g(d).qchem.inp (generated)

000929099.b3lyp_6-31g(d).gjf (generated)

000929099.b3lyp_6-31g(d).firefly.inp (generated)

000929099.b3lyp_6-31g(d).smash.inp (generated)

000929099.b3lyp_6-31g(d).nwchem.inp (generated) 000929099.b3lyp_6-31g(d).log.xz 000929099.td-b3lyp_6-31g+(d).inp 000929099.td-b3lyp_6-31g+(d).log.xz

000929099.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929099.td-b3lyp_6-31+g(d).gjf (generated)

000929099.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929099.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929099.mol 000929099.PUBCHEM 000929099.mol (via Jmol)
000929100.b3lyp_6-31g(d).inp

000929100.b3lyp_6-31g(d).qchem.inp (generated)

000929100.b3lyp_6-31g(d).gjf (generated)

000929100.b3lyp_6-31g(d).firefly.inp (generated)

000929100.b3lyp_6-31g(d).smash.inp (generated)

000929100.b3lyp_6-31g(d).nwchem.inp (generated) 000929100.b3lyp_6-31g(d).log.xz 000929100.td-b3lyp_6-31g+(d).inp 000929100.td-b3lyp_6-31g+(d).log.xz

000929100.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929100.td-b3lyp_6-31+g(d).gjf (generated)

000929100.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929100.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929100.mol 000929100.PUBCHEM 000929100.mol (via Jmol)
000929102.b3lyp_6-31g(d).inp

000929102.b3lyp_6-31g(d).qchem.inp (generated)

000929102.b3lyp_6-31g(d).gjf (generated)

000929102.b3lyp_6-31g(d).firefly.inp (generated)

000929102.b3lyp_6-31g(d).smash.inp (generated)

000929102.b3lyp_6-31g(d).nwchem.inp (generated) 000929102.b3lyp_6-31g(d).log.xz 000929102.td-b3lyp_6-31g+(d).inp 000929102.td-b3lyp_6-31g+(d).log.xz

000929102.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929102.td-b3lyp_6-31+g(d).gjf (generated)

000929102.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929102.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929102.mol 000929102.PUBCHEM 000929102.mol (via Jmol)
000929103.b3lyp_6-31g(d).inp

000929103.b3lyp_6-31g(d).qchem.inp (generated)

000929103.b3lyp_6-31g(d).gjf (generated)

000929103.b3lyp_6-31g(d).firefly.inp (generated)

000929103.b3lyp_6-31g(d).smash.inp (generated)

000929103.b3lyp_6-31g(d).nwchem.inp (generated) 000929103.b3lyp_6-31g(d).log.xz 000929103.td-b3lyp_6-31g+(d).inp 000929103.td-b3lyp_6-31g+(d).log.xz

000929103.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929103.td-b3lyp_6-31+g(d).gjf (generated)

000929103.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929103.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929103.mol 000929103.PUBCHEM 000929103.mol (via Jmol)
000929105.b3lyp_6-31g(d).inp

000929105.b3lyp_6-31g(d).qchem.inp (generated)

000929105.b3lyp_6-31g(d).gjf (generated)

000929105.b3lyp_6-31g(d).firefly.inp (generated)

000929105.b3lyp_6-31g(d).smash.inp (generated)

000929105.b3lyp_6-31g(d).nwchem.inp (generated) 000929105.b3lyp_6-31g(d).log.xz 000929105.td-b3lyp_6-31g+(d).inp 000929105.td-b3lyp_6-31g+(d).log.xz

000929105.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929105.td-b3lyp_6-31+g(d).gjf (generated)

000929105.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929105.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929105.mol 000929105.PUBCHEM 000929105.mol (via Jmol)
000929112.b3lyp_6-31g(d).inp

000929112.b3lyp_6-31g(d).qchem.inp (generated)

000929112.b3lyp_6-31g(d).gjf (generated)

000929112.b3lyp_6-31g(d).firefly.inp (generated)

000929112.b3lyp_6-31g(d).smash.inp (generated)

000929112.b3lyp_6-31g(d).nwchem.inp (generated) 000929112.b3lyp_6-31g(d).log.xz 000929112.td-b3lyp_6-31g+(d).inp 000929112.td-b3lyp_6-31g+(d).log.xz

000929112.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929112.td-b3lyp_6-31+g(d).gjf (generated)

000929112.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929112.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929112.mol 000929112.PUBCHEM 000929112.mol (via Jmol)
000929113.b3lyp_6-31g(d).inp

000929113.b3lyp_6-31g(d).qchem.inp (generated)

000929113.b3lyp_6-31g(d).gjf (generated)

000929113.b3lyp_6-31g(d).firefly.inp (generated)

000929113.b3lyp_6-31g(d).smash.inp (generated)

000929113.b3lyp_6-31g(d).nwchem.inp (generated) 000929113.b3lyp_6-31g(d).log.xz 000929113.td-b3lyp_6-31g+(d).inp 000929113.td-b3lyp_6-31g+(d).log.xz

000929113.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929113.td-b3lyp_6-31+g(d).gjf (generated)

000929113.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929113.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929113.mol 000929113.PUBCHEM 000929113.mol (via Jmol)
000929121.b3lyp_6-31g(d).inp

000929121.b3lyp_6-31g(d).qchem.inp (generated)

000929121.b3lyp_6-31g(d).gjf (generated)

000929121.b3lyp_6-31g(d).firefly.inp (generated)

000929121.b3lyp_6-31g(d).smash.inp (generated)

000929121.b3lyp_6-31g(d).nwchem.inp (generated) 000929121.b3lyp_6-31g(d).log.xz 000929121.td-b3lyp_6-31g+(d).inp 000929121.td-b3lyp_6-31g+(d).log.xz

000929121.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929121.td-b3lyp_6-31+g(d).gjf (generated)

000929121.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929121.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929121.mol 000929121.PUBCHEM 000929121.mol (via Jmol)
000929130.b3lyp_6-31g(d).inp

000929130.b3lyp_6-31g(d).qchem.inp (generated)

000929130.b3lyp_6-31g(d).gjf (generated)

000929130.b3lyp_6-31g(d).firefly.inp (generated)

000929130.b3lyp_6-31g(d).smash.inp (generated)

000929130.b3lyp_6-31g(d).nwchem.inp (generated) 000929130.b3lyp_6-31g(d).log.xz 000929130.td-b3lyp_6-31g+(d).inp 000929130.td-b3lyp_6-31g+(d).log.xz

000929130.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929130.td-b3lyp_6-31+g(d).gjf (generated)

000929130.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929130.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929130.mol 000929130.PUBCHEM 000929130.mol (via Jmol)
000929131.b3lyp_6-31g(d).inp

000929131.b3lyp_6-31g(d).qchem.inp (generated)

000929131.b3lyp_6-31g(d).gjf (generated)

000929131.b3lyp_6-31g(d).firefly.inp (generated)

000929131.b3lyp_6-31g(d).smash.inp (generated)

000929131.b3lyp_6-31g(d).nwchem.inp (generated) 000929131.b3lyp_6-31g(d).log.xz 000929131.td-b3lyp_6-31g+(d).inp 000929131.td-b3lyp_6-31g+(d).log.xz

000929131.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929131.td-b3lyp_6-31+g(d).gjf (generated)

000929131.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929131.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929131.mol 000929131.PUBCHEM 000929131.mol (via Jmol)
000929137.b3lyp_6-31g(d).inp

000929137.b3lyp_6-31g(d).qchem.inp (generated)

000929137.b3lyp_6-31g(d).gjf (generated)

000929137.b3lyp_6-31g(d).firefly.inp (generated)

000929137.b3lyp_6-31g(d).smash.inp (generated)

000929137.b3lyp_6-31g(d).nwchem.inp (generated) 000929137.b3lyp_6-31g(d).log.xz 000929137.td-b3lyp_6-31g+(d).inp 000929137.td-b3lyp_6-31g+(d).log.xz

000929137.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929137.td-b3lyp_6-31+g(d).gjf (generated)

000929137.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929137.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929137.mol 000929137.PUBCHEM 000929137.mol (via Jmol)
000929138.b3lyp_6-31g(d).inp

000929138.b3lyp_6-31g(d).qchem.inp (generated)

000929138.b3lyp_6-31g(d).gjf (generated)

000929138.b3lyp_6-31g(d).firefly.inp (generated)

000929138.b3lyp_6-31g(d).smash.inp (generated)

000929138.b3lyp_6-31g(d).nwchem.inp (generated) 000929138.b3lyp_6-31g(d).log.xz 000929138.td-b3lyp_6-31g+(d).inp 000929138.td-b3lyp_6-31g+(d).log.xz

000929138.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929138.td-b3lyp_6-31+g(d).gjf (generated)

000929138.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929138.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929138.mol 000929138.PUBCHEM 000929138.mol (via Jmol)
000929139.b3lyp_6-31g(d).inp

000929139.b3lyp_6-31g(d).qchem.inp (generated)

000929139.b3lyp_6-31g(d).gjf (generated)

000929139.b3lyp_6-31g(d).firefly.inp (generated)

000929139.b3lyp_6-31g(d).smash.inp (generated)

000929139.b3lyp_6-31g(d).nwchem.inp (generated) 000929139.b3lyp_6-31g(d).log.xz 000929139.td-b3lyp_6-31g+(d).inp 000929139.td-b3lyp_6-31g+(d).log.xz

000929139.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929139.td-b3lyp_6-31+g(d).gjf (generated)

000929139.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929139.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929139.mol 000929139.PUBCHEM 000929139.mol (via Jmol)
000929141.b3lyp_6-31g(d).inp

000929141.b3lyp_6-31g(d).qchem.inp (generated)

000929141.b3lyp_6-31g(d).gjf (generated)

000929141.b3lyp_6-31g(d).firefly.inp (generated)

000929141.b3lyp_6-31g(d).smash.inp (generated)

000929141.b3lyp_6-31g(d).nwchem.inp (generated) 000929141.b3lyp_6-31g(d).log.xz 000929141.td-b3lyp_6-31g+(d).inp 000929141.td-b3lyp_6-31g+(d).log.xz

000929141.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929141.td-b3lyp_6-31+g(d).gjf (generated)

000929141.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929141.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929141.mol 000929141.PUBCHEM 000929141.mol (via Jmol)
000929146.b3lyp_6-31g(d).inp

000929146.b3lyp_6-31g(d).qchem.inp (generated)

000929146.b3lyp_6-31g(d).gjf (generated)

000929146.b3lyp_6-31g(d).firefly.inp (generated)

000929146.b3lyp_6-31g(d).smash.inp (generated)

000929146.b3lyp_6-31g(d).nwchem.inp (generated) 000929146.b3lyp_6-31g(d).log.xz 000929146.td-b3lyp_6-31g+(d).inp 000929146.td-b3lyp_6-31g+(d).log.xz

000929146.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929146.td-b3lyp_6-31+g(d).gjf (generated)

000929146.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929146.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929146.mol 000929146.PUBCHEM 000929146.mol (via Jmol)
000929147.b3lyp_6-31g(d).inp

000929147.b3lyp_6-31g(d).qchem.inp (generated)

000929147.b3lyp_6-31g(d).gjf (generated)

000929147.b3lyp_6-31g(d).firefly.inp (generated)

000929147.b3lyp_6-31g(d).smash.inp (generated)

000929147.b3lyp_6-31g(d).nwchem.inp (generated) 000929147.b3lyp_6-31g(d).log.xz 000929147.td-b3lyp_6-31g+(d).inp 000929147.td-b3lyp_6-31g+(d).log.xz

000929147.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929147.td-b3lyp_6-31+g(d).gjf (generated)

000929147.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929147.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929147.mol 000929147.PUBCHEM 000929147.mol (via Jmol)
000929152.b3lyp_6-31g(d).inp

000929152.b3lyp_6-31g(d).qchem.inp (generated)

000929152.b3lyp_6-31g(d).gjf (generated)

000929152.b3lyp_6-31g(d).firefly.inp (generated)

000929152.b3lyp_6-31g(d).smash.inp (generated)

000929152.b3lyp_6-31g(d).nwchem.inp (generated) 000929152.b3lyp_6-31g(d).log.xz 000929152.td-b3lyp_6-31g+(d).inp 000929152.td-b3lyp_6-31g+(d).log.xz

000929152.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929152.td-b3lyp_6-31+g(d).gjf (generated)

000929152.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929152.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929152.mol 000929152.PUBCHEM 000929152.mol (via Jmol)
000929168.b3lyp_6-31g(d).inp

000929168.b3lyp_6-31g(d).qchem.inp (generated)

000929168.b3lyp_6-31g(d).gjf (generated)

000929168.b3lyp_6-31g(d).firefly.inp (generated)

000929168.b3lyp_6-31g(d).smash.inp (generated)

000929168.b3lyp_6-31g(d).nwchem.inp (generated) 000929168.b3lyp_6-31g(d).log.xz 000929168.td-b3lyp_6-31g+(d).inp 000929168.td-b3lyp_6-31g+(d).log.xz

000929168.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929168.td-b3lyp_6-31+g(d).gjf (generated)

000929168.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929168.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929168.mol 000929168.PUBCHEM 000929168.mol (via Jmol)
000929178.b3lyp_6-31g(d).inp

000929178.b3lyp_6-31g(d).qchem.inp (generated)

000929178.b3lyp_6-31g(d).gjf (generated)

000929178.b3lyp_6-31g(d).firefly.inp (generated)

000929178.b3lyp_6-31g(d).smash.inp (generated)

000929178.b3lyp_6-31g(d).nwchem.inp (generated) 000929178.b3lyp_6-31g(d).log.xz 000929178.td-b3lyp_6-31g+(d).inp 000929178.td-b3lyp_6-31g+(d).log.xz

000929178.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929178.td-b3lyp_6-31+g(d).gjf (generated)

000929178.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929178.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929178.mol 000929178.PUBCHEM 000929178.mol (via Jmol)
000929181.b3lyp_6-31g(d).inp

000929181.b3lyp_6-31g(d).qchem.inp (generated)

000929181.b3lyp_6-31g(d).gjf (generated)

000929181.b3lyp_6-31g(d).firefly.inp (generated)

000929181.b3lyp_6-31g(d).smash.inp (generated)

000929181.b3lyp_6-31g(d).nwchem.inp (generated) 000929181.b3lyp_6-31g(d).log.xz 000929181.td-b3lyp_6-31g+(d).inp 000929181.td-b3lyp_6-31g+(d).log.xz

000929181.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929181.td-b3lyp_6-31+g(d).gjf (generated)

000929181.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929181.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929181.mol 000929181.PUBCHEM 000929181.mol (via Jmol)
000929182.b3lyp_6-31g(d).inp

000929182.b3lyp_6-31g(d).qchem.inp (generated)

000929182.b3lyp_6-31g(d).gjf (generated)

000929182.b3lyp_6-31g(d).firefly.inp (generated)

000929182.b3lyp_6-31g(d).smash.inp (generated)

000929182.b3lyp_6-31g(d).nwchem.inp (generated) 000929182.b3lyp_6-31g(d).log.xz 000929182.td-b3lyp_6-31g+(d).inp 000929182.td-b3lyp_6-31g+(d).log.xz

000929182.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929182.td-b3lyp_6-31+g(d).gjf (generated)

000929182.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929182.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929182.mol 000929182.PUBCHEM 000929182.mol (via Jmol)
000929187.b3lyp_6-31g(d).inp

000929187.b3lyp_6-31g(d).qchem.inp (generated)

000929187.b3lyp_6-31g(d).gjf (generated)

000929187.b3lyp_6-31g(d).firefly.inp (generated)

000929187.b3lyp_6-31g(d).smash.inp (generated)

000929187.b3lyp_6-31g(d).nwchem.inp (generated) 000929187.b3lyp_6-31g(d).log.xz 000929187.td-b3lyp_6-31g+(d).inp 000929187.td-b3lyp_6-31g+(d).log.xz

000929187.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929187.td-b3lyp_6-31+g(d).gjf (generated)

000929187.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929187.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929187.mol 000929187.PUBCHEM 000929187.mol (via Jmol)
000929196.b3lyp_6-31g(d).inp

000929196.b3lyp_6-31g(d).qchem.inp (generated)

000929196.b3lyp_6-31g(d).gjf (generated)

000929196.b3lyp_6-31g(d).firefly.inp (generated)

000929196.b3lyp_6-31g(d).smash.inp (generated)

000929196.b3lyp_6-31g(d).nwchem.inp (generated) 000929196.b3lyp_6-31g(d).log.xz 000929196.td-b3lyp_6-31g+(d).inp 000929196.td-b3lyp_6-31g+(d).log.xz

000929196.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929196.td-b3lyp_6-31+g(d).gjf (generated)

000929196.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929196.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929196.mol 000929196.PUBCHEM 000929196.mol (via Jmol)
000929212.b3lyp_6-31g(d).inp

000929212.b3lyp_6-31g(d).qchem.inp (generated)

000929212.b3lyp_6-31g(d).gjf (generated)

000929212.b3lyp_6-31g(d).firefly.inp (generated)

000929212.b3lyp_6-31g(d).smash.inp (generated)

000929212.b3lyp_6-31g(d).nwchem.inp (generated) 000929212.b3lyp_6-31g(d).log.xz 000929212.mol 000929212.PUBCHEM 000929212.mol (via Jmol)
000929224.b3lyp_6-31g(d).inp

000929224.b3lyp_6-31g(d).qchem.inp (generated)

000929224.b3lyp_6-31g(d).gjf (generated)

000929224.b3lyp_6-31g(d).firefly.inp (generated)

000929224.b3lyp_6-31g(d).smash.inp (generated)

000929224.b3lyp_6-31g(d).nwchem.inp (generated) 000929224.b3lyp_6-31g(d).log.xz 000929224.mol 000929224.PUBCHEM 000929224.mol (via Jmol)
000929225.b3lyp_6-31g(d).inp

000929225.b3lyp_6-31g(d).qchem.inp (generated)

000929225.b3lyp_6-31g(d).gjf (generated)

000929225.b3lyp_6-31g(d).firefly.inp (generated)

000929225.b3lyp_6-31g(d).smash.inp (generated)

000929225.b3lyp_6-31g(d).nwchem.inp (generated) 000929225.b3lyp_6-31g(d).log.xz 000929225.td-b3lyp_6-31g+(d).inp 000929225.td-b3lyp_6-31g+(d).log.xz

000929225.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929225.td-b3lyp_6-31+g(d).gjf (generated)

000929225.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929225.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929225.mol 000929225.PUBCHEM 000929225.mol (via Jmol)
000929226.b3lyp_6-31g(d).inp

000929226.b3lyp_6-31g(d).qchem.inp (generated)

000929226.b3lyp_6-31g(d).gjf (generated)

000929226.b3lyp_6-31g(d).firefly.inp (generated)

000929226.b3lyp_6-31g(d).smash.inp (generated)

000929226.b3lyp_6-31g(d).nwchem.inp (generated) 000929226.b3lyp_6-31g(d).log.xz 000929226.td-b3lyp_6-31g+(d).inp 000929226.td-b3lyp_6-31g+(d).log.xz

000929226.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929226.td-b3lyp_6-31+g(d).gjf (generated)

000929226.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929226.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929226.mol 000929226.PUBCHEM 000929226.mol (via Jmol)
000929234.b3lyp_6-31g(d).inp

000929234.b3lyp_6-31g(d).qchem.inp (generated)

000929234.b3lyp_6-31g(d).gjf (generated)

000929234.b3lyp_6-31g(d).firefly.inp (generated)

000929234.b3lyp_6-31g(d).smash.inp (generated)

000929234.b3lyp_6-31g(d).nwchem.inp (generated) 000929234.b3lyp_6-31g(d).log.xz 000929234.mol 000929234.PUBCHEM 000929234.mol (via Jmol)
000929235.b3lyp_6-31g(d).inp

000929235.b3lyp_6-31g(d).qchem.inp (generated)

000929235.b3lyp_6-31g(d).gjf (generated)

000929235.b3lyp_6-31g(d).firefly.inp (generated)

000929235.b3lyp_6-31g(d).smash.inp (generated)

000929235.b3lyp_6-31g(d).nwchem.inp (generated) 000929235.b3lyp_6-31g(d).log.xz 000929235.mol 000929235.PUBCHEM 000929235.mol (via Jmol)
000929238.b3lyp_6-31g(d).inp

000929238.b3lyp_6-31g(d).qchem.inp (generated)

000929238.b3lyp_6-31g(d).gjf (generated)

000929238.b3lyp_6-31g(d).firefly.inp (generated)

000929238.b3lyp_6-31g(d).smash.inp (generated)

000929238.b3lyp_6-31g(d).nwchem.inp (generated) 000929238.b3lyp_6-31g(d).log.xz 000929238.td-b3lyp_6-31g+(d).inp 000929238.td-b3lyp_6-31g+(d).log.xz

000929238.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929238.td-b3lyp_6-31+g(d).gjf (generated)

000929238.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929238.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929238.mol 000929238.PUBCHEM 000929238.mol (via Jmol)
000929255.b3lyp_6-31g(d).inp

000929255.b3lyp_6-31g(d).qchem.inp (generated)

000929255.b3lyp_6-31g(d).gjf (generated)

000929255.b3lyp_6-31g(d).firefly.inp (generated)

000929255.b3lyp_6-31g(d).smash.inp (generated)

000929255.b3lyp_6-31g(d).nwchem.inp (generated) 000929255.b3lyp_6-31g(d).log.xz 000929255.mol 000929255.PUBCHEM 000929255.mol (via Jmol)
000929260.b3lyp_6-31g(d).inp

000929260.b3lyp_6-31g(d).qchem.inp (generated)

000929260.b3lyp_6-31g(d).gjf (generated)

000929260.b3lyp_6-31g(d).firefly.inp (generated)

000929260.b3lyp_6-31g(d).smash.inp (generated)

000929260.b3lyp_6-31g(d).nwchem.inp (generated) 000929260.b3lyp_6-31g(d).log.xz 000929260.td-b3lyp_6-31g+(d).inp 000929260.td-b3lyp_6-31g+(d).log.xz

000929260.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929260.td-b3lyp_6-31+g(d).gjf (generated)

000929260.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929260.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929260.mol 000929260.PUBCHEM 000929260.mol (via Jmol)
000929261.b3lyp_6-31g(d).inp

000929261.b3lyp_6-31g(d).qchem.inp (generated)

000929261.b3lyp_6-31g(d).gjf (generated)

000929261.b3lyp_6-31g(d).firefly.inp (generated)

000929261.b3lyp_6-31g(d).smash.inp (generated)

000929261.b3lyp_6-31g(d).nwchem.inp (generated) 000929261.b3lyp_6-31g(d).log.xz 000929261.td-b3lyp_6-31g+(d).inp 000929261.td-b3lyp_6-31g+(d).log.xz

000929261.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929261.td-b3lyp_6-31+g(d).gjf (generated)

000929261.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929261.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929261.mol 000929261.PUBCHEM 000929261.mol (via Jmol)
000929321.b3lyp_6-31g(d).inp

000929321.b3lyp_6-31g(d).qchem.inp (generated)

000929321.b3lyp_6-31g(d).gjf (generated)

000929321.b3lyp_6-31g(d).firefly.inp (generated)

000929321.b3lyp_6-31g(d).smash.inp (generated)

000929321.b3lyp_6-31g(d).nwchem.inp (generated) 000929321.b3lyp_6-31g(d).log.xz 000929321.td-b3lyp_6-31g+(d).inp 000929321.td-b3lyp_6-31g+(d).log.xz

000929321.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929321.td-b3lyp_6-31+g(d).gjf (generated)

000929321.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929321.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929321.mol 000929321.PUBCHEM 000929321.mol (via Jmol)
000929363.b3lyp_6-31g(d).inp

000929363.b3lyp_6-31g(d).qchem.inp (generated)

000929363.b3lyp_6-31g(d).gjf (generated)

000929363.b3lyp_6-31g(d).firefly.inp (generated)

000929363.b3lyp_6-31g(d).smash.inp (generated)

000929363.b3lyp_6-31g(d).nwchem.inp (generated) 000929363.b3lyp_6-31g(d).log.xz 000929363.td-b3lyp_6-31g+(d).inp 000929363.td-b3lyp_6-31g+(d).log.xz

000929363.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929363.td-b3lyp_6-31+g(d).gjf (generated)

000929363.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929363.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929363.mol 000929363.PUBCHEM 000929363.mol (via Jmol)
000929388.b3lyp_6-31g(d).inp

000929388.b3lyp_6-31g(d).qchem.inp (generated)

000929388.b3lyp_6-31g(d).gjf (generated)

000929388.b3lyp_6-31g(d).firefly.inp (generated)

000929388.b3lyp_6-31g(d).smash.inp (generated)

000929388.b3lyp_6-31g(d).nwchem.inp (generated) 000929388.b3lyp_6-31g(d).log.xz 000929388.td-b3lyp_6-31g+(d).inp 000929388.td-b3lyp_6-31g+(d).log.xz

000929388.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929388.td-b3lyp_6-31+g(d).gjf (generated)

000929388.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929388.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929388.mol 000929388.PUBCHEM 000929388.mol (via Jmol)
000929394.b3lyp_6-31g(d).inp

000929394.b3lyp_6-31g(d).qchem.inp (generated)

000929394.b3lyp_6-31g(d).gjf (generated)

000929394.b3lyp_6-31g(d).firefly.inp (generated)

000929394.b3lyp_6-31g(d).smash.inp (generated)

000929394.b3lyp_6-31g(d).nwchem.inp (generated) 000929394.b3lyp_6-31g(d).log.xz 000929394.td-b3lyp_6-31g+(d).inp 000929394.td-b3lyp_6-31g+(d).log.xz

000929394.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929394.td-b3lyp_6-31+g(d).gjf (generated)

000929394.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929394.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929394.mol 000929394.PUBCHEM 000929394.mol (via Jmol)
000929403.b3lyp_6-31g(d).inp

000929403.b3lyp_6-31g(d).qchem.inp (generated)

000929403.b3lyp_6-31g(d).gjf (generated)

000929403.b3lyp_6-31g(d).firefly.inp (generated)

000929403.b3lyp_6-31g(d).smash.inp (generated)

000929403.b3lyp_6-31g(d).nwchem.inp (generated) 000929403.b3lyp_6-31g(d).log.xz 000929403.td-b3lyp_6-31g+(d).inp 000929403.td-b3lyp_6-31g+(d).log.xz

000929403.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929403.td-b3lyp_6-31+g(d).gjf (generated)

000929403.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929403.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929403.mol 000929403.PUBCHEM 000929403.mol (via Jmol)
000929409.b3lyp_6-31g(d).inp

000929409.b3lyp_6-31g(d).qchem.inp (generated)

000929409.b3lyp_6-31g(d).gjf (generated)

000929409.b3lyp_6-31g(d).firefly.inp (generated)

000929409.b3lyp_6-31g(d).smash.inp (generated)

000929409.b3lyp_6-31g(d).nwchem.inp (generated) 000929409.b3lyp_6-31g(d).log.xz 000929409.td-b3lyp_6-31g+(d).inp 000929409.td-b3lyp_6-31g+(d).log.xz

000929409.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929409.td-b3lyp_6-31+g(d).gjf (generated)

000929409.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929409.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929409.mol 000929409.PUBCHEM 000929409.mol (via Jmol)
000929452.b3lyp_6-31g(d).inp

000929452.b3lyp_6-31g(d).qchem.inp (generated)

000929452.b3lyp_6-31g(d).gjf (generated)

000929452.b3lyp_6-31g(d).firefly.inp (generated)

000929452.b3lyp_6-31g(d).smash.inp (generated)

000929452.b3lyp_6-31g(d).nwchem.inp (generated) 000929452.b3lyp_6-31g(d).log.xz 000929452.td-b3lyp_6-31g+(d).inp 000929452.td-b3lyp_6-31g+(d).log.xz

000929452.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929452.td-b3lyp_6-31+g(d).gjf (generated)

000929452.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929452.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929452.mol 000929452.PUBCHEM 000929452.mol (via Jmol)
000929489.b3lyp_6-31g(d).inp

000929489.b3lyp_6-31g(d).qchem.inp (generated)

000929489.b3lyp_6-31g(d).gjf (generated)

000929489.b3lyp_6-31g(d).firefly.inp (generated)

000929489.b3lyp_6-31g(d).smash.inp (generated)

000929489.b3lyp_6-31g(d).nwchem.inp (generated) 000929489.b3lyp_6-31g(d).log.xz 000929489.td-b3lyp_6-31g+(d).inp 000929489.td-b3lyp_6-31g+(d).log.xz

000929489.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929489.td-b3lyp_6-31+g(d).gjf (generated)

000929489.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929489.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929489.mol 000929489.PUBCHEM 000929489.mol (via Jmol)
000929521.b3lyp_6-31g(d).inp

000929521.b3lyp_6-31g(d).qchem.inp (generated)

000929521.b3lyp_6-31g(d).gjf (generated)

000929521.b3lyp_6-31g(d).firefly.inp (generated)

000929521.b3lyp_6-31g(d).smash.inp (generated)

000929521.b3lyp_6-31g(d).nwchem.inp (generated) 000929521.b3lyp_6-31g(d).log.xz 000929521.mol 000929521.PUBCHEM 000929521.mol (via Jmol)
000929527.b3lyp_6-31g(d).inp

000929527.b3lyp_6-31g(d).qchem.inp (generated)

000929527.b3lyp_6-31g(d).gjf (generated)

000929527.b3lyp_6-31g(d).firefly.inp (generated)

000929527.b3lyp_6-31g(d).smash.inp (generated)

000929527.b3lyp_6-31g(d).nwchem.inp (generated) 000929527.b3lyp_6-31g(d).log.xz 000929527.td-b3lyp_6-31g+(d).inp 000929527.td-b3lyp_6-31g+(d).log.xz

000929527.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929527.td-b3lyp_6-31+g(d).gjf (generated)

000929527.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929527.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929527.mol 000929527.PUBCHEM 000929527.mol (via Jmol)
000929528.b3lyp_6-31g(d).inp

000929528.b3lyp_6-31g(d).qchem.inp (generated)

000929528.b3lyp_6-31g(d).gjf (generated)

000929528.b3lyp_6-31g(d).firefly.inp (generated)

000929528.b3lyp_6-31g(d).smash.inp (generated)

000929528.b3lyp_6-31g(d).nwchem.inp (generated) 000929528.b3lyp_6-31g(d).log.xz 000929528.td-b3lyp_6-31g+(d).inp 000929528.td-b3lyp_6-31g+(d).log.xz

000929528.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929528.td-b3lyp_6-31+g(d).gjf (generated)

000929528.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929528.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929528.mol 000929528.PUBCHEM 000929528.mol (via Jmol)
000929634.b3lyp_6-31g(d).inp

000929634.b3lyp_6-31g(d).qchem.inp (generated)

000929634.b3lyp_6-31g(d).gjf (generated)

000929634.b3lyp_6-31g(d).firefly.inp (generated)

000929634.b3lyp_6-31g(d).smash.inp (generated)

000929634.b3lyp_6-31g(d).nwchem.inp (generated) 000929634.b3lyp_6-31g(d).log.xz 000929634.td-b3lyp_6-31g+(d).inp 000929634.td-b3lyp_6-31g+(d).log.xz

000929634.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929634.td-b3lyp_6-31+g(d).gjf (generated)

000929634.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929634.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929634.mol 000929634.PUBCHEM 000929634.mol (via Jmol)
000929651.b3lyp_6-31g(d).inp

000929651.b3lyp_6-31g(d).qchem.inp (generated)

000929651.b3lyp_6-31g(d).gjf (generated)

000929651.b3lyp_6-31g(d).firefly.inp (generated)

000929651.b3lyp_6-31g(d).smash.inp (generated)

000929651.b3lyp_6-31g(d).nwchem.inp (generated) 000929651.b3lyp_6-31g(d).log.xz 000929651.td-b3lyp_6-31g+(d).inp 000929651.td-b3lyp_6-31g+(d).log.xz

000929651.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929651.td-b3lyp_6-31+g(d).gjf (generated)

000929651.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929651.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929651.mol 000929651.PUBCHEM 000929651.mol (via Jmol)
000929663.b3lyp_6-31g(d).inp

000929663.b3lyp_6-31g(d).qchem.inp (generated)

000929663.b3lyp_6-31g(d).gjf (generated)

000929663.b3lyp_6-31g(d).firefly.inp (generated)

000929663.b3lyp_6-31g(d).smash.inp (generated)

000929663.b3lyp_6-31g(d).nwchem.inp (generated) 000929663.b3lyp_6-31g(d).log.xz 000929663.td-b3lyp_6-31g+(d).inp 000929663.td-b3lyp_6-31g+(d).log.xz

000929663.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929663.td-b3lyp_6-31+g(d).gjf (generated)

000929663.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929663.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929663.mol 000929663.PUBCHEM 000929663.mol (via Jmol)
000929666.b3lyp_6-31g(d).inp

000929666.b3lyp_6-31g(d).qchem.inp (generated)

000929666.b3lyp_6-31g(d).gjf (generated)

000929666.b3lyp_6-31g(d).firefly.inp (generated)

000929666.b3lyp_6-31g(d).smash.inp (generated)

000929666.b3lyp_6-31g(d).nwchem.inp (generated) 000929666.b3lyp_6-31g(d).log.xz 000929666.td-b3lyp_6-31g+(d).inp 000929666.td-b3lyp_6-31g+(d).log.xz

000929666.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929666.td-b3lyp_6-31+g(d).gjf (generated)

000929666.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929666.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929666.mol 000929666.PUBCHEM 000929666.mol (via Jmol)
000929735.b3lyp_6-31g(d).inp

000929735.b3lyp_6-31g(d).qchem.inp (generated)

000929735.b3lyp_6-31g(d).gjf (generated)

000929735.b3lyp_6-31g(d).firefly.inp (generated)

000929735.b3lyp_6-31g(d).smash.inp (generated)

000929735.b3lyp_6-31g(d).nwchem.inp (generated) 000929735.b3lyp_6-31g(d).log.xz 000929735.td-b3lyp_6-31g+(d).inp 000929735.td-b3lyp_6-31g+(d).log.xz

000929735.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929735.td-b3lyp_6-31+g(d).gjf (generated)

000929735.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929735.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929735.mol 000929735.PUBCHEM 000929735.mol (via Jmol)
000929819.b3lyp_6-31g(d).inp

000929819.b3lyp_6-31g(d).qchem.inp (generated)

000929819.b3lyp_6-31g(d).gjf (generated)

000929819.b3lyp_6-31g(d).firefly.inp (generated)

000929819.b3lyp_6-31g(d).smash.inp (generated)

000929819.b3lyp_6-31g(d).nwchem.inp (generated) 000929819.b3lyp_6-31g(d).log.xz 000929819.td-b3lyp_6-31g+(d).inp 000929819.td-b3lyp_6-31g+(d).log.xz

000929819.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929819.td-b3lyp_6-31+g(d).gjf (generated)

000929819.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929819.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929819.mol 000929819.PUBCHEM 000929819.mol (via Jmol)
000929834.b3lyp_6-31g(d).inp

000929834.b3lyp_6-31g(d).qchem.inp (generated)

000929834.b3lyp_6-31g(d).gjf (generated)

000929834.b3lyp_6-31g(d).firefly.inp (generated)

000929834.b3lyp_6-31g(d).smash.inp (generated)

000929834.b3lyp_6-31g(d).nwchem.inp (generated) 000929834.b3lyp_6-31g(d).log.xz 000929834.td-b3lyp_6-31g+(d).inp 000929834.td-b3lyp_6-31g+(d).log.xz

000929834.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929834.td-b3lyp_6-31+g(d).gjf (generated)

000929834.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929834.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929834.mol 000929834.PUBCHEM 000929834.mol (via Jmol)
000929884.b3lyp_6-31g(d).inp

000929884.b3lyp_6-31g(d).qchem.inp (generated)

000929884.b3lyp_6-31g(d).gjf (generated)

000929884.b3lyp_6-31g(d).firefly.inp (generated)

000929884.b3lyp_6-31g(d).smash.inp (generated)

000929884.b3lyp_6-31g(d).nwchem.inp (generated) 000929884.b3lyp_6-31g(d).log.xz 000929884.td-b3lyp_6-31g+(d).inp 000929884.td-b3lyp_6-31g+(d).log.xz

000929884.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929884.td-b3lyp_6-31+g(d).gjf (generated)

000929884.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929884.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929884.mol 000929884.PUBCHEM 000929884.mol (via Jmol)
000929902.b3lyp_6-31g(d).inp

000929902.b3lyp_6-31g(d).qchem.inp (generated)

000929902.b3lyp_6-31g(d).gjf (generated)

000929902.b3lyp_6-31g(d).firefly.inp (generated)

000929902.b3lyp_6-31g(d).smash.inp (generated)

000929902.b3lyp_6-31g(d).nwchem.inp (generated) 000929902.b3lyp_6-31g(d).log.xz 000929902.td-b3lyp_6-31g+(d).inp 000929902.td-b3lyp_6-31g+(d).log.xz

000929902.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929902.td-b3lyp_6-31+g(d).gjf (generated)

000929902.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929902.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929902.mol 000929902.PUBCHEM 000929902.mol (via Jmol)
000929903.b3lyp_6-31g(d).inp

000929903.b3lyp_6-31g(d).qchem.inp (generated)

000929903.b3lyp_6-31g(d).gjf (generated)

000929903.b3lyp_6-31g(d).firefly.inp (generated)

000929903.b3lyp_6-31g(d).smash.inp (generated)

000929903.b3lyp_6-31g(d).nwchem.inp (generated) 000929903.b3lyp_6-31g(d).log.xz 000929903.td-b3lyp_6-31g+(d).inp 000929903.td-b3lyp_6-31g+(d).log.xz

000929903.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929903.td-b3lyp_6-31+g(d).gjf (generated)

000929903.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929903.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929903.mol 000929903.PUBCHEM 000929903.mol (via Jmol)
000929928.b3lyp_6-31g(d).inp

000929928.b3lyp_6-31g(d).qchem.inp (generated)

000929928.b3lyp_6-31g(d).gjf (generated)

000929928.b3lyp_6-31g(d).firefly.inp (generated)

000929928.b3lyp_6-31g(d).smash.inp (generated)

000929928.b3lyp_6-31g(d).nwchem.inp (generated) 000929928.b3lyp_6-31g(d).log.xz 000929928.td-b3lyp_6-31g+(d).inp 000929928.td-b3lyp_6-31g+(d).log.xz

000929928.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929928.td-b3lyp_6-31+g(d).gjf (generated)

000929928.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929928.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929928.mol 000929928.PUBCHEM 000929928.mol (via Jmol)
000929948.b3lyp_6-31g(d).inp

000929948.b3lyp_6-31g(d).qchem.inp (generated)

000929948.b3lyp_6-31g(d).gjf (generated)

000929948.b3lyp_6-31g(d).firefly.inp (generated)

000929948.b3lyp_6-31g(d).smash.inp (generated)

000929948.b3lyp_6-31g(d).nwchem.inp (generated) 000929948.b3lyp_6-31g(d).log.xz 000929948.td-b3lyp_6-31g+(d).inp 000929948.td-b3lyp_6-31g+(d).log.xz

000929948.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929948.td-b3lyp_6-31+g(d).gjf (generated)

000929948.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929948.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929948.mol 000929948.PUBCHEM 000929948.mol (via Jmol)
000929949.b3lyp_6-31g(d).inp

000929949.b3lyp_6-31g(d).qchem.inp (generated)

000929949.b3lyp_6-31g(d).gjf (generated)

000929949.b3lyp_6-31g(d).firefly.inp (generated)

000929949.b3lyp_6-31g(d).smash.inp (generated)

000929949.b3lyp_6-31g(d).nwchem.inp (generated) 000929949.b3lyp_6-31g(d).log.xz 000929949.td-b3lyp_6-31g+(d).inp 000929949.td-b3lyp_6-31g+(d).log.xz

000929949.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929949.td-b3lyp_6-31+g(d).gjf (generated)

000929949.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929949.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929949.mol 000929949.PUBCHEM 000929949.mol (via Jmol)
000929955.b3lyp_6-31g(d).inp

000929955.b3lyp_6-31g(d).qchem.inp (generated)

000929955.b3lyp_6-31g(d).gjf (generated)

000929955.b3lyp_6-31g(d).firefly.inp (generated)

000929955.b3lyp_6-31g(d).smash.inp (generated)

000929955.b3lyp_6-31g(d).nwchem.inp (generated) 000929955.b3lyp_6-31g(d).log.xz 000929955.td-b3lyp_6-31g+(d).inp 000929955.td-b3lyp_6-31g+(d).log.xz

000929955.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929955.td-b3lyp_6-31+g(d).gjf (generated)

000929955.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929955.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929955.mol 000929955.PUBCHEM 000929955.mol (via Jmol)
000929974.b3lyp_6-31g(d).inp

000929974.b3lyp_6-31g(d).qchem.inp (generated)

000929974.b3lyp_6-31g(d).gjf (generated)

000929974.b3lyp_6-31g(d).firefly.inp (generated)

000929974.b3lyp_6-31g(d).smash.inp (generated)

000929974.b3lyp_6-31g(d).nwchem.inp (generated) 000929974.b3lyp_6-31g(d).log.xz 000929974.td-b3lyp_6-31g+(d).inp 000929974.td-b3lyp_6-31g+(d).log.xz

000929974.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929974.td-b3lyp_6-31+g(d).gjf (generated)

000929974.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929974.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929974.mol 000929974.PUBCHEM 000929974.mol (via Jmol)
000929975.b3lyp_6-31g(d).inp

000929975.b3lyp_6-31g(d).qchem.inp (generated)

000929975.b3lyp_6-31g(d).gjf (generated)

000929975.b3lyp_6-31g(d).firefly.inp (generated)

000929975.b3lyp_6-31g(d).smash.inp (generated)

000929975.b3lyp_6-31g(d).nwchem.inp (generated) 000929975.b3lyp_6-31g(d).log.xz 000929975.mol 000929975.PUBCHEM 000929975.mol (via Jmol)
000929976.b3lyp_6-31g(d).inp

000929976.b3lyp_6-31g(d).qchem.inp (generated)

000929976.b3lyp_6-31g(d).gjf (generated)

000929976.b3lyp_6-31g(d).firefly.inp (generated)

000929976.b3lyp_6-31g(d).smash.inp (generated)

000929976.b3lyp_6-31g(d).nwchem.inp (generated) 000929976.b3lyp_6-31g(d).log.xz 000929976.td-b3lyp_6-31g+(d).inp 000929976.td-b3lyp_6-31g+(d).log.xz

000929976.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929976.td-b3lyp_6-31+g(d).gjf (generated)

000929976.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929976.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929976.mol 000929976.PUBCHEM 000929976.mol (via Jmol)
000929977.b3lyp_6-31g(d).inp

000929977.b3lyp_6-31g(d).qchem.inp (generated)

000929977.b3lyp_6-31g(d).gjf (generated)

000929977.b3lyp_6-31g(d).firefly.inp (generated)

000929977.b3lyp_6-31g(d).smash.inp (generated)

000929977.b3lyp_6-31g(d).nwchem.inp (generated) 000929977.b3lyp_6-31g(d).log.xz 000929977.td-b3lyp_6-31g+(d).inp 000929977.td-b3lyp_6-31g+(d).log.xz

000929977.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929977.td-b3lyp_6-31+g(d).gjf (generated)

000929977.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929977.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929977.mol 000929977.PUBCHEM 000929977.mol (via Jmol)
000929997.b3lyp_6-31g(d).inp

000929997.b3lyp_6-31g(d).qchem.inp (generated)

000929997.b3lyp_6-31g(d).gjf (generated)

000929997.b3lyp_6-31g(d).firefly.inp (generated)

000929997.b3lyp_6-31g(d).smash.inp (generated)

000929997.b3lyp_6-31g(d).nwchem.inp (generated) 000929997.b3lyp_6-31g(d).log.xz 000929997.td-b3lyp_6-31g+(d).inp 000929997.td-b3lyp_6-31g+(d).log.xz

000929997.td-b3lyp_6-31+g(d).qchem.inp (generated)

000929997.td-b3lyp_6-31+g(d).gjf (generated)

000929997.td-b3lyp_6-31+g(d).firefly.inp (generated)

000929997.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000929997.mol 000929997.PUBCHEM 000929997.mol (via Jmol)
000930231.b3lyp_6-31g(d).inp

000930231.b3lyp_6-31g(d).qchem.inp (generated)

000930231.b3lyp_6-31g(d).gjf (generated)

000930231.b3lyp_6-31g(d).firefly.inp (generated)

000930231.b3lyp_6-31g(d).smash.inp (generated)

000930231.b3lyp_6-31g(d).nwchem.inp (generated) 000930231.b3lyp_6-31g(d).log.xz 000930231.td-b3lyp_6-31g+(d).inp 000930231.td-b3lyp_6-31g+(d).log.xz

000930231.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930231.td-b3lyp_6-31+g(d).gjf (generated)

000930231.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930231.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930231.mol 000930231.PUBCHEM 000930231.mol (via Jmol)
000930232.b3lyp_6-31g(d).inp

000930232.b3lyp_6-31g(d).qchem.inp (generated)

000930232.b3lyp_6-31g(d).gjf (generated)

000930232.b3lyp_6-31g(d).firefly.inp (generated)

000930232.b3lyp_6-31g(d).smash.inp (generated)

000930232.b3lyp_6-31g(d).nwchem.inp (generated) 000930232.b3lyp_6-31g(d).log.xz 000930232.td-b3lyp_6-31g+(d).inp 000930232.td-b3lyp_6-31g+(d).log.xz

000930232.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930232.td-b3lyp_6-31+g(d).gjf (generated)

000930232.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930232.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930232.mol 000930232.PUBCHEM 000930232.mol (via Jmol)
000930237.b3lyp_6-31g(d).inp

000930237.b3lyp_6-31g(d).qchem.inp (generated)

000930237.b3lyp_6-31g(d).gjf (generated)

000930237.b3lyp_6-31g(d).firefly.inp (generated)

000930237.b3lyp_6-31g(d).smash.inp (generated)

000930237.b3lyp_6-31g(d).nwchem.inp (generated) 000930237.b3lyp_6-31g(d).log.xz 000930237.td-b3lyp_6-31g+(d).inp 000930237.td-b3lyp_6-31g+(d).log.xz

000930237.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930237.td-b3lyp_6-31+g(d).gjf (generated)

000930237.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930237.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930237.mol 000930237.PUBCHEM 000930237.mol (via Jmol)
000930253.b3lyp_6-31g(d).inp

000930253.b3lyp_6-31g(d).qchem.inp (generated)

000930253.b3lyp_6-31g(d).gjf (generated)

000930253.b3lyp_6-31g(d).firefly.inp (generated)

000930253.b3lyp_6-31g(d).smash.inp (generated)

000930253.b3lyp_6-31g(d).nwchem.inp (generated) 000930253.b3lyp_6-31g(d).log.xz 000930253.mol 000930253.PUBCHEM 000930253.mol (via Jmol)
000930294.b3lyp_6-31g(d).inp

000930294.b3lyp_6-31g(d).qchem.inp (generated)

000930294.b3lyp_6-31g(d).gjf (generated)

000930294.b3lyp_6-31g(d).firefly.inp (generated)

000930294.b3lyp_6-31g(d).smash.inp (generated)

000930294.b3lyp_6-31g(d).nwchem.inp (generated) 000930294.b3lyp_6-31g(d).log.xz 000930294.mol 000930294.PUBCHEM 000930294.mol (via Jmol)
000930322.b3lyp_6-31g(d).inp

000930322.b3lyp_6-31g(d).qchem.inp (generated)

000930322.b3lyp_6-31g(d).gjf (generated)

000930322.b3lyp_6-31g(d).firefly.inp (generated)

000930322.b3lyp_6-31g(d).smash.inp (generated)

000930322.b3lyp_6-31g(d).nwchem.inp (generated) 000930322.b3lyp_6-31g(d).log.xz 000930322.td-b3lyp_6-31g+(d).inp 000930322.td-b3lyp_6-31g+(d).log.xz

000930322.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930322.td-b3lyp_6-31+g(d).gjf (generated)

000930322.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930322.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930322.mol 000930322.PUBCHEM 000930322.mol (via Jmol)
000930380.b3lyp_6-31g(d).inp

000930380.b3lyp_6-31g(d).qchem.inp (generated)

000930380.b3lyp_6-31g(d).gjf (generated)

000930380.b3lyp_6-31g(d).firefly.inp (generated)

000930380.b3lyp_6-31g(d).smash.inp (generated)

000930380.b3lyp_6-31g(d).nwchem.inp (generated) 000930380.b3lyp_6-31g(d).log.xz 000930380.td-b3lyp_6-31g+(d).inp 000930380.td-b3lyp_6-31g+(d).log.xz

000930380.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930380.td-b3lyp_6-31+g(d).gjf (generated)

000930380.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930380.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930380.mol 000930380.PUBCHEM 000930380.mol (via Jmol)
000930424.b3lyp_6-31g(d).inp

000930424.b3lyp_6-31g(d).qchem.inp (generated)

000930424.b3lyp_6-31g(d).gjf (generated)

000930424.b3lyp_6-31g(d).firefly.inp (generated)

000930424.b3lyp_6-31g(d).smash.inp (generated)

000930424.b3lyp_6-31g(d).nwchem.inp (generated) 000930424.b3lyp_6-31g(d).log.xz 000930424.mol 000930424.PUBCHEM 000930424.mol (via Jmol)
000930428.b3lyp_6-31g(d).inp

000930428.b3lyp_6-31g(d).qchem.inp (generated)

000930428.b3lyp_6-31g(d).gjf (generated)

000930428.b3lyp_6-31g(d).firefly.inp (generated)

000930428.b3lyp_6-31g(d).smash.inp (generated)

000930428.b3lyp_6-31g(d).nwchem.inp (generated) 000930428.b3lyp_6-31g(d).log.xz 000930428.td-b3lyp_6-31g+(d).inp 000930428.td-b3lyp_6-31g+(d).log.xz

000930428.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930428.td-b3lyp_6-31+g(d).gjf (generated)

000930428.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930428.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930428.mol 000930428.PUBCHEM 000930428.mol (via Jmol)
000930432.b3lyp_6-31g(d).inp

000930432.b3lyp_6-31g(d).qchem.inp (generated)

000930432.b3lyp_6-31g(d).gjf (generated)

000930432.b3lyp_6-31g(d).firefly.inp (generated)

000930432.b3lyp_6-31g(d).smash.inp (generated)

000930432.b3lyp_6-31g(d).nwchem.inp (generated) 000930432.b3lyp_6-31g(d).log.xz 000930432.td-b3lyp_6-31g+(d).inp 000930432.td-b3lyp_6-31g+(d).log.xz

000930432.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930432.td-b3lyp_6-31+g(d).gjf (generated)

000930432.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930432.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930432.mol 000930432.PUBCHEM 000930432.mol (via Jmol)
000930473.b3lyp_6-31g(d).inp

000930473.b3lyp_6-31g(d).qchem.inp (generated)

000930473.b3lyp_6-31g(d).gjf (generated)

000930473.b3lyp_6-31g(d).firefly.inp (generated)

000930473.b3lyp_6-31g(d).smash.inp (generated)

000930473.b3lyp_6-31g(d).nwchem.inp (generated) 000930473.b3lyp_6-31g(d).log.xz 000930473.mol 000930473.PUBCHEM 000930473.mol (via Jmol)
000930597.b3lyp_6-31g(d).inp

000930597.b3lyp_6-31g(d).qchem.inp (generated)

000930597.b3lyp_6-31g(d).gjf (generated)

000930597.b3lyp_6-31g(d).firefly.inp (generated)

000930597.b3lyp_6-31g(d).smash.inp (generated)

000930597.b3lyp_6-31g(d).nwchem.inp (generated) 000930597.b3lyp_6-31g(d).log.xz 000930597.td-b3lyp_6-31g+(d).inp 000930597.td-b3lyp_6-31g+(d).log.xz

000930597.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930597.td-b3lyp_6-31+g(d).gjf (generated)

000930597.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930597.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930597.mol 000930597.PUBCHEM 000930597.mol (via Jmol)
000930598.b3lyp_6-31g(d).inp

000930598.b3lyp_6-31g(d).qchem.inp (generated)

000930598.b3lyp_6-31g(d).gjf (generated)

000930598.b3lyp_6-31g(d).firefly.inp (generated)

000930598.b3lyp_6-31g(d).smash.inp (generated)

000930598.b3lyp_6-31g(d).nwchem.inp (generated) 000930598.b3lyp_6-31g(d).log.xz 000930598.td-b3lyp_6-31g+(d).inp 000930598.td-b3lyp_6-31g+(d).log.xz

000930598.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930598.td-b3lyp_6-31+g(d).gjf (generated)

000930598.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930598.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930598.mol 000930598.PUBCHEM 000930598.mol (via Jmol)
000930624.b3lyp_6-31g(d).inp

000930624.b3lyp_6-31g(d).qchem.inp (generated)

000930624.b3lyp_6-31g(d).gjf (generated)

000930624.b3lyp_6-31g(d).firefly.inp (generated)

000930624.b3lyp_6-31g(d).smash.inp (generated)

000930624.b3lyp_6-31g(d).nwchem.inp (generated) 000930624.b3lyp_6-31g(d).log.xz 000930624.td-b3lyp_6-31g+(d).inp 000930624.td-b3lyp_6-31g+(d).log.xz

000930624.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930624.td-b3lyp_6-31+g(d).gjf (generated)

000930624.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930624.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930624.mol 000930624.PUBCHEM 000930624.mol (via Jmol)
000930638.b3lyp_6-31g(d).inp

000930638.b3lyp_6-31g(d).qchem.inp (generated)

000930638.b3lyp_6-31g(d).gjf (generated)

000930638.b3lyp_6-31g(d).firefly.inp (generated)

000930638.b3lyp_6-31g(d).smash.inp (generated)

000930638.b3lyp_6-31g(d).nwchem.inp (generated) 000930638.b3lyp_6-31g(d).log.xz 000930638.td-b3lyp_6-31g+(d).inp 000930638.td-b3lyp_6-31g+(d).log.xz

000930638.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930638.td-b3lyp_6-31+g(d).gjf (generated)

000930638.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930638.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930638.mol 000930638.PUBCHEM 000930638.mol (via Jmol)
000930639.b3lyp_6-31g(d).inp

000930639.b3lyp_6-31g(d).qchem.inp (generated)

000930639.b3lyp_6-31g(d).gjf (generated)

000930639.b3lyp_6-31g(d).firefly.inp (generated)

000930639.b3lyp_6-31g(d).smash.inp (generated)

000930639.b3lyp_6-31g(d).nwchem.inp (generated) 000930639.b3lyp_6-31g(d).log.xz 000930639.td-b3lyp_6-31g+(d).inp 000930639.td-b3lyp_6-31g+(d).log.xz

000930639.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930639.td-b3lyp_6-31+g(d).gjf (generated)

000930639.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930639.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930639.mol 000930639.PUBCHEM 000930639.mol (via Jmol)
000930661.b3lyp_6-31g(d).inp

000930661.b3lyp_6-31g(d).qchem.inp (generated)

000930661.b3lyp_6-31g(d).gjf (generated)

000930661.b3lyp_6-31g(d).firefly.inp (generated)

000930661.b3lyp_6-31g(d).smash.inp (generated)

000930661.b3lyp_6-31g(d).nwchem.inp (generated) 000930661.b3lyp_6-31g(d).log.xz 000930661.td-b3lyp_6-31g+(d).inp 000930661.td-b3lyp_6-31g+(d).log.xz

000930661.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930661.td-b3lyp_6-31+g(d).gjf (generated)

000930661.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930661.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930661.mol 000930661.PUBCHEM 000930661.mol (via Jmol)
000930669.b3lyp_6-31g(d).inp

000930669.b3lyp_6-31g(d).qchem.inp (generated)

000930669.b3lyp_6-31g(d).gjf (generated)

000930669.b3lyp_6-31g(d).firefly.inp (generated)

000930669.b3lyp_6-31g(d).smash.inp (generated)

000930669.b3lyp_6-31g(d).nwchem.inp (generated) 000930669.b3lyp_6-31g(d).log.xz 000930669.td-b3lyp_6-31g+(d).inp 000930669.td-b3lyp_6-31g+(d).log.xz

000930669.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930669.td-b3lyp_6-31+g(d).gjf (generated)

000930669.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930669.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930669.mol 000930669.PUBCHEM 000930669.mol (via Jmol)
000930670.b3lyp_6-31g(d).inp

000930670.b3lyp_6-31g(d).qchem.inp (generated)

000930670.b3lyp_6-31g(d).gjf (generated)

000930670.b3lyp_6-31g(d).firefly.inp (generated)

000930670.b3lyp_6-31g(d).smash.inp (generated)

000930670.b3lyp_6-31g(d).nwchem.inp (generated) 000930670.b3lyp_6-31g(d).log.xz 000930670.td-b3lyp_6-31g+(d).inp 000930670.td-b3lyp_6-31g+(d).log.xz

000930670.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930670.td-b3lyp_6-31+g(d).gjf (generated)

000930670.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930670.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930670.mol 000930670.PUBCHEM 000930670.mol (via Jmol)
000930673.b3lyp_6-31g(d).inp

000930673.b3lyp_6-31g(d).qchem.inp (generated)

000930673.b3lyp_6-31g(d).gjf (generated)

000930673.b3lyp_6-31g(d).firefly.inp (generated)

000930673.b3lyp_6-31g(d).smash.inp (generated)

000930673.b3lyp_6-31g(d).nwchem.inp (generated) 000930673.b3lyp_6-31g(d).log.xz 000930673.td-b3lyp_6-31g+(d).inp 000930673.td-b3lyp_6-31g+(d).log.xz

000930673.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930673.td-b3lyp_6-31+g(d).gjf (generated)

000930673.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930673.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930673.mol 000930673.PUBCHEM 000930673.mol (via Jmol)
000930682.b3lyp_6-31g(d).inp

000930682.b3lyp_6-31g(d).qchem.inp (generated)

000930682.b3lyp_6-31g(d).gjf (generated)

000930682.b3lyp_6-31g(d).firefly.inp (generated)

000930682.b3lyp_6-31g(d).smash.inp (generated)

000930682.b3lyp_6-31g(d).nwchem.inp (generated) 000930682.b3lyp_6-31g(d).log.xz 000930682.mol 000930682.PUBCHEM 000930682.mol (via Jmol)
000930708.b3lyp_6-31g(d).inp

000930708.b3lyp_6-31g(d).qchem.inp (generated)

000930708.b3lyp_6-31g(d).gjf (generated)

000930708.b3lyp_6-31g(d).firefly.inp (generated)

000930708.b3lyp_6-31g(d).smash.inp (generated)

000930708.b3lyp_6-31g(d).nwchem.inp (generated) 000930708.b3lyp_6-31g(d).log.xz 000930708.td-b3lyp_6-31g+(d).inp 000930708.td-b3lyp_6-31g+(d).log.xz

000930708.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930708.td-b3lyp_6-31+g(d).gjf (generated)

000930708.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930708.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930708.mol 000930708.PUBCHEM 000930708.mol (via Jmol)
000930740.b3lyp_6-31g(d).inp

000930740.b3lyp_6-31g(d).qchem.inp (generated)

000930740.b3lyp_6-31g(d).gjf (generated)

000930740.b3lyp_6-31g(d).firefly.inp (generated)

000930740.b3lyp_6-31g(d).smash.inp (generated)

000930740.b3lyp_6-31g(d).nwchem.inp (generated) 000930740.b3lyp_6-31g(d).log.xz 000930740.td-b3lyp_6-31g+(d).inp 000930740.td-b3lyp_6-31g+(d).log.xz

000930740.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930740.td-b3lyp_6-31+g(d).gjf (generated)

000930740.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930740.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930740.mol 000930740.PUBCHEM 000930740.mol (via Jmol)
000930741.b3lyp_6-31g(d).inp

000930741.b3lyp_6-31g(d).qchem.inp (generated)

000930741.b3lyp_6-31g(d).gjf (generated)

000930741.b3lyp_6-31g(d).firefly.inp (generated)

000930741.b3lyp_6-31g(d).smash.inp (generated)

000930741.b3lyp_6-31g(d).nwchem.inp (generated) 000930741.b3lyp_6-31g(d).log.xz 000930741.td-b3lyp_6-31g+(d).inp 000930741.td-b3lyp_6-31g+(d).log.xz

000930741.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930741.td-b3lyp_6-31+g(d).gjf (generated)

000930741.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930741.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930741.mol 000930741.PUBCHEM 000930741.mol (via Jmol)
000930768.b3lyp_6-31g(d).inp

000930768.b3lyp_6-31g(d).qchem.inp (generated)

000930768.b3lyp_6-31g(d).gjf (generated)

000930768.b3lyp_6-31g(d).firefly.inp (generated)

000930768.b3lyp_6-31g(d).smash.inp (generated)

000930768.b3lyp_6-31g(d).nwchem.inp (generated) 000930768.b3lyp_6-31g(d).log.xz 000930768.td-b3lyp_6-31g+(d).inp 000930768.td-b3lyp_6-31g+(d).log.xz

000930768.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930768.td-b3lyp_6-31+g(d).gjf (generated)

000930768.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930768.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930768.mol 000930768.PUBCHEM 000930768.mol (via Jmol)
000930769.b3lyp_6-31g(d).inp

000930769.b3lyp_6-31g(d).qchem.inp (generated)

000930769.b3lyp_6-31g(d).gjf (generated)

000930769.b3lyp_6-31g(d).firefly.inp (generated)

000930769.b3lyp_6-31g(d).smash.inp (generated)

000930769.b3lyp_6-31g(d).nwchem.inp (generated) 000930769.b3lyp_6-31g(d).log.xz 000930769.td-b3lyp_6-31g+(d).inp 000930769.td-b3lyp_6-31g+(d).log.xz

000930769.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930769.td-b3lyp_6-31+g(d).gjf (generated)

000930769.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930769.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930769.mol 000930769.PUBCHEM 000930769.mol (via Jmol)
000930786.b3lyp_6-31g(d).inp

000930786.b3lyp_6-31g(d).qchem.inp (generated)

000930786.b3lyp_6-31g(d).gjf (generated)

000930786.b3lyp_6-31g(d).firefly.inp (generated)

000930786.b3lyp_6-31g(d).smash.inp (generated)

000930786.b3lyp_6-31g(d).nwchem.inp (generated) 000930786.b3lyp_6-31g(d).log.xz 000930786.mol 000930786.PUBCHEM 000930786.mol (via Jmol)
000930801.b3lyp_6-31g(d).inp

000930801.b3lyp_6-31g(d).qchem.inp (generated)

000930801.b3lyp_6-31g(d).gjf (generated)

000930801.b3lyp_6-31g(d).firefly.inp (generated)

000930801.b3lyp_6-31g(d).smash.inp (generated)

000930801.b3lyp_6-31g(d).nwchem.inp (generated) 000930801.b3lyp_6-31g(d).log.xz 000930801.td-b3lyp_6-31g+(d).inp 000930801.td-b3lyp_6-31g+(d).log.xz

000930801.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930801.td-b3lyp_6-31+g(d).gjf (generated)

000930801.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930801.mol 000930801.PUBCHEM 000930801.mol (via Jmol)
000930835.b3lyp_6-31g(d).inp

000930835.b3lyp_6-31g(d).qchem.inp (generated)

000930835.b3lyp_6-31g(d).gjf (generated)

000930835.b3lyp_6-31g(d).firefly.inp (generated)

000930835.b3lyp_6-31g(d).smash.inp (generated)

000930835.b3lyp_6-31g(d).nwchem.inp (generated) 000930835.b3lyp_6-31g(d).log.xz 000930835.td-b3lyp_6-31g+(d).inp 000930835.td-b3lyp_6-31g+(d).log.xz

000930835.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930835.td-b3lyp_6-31+g(d).gjf (generated)

000930835.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930835.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930835.mol 000930835.PUBCHEM 000930835.mol (via Jmol)
000930836.b3lyp_6-31g(d).inp

000930836.b3lyp_6-31g(d).qchem.inp (generated)

000930836.b3lyp_6-31g(d).gjf (generated)

000930836.b3lyp_6-31g(d).firefly.inp (generated)

000930836.b3lyp_6-31g(d).smash.inp (generated)

000930836.b3lyp_6-31g(d).nwchem.inp (generated) 000930836.b3lyp_6-31g(d).log.xz 000930836.td-b3lyp_6-31g+(d).inp 000930836.td-b3lyp_6-31g+(d).log.xz

000930836.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930836.td-b3lyp_6-31+g(d).gjf (generated)

000930836.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930836.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930836.mol 000930836.PUBCHEM 000930836.mol (via Jmol)
000930897.b3lyp_6-31g(d).inp

000930897.b3lyp_6-31g(d).qchem.inp (generated)

000930897.b3lyp_6-31g(d).gjf (generated)

000930897.b3lyp_6-31g(d).firefly.inp (generated)

000930897.b3lyp_6-31g(d).smash.inp (generated)

000930897.b3lyp_6-31g(d).nwchem.inp (generated) 000930897.b3lyp_6-31g(d).log.xz 000930897.td-b3lyp_6-31g+(d).inp 000930897.td-b3lyp_6-31g+(d).log.xz

000930897.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930897.td-b3lyp_6-31+g(d).gjf (generated)

000930897.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930897.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930897.mol 000930897.PUBCHEM 000930897.mol (via Jmol)
000930948.b3lyp_6-31g(d).inp

000930948.b3lyp_6-31g(d).qchem.inp (generated)

000930948.b3lyp_6-31g(d).gjf (generated)

000930948.b3lyp_6-31g(d).firefly.inp (generated)

000930948.b3lyp_6-31g(d).smash.inp (generated)

000930948.b3lyp_6-31g(d).nwchem.inp (generated) 000930948.b3lyp_6-31g(d).log.xz 000930948.mol 000930948.PUBCHEM 000930948.mol (via Jmol)
000930950.b3lyp_6-31g(d).inp

000930950.b3lyp_6-31g(d).qchem.inp (generated)

000930950.b3lyp_6-31g(d).gjf (generated)

000930950.b3lyp_6-31g(d).firefly.inp (generated)

000930950.b3lyp_6-31g(d).smash.inp (generated)

000930950.b3lyp_6-31g(d).nwchem.inp (generated) 000930950.b3lyp_6-31g(d).log.xz 000930950.td-b3lyp_6-31g+(d).inp 000930950.td-b3lyp_6-31g+(d).log.xz

000930950.td-b3lyp_6-31+g(d).qchem.inp (generated)

000930950.td-b3lyp_6-31+g(d).gjf (generated)

000930950.td-b3lyp_6-31+g(d).firefly.inp (generated)

000930950.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000930950.mol 000930950.PUBCHEM 000930950.mol (via Jmol)
000931070.b3lyp_6-31g(d).inp

000931070.b3lyp_6-31g(d).qchem.inp (generated)

000931070.b3lyp_6-31g(d).gjf (generated)

000931070.b3lyp_6-31g(d).firefly.inp (generated)

000931070.b3lyp_6-31g(d).smash.inp (generated)

000931070.b3lyp_6-31g(d).nwchem.inp (generated) 000931070.b3lyp_6-31g(d).log.xz 000931070.td-b3lyp_6-31g+(d).inp 000931070.td-b3lyp_6-31g+(d).log.xz

000931070.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931070.td-b3lyp_6-31+g(d).gjf (generated)

000931070.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931070.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931070.mol 000931070.PUBCHEM 000931070.mol (via Jmol)
000931076.b3lyp_6-31g(d).inp

000931076.b3lyp_6-31g(d).qchem.inp (generated)

000931076.b3lyp_6-31g(d).gjf (generated)

000931076.b3lyp_6-31g(d).firefly.inp (generated)

000931076.b3lyp_6-31g(d).smash.inp (generated)

000931076.b3lyp_6-31g(d).nwchem.inp (generated) 000931076.b3lyp_6-31g(d).log.xz 000931076.mol 000931076.PUBCHEM 000931076.mol (via Jmol)
000931086.b3lyp_6-31g(d).inp

000931086.b3lyp_6-31g(d).qchem.inp (generated)

000931086.b3lyp_6-31g(d).gjf (generated)

000931086.b3lyp_6-31g(d).firefly.inp (generated)

000931086.b3lyp_6-31g(d).smash.inp (generated)

000931086.b3lyp_6-31g(d).nwchem.inp (generated) 000931086.b3lyp_6-31g(d).log.xz 000931086.td-b3lyp_6-31g+(d).inp 000931086.td-b3lyp_6-31g+(d).log.xz

000931086.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931086.td-b3lyp_6-31+g(d).gjf (generated)

000931086.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931086.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931086.mol 000931086.PUBCHEM 000931086.mol (via Jmol)
000931175.b3lyp_6-31g(d).inp

000931175.b3lyp_6-31g(d).qchem.inp (generated)

000931175.b3lyp_6-31g(d).gjf (generated)

000931175.b3lyp_6-31g(d).firefly.inp (generated)

000931175.b3lyp_6-31g(d).smash.inp (generated)

000931175.b3lyp_6-31g(d).nwchem.inp (generated) 000931175.b3lyp_6-31g(d).log.xz 000931175.td-b3lyp_6-31g+(d).inp 000931175.td-b3lyp_6-31g+(d).log.xz

000931175.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931175.td-b3lyp_6-31+g(d).gjf (generated)

000931175.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931175.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931175.mol 000931175.PUBCHEM 000931175.mol (via Jmol)
000931177.b3lyp_6-31g(d).inp

000931177.b3lyp_6-31g(d).qchem.inp (generated)

000931177.b3lyp_6-31g(d).gjf (generated)

000931177.b3lyp_6-31g(d).firefly.inp (generated)

000931177.b3lyp_6-31g(d).smash.inp (generated)

000931177.b3lyp_6-31g(d).nwchem.inp (generated) 000931177.b3lyp_6-31g(d).log.xz 000931177.td-b3lyp_6-31g+(d).inp 000931177.td-b3lyp_6-31g+(d).log.xz

000931177.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931177.td-b3lyp_6-31+g(d).gjf (generated)

000931177.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931177.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931177.mol 000931177.PUBCHEM 000931177.mol (via Jmol)
000931181.b3lyp_6-31g(d).inp

000931181.b3lyp_6-31g(d).qchem.inp (generated)

000931181.b3lyp_6-31g(d).gjf (generated)

000931181.b3lyp_6-31g(d).firefly.inp (generated)

000931181.b3lyp_6-31g(d).smash.inp (generated)

000931181.b3lyp_6-31g(d).nwchem.inp (generated) 000931181.b3lyp_6-31g(d).log.xz 000931181.td-b3lyp_6-31g+(d).inp 000931181.td-b3lyp_6-31g+(d).log.xz

000931181.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931181.td-b3lyp_6-31+g(d).gjf (generated)

000931181.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931181.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931181.mol 000931181.PUBCHEM 000931181.mol (via Jmol)
000931182.b3lyp_6-31g(d).inp

000931182.b3lyp_6-31g(d).qchem.inp (generated)

000931182.b3lyp_6-31g(d).gjf (generated)

000931182.b3lyp_6-31g(d).firefly.inp (generated)

000931182.b3lyp_6-31g(d).smash.inp (generated)

000931182.b3lyp_6-31g(d).nwchem.inp (generated) 000931182.b3lyp_6-31g(d).log.xz 000931182.td-b3lyp_6-31g+(d).inp 000931182.td-b3lyp_6-31g+(d).log.xz

000931182.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931182.td-b3lyp_6-31+g(d).gjf (generated)

000931182.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931182.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931182.mol 000931182.PUBCHEM 000931182.mol (via Jmol)
000931190.b3lyp_6-31g(d).inp

000931190.b3lyp_6-31g(d).qchem.inp (generated)

000931190.b3lyp_6-31g(d).gjf (generated)

000931190.b3lyp_6-31g(d).firefly.inp (generated)

000931190.b3lyp_6-31g(d).smash.inp (generated)

000931190.b3lyp_6-31g(d).nwchem.inp (generated) 000931190.b3lyp_6-31g(d).log.xz 000931190.td-b3lyp_6-31g+(d).inp 000931190.td-b3lyp_6-31g+(d).log.xz

000931190.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931190.td-b3lyp_6-31+g(d).gjf (generated)

000931190.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931190.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931190.mol 000931190.PUBCHEM 000931190.mol (via Jmol)
000931198.b3lyp_6-31g(d).inp

000931198.b3lyp_6-31g(d).qchem.inp (generated)

000931198.b3lyp_6-31g(d).gjf (generated)

000931198.b3lyp_6-31g(d).firefly.inp (generated)

000931198.b3lyp_6-31g(d).smash.inp (generated)

000931198.b3lyp_6-31g(d).nwchem.inp (generated) 000931198.b3lyp_6-31g(d).log.xz 000931198.td-b3lyp_6-31g+(d).inp 000931198.td-b3lyp_6-31g+(d).log.xz

000931198.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931198.td-b3lyp_6-31+g(d).gjf (generated)

000931198.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931198.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931198.mol 000931198.PUBCHEM 000931198.mol (via Jmol)
000931199.b3lyp_6-31g(d).inp

000931199.b3lyp_6-31g(d).qchem.inp (generated)

000931199.b3lyp_6-31g(d).gjf (generated)

000931199.b3lyp_6-31g(d).firefly.inp (generated)

000931199.b3lyp_6-31g(d).smash.inp (generated)

000931199.b3lyp_6-31g(d).nwchem.inp (generated) 000931199.b3lyp_6-31g(d).log.xz 000931199.td-b3lyp_6-31g+(d).inp 000931199.td-b3lyp_6-31g+(d).log.xz

000931199.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931199.td-b3lyp_6-31+g(d).gjf (generated)

000931199.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931199.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931199.mol 000931199.PUBCHEM 000931199.mol (via Jmol)
000931200.b3lyp_6-31g(d).inp

000931200.b3lyp_6-31g(d).qchem.inp (generated)

000931200.b3lyp_6-31g(d).gjf (generated)

000931200.b3lyp_6-31g(d).firefly.inp (generated)

000931200.b3lyp_6-31g(d).smash.inp (generated)

000931200.b3lyp_6-31g(d).nwchem.inp (generated) 000931200.b3lyp_6-31g(d).log.xz 000931200.td-b3lyp_6-31g+(d).inp 000931200.td-b3lyp_6-31g+(d).log.xz

000931200.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931200.td-b3lyp_6-31+g(d).gjf (generated)

000931200.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931200.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931200.mol 000931200.PUBCHEM 000931200.mol (via Jmol)
000931211.b3lyp_6-31g(d).inp

000931211.b3lyp_6-31g(d).qchem.inp (generated)

000931211.b3lyp_6-31g(d).gjf (generated)

000931211.b3lyp_6-31g(d).firefly.inp (generated)

000931211.b3lyp_6-31g(d).smash.inp (generated)

000931211.b3lyp_6-31g(d).nwchem.inp (generated) 000931211.b3lyp_6-31g(d).log.xz 000931211.td-b3lyp_6-31g+(d).inp 000931211.td-b3lyp_6-31g+(d).log.xz

000931211.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931211.td-b3lyp_6-31+g(d).gjf (generated)

000931211.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931211.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931211.mol 000931211.PUBCHEM 000931211.mol (via Jmol)
000931212.b3lyp_6-31g(d).inp

000931212.b3lyp_6-31g(d).qchem.inp (generated)

000931212.b3lyp_6-31g(d).gjf (generated)

000931212.b3lyp_6-31g(d).firefly.inp (generated)

000931212.b3lyp_6-31g(d).smash.inp (generated)

000931212.b3lyp_6-31g(d).nwchem.inp (generated) 000931212.b3lyp_6-31g(d).log.xz 000931212.td-b3lyp_6-31g+(d).inp 000931212.td-b3lyp_6-31g+(d).log.xz

000931212.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931212.td-b3lyp_6-31+g(d).gjf (generated)

000931212.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931212.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931212.mol 000931212.PUBCHEM 000931212.mol (via Jmol)
000931291.b3lyp_6-31g(d).inp

000931291.b3lyp_6-31g(d).qchem.inp (generated)

000931291.b3lyp_6-31g(d).gjf (generated)

000931291.b3lyp_6-31g(d).firefly.inp (generated)

000931291.b3lyp_6-31g(d).smash.inp (generated)

000931291.b3lyp_6-31g(d).nwchem.inp (generated) 000931291.b3lyp_6-31g(d).log.xz 000931291.mol 000931291.PUBCHEM 000931291.mol (via Jmol)
000931345.b3lyp_6-31g(d).inp

000931345.b3lyp_6-31g(d).qchem.inp (generated)

000931345.b3lyp_6-31g(d).gjf (generated)

000931345.b3lyp_6-31g(d).firefly.inp (generated)

000931345.b3lyp_6-31g(d).smash.inp (generated)

000931345.b3lyp_6-31g(d).nwchem.inp (generated) 000931345.b3lyp_6-31g(d).log.xz 000931345.td-b3lyp_6-31g+(d).inp 000931345.td-b3lyp_6-31g+(d).log.xz

000931345.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931345.td-b3lyp_6-31+g(d).gjf (generated)

000931345.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931345.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931345.mol 000931345.PUBCHEM 000931345.mol (via Jmol)
000931346.b3lyp_6-31g(d).inp

000931346.b3lyp_6-31g(d).qchem.inp (generated)

000931346.b3lyp_6-31g(d).gjf (generated)

000931346.b3lyp_6-31g(d).firefly.inp (generated)

000931346.b3lyp_6-31g(d).smash.inp (generated)

000931346.b3lyp_6-31g(d).nwchem.inp (generated) 000931346.b3lyp_6-31g(d).log.xz 000931346.td-b3lyp_6-31g+(d).inp 000931346.td-b3lyp_6-31g+(d).log.xz

000931346.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931346.td-b3lyp_6-31+g(d).gjf (generated)

000931346.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931346.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931346.mol 000931346.PUBCHEM 000931346.mol (via Jmol)
000931370.b3lyp_6-31g(d).inp

000931370.b3lyp_6-31g(d).qchem.inp (generated)

000931370.b3lyp_6-31g(d).gjf (generated)

000931370.b3lyp_6-31g(d).firefly.inp (generated)

000931370.b3lyp_6-31g(d).smash.inp (generated)

000931370.b3lyp_6-31g(d).nwchem.inp (generated) 000931370.b3lyp_6-31g(d).log.xz 000931370.td-b3lyp_6-31g+(d).inp 000931370.td-b3lyp_6-31g+(d).log.xz

000931370.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931370.td-b3lyp_6-31+g(d).gjf (generated)

000931370.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931370.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931370.mol 000931370.PUBCHEM 000931370.mol (via Jmol)
000931379.b3lyp_6-31g(d).inp

000931379.b3lyp_6-31g(d).qchem.inp (generated)

000931379.b3lyp_6-31g(d).gjf (generated)

000931379.b3lyp_6-31g(d).firefly.inp (generated)

000931379.b3lyp_6-31g(d).smash.inp (generated)

000931379.b3lyp_6-31g(d).nwchem.inp (generated) 000931379.b3lyp_6-31g(d).log.xz 000931379.td-b3lyp_6-31g+(d).inp 000931379.td-b3lyp_6-31g+(d).log.xz

000931379.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931379.td-b3lyp_6-31+g(d).gjf (generated)

000931379.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931379.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931379.mol 000931379.PUBCHEM 000931379.mol (via Jmol)
000931380.b3lyp_6-31g(d).inp

000931380.b3lyp_6-31g(d).qchem.inp (generated)

000931380.b3lyp_6-31g(d).gjf (generated)

000931380.b3lyp_6-31g(d).firefly.inp (generated)

000931380.b3lyp_6-31g(d).smash.inp (generated)

000931380.b3lyp_6-31g(d).nwchem.inp (generated) 000931380.b3lyp_6-31g(d).log.xz 000931380.td-b3lyp_6-31g+(d).inp 000931380.td-b3lyp_6-31g+(d).log.xz

000931380.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931380.td-b3lyp_6-31+g(d).gjf (generated)

000931380.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931380.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931380.mol 000931380.PUBCHEM 000931380.mol (via Jmol)
000931381.b3lyp_6-31g(d).inp

000931381.b3lyp_6-31g(d).qchem.inp (generated)

000931381.b3lyp_6-31g(d).gjf (generated)

000931381.b3lyp_6-31g(d).firefly.inp (generated)

000931381.b3lyp_6-31g(d).smash.inp (generated)

000931381.b3lyp_6-31g(d).nwchem.inp (generated) 000931381.b3lyp_6-31g(d).log.xz 000931381.td-b3lyp_6-31g+(d).inp 000931381.td-b3lyp_6-31g+(d).log.xz

000931381.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931381.td-b3lyp_6-31+g(d).gjf (generated)

000931381.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931381.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931381.mol 000931381.PUBCHEM 000931381.mol (via Jmol)
000931413.b3lyp_6-31g(d).inp

000931413.b3lyp_6-31g(d).qchem.inp (generated)

000931413.b3lyp_6-31g(d).gjf (generated)

000931413.b3lyp_6-31g(d).firefly.inp (generated)

000931413.b3lyp_6-31g(d).smash.inp (generated)

000931413.b3lyp_6-31g(d).nwchem.inp (generated) 000931413.b3lyp_6-31g(d).log.xz 000931413.mol 000931413.PUBCHEM 000931413.mol (via Jmol)
000931415.b3lyp_6-31g(d).inp

000931415.b3lyp_6-31g(d).qchem.inp (generated)

000931415.b3lyp_6-31g(d).gjf (generated)

000931415.b3lyp_6-31g(d).firefly.inp (generated)

000931415.b3lyp_6-31g(d).smash.inp (generated)

000931415.b3lyp_6-31g(d).nwchem.inp (generated) 000931415.b3lyp_6-31g(d).log.xz 000931415.td-b3lyp_6-31g+(d).inp 000931415.td-b3lyp_6-31g+(d).log.xz

000931415.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931415.td-b3lyp_6-31+g(d).gjf (generated)

000931415.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931415.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931415.mol 000931415.PUBCHEM 000931415.mol (via Jmol)
000931421.b3lyp_6-31g(d).inp

000931421.b3lyp_6-31g(d).qchem.inp (generated)

000931421.b3lyp_6-31g(d).gjf (generated)

000931421.b3lyp_6-31g(d).firefly.inp (generated)

000931421.b3lyp_6-31g(d).smash.inp (generated)

000931421.b3lyp_6-31g(d).nwchem.inp (generated) 000931421.b3lyp_6-31g(d).log.xz 000931421.td-b3lyp_6-31g+(d).inp 000931421.td-b3lyp_6-31g+(d).log.xz

000931421.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931421.td-b3lyp_6-31+g(d).gjf (generated)

000931421.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931421.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931421.mol 000931421.PUBCHEM 000931421.mol (via Jmol)
000931429.b3lyp_6-31g(d).inp

000931429.b3lyp_6-31g(d).qchem.inp (generated)

000931429.b3lyp_6-31g(d).gjf (generated)

000931429.b3lyp_6-31g(d).firefly.inp (generated)

000931429.b3lyp_6-31g(d).smash.inp (generated)

000931429.b3lyp_6-31g(d).nwchem.inp (generated) 000931429.b3lyp_6-31g(d).log.xz 000931429.td-b3lyp_6-31g+(d).inp 000931429.td-b3lyp_6-31g+(d).log.xz

000931429.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931429.td-b3lyp_6-31+g(d).gjf (generated)

000931429.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931429.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931429.mol 000931429.PUBCHEM 000931429.mol (via Jmol)
000931438.b3lyp_6-31g(d).inp

000931438.b3lyp_6-31g(d).qchem.inp (generated)

000931438.b3lyp_6-31g(d).gjf (generated)

000931438.b3lyp_6-31g(d).firefly.inp (generated)

000931438.b3lyp_6-31g(d).smash.inp (generated)

000931438.b3lyp_6-31g(d).nwchem.inp (generated) 000931438.b3lyp_6-31g(d).log.xz 000931438.td-b3lyp_6-31g+(d).inp 000931438.td-b3lyp_6-31g+(d).log.xz

000931438.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931438.td-b3lyp_6-31+g(d).gjf (generated)

000931438.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931438.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931438.mol 000931438.PUBCHEM 000931438.mol (via Jmol)
000931450.b3lyp_6-31g(d).inp

000931450.b3lyp_6-31g(d).qchem.inp (generated)

000931450.b3lyp_6-31g(d).gjf (generated)

000931450.b3lyp_6-31g(d).firefly.inp (generated)

000931450.b3lyp_6-31g(d).smash.inp (generated)

000931450.b3lyp_6-31g(d).nwchem.inp (generated) 000931450.b3lyp_6-31g(d).log.xz 000931450.td-b3lyp_6-31g+(d).inp 000931450.td-b3lyp_6-31g+(d).log.xz

000931450.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931450.td-b3lyp_6-31+g(d).gjf (generated)

000931450.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931450.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931450.mol 000931450.PUBCHEM 000931450.mol (via Jmol)
000931469.b3lyp_6-31g(d).inp

000931469.b3lyp_6-31g(d).qchem.inp (generated)

000931469.b3lyp_6-31g(d).gjf (generated)

000931469.b3lyp_6-31g(d).firefly.inp (generated)

000931469.b3lyp_6-31g(d).smash.inp (generated)

000931469.b3lyp_6-31g(d).nwchem.inp (generated) 000931469.b3lyp_6-31g(d).log.xz 000931469.td-b3lyp_6-31g+(d).inp 000931469.td-b3lyp_6-31g+(d).log.xz

000931469.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931469.td-b3lyp_6-31+g(d).gjf (generated)

000931469.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931469.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931469.mol 000931469.PUBCHEM 000931469.mol (via Jmol)
000931478.b3lyp_6-31g(d).inp

000931478.b3lyp_6-31g(d).qchem.inp (generated)

000931478.b3lyp_6-31g(d).gjf (generated)

000931478.b3lyp_6-31g(d).firefly.inp (generated)

000931478.b3lyp_6-31g(d).smash.inp (generated)

000931478.b3lyp_6-31g(d).nwchem.inp (generated) 000931478.b3lyp_6-31g(d).log.xz 000931478.mol 000931478.PUBCHEM 000931478.mol (via Jmol)
000931480.b3lyp_6-31g(d).inp

000931480.b3lyp_6-31g(d).qchem.inp (generated)

000931480.b3lyp_6-31g(d).gjf (generated)

000931480.b3lyp_6-31g(d).firefly.inp (generated)

000931480.b3lyp_6-31g(d).smash.inp (generated)

000931480.b3lyp_6-31g(d).nwchem.inp (generated) 000931480.b3lyp_6-31g(d).log.xz 000931480.td-b3lyp_6-31g+(d).inp 000931480.td-b3lyp_6-31g+(d).log.xz

000931480.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931480.td-b3lyp_6-31+g(d).gjf (generated)

000931480.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931480.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931480.mol 000931480.PUBCHEM 000931480.mol (via Jmol)
000931497.b3lyp_6-31g(d).inp

000931497.b3lyp_6-31g(d).qchem.inp (generated)

000931497.b3lyp_6-31g(d).gjf (generated)

000931497.b3lyp_6-31g(d).firefly.inp (generated)

000931497.b3lyp_6-31g(d).smash.inp (generated)

000931497.b3lyp_6-31g(d).nwchem.inp (generated) 000931497.b3lyp_6-31g(d).log.xz 000931497.td-b3lyp_6-31g+(d).inp 000931497.td-b3lyp_6-31g+(d).log.xz

000931497.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931497.td-b3lyp_6-31+g(d).gjf (generated)

000931497.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931497.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931497.mol 000931497.PUBCHEM 000931497.mol (via Jmol)
000931527.b3lyp_6-31g(d).inp

000931527.b3lyp_6-31g(d).qchem.inp (generated)

000931527.b3lyp_6-31g(d).gjf (generated)

000931527.b3lyp_6-31g(d).firefly.inp (generated)

000931527.b3lyp_6-31g(d).smash.inp (generated)

000931527.b3lyp_6-31g(d).nwchem.inp (generated) 000931527.b3lyp_6-31g(d).log.xz 000931527.td-b3lyp_6-31g+(d).inp 000931527.td-b3lyp_6-31g+(d).log.xz

000931527.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931527.td-b3lyp_6-31+g(d).gjf (generated)

000931527.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931527.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931527.mol 000931527.PUBCHEM 000931527.mol (via Jmol)
000931540.b3lyp_6-31g(d).inp

000931540.b3lyp_6-31g(d).qchem.inp (generated)

000931540.b3lyp_6-31g(d).gjf (generated)

000931540.b3lyp_6-31g(d).firefly.inp (generated)

000931540.b3lyp_6-31g(d).smash.inp (generated)

000931540.b3lyp_6-31g(d).nwchem.inp (generated) 000931540.b3lyp_6-31g(d).log.xz 000931540.mol 000931540.PUBCHEM 000931540.mol (via Jmol)
000931564.b3lyp_6-31g(d).inp

000931564.b3lyp_6-31g(d).qchem.inp (generated)

000931564.b3lyp_6-31g(d).gjf (generated)

000931564.b3lyp_6-31g(d).firefly.inp (generated)

000931564.b3lyp_6-31g(d).smash.inp (generated)

000931564.b3lyp_6-31g(d).nwchem.inp (generated) 000931564.b3lyp_6-31g(d).log.xz 000931564.td-b3lyp_6-31g+(d).inp 000931564.td-b3lyp_6-31g+(d).log.xz

000931564.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931564.td-b3lyp_6-31+g(d).gjf (generated)

000931564.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931564.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931564.mol 000931564.PUBCHEM 000931564.mol (via Jmol)
000931608.b3lyp_6-31g(d).inp

000931608.b3lyp_6-31g(d).qchem.inp (generated)

000931608.b3lyp_6-31g(d).gjf (generated)

000931608.b3lyp_6-31g(d).firefly.inp (generated)

000931608.b3lyp_6-31g(d).smash.inp (generated)

000931608.b3lyp_6-31g(d).nwchem.inp (generated) 000931608.b3lyp_6-31g(d).log.xz 000931608.td-b3lyp_6-31g+(d).inp 000931608.td-b3lyp_6-31g+(d).log.xz

000931608.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931608.td-b3lyp_6-31+g(d).gjf (generated)

000931608.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931608.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931608.mol 000931608.PUBCHEM 000931608.mol (via Jmol)
000931643.b3lyp_6-31g(d).inp

000931643.b3lyp_6-31g(d).qchem.inp (generated)

000931643.b3lyp_6-31g(d).gjf (generated)

000931643.b3lyp_6-31g(d).firefly.inp (generated)

000931643.b3lyp_6-31g(d).smash.inp (generated)

000931643.b3lyp_6-31g(d).nwchem.inp (generated) 000931643.b3lyp_6-31g(d).log.xz 000931643.td-b3lyp_6-31g+(d).inp 000931643.td-b3lyp_6-31g+(d).log.xz

000931643.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931643.td-b3lyp_6-31+g(d).gjf (generated)

000931643.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931643.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931643.mol 000931643.PUBCHEM 000931643.mol (via Jmol)
000931644.b3lyp_6-31g(d).inp

000931644.b3lyp_6-31g(d).qchem.inp (generated)

000931644.b3lyp_6-31g(d).gjf (generated)

000931644.b3lyp_6-31g(d).firefly.inp (generated)

000931644.b3lyp_6-31g(d).smash.inp (generated)

000931644.b3lyp_6-31g(d).nwchem.inp (generated) 000931644.b3lyp_6-31g(d).log.xz 000931644.td-b3lyp_6-31g+(d).inp 000931644.td-b3lyp_6-31g+(d).log.xz

000931644.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931644.td-b3lyp_6-31+g(d).gjf (generated)

000931644.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931644.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931644.mol 000931644.PUBCHEM 000931644.mol (via Jmol)
000931660.b3lyp_6-31g(d).inp

000931660.b3lyp_6-31g(d).qchem.inp (generated)

000931660.b3lyp_6-31g(d).gjf (generated)

000931660.b3lyp_6-31g(d).firefly.inp (generated)

000931660.b3lyp_6-31g(d).smash.inp (generated)

000931660.b3lyp_6-31g(d).nwchem.inp (generated) 000931660.b3lyp_6-31g(d).log.xz 000931660.td-b3lyp_6-31g+(d).inp 000931660.td-b3lyp_6-31g+(d).log.xz

000931660.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931660.td-b3lyp_6-31+g(d).gjf (generated)

000931660.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931660.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931660.mol 000931660.PUBCHEM 000931660.mol (via Jmol)
000931703.b3lyp_6-31g(d).inp

000931703.b3lyp_6-31g(d).qchem.inp (generated)

000931703.b3lyp_6-31g(d).gjf (generated)

000931703.b3lyp_6-31g(d).firefly.inp (generated)

000931703.b3lyp_6-31g(d).smash.inp (generated)

000931703.b3lyp_6-31g(d).nwchem.inp (generated) 000931703.b3lyp_6-31g(d).log.xz 000931703.td-b3lyp_6-31g+(d).inp 000931703.td-b3lyp_6-31g+(d).log.xz

000931703.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931703.td-b3lyp_6-31+g(d).gjf (generated)

000931703.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931703.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931703.mol 000931703.PUBCHEM 000931703.mol (via Jmol)
000931711.b3lyp_6-31g(d).inp

000931711.b3lyp_6-31g(d).qchem.inp (generated)

000931711.b3lyp_6-31g(d).gjf (generated)

000931711.b3lyp_6-31g(d).firefly.inp (generated)

000931711.b3lyp_6-31g(d).smash.inp (generated)

000931711.b3lyp_6-31g(d).nwchem.inp (generated) 000931711.b3lyp_6-31g(d).log.xz 000931711.td-b3lyp_6-31g+(d).inp 000931711.td-b3lyp_6-31g+(d).log.xz

000931711.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931711.td-b3lyp_6-31+g(d).gjf (generated)

000931711.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931711.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931711.mol 000931711.PUBCHEM 000931711.mol (via Jmol)
000931713.b3lyp_6-31g(d).inp

000931713.b3lyp_6-31g(d).qchem.inp (generated)

000931713.b3lyp_6-31g(d).gjf (generated)

000931713.b3lyp_6-31g(d).firefly.inp (generated)

000931713.b3lyp_6-31g(d).smash.inp (generated)

000931713.b3lyp_6-31g(d).nwchem.inp (generated) 000931713.b3lyp_6-31g(d).log.xz 000931713.mol 000931713.PUBCHEM 000931713.mol (via Jmol)
000931726.b3lyp_6-31g(d).inp

000931726.b3lyp_6-31g(d).qchem.inp (generated)

000931726.b3lyp_6-31g(d).gjf (generated)

000931726.b3lyp_6-31g(d).firefly.inp (generated)

000931726.b3lyp_6-31g(d).smash.inp (generated)

000931726.b3lyp_6-31g(d).nwchem.inp (generated) 000931726.b3lyp_6-31g(d).log.xz 000931726.td-b3lyp_6-31g+(d).inp 000931726.td-b3lyp_6-31g+(d).log.xz

000931726.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931726.td-b3lyp_6-31+g(d).gjf (generated)

000931726.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931726.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931726.mol 000931726.PUBCHEM 000931726.mol (via Jmol)
000931764.b3lyp_6-31g(d).inp

000931764.b3lyp_6-31g(d).qchem.inp (generated)

000931764.b3lyp_6-31g(d).gjf (generated)

000931764.b3lyp_6-31g(d).firefly.inp (generated)

000931764.b3lyp_6-31g(d).smash.inp (generated)

000931764.b3lyp_6-31g(d).nwchem.inp (generated) 000931764.b3lyp_6-31g(d).log.xz 000931764.td-b3lyp_6-31g+(d).inp 000931764.td-b3lyp_6-31g+(d).log.xz

000931764.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931764.td-b3lyp_6-31+g(d).gjf (generated)

000931764.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931764.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931764.mol 000931764.PUBCHEM 000931764.mol (via Jmol)
000931776.b3lyp_6-31g(d).inp

000931776.b3lyp_6-31g(d).qchem.inp (generated)

000931776.b3lyp_6-31g(d).gjf (generated)

000931776.b3lyp_6-31g(d).firefly.inp (generated)

000931776.b3lyp_6-31g(d).smash.inp (generated)

000931776.b3lyp_6-31g(d).nwchem.inp (generated) 000931776.b3lyp_6-31g(d).log.xz 000931776.mol 000931776.PUBCHEM 000931776.mol (via Jmol)
000931807.b3lyp_6-31g(d).inp

000931807.b3lyp_6-31g(d).qchem.inp (generated)

000931807.b3lyp_6-31g(d).gjf (generated)

000931807.b3lyp_6-31g(d).firefly.inp (generated)

000931807.b3lyp_6-31g(d).smash.inp (generated)

000931807.b3lyp_6-31g(d).nwchem.inp (generated) 000931807.b3lyp_6-31g(d).log.xz 000931807.td-b3lyp_6-31g+(d).inp 000931807.td-b3lyp_6-31g+(d).log.xz

000931807.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931807.td-b3lyp_6-31+g(d).gjf (generated)

000931807.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931807.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931807.mol 000931807.PUBCHEM 000931807.mol (via Jmol)
000931809.b3lyp_6-31g(d).inp

000931809.b3lyp_6-31g(d).qchem.inp (generated)

000931809.b3lyp_6-31g(d).gjf (generated)

000931809.b3lyp_6-31g(d).firefly.inp (generated)

000931809.b3lyp_6-31g(d).smash.inp (generated)

000931809.b3lyp_6-31g(d).nwchem.inp (generated) 000931809.b3lyp_6-31g(d).log.xz 000931809.td-b3lyp_6-31g+(d).inp 000931809.td-b3lyp_6-31g+(d).log.xz

000931809.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931809.td-b3lyp_6-31+g(d).gjf (generated)

000931809.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931809.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931809.mol 000931809.PUBCHEM 000931809.mol (via Jmol)
000931907.b3lyp_6-31g(d).inp

000931907.b3lyp_6-31g(d).qchem.inp (generated)

000931907.b3lyp_6-31g(d).gjf (generated)

000931907.b3lyp_6-31g(d).firefly.inp (generated)

000931907.b3lyp_6-31g(d).smash.inp (generated)

000931907.b3lyp_6-31g(d).nwchem.inp (generated) 000931907.b3lyp_6-31g(d).log.xz 000931907.td-b3lyp_6-31g+(d).inp 000931907.td-b3lyp_6-31g+(d).log.xz

000931907.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931907.td-b3lyp_6-31+g(d).gjf (generated)

000931907.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931907.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931907.mol 000931907.PUBCHEM 000931907.mol (via Jmol)
000931929.b3lyp_6-31g(d).inp

000931929.b3lyp_6-31g(d).qchem.inp (generated)

000931929.b3lyp_6-31g(d).gjf (generated)

000931929.b3lyp_6-31g(d).firefly.inp (generated)

000931929.b3lyp_6-31g(d).smash.inp (generated)

000931929.b3lyp_6-31g(d).nwchem.inp (generated) 000931929.b3lyp_6-31g(d).log.xz 000931929.td-b3lyp_6-31g+(d).inp 000931929.td-b3lyp_6-31g+(d).log.xz

000931929.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931929.td-b3lyp_6-31+g(d).gjf (generated)

000931929.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931929.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931929.mol 000931929.PUBCHEM 000931929.mol (via Jmol)
000931990.b3lyp_6-31g(d).inp

000931990.b3lyp_6-31g(d).qchem.inp (generated)

000931990.b3lyp_6-31g(d).gjf (generated)

000931990.b3lyp_6-31g(d).firefly.inp (generated)

000931990.b3lyp_6-31g(d).smash.inp (generated)

000931990.b3lyp_6-31g(d).nwchem.inp (generated) 000931990.b3lyp_6-31g(d).log.xz 000931990.td-b3lyp_6-31g+(d).inp 000931990.td-b3lyp_6-31g+(d).log.xz

000931990.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931990.td-b3lyp_6-31+g(d).gjf (generated)

000931990.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931990.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931990.mol 000931990.PUBCHEM 000931990.mol (via Jmol)
000931992.b3lyp_6-31g(d).inp

000931992.b3lyp_6-31g(d).qchem.inp (generated)

000931992.b3lyp_6-31g(d).gjf (generated)

000931992.b3lyp_6-31g(d).firefly.inp (generated)

000931992.b3lyp_6-31g(d).smash.inp (generated)

000931992.b3lyp_6-31g(d).nwchem.inp (generated) 000931992.b3lyp_6-31g(d).log.xz 000931992.td-b3lyp_6-31g+(d).inp 000931992.td-b3lyp_6-31g+(d).log.xz

000931992.td-b3lyp_6-31+g(d).qchem.inp (generated)

000931992.td-b3lyp_6-31+g(d).gjf (generated)

000931992.td-b3lyp_6-31+g(d).firefly.inp (generated)

000931992.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000931992.mol 000931992.PUBCHEM 000931992.mol (via Jmol)
000932007.b3lyp_6-31g(d).inp

000932007.b3lyp_6-31g(d).qchem.inp (generated)

000932007.b3lyp_6-31g(d).gjf (generated)

000932007.b3lyp_6-31g(d).firefly.inp (generated)

000932007.b3lyp_6-31g(d).smash.inp (generated)

000932007.b3lyp_6-31g(d).nwchem.inp (generated) 000932007.b3lyp_6-31g(d).log.xz 000932007.td-b3lyp_6-31g+(d).inp 000932007.td-b3lyp_6-31g+(d).log.xz

000932007.td-b3lyp_6-31+g(d).qchem.inp (generated)

000932007.td-b3lyp_6-31+g(d).gjf (generated)

000932007.td-b3lyp_6-31+g(d).firefly.inp (generated)

000932007.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000932007.mol 000932007.PUBCHEM 000932007.mol (via Jmol)
000932015.b3lyp_6-31g(d).inp

000932015.b3lyp_6-31g(d).qchem.inp (generated)

000932015.b3lyp_6-31g(d).gjf (generated)

000932015.b3lyp_6-31g(d).firefly.inp (generated)

000932015.b3lyp_6-31g(d).smash.inp (generated)

000932015.b3lyp_6-31g(d).nwchem.inp (generated) 000932015.b3lyp_6-31g(d).log.xz 000932015.mol 000932015.PUBCHEM 000932015.mol (via Jmol)
000932023.b3lyp_6-31g(d).inp

000932023.b3lyp_6-31g(d).qchem.inp (generated)

000932023.b3lyp_6-31g(d).gjf (generated)

000932023.b3lyp_6-31g(d).firefly.inp (generated)

000932023.b3lyp_6-31g(d).smash.inp (generated)

000932023.b3lyp_6-31g(d).nwchem.inp (generated) 000932023.b3lyp_6-31g(d).log.xz 000932023.td-b3lyp_6-31g+(d).inp 000932023.td-b3lyp_6-31g+(d).log.xz

000932023.td-b3lyp_6-31+g(d).qchem.inp (generated)

000932023.td-b3lyp_6-31+g(d).gjf (generated)

000932023.td-b3lyp_6-31+g(d).firefly.inp (generated)

000932023.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000932023.mol 000932023.PUBCHEM 000932023.mol (via Jmol)
000932024.b3lyp_6-31g(d).inp

000932024.b3lyp_6-31g(d).qchem.inp (generated)

000932024.b3lyp_6-31g(d).gjf (generated)

000932024.b3lyp_6-31g(d).firefly.inp (generated)

000932024.b3lyp_6-31g(d).smash.inp (generated)

000932024.b3lyp_6-31g(d).nwchem.inp (generated) 000932024.b3lyp_6-31g(d).log.xz 000932024.mol 000932024.PUBCHEM 000932024.mol (via Jmol)
000932036.b3lyp_6-31g(d).inp

000932036.b3lyp_6-31g(d).qchem.inp (generated)

000932036.b3lyp_6-31g(d).gjf (generated)

000932036.b3lyp_6-31g(d).firefly.inp (generated)

000932036.b3lyp_6-31g(d).smash.inp (generated)

000932036.b3lyp_6-31g(d).nwchem.inp (generated) 000932036.b3lyp_6-31g(d).log.xz