Index of

Last updated : Thu May 25 01:35:26 JST 2017
Total : 244 (217) in this page
030102037.b3lyp_6-31g(d).inp

030102037.b3lyp_6-31g(d).qchem.inp (generated)

030102037.b3lyp_6-31g(d).gjf (generated)

030102037.b3lyp_6-31g(d).firefly.inp (generated)

030102037.b3lyp_6-31g(d).smash.inp (generated)

030102037.b3lyp_6-31g(d).nwchem.inp (generated) 030102037.b3lyp_6-31g(d).log.xz 030102037.td-b3lyp_6-31g+(d).inp 030102037.td-b3lyp_6-31g+(d).log.xz

030102037.td-b3lyp_6-31+g(d).qchem.inp (generated)

030102037.td-b3lyp_6-31+g(d).gjf (generated)

030102037.td-b3lyp_6-31+g(d).firefly.inp (generated)

030102037.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030102037.mol 030102037.PUBCHEM 030102037.mol (via Jmol)
030103676.b3lyp_6-31g(d).inp

030103676.b3lyp_6-31g(d).qchem.inp (generated)

030103676.b3lyp_6-31g(d).gjf (generated)

030103676.b3lyp_6-31g(d).firefly.inp (generated)

030103676.b3lyp_6-31g(d).smash.inp (generated)

030103676.b3lyp_6-31g(d).nwchem.inp (generated) 030103676.b3lyp_6-31g(d).log.xz 030103676.td-b3lyp_6-31g+(d).inp 030103676.td-b3lyp_6-31g+(d).log.xz

030103676.td-b3lyp_6-31+g(d).qchem.inp (generated)

030103676.td-b3lyp_6-31+g(d).gjf (generated)

030103676.td-b3lyp_6-31+g(d).firefly.inp (generated)

030103676.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030103676.mol 030103676.PUBCHEM 030103676.mol (via Jmol)
030104101.b3lyp_6-31g(d).inp

030104101.b3lyp_6-31g(d).qchem.inp (generated)

030104101.b3lyp_6-31g(d).gjf (generated)

030104101.b3lyp_6-31g(d).firefly.inp (generated)

030104101.b3lyp_6-31g(d).smash.inp (generated)

030104101.b3lyp_6-31g(d).nwchem.inp (generated) 030104101.b3lyp_6-31g(d).log.xz 030104101.td-b3lyp_6-31g+(d).inp 030104101.td-b3lyp_6-31g+(d).log.xz

030104101.td-b3lyp_6-31+g(d).qchem.inp (generated)

030104101.td-b3lyp_6-31+g(d).gjf (generated)

030104101.td-b3lyp_6-31+g(d).firefly.inp (generated)

030104101.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030104101.mol 030104101.PUBCHEM 030104101.mol (via Jmol)
030104120.b3lyp_6-31g(d).inp

030104120.b3lyp_6-31g(d).qchem.inp (generated)

030104120.b3lyp_6-31g(d).gjf (generated)

030104120.b3lyp_6-31g(d).firefly.inp (generated)

030104120.b3lyp_6-31g(d).smash.inp (generated)

030104120.b3lyp_6-31g(d).nwchem.inp (generated) 030104120.b3lyp_6-31g(d).log.xz 030104120.td-b3lyp_6-31g+(d).inp 030104120.td-b3lyp_6-31g+(d).log.xz

030104120.td-b3lyp_6-31+g(d).qchem.inp (generated)

030104120.td-b3lyp_6-31+g(d).gjf (generated)

030104120.td-b3lyp_6-31+g(d).firefly.inp (generated)

030104120.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030104120.mol 030104120.PUBCHEM 030104120.mol (via Jmol)
030104142.b3lyp_6-31g(d).inp

030104142.b3lyp_6-31g(d).qchem.inp (generated)

030104142.b3lyp_6-31g(d).gjf (generated)

030104142.b3lyp_6-31g(d).firefly.inp (generated)

030104142.b3lyp_6-31g(d).smash.inp (generated)

030104142.b3lyp_6-31g(d).nwchem.inp (generated) 030104142.b3lyp_6-31g(d).log.xz 030104142.td-b3lyp_6-31g+(d).inp 030104142.td-b3lyp_6-31g+(d).log.xz

030104142.td-b3lyp_6-31+g(d).qchem.inp (generated)

030104142.td-b3lyp_6-31+g(d).gjf (generated)

030104142.td-b3lyp_6-31+g(d).firefly.inp (generated)

030104142.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030104142.mol 030104142.PUBCHEM 030104142.mol (via Jmol)
030104275.b3lyp_6-31g(d).inp

030104275.b3lyp_6-31g(d).qchem.inp (generated)

030104275.b3lyp_6-31g(d).gjf (generated)

030104275.b3lyp_6-31g(d).firefly.inp (generated)

030104275.b3lyp_6-31g(d).smash.inp (generated)

030104275.b3lyp_6-31g(d).nwchem.inp (generated) 030104275.b3lyp_6-31g(d).log.xz 030104275.td-b3lyp_6-31g+(d).inp 030104275.td-b3lyp_6-31g+(d).log.xz

030104275.td-b3lyp_6-31+g(d).qchem.inp (generated)

030104275.td-b3lyp_6-31+g(d).gjf (generated)

030104275.td-b3lyp_6-31+g(d).firefly.inp (generated)

030104275.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030104275.mol 030104275.PUBCHEM 030104275.mol (via Jmol)
030104734.b3lyp_6-31g(d).inp

030104734.b3lyp_6-31g(d).qchem.inp (generated)

030104734.b3lyp_6-31g(d).gjf (generated)

030104734.b3lyp_6-31g(d).firefly.inp (generated)

030104734.b3lyp_6-31g(d).smash.inp (generated)

030104734.b3lyp_6-31g(d).nwchem.inp (generated) 030104734.b3lyp_6-31g(d).log.xz 030104734.td-b3lyp_6-31g+(d).inp 030104734.td-b3lyp_6-31g+(d).log.xz

030104734.td-b3lyp_6-31+g(d).qchem.inp (generated)

030104734.td-b3lyp_6-31+g(d).gjf (generated)

030104734.td-b3lyp_6-31+g(d).firefly.inp (generated)

030104734.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030104734.mol 030104734.PUBCHEM 030104734.mol (via Jmol)
030104739.b3lyp_6-31g(d).inp

030104739.b3lyp_6-31g(d).qchem.inp (generated)

030104739.b3lyp_6-31g(d).gjf (generated)

030104739.b3lyp_6-31g(d).firefly.inp (generated)

030104739.b3lyp_6-31g(d).smash.inp (generated)

030104739.b3lyp_6-31g(d).nwchem.inp (generated) 030104739.b3lyp_6-31g(d).log.xz 030104739.td-b3lyp_6-31g+(d).inp 030104739.td-b3lyp_6-31g+(d).log.xz

030104739.td-b3lyp_6-31+g(d).qchem.inp (generated)

030104739.td-b3lyp_6-31+g(d).gjf (generated)

030104739.td-b3lyp_6-31+g(d).firefly.inp (generated)

030104739.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030104739.mol 030104739.PUBCHEM 030104739.mol (via Jmol)
030104740.b3lyp_6-31g(d).inp

030104740.b3lyp_6-31g(d).qchem.inp (generated)

030104740.b3lyp_6-31g(d).gjf (generated)

030104740.b3lyp_6-31g(d).firefly.inp (generated)

030104740.b3lyp_6-31g(d).smash.inp (generated)

030104740.b3lyp_6-31g(d).nwchem.inp (generated) 030104740.b3lyp_6-31g(d).log.xz 030104740.td-b3lyp_6-31g+(d).inp 030104740.td-b3lyp_6-31g+(d).log.xz

030104740.td-b3lyp_6-31+g(d).qchem.inp (generated)

030104740.td-b3lyp_6-31+g(d).gjf (generated)

030104740.td-b3lyp_6-31+g(d).firefly.inp (generated)

030104740.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030104740.mol 030104740.PUBCHEM 030104740.mol (via Jmol)
030104821.b3lyp_6-31g(d).inp

030104821.b3lyp_6-31g(d).qchem.inp (generated)

030104821.b3lyp_6-31g(d).gjf (generated)

030104821.b3lyp_6-31g(d).firefly.inp (generated)

030104821.b3lyp_6-31g(d).smash.inp (generated)

030104821.b3lyp_6-31g(d).nwchem.inp (generated) 030104821.b3lyp_6-31g(d).log.xz 030104821.td-b3lyp_6-31g+(d).inp 030104821.td-b3lyp_6-31g+(d).log.xz

030104821.td-b3lyp_6-31+g(d).qchem.inp (generated)

030104821.td-b3lyp_6-31+g(d).gjf (generated)

030104821.td-b3lyp_6-31+g(d).firefly.inp (generated)

030104821.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030104821.mol 030104821.PUBCHEM 030104821.mol (via Jmol)
030105091.b3lyp_6-31g(d).inp

030105091.b3lyp_6-31g(d).qchem.inp (generated)

030105091.b3lyp_6-31g(d).gjf (generated)

030105091.b3lyp_6-31g(d).firefly.inp (generated)

030105091.b3lyp_6-31g(d).smash.inp (generated)

030105091.b3lyp_6-31g(d).nwchem.inp (generated) 030105091.b3lyp_6-31g(d).log.xz 030105091.mol 030105091.PUBCHEM 030105091.mol (via Jmol)
030105095.b3lyp_6-31g(d).inp

030105095.b3lyp_6-31g(d).qchem.inp (generated)

030105095.b3lyp_6-31g(d).gjf (generated)

030105095.b3lyp_6-31g(d).firefly.inp (generated)

030105095.b3lyp_6-31g(d).smash.inp (generated)

030105095.b3lyp_6-31g(d).nwchem.inp (generated) 030105095.b3lyp_6-31g(d).log.xz 030105095.td-b3lyp_6-31g+(d).inp 030105095.td-b3lyp_6-31g+(d).log.xz

030105095.td-b3lyp_6-31+g(d).qchem.inp (generated)

030105095.td-b3lyp_6-31+g(d).gjf (generated)

030105095.td-b3lyp_6-31+g(d).firefly.inp (generated)

030105095.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030105095.mol 030105095.PUBCHEM 030105095.mol (via Jmol)
030105096.b3lyp_6-31g(d).inp

030105096.b3lyp_6-31g(d).qchem.inp (generated)

030105096.b3lyp_6-31g(d).gjf (generated)

030105096.b3lyp_6-31g(d).firefly.inp (generated)

030105096.b3lyp_6-31g(d).smash.inp (generated)

030105096.b3lyp_6-31g(d).nwchem.inp (generated) 030105096.b3lyp_6-31g(d).log.xz 030105096.td-b3lyp_6-31g+(d).inp 030105096.td-b3lyp_6-31g+(d).log.xz

030105096.td-b3lyp_6-31+g(d).qchem.inp (generated)

030105096.td-b3lyp_6-31+g(d).gjf (generated)

030105096.td-b3lyp_6-31+g(d).firefly.inp (generated)

030105096.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030105096.mol 030105096.PUBCHEM 030105096.mol (via Jmol)
030105099.b3lyp_6-31g(d).inp

030105099.b3lyp_6-31g(d).qchem.inp (generated)

030105099.b3lyp_6-31g(d).gjf (generated)

030105099.b3lyp_6-31g(d).firefly.inp (generated)

030105099.b3lyp_6-31g(d).smash.inp (generated)

030105099.b3lyp_6-31g(d).nwchem.inp (generated) 030105099.b3lyp_6-31g(d).log.xz 030105099.td-b3lyp_6-31g+(d).inp 030105099.td-b3lyp_6-31g+(d).log.xz

030105099.td-b3lyp_6-31+g(d).qchem.inp (generated)

030105099.td-b3lyp_6-31+g(d).gjf (generated)

030105099.td-b3lyp_6-31+g(d).firefly.inp (generated)

030105099.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030105099.mol 030105099.PUBCHEM 030105099.mol (via Jmol)
030105102.b3lyp_6-31g(d).inp

030105102.b3lyp_6-31g(d).qchem.inp (generated)

030105102.b3lyp_6-31g(d).gjf (generated)

030105102.b3lyp_6-31g(d).firefly.inp (generated)

030105102.b3lyp_6-31g(d).smash.inp (generated)

030105102.b3lyp_6-31g(d).nwchem.inp (generated) 030105102.b3lyp_6-31g(d).log.xz 030105102.td-b3lyp_6-31g+(d).inp 030105102.td-b3lyp_6-31g+(d).log.xz

030105102.td-b3lyp_6-31+g(d).qchem.inp (generated)

030105102.td-b3lyp_6-31+g(d).gjf (generated)

030105102.td-b3lyp_6-31+g(d).firefly.inp (generated)

030105102.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030105102.mol 030105102.PUBCHEM 030105102.mol (via Jmol)
030105106.b3lyp_6-31g(d).inp

030105106.b3lyp_6-31g(d).qchem.inp (generated)

030105106.b3lyp_6-31g(d).gjf (generated)

030105106.b3lyp_6-31g(d).firefly.inp (generated)

030105106.b3lyp_6-31g(d).smash.inp (generated)

030105106.b3lyp_6-31g(d).nwchem.inp (generated) 030105106.b3lyp_6-31g(d).log.xz 030105106.td-b3lyp_6-31g+(d).inp 030105106.td-b3lyp_6-31g+(d).log.xz

030105106.td-b3lyp_6-31+g(d).qchem.inp (generated)

030105106.td-b3lyp_6-31+g(d).gjf (generated)

030105106.td-b3lyp_6-31+g(d).firefly.inp (generated)

030105106.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030105106.mol 030105106.PUBCHEM 030105106.mol (via Jmol)
030105107.b3lyp_6-31g(d).inp

030105107.b3lyp_6-31g(d).qchem.inp (generated)

030105107.b3lyp_6-31g(d).gjf (generated)

030105107.b3lyp_6-31g(d).firefly.inp (generated)

030105107.b3lyp_6-31g(d).smash.inp (generated)

030105107.b3lyp_6-31g(d).nwchem.inp (generated) 030105107.b3lyp_6-31g(d).log.xz 030105107.td-b3lyp_6-31g+(d).inp 030105107.td-b3lyp_6-31g+(d).log.xz

030105107.td-b3lyp_6-31+g(d).qchem.inp (generated)

030105107.td-b3lyp_6-31+g(d).gjf (generated)

030105107.td-b3lyp_6-31+g(d).firefly.inp (generated)

030105107.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030105107.mol 030105107.PUBCHEM 030105107.mol (via Jmol)
030105167.b3lyp_6-31g(d).inp

030105167.b3lyp_6-31g(d).qchem.inp (generated)

030105167.b3lyp_6-31g(d).gjf (generated)

030105167.b3lyp_6-31g(d).firefly.inp (generated)

030105167.b3lyp_6-31g(d).smash.inp (generated)

030105167.b3lyp_6-31g(d).nwchem.inp (generated) 030105167.b3lyp_6-31g(d).log.xz 030105167.td-b3lyp_6-31g+(d).inp 030105167.td-b3lyp_6-31g+(d).log.xz

030105167.td-b3lyp_6-31+g(d).qchem.inp (generated)

030105167.td-b3lyp_6-31+g(d).gjf (generated)

030105167.td-b3lyp_6-31+g(d).firefly.inp (generated)

030105167.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030105167.mol 030105167.PUBCHEM 030105167.mol (via Jmol)
030105168.b3lyp_6-31g(d).inp

030105168.b3lyp_6-31g(d).qchem.inp (generated)

030105168.b3lyp_6-31g(d).gjf (generated)

030105168.b3lyp_6-31g(d).firefly.inp (generated)

030105168.b3lyp_6-31g(d).smash.inp (generated)

030105168.b3lyp_6-31g(d).nwchem.inp (generated) 030105168.b3lyp_6-31g(d).log.xz 030105168.td-b3lyp_6-31g+(d).inp 030105168.td-b3lyp_6-31g+(d).log.xz

030105168.td-b3lyp_6-31+g(d).qchem.inp (generated)

030105168.td-b3lyp_6-31+g(d).gjf (generated)

030105168.td-b3lyp_6-31+g(d).firefly.inp (generated)

030105168.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030105168.mol 030105168.PUBCHEM 030105168.mol (via Jmol)
030105429.b3lyp_6-31g(d).inp

030105429.b3lyp_6-31g(d).qchem.inp (generated)

030105429.b3lyp_6-31g(d).gjf (generated)

030105429.b3lyp_6-31g(d).firefly.inp (generated)

030105429.b3lyp_6-31g(d).smash.inp (generated)

030105429.b3lyp_6-31g(d).nwchem.inp (generated) 030105429.b3lyp_6-31g(d).log.xz 030105429.td-b3lyp_6-31g+(d).inp 030105429.td-b3lyp_6-31g+(d).log.xz

030105429.td-b3lyp_6-31+g(d).qchem.inp (generated)

030105429.td-b3lyp_6-31+g(d).gjf (generated)

030105429.td-b3lyp_6-31+g(d).firefly.inp (generated)

030105429.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030105429.mol 030105429.PUBCHEM 030105429.mol (via Jmol)
030105435.b3lyp_6-31g(d).inp

030105435.b3lyp_6-31g(d).qchem.inp (generated)

030105435.b3lyp_6-31g(d).gjf (generated)

030105435.b3lyp_6-31g(d).firefly.inp (generated)

030105435.b3lyp_6-31g(d).smash.inp (generated)

030105435.b3lyp_6-31g(d).nwchem.inp (generated) 030105435.b3lyp_6-31g(d).log.xz 030105435.td-b3lyp_6-31g+(d).inp 030105435.td-b3lyp_6-31g+(d).log.xz

030105435.td-b3lyp_6-31+g(d).qchem.inp (generated)

030105435.td-b3lyp_6-31+g(d).gjf (generated)

030105435.td-b3lyp_6-31+g(d).firefly.inp (generated)

030105435.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030105435.mol 030105435.PUBCHEM 030105435.mol (via Jmol)
030105515.b3lyp_6-31g(d).inp

030105515.b3lyp_6-31g(d).qchem.inp (generated)

030105515.b3lyp_6-31g(d).gjf (generated)

030105515.b3lyp_6-31g(d).firefly.inp (generated)

030105515.b3lyp_6-31g(d).smash.inp (generated)

030105515.b3lyp_6-31g(d).nwchem.inp (generated) 030105515.b3lyp_6-31g(d).log.xz 030105515.td-b3lyp_6-31g+(d).inp 030105515.td-b3lyp_6-31g+(d).log.xz

030105515.td-b3lyp_6-31+g(d).qchem.inp (generated)

030105515.td-b3lyp_6-31+g(d).gjf (generated)

030105515.td-b3lyp_6-31+g(d).firefly.inp (generated)

030105515.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030105515.mol 030105515.PUBCHEM 030105515.mol (via Jmol)
030105516.b3lyp_6-31g(d).inp

030105516.b3lyp_6-31g(d).qchem.inp (generated)

030105516.b3lyp_6-31g(d).gjf (generated)

030105516.b3lyp_6-31g(d).firefly.inp (generated)

030105516.b3lyp_6-31g(d).smash.inp (generated)

030105516.b3lyp_6-31g(d).nwchem.inp (generated) 030105516.b3lyp_6-31g(d).log.xz 030105516.td-b3lyp_6-31g+(d).inp 030105516.td-b3lyp_6-31g+(d).log.xz

030105516.td-b3lyp_6-31+g(d).qchem.inp (generated)

030105516.td-b3lyp_6-31+g(d).gjf (generated)

030105516.td-b3lyp_6-31+g(d).firefly.inp (generated)

030105516.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030105516.mol 030105516.PUBCHEM 030105516.mol (via Jmol)
030105519.b3lyp_6-31g(d).inp

030105519.b3lyp_6-31g(d).qchem.inp (generated)

030105519.b3lyp_6-31g(d).gjf (generated)

030105519.b3lyp_6-31g(d).firefly.inp (generated)

030105519.b3lyp_6-31g(d).smash.inp (generated)

030105519.b3lyp_6-31g(d).nwchem.inp (generated) 030105519.b3lyp_6-31g(d).log.xz 030105519.td-b3lyp_6-31g+(d).inp 030105519.td-b3lyp_6-31g+(d).log.xz

030105519.td-b3lyp_6-31+g(d).qchem.inp (generated)

030105519.td-b3lyp_6-31+g(d).gjf (generated)

030105519.td-b3lyp_6-31+g(d).firefly.inp (generated)

030105519.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030105519.mol 030105519.PUBCHEM 030105519.mol (via Jmol)
030105520.b3lyp_6-31g(d).inp

030105520.b3lyp_6-31g(d).qchem.inp (generated)

030105520.b3lyp_6-31g(d).gjf (generated)

030105520.b3lyp_6-31g(d).firefly.inp (generated)

030105520.b3lyp_6-31g(d).smash.inp (generated)

030105520.b3lyp_6-31g(d).nwchem.inp (generated) 030105520.b3lyp_6-31g(d).log.xz 030105520.td-b3lyp_6-31g+(d).inp 030105520.td-b3lyp_6-31g+(d).log.xz

030105520.td-b3lyp_6-31+g(d).qchem.inp (generated)

030105520.td-b3lyp_6-31+g(d).gjf (generated)

030105520.td-b3lyp_6-31+g(d).firefly.inp (generated)

030105520.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030105520.mol 030105520.PUBCHEM 030105520.mol (via Jmol)
030105867.b3lyp_6-31g(d).inp

030105867.b3lyp_6-31g(d).qchem.inp (generated)

030105867.b3lyp_6-31g(d).gjf (generated)

030105867.b3lyp_6-31g(d).firefly.inp (generated)

030105867.b3lyp_6-31g(d).smash.inp (generated)

030105867.b3lyp_6-31g(d).nwchem.inp (generated) 030105867.b3lyp_6-31g(d).log.xz 030105867.td-b3lyp_6-31g+(d).inp 030105867.td-b3lyp_6-31g+(d).log.xz

030105867.td-b3lyp_6-31+g(d).qchem.inp (generated)

030105867.td-b3lyp_6-31+g(d).gjf (generated)

030105867.td-b3lyp_6-31+g(d).firefly.inp (generated)

030105867.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030105867.mol 030105867.PUBCHEM 030105867.mol (via Jmol)
030106140.b3lyp_6-31g(d).inp

030106140.b3lyp_6-31g(d).qchem.inp (generated)

030106140.b3lyp_6-31g(d).gjf (generated)

030106140.b3lyp_6-31g(d).firefly.inp (generated)

030106140.b3lyp_6-31g(d).smash.inp (generated)

030106140.b3lyp_6-31g(d).nwchem.inp (generated) 030106140.b3lyp_6-31g(d).log.xz 030106140.td-b3lyp_6-31g+(d).inp 030106140.td-b3lyp_6-31g+(d).log.xz

030106140.td-b3lyp_6-31+g(d).qchem.inp (generated)

030106140.td-b3lyp_6-31+g(d).gjf (generated)

030106140.td-b3lyp_6-31+g(d).firefly.inp (generated)

030106140.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030106140.mol 030106140.PUBCHEM 030106140.mol (via Jmol)
030106148.b3lyp_6-31g(d).inp

030106148.b3lyp_6-31g(d).qchem.inp (generated)

030106148.b3lyp_6-31g(d).gjf (generated)

030106148.b3lyp_6-31g(d).firefly.inp (generated)

030106148.b3lyp_6-31g(d).smash.inp (generated)

030106148.b3lyp_6-31g(d).nwchem.inp (generated) 030106148.b3lyp_6-31g(d).log.xz 030106148.td-b3lyp_6-31g+(d).inp 030106148.td-b3lyp_6-31g+(d).log.xz

030106148.td-b3lyp_6-31+g(d).qchem.inp (generated)

030106148.td-b3lyp_6-31+g(d).gjf (generated)

030106148.td-b3lyp_6-31+g(d).firefly.inp (generated)

030106148.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030106148.mol 030106148.PUBCHEM 030106148.mol (via Jmol)
030106210.b3lyp_6-31g(d).inp

030106210.b3lyp_6-31g(d).qchem.inp (generated)

030106210.b3lyp_6-31g(d).gjf (generated)

030106210.b3lyp_6-31g(d).firefly.inp (generated)

030106210.b3lyp_6-31g(d).smash.inp (generated)

030106210.b3lyp_6-31g(d).nwchem.inp (generated) 030106210.b3lyp_6-31g(d).log.xz 030106210.td-b3lyp_6-31g+(d).inp 030106210.td-b3lyp_6-31g+(d).log.xz

030106210.td-b3lyp_6-31+g(d).qchem.inp (generated)

030106210.td-b3lyp_6-31+g(d).gjf (generated)

030106210.td-b3lyp_6-31+g(d).firefly.inp (generated)

030106210.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030106210.mol 030106210.PUBCHEM 030106210.mol (via Jmol)
030106235.b3lyp_6-31g(d).inp

030106235.b3lyp_6-31g(d).qchem.inp (generated)

030106235.b3lyp_6-31g(d).gjf (generated)

030106235.b3lyp_6-31g(d).firefly.inp (generated)

030106235.b3lyp_6-31g(d).smash.inp (generated)

030106235.b3lyp_6-31g(d).nwchem.inp (generated) 030106235.b3lyp_6-31g(d).log.xz 030106235.td-b3lyp_6-31g+(d).inp 030106235.td-b3lyp_6-31g+(d).log.xz

030106235.td-b3lyp_6-31+g(d).qchem.inp (generated)

030106235.td-b3lyp_6-31+g(d).gjf (generated)

030106235.td-b3lyp_6-31+g(d).firefly.inp (generated)

030106235.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030106235.mol 030106235.PUBCHEM 030106235.mol (via Jmol)
030106236.b3lyp_6-31g(d).inp

030106236.b3lyp_6-31g(d).qchem.inp (generated)

030106236.b3lyp_6-31g(d).gjf (generated)

030106236.b3lyp_6-31g(d).firefly.inp (generated)

030106236.b3lyp_6-31g(d).smash.inp (generated)

030106236.b3lyp_6-31g(d).nwchem.inp (generated) 030106236.b3lyp_6-31g(d).log.xz 030106236.td-b3lyp_6-31g+(d).inp 030106236.td-b3lyp_6-31g+(d).log.xz

030106236.td-b3lyp_6-31+g(d).qchem.inp (generated)

030106236.td-b3lyp_6-31+g(d).gjf (generated)

030106236.td-b3lyp_6-31+g(d).firefly.inp (generated)

030106236.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030106236.mol 030106236.PUBCHEM 030106236.mol (via Jmol)
030106240.b3lyp_6-31g(d).inp

030106240.b3lyp_6-31g(d).qchem.inp (generated)

030106240.b3lyp_6-31g(d).gjf (generated)

030106240.b3lyp_6-31g(d).firefly.inp (generated)

030106240.b3lyp_6-31g(d).smash.inp (generated)

030106240.b3lyp_6-31g(d).nwchem.inp (generated) 030106240.b3lyp_6-31g(d).log.xz 030106240.td-b3lyp_6-31g+(d).inp 030106240.td-b3lyp_6-31g+(d).log.xz

030106240.td-b3lyp_6-31+g(d).qchem.inp (generated)

030106240.td-b3lyp_6-31+g(d).gjf (generated)

030106240.td-b3lyp_6-31+g(d).firefly.inp (generated)

030106240.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030106240.mol 030106240.PUBCHEM 030106240.mol (via Jmol)
030106241.b3lyp_6-31g(d).inp

030106241.b3lyp_6-31g(d).qchem.inp (generated)

030106241.b3lyp_6-31g(d).gjf (generated)

030106241.b3lyp_6-31g(d).firefly.inp (generated)

030106241.b3lyp_6-31g(d).smash.inp (generated)

030106241.b3lyp_6-31g(d).nwchem.inp (generated) 030106241.b3lyp_6-31g(d).log.xz 030106241.td-b3lyp_6-31g+(d).inp 030106241.td-b3lyp_6-31g+(d).log.xz

030106241.td-b3lyp_6-31+g(d).qchem.inp (generated)

030106241.td-b3lyp_6-31+g(d).gjf (generated)

030106241.td-b3lyp_6-31+g(d).firefly.inp (generated)

030106241.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030106241.mol 030106241.PUBCHEM 030106241.mol (via Jmol)
030106244.b3lyp_6-31g(d).inp

030106244.b3lyp_6-31g(d).qchem.inp (generated)

030106244.b3lyp_6-31g(d).gjf (generated)

030106244.b3lyp_6-31g(d).firefly.inp (generated)

030106244.b3lyp_6-31g(d).smash.inp (generated)

030106244.b3lyp_6-31g(d).nwchem.inp (generated) 030106244.b3lyp_6-31g(d).log.xz 030106244.td-b3lyp_6-31g+(d).inp 030106244.td-b3lyp_6-31g+(d).log.xz

030106244.td-b3lyp_6-31+g(d).qchem.inp (generated)

030106244.td-b3lyp_6-31+g(d).gjf (generated)

030106244.td-b3lyp_6-31+g(d).firefly.inp (generated)

030106244.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030106244.mol 030106244.PUBCHEM 030106244.mol (via Jmol)
030106245.b3lyp_6-31g(d).inp

030106245.b3lyp_6-31g(d).qchem.inp (generated)

030106245.b3lyp_6-31g(d).gjf (generated)

030106245.b3lyp_6-31g(d).firefly.inp (generated)

030106245.b3lyp_6-31g(d).smash.inp (generated)

030106245.b3lyp_6-31g(d).nwchem.inp (generated) 030106245.b3lyp_6-31g(d).log.xz 030106245.td-b3lyp_6-31g+(d).inp 030106245.td-b3lyp_6-31g+(d).log.xz

030106245.td-b3lyp_6-31+g(d).qchem.inp (generated)

030106245.td-b3lyp_6-31+g(d).gjf (generated)

030106245.td-b3lyp_6-31+g(d).firefly.inp (generated)

030106245.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030106245.mol 030106245.PUBCHEM 030106245.mol (via Jmol)
030106249.b3lyp_6-31g(d).inp

030106249.b3lyp_6-31g(d).qchem.inp (generated)

030106249.b3lyp_6-31g(d).gjf (generated)

030106249.b3lyp_6-31g(d).firefly.inp (generated)

030106249.b3lyp_6-31g(d).smash.inp (generated)

030106249.b3lyp_6-31g(d).nwchem.inp (generated) 030106249.b3lyp_6-31g(d).log.xz 030106249.td-b3lyp_6-31g+(d).inp 030106249.td-b3lyp_6-31g+(d).log.xz

030106249.td-b3lyp_6-31+g(d).qchem.inp (generated)

030106249.td-b3lyp_6-31+g(d).gjf (generated)

030106249.td-b3lyp_6-31+g(d).firefly.inp (generated)

030106249.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030106249.mol 030106249.PUBCHEM 030106249.mol (via Jmol)
030106250.b3lyp_6-31g(d).inp

030106250.b3lyp_6-31g(d).qchem.inp (generated)

030106250.b3lyp_6-31g(d).gjf (generated)

030106250.b3lyp_6-31g(d).firefly.inp (generated)

030106250.b3lyp_6-31g(d).smash.inp (generated)

030106250.b3lyp_6-31g(d).nwchem.inp (generated) 030106250.b3lyp_6-31g(d).log.xz 030106250.td-b3lyp_6-31g+(d).inp 030106250.td-b3lyp_6-31g+(d).log.xz

030106250.td-b3lyp_6-31+g(d).qchem.inp (generated)

030106250.td-b3lyp_6-31+g(d).gjf (generated)

030106250.td-b3lyp_6-31+g(d).firefly.inp (generated)

030106250.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030106250.mol 030106250.PUBCHEM 030106250.mol (via Jmol)
030106254.b3lyp_6-31g(d).inp

030106254.b3lyp_6-31g(d).qchem.inp (generated)

030106254.b3lyp_6-31g(d).gjf (generated)

030106254.b3lyp_6-31g(d).firefly.inp (generated)

030106254.b3lyp_6-31g(d).smash.inp (generated)

030106254.b3lyp_6-31g(d).nwchem.inp (generated) 030106254.b3lyp_6-31g(d).log.xz 030106254.td-b3lyp_6-31g+(d).inp 030106254.td-b3lyp_6-31g+(d).log.xz

030106254.td-b3lyp_6-31+g(d).qchem.inp (generated)

030106254.td-b3lyp_6-31+g(d).gjf (generated)

030106254.td-b3lyp_6-31+g(d).firefly.inp (generated)

030106254.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030106254.mol 030106254.PUBCHEM 030106254.mol (via Jmol)
030106255.b3lyp_6-31g(d).inp

030106255.b3lyp_6-31g(d).qchem.inp (generated)

030106255.b3lyp_6-31g(d).gjf (generated)

030106255.b3lyp_6-31g(d).firefly.inp (generated)

030106255.b3lyp_6-31g(d).smash.inp (generated)

030106255.b3lyp_6-31g(d).nwchem.inp (generated) 030106255.b3lyp_6-31g(d).log.xz 030106255.td-b3lyp_6-31g+(d).inp 030106255.td-b3lyp_6-31g+(d).log.xz

030106255.td-b3lyp_6-31+g(d).qchem.inp (generated)

030106255.td-b3lyp_6-31+g(d).gjf (generated)

030106255.td-b3lyp_6-31+g(d).firefly.inp (generated)

030106255.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030106255.mol 030106255.PUBCHEM 030106255.mol (via Jmol)
030106263.b3lyp_6-31g(d).inp

030106263.b3lyp_6-31g(d).qchem.inp (generated)

030106263.b3lyp_6-31g(d).gjf (generated)

030106263.b3lyp_6-31g(d).firefly.inp (generated)

030106263.b3lyp_6-31g(d).smash.inp (generated)

030106263.b3lyp_6-31g(d).nwchem.inp (generated) 030106263.b3lyp_6-31g(d).log.xz 030106263.mol 030106263.PUBCHEM 030106263.mol (via Jmol)
030106266.b3lyp_6-31g(d).inp

030106266.b3lyp_6-31g(d).qchem.inp (generated)

030106266.b3lyp_6-31g(d).gjf (generated)

030106266.b3lyp_6-31g(d).firefly.inp (generated)

030106266.b3lyp_6-31g(d).smash.inp (generated)

030106266.b3lyp_6-31g(d).nwchem.inp (generated) 030106266.b3lyp_6-31g(d).log.xz 030106266.mol 030106266.PUBCHEM 030106266.mol (via Jmol)
030106390.b3lyp_6-31g(d).inp

030106390.b3lyp_6-31g(d).qchem.inp (generated)

030106390.b3lyp_6-31g(d).gjf (generated)

030106390.b3lyp_6-31g(d).firefly.inp (generated)

030106390.b3lyp_6-31g(d).smash.inp (generated)

030106390.b3lyp_6-31g(d).nwchem.inp (generated) 030106390.b3lyp_6-31g(d).log.xz 030106390.td-b3lyp_6-31g+(d).inp 030106390.td-b3lyp_6-31g+(d).log.xz

030106390.td-b3lyp_6-31+g(d).qchem.inp (generated)

030106390.td-b3lyp_6-31+g(d).gjf (generated)

030106390.td-b3lyp_6-31+g(d).firefly.inp (generated)

030106390.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030106390.mol 030106390.PUBCHEM 030106390.mol (via Jmol)
030106391.b3lyp_6-31g(d).inp

030106391.b3lyp_6-31g(d).qchem.inp (generated)

030106391.b3lyp_6-31g(d).gjf (generated)

030106391.b3lyp_6-31g(d).firefly.inp (generated)

030106391.b3lyp_6-31g(d).smash.inp (generated)

030106391.b3lyp_6-31g(d).nwchem.inp (generated) 030106391.b3lyp_6-31g(d).log.xz 030106391.td-b3lyp_6-31g+(d).inp 030106391.td-b3lyp_6-31g+(d).log.xz

030106391.td-b3lyp_6-31+g(d).qchem.inp (generated)

030106391.td-b3lyp_6-31+g(d).gjf (generated)

030106391.td-b3lyp_6-31+g(d).firefly.inp (generated)

030106391.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030106391.mol 030106391.PUBCHEM 030106391.mol (via Jmol)
030106700.b3lyp_6-31g(d).inp

030106700.b3lyp_6-31g(d).qchem.inp (generated)

030106700.b3lyp_6-31g(d).gjf (generated)

030106700.b3lyp_6-31g(d).firefly.inp (generated)

030106700.b3lyp_6-31g(d).smash.inp (generated)

030106700.b3lyp_6-31g(d).nwchem.inp (generated) 030106700.b3lyp_6-31g(d).log.xz 030106700.td-b3lyp_6-31g+(d).inp 030106700.td-b3lyp_6-31g+(d).log.xz

030106700.td-b3lyp_6-31+g(d).qchem.inp (generated)

030106700.td-b3lyp_6-31+g(d).gjf (generated)

030106700.td-b3lyp_6-31+g(d).firefly.inp (generated)

030106700.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030106700.mol 030106700.PUBCHEM 030106700.mol (via Jmol)
030106705.b3lyp_6-31g(d).inp

030106705.b3lyp_6-31g(d).qchem.inp (generated)

030106705.b3lyp_6-31g(d).gjf (generated)

030106705.b3lyp_6-31g(d).firefly.inp (generated)

030106705.b3lyp_6-31g(d).smash.inp (generated)

030106705.b3lyp_6-31g(d).nwchem.inp (generated) 030106705.b3lyp_6-31g(d).log.xz 030106705.td-b3lyp_6-31g+(d).inp 030106705.td-b3lyp_6-31g+(d).log.xz

030106705.td-b3lyp_6-31+g(d).qchem.inp (generated)

030106705.td-b3lyp_6-31+g(d).gjf (generated)

030106705.td-b3lyp_6-31+g(d).firefly.inp (generated)

030106705.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030106705.mol 030106705.PUBCHEM 030106705.mol (via Jmol)
030110191.b3lyp_6-31g(d).inp

030110191.b3lyp_6-31g(d).qchem.inp (generated)

030110191.b3lyp_6-31g(d).gjf (generated)

030110191.b3lyp_6-31g(d).firefly.inp (generated)

030110191.b3lyp_6-31g(d).smash.inp (generated)

030110191.b3lyp_6-31g(d).nwchem.inp (generated) 030110191.b3lyp_6-31g(d).log.xz 030110191.td-b3lyp_6-31g+(d).inp 030110191.td-b3lyp_6-31g+(d).log.xz

030110191.td-b3lyp_6-31+g(d).qchem.inp (generated)

030110191.td-b3lyp_6-31+g(d).gjf (generated)

030110191.td-b3lyp_6-31+g(d).firefly.inp (generated)

030110191.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030110191.mol 030110191.PUBCHEM 030110191.mol (via Jmol)
030110240.b3lyp_6-31g(d).inp

030110240.b3lyp_6-31g(d).qchem.inp (generated)

030110240.b3lyp_6-31g(d).gjf (generated)

030110240.b3lyp_6-31g(d).firefly.inp (generated)

030110240.b3lyp_6-31g(d).smash.inp (generated)

030110240.b3lyp_6-31g(d).nwchem.inp (generated) 030110240.b3lyp_6-31g(d).log.xz 030110240.td-b3lyp_6-31g+(d).inp 030110240.td-b3lyp_6-31g+(d).log.xz

030110240.td-b3lyp_6-31+g(d).qchem.inp (generated)

030110240.td-b3lyp_6-31+g(d).gjf (generated)

030110240.td-b3lyp_6-31+g(d).firefly.inp (generated)

030110240.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030110240.mol 030110240.PUBCHEM 030110240.mol (via Jmol)
030110303.b3lyp_6-31g(d).inp

030110303.b3lyp_6-31g(d).qchem.inp (generated)

030110303.b3lyp_6-31g(d).gjf (generated)

030110303.b3lyp_6-31g(d).firefly.inp (generated)

030110303.b3lyp_6-31g(d).smash.inp (generated)

030110303.b3lyp_6-31g(d).nwchem.inp (generated) 030110303.b3lyp_6-31g(d).log.xz 030110303.td-b3lyp_6-31g+(d).inp 030110303.td-b3lyp_6-31g+(d).log.xz

030110303.td-b3lyp_6-31+g(d).qchem.inp (generated)

030110303.td-b3lyp_6-31+g(d).gjf (generated)

030110303.td-b3lyp_6-31+g(d).firefly.inp (generated)

030110303.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030110303.mol 030110303.PUBCHEM 030110303.mol (via Jmol)
030110355.b3lyp_6-31g(d).inp

030110355.b3lyp_6-31g(d).qchem.inp (generated)

030110355.b3lyp_6-31g(d).gjf (generated)

030110355.b3lyp_6-31g(d).firefly.inp (generated)

030110355.b3lyp_6-31g(d).smash.inp (generated)

030110355.b3lyp_6-31g(d).nwchem.inp (generated) 030110355.b3lyp_6-31g(d).log.xz 030110355.td-b3lyp_6-31g+(d).inp 030110355.td-b3lyp_6-31g+(d).log.xz

030110355.td-b3lyp_6-31+g(d).qchem.inp (generated)

030110355.td-b3lyp_6-31+g(d).gjf (generated)

030110355.td-b3lyp_6-31+g(d).firefly.inp (generated)

030110355.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030110355.mol 030110355.PUBCHEM 030110355.mol (via Jmol)
030110357.b3lyp_6-31g(d).inp

030110357.b3lyp_6-31g(d).qchem.inp (generated)

030110357.b3lyp_6-31g(d).gjf (generated)

030110357.b3lyp_6-31g(d).firefly.inp (generated)

030110357.b3lyp_6-31g(d).smash.inp (generated)

030110357.b3lyp_6-31g(d).nwchem.inp (generated) 030110357.b3lyp_6-31g(d).log.xz 030110357.td-b3lyp_6-31g+(d).inp 030110357.td-b3lyp_6-31g+(d).log.xz

030110357.td-b3lyp_6-31+g(d).qchem.inp (generated)

030110357.td-b3lyp_6-31+g(d).gjf (generated)

030110357.td-b3lyp_6-31+g(d).firefly.inp (generated)

030110357.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030110357.mol 030110357.PUBCHEM 030110357.mol (via Jmol)
030110404.b3lyp_6-31g(d).inp

030110404.b3lyp_6-31g(d).qchem.inp (generated)

030110404.b3lyp_6-31g(d).gjf (generated)

030110404.b3lyp_6-31g(d).firefly.inp (generated)

030110404.b3lyp_6-31g(d).smash.inp (generated)

030110404.b3lyp_6-31g(d).nwchem.inp (generated) 030110404.b3lyp_6-31g(d).log.xz 030110404.mol 030110404.PUBCHEM 030110404.mol (via Jmol)
030110483.b3lyp_6-31g(d).inp

030110483.b3lyp_6-31g(d).qchem.inp (generated)

030110483.b3lyp_6-31g(d).gjf (generated)

030110483.b3lyp_6-31g(d).firefly.inp (generated)

030110483.b3lyp_6-31g(d).smash.inp (generated)

030110483.b3lyp_6-31g(d).nwchem.inp (generated) 030110483.b3lyp_6-31g(d).log.xz 030110483.td-b3lyp_6-31g+(d).inp 030110483.td-b3lyp_6-31g+(d).log.xz

030110483.td-b3lyp_6-31+g(d).qchem.inp (generated)

030110483.td-b3lyp_6-31+g(d).gjf (generated)

030110483.td-b3lyp_6-31+g(d).firefly.inp (generated)

030110483.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030110483.mol 030110483.PUBCHEM 030110483.mol (via Jmol)
030110605.b3lyp_6-31g(d).inp

030110605.b3lyp_6-31g(d).qchem.inp (generated)

030110605.b3lyp_6-31g(d).gjf (generated)

030110605.b3lyp_6-31g(d).firefly.inp (generated)

030110605.b3lyp_6-31g(d).smash.inp (generated)

030110605.b3lyp_6-31g(d).nwchem.inp (generated) 030110605.b3lyp_6-31g(d).log.xz 030110605.td-b3lyp_6-31g+(d).inp 030110605.td-b3lyp_6-31g+(d).log.xz

030110605.td-b3lyp_6-31+g(d).qchem.inp (generated)

030110605.td-b3lyp_6-31+g(d).gjf (generated)

030110605.td-b3lyp_6-31+g(d).firefly.inp (generated)

030110605.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030110605.mol 030110605.PUBCHEM 030110605.mol (via Jmol)
030110760.b3lyp_6-31g(d).inp

030110760.b3lyp_6-31g(d).qchem.inp (generated)

030110760.b3lyp_6-31g(d).gjf (generated)

030110760.b3lyp_6-31g(d).firefly.inp (generated)

030110760.b3lyp_6-31g(d).smash.inp (generated)

030110760.b3lyp_6-31g(d).nwchem.inp (generated) 030110760.b3lyp_6-31g(d).log.xz 030110760.td-b3lyp_6-31g+(d).inp 030110760.td-b3lyp_6-31g+(d).log.xz

030110760.td-b3lyp_6-31+g(d).qchem.inp (generated)

030110760.td-b3lyp_6-31+g(d).gjf (generated)

030110760.td-b3lyp_6-31+g(d).firefly.inp (generated)

030110760.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030110760.mol 030110760.PUBCHEM 030110760.mol (via Jmol)
030110762.b3lyp_6-31g(d).inp

030110762.b3lyp_6-31g(d).qchem.inp (generated)

030110762.b3lyp_6-31g(d).gjf (generated)

030110762.b3lyp_6-31g(d).firefly.inp (generated)

030110762.b3lyp_6-31g(d).smash.inp (generated)

030110762.b3lyp_6-31g(d).nwchem.inp (generated) 030110762.b3lyp_6-31g(d).log.xz 030110762.td-b3lyp_6-31g+(d).inp 030110762.td-b3lyp_6-31g+(d).log.xz

030110762.td-b3lyp_6-31+g(d).qchem.inp (generated)

030110762.td-b3lyp_6-31+g(d).gjf (generated)

030110762.td-b3lyp_6-31+g(d).firefly.inp (generated)

030110762.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030110762.mol 030110762.PUBCHEM 030110762.mol (via Jmol)
030110784.b3lyp_6-31g(d).inp

030110784.b3lyp_6-31g(d).qchem.inp (generated)

030110784.b3lyp_6-31g(d).gjf (generated)

030110784.b3lyp_6-31g(d).firefly.inp (generated)

030110784.b3lyp_6-31g(d).smash.inp (generated)

030110784.b3lyp_6-31g(d).nwchem.inp (generated) 030110784.b3lyp_6-31g(d).log.xz 030110784.td-b3lyp_6-31g+(d).inp 030110784.td-b3lyp_6-31g+(d).log.xz

030110784.td-b3lyp_6-31+g(d).qchem.inp (generated)

030110784.td-b3lyp_6-31+g(d).gjf (generated)

030110784.td-b3lyp_6-31+g(d).firefly.inp (generated)

030110784.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030110784.mol 030110784.PUBCHEM 030110784.mol (via Jmol)
030110797.b3lyp_6-31g(d).inp

030110797.b3lyp_6-31g(d).qchem.inp (generated)

030110797.b3lyp_6-31g(d).gjf (generated)

030110797.b3lyp_6-31g(d).firefly.inp (generated)

030110797.b3lyp_6-31g(d).smash.inp (generated)

030110797.b3lyp_6-31g(d).nwchem.inp (generated) 030110797.b3lyp_6-31g(d).log.xz 030110797.td-b3lyp_6-31g+(d).inp 030110797.td-b3lyp_6-31g+(d).log.xz

030110797.td-b3lyp_6-31+g(d).qchem.inp (generated)

030110797.td-b3lyp_6-31+g(d).gjf (generated)

030110797.td-b3lyp_6-31+g(d).firefly.inp (generated)

030110797.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030110797.mol 030110797.PUBCHEM 030110797.mol (via Jmol)
030110905.b3lyp_6-31g(d).inp

030110905.b3lyp_6-31g(d).qchem.inp (generated)

030110905.b3lyp_6-31g(d).gjf (generated)

030110905.b3lyp_6-31g(d).firefly.inp (generated)

030110905.b3lyp_6-31g(d).smash.inp (generated)

030110905.b3lyp_6-31g(d).nwchem.inp (generated) 030110905.b3lyp_6-31g(d).log.xz 030110905.td-b3lyp_6-31g+(d).inp 030110905.td-b3lyp_6-31g+(d).log.xz

030110905.td-b3lyp_6-31+g(d).qchem.inp (generated)

030110905.td-b3lyp_6-31+g(d).gjf (generated)

030110905.td-b3lyp_6-31+g(d).firefly.inp (generated)

030110905.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030110905.mol 030110905.PUBCHEM 030110905.mol (via Jmol)
030110907.b3lyp_6-31g(d).inp

030110907.b3lyp_6-31g(d).qchem.inp (generated)

030110907.b3lyp_6-31g(d).gjf (generated)

030110907.b3lyp_6-31g(d).firefly.inp (generated)

030110907.b3lyp_6-31g(d).smash.inp (generated)

030110907.b3lyp_6-31g(d).nwchem.inp (generated) 030110907.b3lyp_6-31g(d).log.xz 030110907.td-b3lyp_6-31g+(d).inp 030110907.td-b3lyp_6-31g+(d).log.xz

030110907.td-b3lyp_6-31+g(d).qchem.inp (generated)

030110907.td-b3lyp_6-31+g(d).gjf (generated)

030110907.td-b3lyp_6-31+g(d).firefly.inp (generated)

030110907.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030110907.mol 030110907.PUBCHEM 030110907.mol (via Jmol)
030110908.b3lyp_6-31g(d).inp

030110908.b3lyp_6-31g(d).qchem.inp (generated)

030110908.b3lyp_6-31g(d).gjf (generated)

030110908.b3lyp_6-31g(d).firefly.inp (generated)

030110908.b3lyp_6-31g(d).smash.inp (generated)

030110908.b3lyp_6-31g(d).nwchem.inp (generated) 030110908.b3lyp_6-31g(d).log.xz 030110908.td-b3lyp_6-31g+(d).inp 030110908.td-b3lyp_6-31g+(d).log.xz

030110908.td-b3lyp_6-31+g(d).qchem.inp (generated)

030110908.td-b3lyp_6-31+g(d).gjf (generated)

030110908.td-b3lyp_6-31+g(d).firefly.inp (generated)

030110908.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030110908.mol 030110908.PUBCHEM 030110908.mol (via Jmol)
030110911.b3lyp_6-31g(d).inp

030110911.b3lyp_6-31g(d).qchem.inp (generated)

030110911.b3lyp_6-31g(d).gjf (generated)

030110911.b3lyp_6-31g(d).firefly.inp (generated)

030110911.b3lyp_6-31g(d).smash.inp (generated)

030110911.b3lyp_6-31g(d).nwchem.inp (generated) 030110911.b3lyp_6-31g(d).log.xz 030110911.td-b3lyp_6-31g+(d).inp 030110911.td-b3lyp_6-31g+(d).log.xz

030110911.td-b3lyp_6-31+g(d).qchem.inp (generated)

030110911.td-b3lyp_6-31+g(d).gjf (generated)

030110911.td-b3lyp_6-31+g(d).firefly.inp (generated)

030110911.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030110911.mol 030110911.PUBCHEM 030110911.mol (via Jmol)
030110912.b3lyp_6-31g(d).inp

030110912.b3lyp_6-31g(d).qchem.inp (generated)

030110912.b3lyp_6-31g(d).gjf (generated)

030110912.b3lyp_6-31g(d).firefly.inp (generated)

030110912.b3lyp_6-31g(d).smash.inp (generated)

030110912.b3lyp_6-31g(d).nwchem.inp (generated) 030110912.b3lyp_6-31g(d).log.xz 030110912.td-b3lyp_6-31g+(d).inp 030110912.td-b3lyp_6-31g+(d).log.xz

030110912.td-b3lyp_6-31+g(d).qchem.inp (generated)

030110912.td-b3lyp_6-31+g(d).gjf (generated)

030110912.td-b3lyp_6-31+g(d).firefly.inp (generated)

030110912.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030110912.mol 030110912.PUBCHEM 030110912.mol (via Jmol)
030110945.b3lyp_6-31g(d).inp

030110945.b3lyp_6-31g(d).qchem.inp (generated)

030110945.b3lyp_6-31g(d).gjf (generated)

030110945.b3lyp_6-31g(d).firefly.inp (generated)

030110945.b3lyp_6-31g(d).smash.inp (generated)

030110945.b3lyp_6-31g(d).nwchem.inp (generated) 030110945.b3lyp_6-31g(d).log.xz 030110945.mol 030110945.PUBCHEM 030110945.mol (via Jmol)
030111032.b3lyp_6-31g(d).inp

030111032.b3lyp_6-31g(d).qchem.inp (generated)

030111032.b3lyp_6-31g(d).gjf (generated)

030111032.b3lyp_6-31g(d).firefly.inp (generated)

030111032.b3lyp_6-31g(d).smash.inp (generated)

030111032.b3lyp_6-31g(d).nwchem.inp (generated) 030111032.b3lyp_6-31g(d).log.xz 030111032.mol 030111032.PUBCHEM 030111032.mol (via Jmol)
030111136.b3lyp_6-31g(d).inp

030111136.b3lyp_6-31g(d).qchem.inp (generated)

030111136.b3lyp_6-31g(d).gjf (generated)

030111136.b3lyp_6-31g(d).firefly.inp (generated)

030111136.b3lyp_6-31g(d).smash.inp (generated)

030111136.b3lyp_6-31g(d).nwchem.inp (generated) 030111136.b3lyp_6-31g(d).log.xz 030111136.td-b3lyp_6-31g+(d).inp 030111136.td-b3lyp_6-31g+(d).log.xz

030111136.td-b3lyp_6-31+g(d).qchem.inp (generated)

030111136.td-b3lyp_6-31+g(d).gjf (generated)

030111136.td-b3lyp_6-31+g(d).firefly.inp (generated)

030111136.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030111136.mol 030111136.PUBCHEM 030111136.mol (via Jmol)
030111245.b3lyp_6-31g(d).inp

030111245.b3lyp_6-31g(d).qchem.inp (generated)

030111245.b3lyp_6-31g(d).gjf (generated)

030111245.b3lyp_6-31g(d).firefly.inp (generated)

030111245.b3lyp_6-31g(d).smash.inp (generated)

030111245.b3lyp_6-31g(d).nwchem.inp (generated) 030111245.b3lyp_6-31g(d).log.xz 030111245.td-b3lyp_6-31g+(d).inp 030111245.td-b3lyp_6-31g+(d).log.xz

030111245.td-b3lyp_6-31+g(d).qchem.inp (generated)

030111245.td-b3lyp_6-31+g(d).gjf (generated)

030111245.td-b3lyp_6-31+g(d).firefly.inp (generated)

030111245.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030111245.mol 030111245.PUBCHEM 030111245.mol (via Jmol)
030111350.b3lyp_6-31g(d).inp

030111350.b3lyp_6-31g(d).qchem.inp (generated)

030111350.b3lyp_6-31g(d).gjf (generated)

030111350.b3lyp_6-31g(d).firefly.inp (generated)

030111350.b3lyp_6-31g(d).smash.inp (generated)

030111350.b3lyp_6-31g(d).nwchem.inp (generated) 030111350.b3lyp_6-31g(d).log.xz 030111350.mol 030111350.PUBCHEM 030111350.mol (via Jmol)
030111357.b3lyp_6-31g(d).inp

030111357.b3lyp_6-31g(d).qchem.inp (generated)

030111357.b3lyp_6-31g(d).gjf (generated)

030111357.b3lyp_6-31g(d).firefly.inp (generated)

030111357.b3lyp_6-31g(d).smash.inp (generated)

030111357.b3lyp_6-31g(d).nwchem.inp (generated) 030111357.b3lyp_6-31g(d).log.xz 030111357.td-b3lyp_6-31g+(d).inp 030111357.td-b3lyp_6-31g+(d).log.xz

030111357.td-b3lyp_6-31+g(d).qchem.inp (generated)

030111357.td-b3lyp_6-31+g(d).gjf (generated)

030111357.td-b3lyp_6-31+g(d).firefly.inp (generated)

030111357.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030111357.mol 030111357.PUBCHEM 030111357.mol (via Jmol)
030111360.b3lyp_6-31g(d).inp

030111360.b3lyp_6-31g(d).qchem.inp (generated)

030111360.b3lyp_6-31g(d).gjf (generated)

030111360.b3lyp_6-31g(d).firefly.inp (generated)

030111360.b3lyp_6-31g(d).smash.inp (generated)

030111360.b3lyp_6-31g(d).nwchem.inp (generated) 030111360.b3lyp_6-31g(d).log.xz 030111360.td-b3lyp_6-31g+(d).inp 030111360.td-b3lyp_6-31g+(d).log.xz

030111360.td-b3lyp_6-31+g(d).qchem.inp (generated)

030111360.td-b3lyp_6-31+g(d).gjf (generated)

030111360.td-b3lyp_6-31+g(d).firefly.inp (generated)

030111360.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030111360.mol 030111360.PUBCHEM 030111360.mol (via Jmol)
030111500.b3lyp_6-31g(d).inp

030111500.b3lyp_6-31g(d).qchem.inp (generated)

030111500.b3lyp_6-31g(d).gjf (generated)

030111500.b3lyp_6-31g(d).firefly.inp (generated)

030111500.b3lyp_6-31g(d).smash.inp (generated)

030111500.b3lyp_6-31g(d).nwchem.inp (generated) 030111500.b3lyp_6-31g(d).log.xz 030111500.td-b3lyp_6-31g+(d).inp 030111500.td-b3lyp_6-31g+(d).log.xz

030111500.td-b3lyp_6-31+g(d).qchem.inp (generated)

030111500.td-b3lyp_6-31+g(d).gjf (generated)

030111500.td-b3lyp_6-31+g(d).firefly.inp (generated)

030111500.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030111500.mol 030111500.PUBCHEM 030111500.mol (via Jmol)
030111576.b3lyp_6-31g(d).inp

030111576.b3lyp_6-31g(d).qchem.inp (generated)

030111576.b3lyp_6-31g(d).gjf (generated)

030111576.b3lyp_6-31g(d).firefly.inp (generated)

030111576.b3lyp_6-31g(d).smash.inp (generated)

030111576.b3lyp_6-31g(d).nwchem.inp (generated) 030111576.b3lyp_6-31g(d).log.xz 030111576.td-b3lyp_6-31g+(d).inp 030111576.td-b3lyp_6-31g+(d).log.xz

030111576.td-b3lyp_6-31+g(d).qchem.inp (generated)

030111576.td-b3lyp_6-31+g(d).gjf (generated)

030111576.td-b3lyp_6-31+g(d).firefly.inp (generated)

030111576.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030111576.mol 030111576.PUBCHEM 030111576.mol (via Jmol)
030111677.b3lyp_6-31g(d).inp

030111677.b3lyp_6-31g(d).qchem.inp (generated)

030111677.b3lyp_6-31g(d).gjf (generated)

030111677.b3lyp_6-31g(d).firefly.inp (generated)

030111677.b3lyp_6-31g(d).smash.inp (generated)

030111677.b3lyp_6-31g(d).nwchem.inp (generated) 030111677.b3lyp_6-31g(d).log.xz 030111677.td-b3lyp_6-31g+(d).inp 030111677.td-b3lyp_6-31g+(d).log.xz

030111677.td-b3lyp_6-31+g(d).qchem.inp (generated)

030111677.td-b3lyp_6-31+g(d).gjf (generated)

030111677.td-b3lyp_6-31+g(d).firefly.inp (generated)

030111677.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030111677.mol 030111677.PUBCHEM 030111677.mol (via Jmol)
030111678.b3lyp_6-31g(d).inp

030111678.b3lyp_6-31g(d).qchem.inp (generated)

030111678.b3lyp_6-31g(d).gjf (generated)

030111678.b3lyp_6-31g(d).firefly.inp (generated)

030111678.b3lyp_6-31g(d).smash.inp (generated)

030111678.b3lyp_6-31g(d).nwchem.inp (generated) 030111678.b3lyp_6-31g(d).log.xz 030111678.td-b3lyp_6-31g+(d).inp 030111678.td-b3lyp_6-31g+(d).log.xz

030111678.td-b3lyp_6-31+g(d).qchem.inp (generated)

030111678.td-b3lyp_6-31+g(d).gjf (generated)

030111678.td-b3lyp_6-31+g(d).firefly.inp (generated)

030111678.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030111678.mol 030111678.PUBCHEM 030111678.mol (via Jmol)
030112006.b3lyp_6-31g(d).inp

030112006.b3lyp_6-31g(d).qchem.inp (generated)

030112006.b3lyp_6-31g(d).gjf (generated)

030112006.b3lyp_6-31g(d).firefly.inp (generated)

030112006.b3lyp_6-31g(d).smash.inp (generated)

030112006.b3lyp_6-31g(d).nwchem.inp (generated) 030112006.b3lyp_6-31g(d).log.xz 030112006.td-b3lyp_6-31g+(d).inp 030112006.td-b3lyp_6-31g+(d).log.xz

030112006.td-b3lyp_6-31+g(d).qchem.inp (generated)

030112006.td-b3lyp_6-31+g(d).gjf (generated)

030112006.td-b3lyp_6-31+g(d).firefly.inp (generated)

030112006.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030112006.mol 030112006.PUBCHEM 030112006.mol (via Jmol)
030112009.b3lyp_6-31g(d).inp

030112009.b3lyp_6-31g(d).qchem.inp (generated)

030112009.b3lyp_6-31g(d).gjf (generated)

030112009.b3lyp_6-31g(d).firefly.inp (generated)

030112009.b3lyp_6-31g(d).smash.inp (generated)

030112009.b3lyp_6-31g(d).nwchem.inp (generated) 030112009.b3lyp_6-31g(d).log.xz 030112009.td-b3lyp_6-31g+(d).inp 030112009.td-b3lyp_6-31g+(d).log.xz

030112009.td-b3lyp_6-31+g(d).qchem.inp (generated)

030112009.td-b3lyp_6-31+g(d).gjf (generated)

030112009.td-b3lyp_6-31+g(d).firefly.inp (generated)

030112009.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030112009.mol 030112009.PUBCHEM 030112009.mol (via Jmol)
030112685.b3lyp_6-31g(d).inp

030112685.b3lyp_6-31g(d).qchem.inp (generated)

030112685.b3lyp_6-31g(d).gjf (generated)

030112685.b3lyp_6-31g(d).firefly.inp (generated)

030112685.b3lyp_6-31g(d).smash.inp (generated)

030112685.b3lyp_6-31g(d).nwchem.inp (generated) 030112685.b3lyp_6-31g(d).log.xz 030112685.td-b3lyp_6-31g+(d).inp 030112685.td-b3lyp_6-31g+(d).log.xz

030112685.td-b3lyp_6-31+g(d).qchem.inp (generated)

030112685.td-b3lyp_6-31+g(d).gjf (generated)

030112685.td-b3lyp_6-31+g(d).firefly.inp (generated)

030112685.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030112685.mol 030112685.PUBCHEM 030112685.mol (via Jmol)
030112688.b3lyp_6-31g(d).inp

030112688.b3lyp_6-31g(d).qchem.inp (generated)

030112688.b3lyp_6-31g(d).gjf (generated)

030112688.b3lyp_6-31g(d).firefly.inp (generated)

030112688.b3lyp_6-31g(d).smash.inp (generated)

030112688.b3lyp_6-31g(d).nwchem.inp (generated) 030112688.b3lyp_6-31g(d).log.xz 030112688.td-b3lyp_6-31g+(d).inp 030112688.td-b3lyp_6-31g+(d).log.xz

030112688.td-b3lyp_6-31+g(d).qchem.inp (generated)

030112688.td-b3lyp_6-31+g(d).gjf (generated)

030112688.td-b3lyp_6-31+g(d).firefly.inp (generated)

030112688.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030112688.mol 030112688.PUBCHEM 030112688.mol (via Jmol)
030112723.b3lyp_6-31g(d).inp

030112723.b3lyp_6-31g(d).qchem.inp (generated)

030112723.b3lyp_6-31g(d).gjf (generated)

030112723.b3lyp_6-31g(d).firefly.inp (generated)

030112723.b3lyp_6-31g(d).smash.inp (generated)

030112723.b3lyp_6-31g(d).nwchem.inp (generated) 030112723.b3lyp_6-31g(d).log.xz 030112723.td-b3lyp_6-31g+(d).inp 030112723.td-b3lyp_6-31g+(d).log.xz

030112723.td-b3lyp_6-31+g(d).qchem.inp (generated)

030112723.td-b3lyp_6-31+g(d).gjf (generated)

030112723.td-b3lyp_6-31+g(d).firefly.inp (generated)

030112723.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030112723.mol 030112723.PUBCHEM 030112723.mol (via Jmol)
030112880.b3lyp_6-31g(d).inp

030112880.b3lyp_6-31g(d).qchem.inp (generated)

030112880.b3lyp_6-31g(d).gjf (generated)

030112880.b3lyp_6-31g(d).firefly.inp (generated)

030112880.b3lyp_6-31g(d).smash.inp (generated)

030112880.b3lyp_6-31g(d).nwchem.inp (generated) 030112880.b3lyp_6-31g(d).log.xz 030112880.td-b3lyp_6-31g+(d).inp 030112880.td-b3lyp_6-31g+(d).log.xz

030112880.td-b3lyp_6-31+g(d).qchem.inp (generated)

030112880.td-b3lyp_6-31+g(d).gjf (generated)

030112880.td-b3lyp_6-31+g(d).firefly.inp (generated)

030112880.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030112880.mol 030112880.PUBCHEM 030112880.mol (via Jmol)
030113297.b3lyp_6-31g(d).inp

030113297.b3lyp_6-31g(d).qchem.inp (generated)

030113297.b3lyp_6-31g(d).gjf (generated)

030113297.b3lyp_6-31g(d).firefly.inp (generated)

030113297.b3lyp_6-31g(d).smash.inp (generated)

030113297.b3lyp_6-31g(d).nwchem.inp (generated) 030113297.b3lyp_6-31g(d).log.xz 030113297.td-b3lyp_6-31g+(d).inp 030113297.td-b3lyp_6-31g+(d).log.xz

030113297.td-b3lyp_6-31+g(d).qchem.inp (generated)

030113297.td-b3lyp_6-31+g(d).gjf (generated)

030113297.td-b3lyp_6-31+g(d).firefly.inp (generated)

030113297.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030113297.mol 030113297.PUBCHEM 030113297.mol (via Jmol)
030113310.b3lyp_6-31g(d).inp

030113310.b3lyp_6-31g(d).qchem.inp (generated)

030113310.b3lyp_6-31g(d).gjf (generated)

030113310.b3lyp_6-31g(d).firefly.inp (generated)

030113310.b3lyp_6-31g(d).smash.inp (generated)

030113310.b3lyp_6-31g(d).nwchem.inp (generated) 030113310.b3lyp_6-31g(d).log.xz 030113310.mol 030113310.PUBCHEM 030113310.mol (via Jmol)
030113337.b3lyp_6-31g(d).inp

030113337.b3lyp_6-31g(d).qchem.inp (generated)

030113337.b3lyp_6-31g(d).gjf (generated)

030113337.b3lyp_6-31g(d).firefly.inp (generated)

030113337.b3lyp_6-31g(d).smash.inp (generated)

030113337.b3lyp_6-31g(d).nwchem.inp (generated) 030113337.b3lyp_6-31g(d).log.xz 030113337.td-b3lyp_6-31g+(d).inp 030113337.td-b3lyp_6-31g+(d).log.xz

030113337.td-b3lyp_6-31+g(d).qchem.inp (generated)

030113337.td-b3lyp_6-31+g(d).gjf (generated)

030113337.td-b3lyp_6-31+g(d).firefly.inp (generated)

030113337.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030113337.mol 030113337.PUBCHEM 030113337.mol (via Jmol)
030113390.b3lyp_6-31g(d).inp

030113390.b3lyp_6-31g(d).qchem.inp (generated)

030113390.b3lyp_6-31g(d).gjf (generated)

030113390.b3lyp_6-31g(d).firefly.inp (generated)

030113390.b3lyp_6-31g(d).smash.inp (generated)

030113390.b3lyp_6-31g(d).nwchem.inp (generated) 030113390.b3lyp_6-31g(d).log.xz 030113390.td-b3lyp_6-31g+(d).inp 030113390.td-b3lyp_6-31g+(d).log.xz

030113390.td-b3lyp_6-31+g(d).qchem.inp (generated)

030113390.td-b3lyp_6-31+g(d).gjf (generated)

030113390.td-b3lyp_6-31+g(d).firefly.inp (generated)

030113390.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030113390.mol 030113390.PUBCHEM 030113390.mol (via Jmol)
030113426.b3lyp_6-31g(d).inp

030113426.b3lyp_6-31g(d).qchem.inp (generated)

030113426.b3lyp_6-31g(d).gjf (generated)

030113426.b3lyp_6-31g(d).firefly.inp (generated)

030113426.b3lyp_6-31g(d).smash.inp (generated)

030113426.b3lyp_6-31g(d).nwchem.inp (generated) 030113426.b3lyp_6-31g(d).log.xz 030113426.td-b3lyp_6-31g+(d).inp 030113426.td-b3lyp_6-31g+(d).log.xz

030113426.td-b3lyp_6-31+g(d).qchem.inp (generated)

030113426.td-b3lyp_6-31+g(d).gjf (generated)

030113426.td-b3lyp_6-31+g(d).firefly.inp (generated)

030113426.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030113426.mol 030113426.PUBCHEM 030113426.mol (via Jmol)
030113496.b3lyp_6-31g(d).inp

030113496.b3lyp_6-31g(d).qchem.inp (generated)

030113496.b3lyp_6-31g(d).gjf (generated)

030113496.b3lyp_6-31g(d).firefly.inp (generated)

030113496.b3lyp_6-31g(d).smash.inp (generated)

030113496.b3lyp_6-31g(d).nwchem.inp (generated) 030113496.b3lyp_6-31g(d).log.xz 030113496.td-b3lyp_6-31g+(d).inp 030113496.td-b3lyp_6-31g+(d).log.xz

030113496.td-b3lyp_6-31+g(d).qchem.inp (generated)

030113496.td-b3lyp_6-31+g(d).gjf (generated)

030113496.td-b3lyp_6-31+g(d).firefly.inp (generated)

030113496.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030113496.mol 030113496.PUBCHEM 030113496.mol (via Jmol)
030113631.b3lyp_6-31g(d).inp

030113631.b3lyp_6-31g(d).qchem.inp (generated)

030113631.b3lyp_6-31g(d).gjf (generated)

030113631.b3lyp_6-31g(d).firefly.inp (generated)

030113631.b3lyp_6-31g(d).smash.inp (generated)

030113631.b3lyp_6-31g(d).nwchem.inp (generated) 030113631.b3lyp_6-31g(d).log.xz 030113631.td-b3lyp_6-31g+(d).inp 030113631.td-b3lyp_6-31g+(d).log.xz

030113631.td-b3lyp_6-31+g(d).qchem.inp (generated)

030113631.td-b3lyp_6-31+g(d).gjf (generated)

030113631.td-b3lyp_6-31+g(d).firefly.inp (generated)

030113631.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030113631.mol 030113631.PUBCHEM 030113631.mol (via Jmol)
030113745.b3lyp_6-31g(d).inp

030113745.b3lyp_6-31g(d).qchem.inp (generated)

030113745.b3lyp_6-31g(d).gjf (generated)

030113745.b3lyp_6-31g(d).firefly.inp (generated)

030113745.b3lyp_6-31g(d).smash.inp (generated)

030113745.b3lyp_6-31g(d).nwchem.inp (generated) 030113745.b3lyp_6-31g(d).log.xz 030113745.td-b3lyp_6-31g+(d).inp 030113745.td-b3lyp_6-31g+(d).log.xz

030113745.td-b3lyp_6-31+g(d).qchem.inp (generated)

030113745.td-b3lyp_6-31+g(d).gjf (generated)

030113745.td-b3lyp_6-31+g(d).firefly.inp (generated)

030113745.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030113745.mol 030113745.PUBCHEM 030113745.mol (via Jmol)
030114069.b3lyp_6-31g(d).inp

030114069.b3lyp_6-31g(d).qchem.inp (generated)

030114069.b3lyp_6-31g(d).gjf (generated)

030114069.b3lyp_6-31g(d).firefly.inp (generated)

030114069.b3lyp_6-31g(d).smash.inp (generated)

030114069.b3lyp_6-31g(d).nwchem.inp (generated) 030114069.b3lyp_6-31g(d).log.xz 030114069.td-b3lyp_6-31g+(d).inp 030114069.td-b3lyp_6-31g+(d).log.xz

030114069.td-b3lyp_6-31+g(d).qchem.inp (generated)

030114069.td-b3lyp_6-31+g(d).gjf (generated)

030114069.td-b3lyp_6-31+g(d).firefly.inp (generated)

030114069.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030114069.mol 030114069.PUBCHEM 030114069.mol (via Jmol)
030114087.b3lyp_6-31g(d).inp

030114087.b3lyp_6-31g(d).qchem.inp (generated)

030114087.b3lyp_6-31g(d).gjf (generated)

030114087.b3lyp_6-31g(d).firefly.inp (generated)

030114087.b3lyp_6-31g(d).smash.inp (generated)

030114087.b3lyp_6-31g(d).nwchem.inp (generated) 030114087.b3lyp_6-31g(d).log.xz 030114087.td-b3lyp_6-31g+(d).inp 030114087.td-b3lyp_6-31g+(d).log.xz

030114087.td-b3lyp_6-31+g(d).qchem.inp (generated)

030114087.td-b3lyp_6-31+g(d).gjf (generated)

030114087.td-b3lyp_6-31+g(d).firefly.inp (generated)

030114087.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030114087.mol 030114087.PUBCHEM 030114087.mol (via Jmol)
030114120.b3lyp_6-31g(d).inp

030114120.b3lyp_6-31g(d).qchem.inp (generated)

030114120.b3lyp_6-31g(d).gjf (generated)

030114120.b3lyp_6-31g(d).firefly.inp (generated)

030114120.b3lyp_6-31g(d).smash.inp (generated)

030114120.b3lyp_6-31g(d).nwchem.inp (generated) 030114120.b3lyp_6-31g(d).log.xz 030114120.td-b3lyp_6-31g+(d).inp 030114120.td-b3lyp_6-31g+(d).log.xz

030114120.td-b3lyp_6-31+g(d).qchem.inp (generated)

030114120.td-b3lyp_6-31+g(d).gjf (generated)

030114120.td-b3lyp_6-31+g(d).firefly.inp (generated)

030114120.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030114120.mol 030114120.PUBCHEM 030114120.mol (via Jmol)
030114121.b3lyp_6-31g(d).inp

030114121.b3lyp_6-31g(d).qchem.inp (generated)

030114121.b3lyp_6-31g(d).gjf (generated)

030114121.b3lyp_6-31g(d).firefly.inp (generated)

030114121.b3lyp_6-31g(d).smash.inp (generated)

030114121.b3lyp_6-31g(d).nwchem.inp (generated) 030114121.b3lyp_6-31g(d).log.xz 030114121.td-b3lyp_6-31g+(d).inp 030114121.td-b3lyp_6-31g+(d).log.xz

030114121.td-b3lyp_6-31+g(d).qchem.inp (generated)

030114121.td-b3lyp_6-31+g(d).gjf (generated)

030114121.td-b3lyp_6-31+g(d).firefly.inp (generated)

030114121.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030114121.mol 030114121.PUBCHEM 030114121.mol (via Jmol)
030114124.b3lyp_6-31g(d).inp

030114124.b3lyp_6-31g(d).qchem.inp (generated)

030114124.b3lyp_6-31g(d).gjf (generated)

030114124.b3lyp_6-31g(d).firefly.inp (generated)

030114124.b3lyp_6-31g(d).smash.inp (generated)

030114124.b3lyp_6-31g(d).nwchem.inp (generated) 030114124.b3lyp_6-31g(d).log.xz 030114124.td-b3lyp_6-31g+(d).inp 030114124.td-b3lyp_6-31g+(d).log.xz

030114124.td-b3lyp_6-31+g(d).qchem.inp (generated)

030114124.td-b3lyp_6-31+g(d).gjf (generated)

030114124.td-b3lyp_6-31+g(d).firefly.inp (generated)

030114124.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030114124.mol 030114124.PUBCHEM 030114124.mol (via Jmol)
030114142.b3lyp_6-31g(d).inp

030114142.b3lyp_6-31g(d).qchem.inp (generated)

030114142.b3lyp_6-31g(d).gjf (generated)

030114142.b3lyp_6-31g(d).firefly.inp (generated)

030114142.b3lyp_6-31g(d).smash.inp (generated)

030114142.b3lyp_6-31g(d).nwchem.inp (generated) 030114142.b3lyp_6-31g(d).log.xz 030114142.td-b3lyp_6-31g+(d).inp 030114142.td-b3lyp_6-31g+(d).log.xz

030114142.td-b3lyp_6-31+g(d).qchem.inp (generated)

030114142.td-b3lyp_6-31+g(d).gjf (generated)

030114142.td-b3lyp_6-31+g(d).firefly.inp (generated)

030114142.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030114142.mol 030114142.PUBCHEM 030114142.mol (via Jmol)
030114161.b3lyp_6-31g(d).inp

030114161.b3lyp_6-31g(d).qchem.inp (generated)

030114161.b3lyp_6-31g(d).gjf (generated)

030114161.b3lyp_6-31g(d).firefly.inp (generated)

030114161.b3lyp_6-31g(d).smash.inp (generated)

030114161.b3lyp_6-31g(d).nwchem.inp (generated) 030114161.b3lyp_6-31g(d).log.xz 030114161.td-b3lyp_6-31g+(d).inp 030114161.td-b3lyp_6-31g+(d).log.xz

030114161.td-b3lyp_6-31+g(d).qchem.inp (generated)

030114161.td-b3lyp_6-31+g(d).gjf (generated)

030114161.td-b3lyp_6-31+g(d).firefly.inp (generated)

030114161.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030114161.mol 030114161.PUBCHEM 030114161.mol (via Jmol)
030114242.b3lyp_6-31g(d).inp

030114242.b3lyp_6-31g(d).qchem.inp (generated)

030114242.b3lyp_6-31g(d).gjf (generated)

030114242.b3lyp_6-31g(d).firefly.inp (generated)

030114242.b3lyp_6-31g(d).smash.inp (generated)

030114242.b3lyp_6-31g(d).nwchem.inp (generated) 030114242.b3lyp_6-31g(d).log.xz 030114242.mol 030114242.PUBCHEM 030114242.mol (via Jmol)
030114244.b3lyp_6-31g(d).inp

030114244.b3lyp_6-31g(d).qchem.inp (generated)

030114244.b3lyp_6-31g(d).gjf (generated)

030114244.b3lyp_6-31g(d).firefly.inp (generated)

030114244.b3lyp_6-31g(d).smash.inp (generated)

030114244.b3lyp_6-31g(d).nwchem.inp (generated) 030114244.b3lyp_6-31g(d).log.xz 030114244.mol 030114244.PUBCHEM 030114244.mol (via Jmol)
030114360.b3lyp_6-31g(d).inp

030114360.b3lyp_6-31g(d).qchem.inp (generated)

030114360.b3lyp_6-31g(d).gjf (generated)

030114360.b3lyp_6-31g(d).firefly.inp (generated)

030114360.b3lyp_6-31g(d).smash.inp (generated)

030114360.b3lyp_6-31g(d).nwchem.inp (generated) 030114360.b3lyp_6-31g(d).log.xz 030114360.td-b3lyp_6-31g+(d).inp 030114360.td-b3lyp_6-31g+(d).log.xz

030114360.td-b3lyp_6-31+g(d).qchem.inp (generated)

030114360.td-b3lyp_6-31+g(d).gjf (generated)

030114360.td-b3lyp_6-31+g(d).firefly.inp (generated)

030114360.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030114360.mol 030114360.PUBCHEM 030114360.mol (via Jmol)
030114361.b3lyp_6-31g(d).inp

030114361.b3lyp_6-31g(d).qchem.inp (generated)

030114361.b3lyp_6-31g(d).gjf (generated)

030114361.b3lyp_6-31g(d).firefly.inp (generated)

030114361.b3lyp_6-31g(d).smash.inp (generated)

030114361.b3lyp_6-31g(d).nwchem.inp (generated) 030114361.b3lyp_6-31g(d).log.xz 030114361.td-b3lyp_6-31g+(d).inp 030114361.td-b3lyp_6-31g+(d).log.xz

030114361.td-b3lyp_6-31+g(d).qchem.inp (generated)

030114361.td-b3lyp_6-31+g(d).gjf (generated)

030114361.td-b3lyp_6-31+g(d).firefly.inp (generated)

030114361.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030114361.mol 030114361.PUBCHEM 030114361.mol (via Jmol)
030114363.b3lyp_6-31g(d).inp

030114363.b3lyp_6-31g(d).qchem.inp (generated)

030114363.b3lyp_6-31g(d).gjf (generated)

030114363.b3lyp_6-31g(d).firefly.inp (generated)

030114363.b3lyp_6-31g(d).smash.inp (generated)

030114363.b3lyp_6-31g(d).nwchem.inp (generated) 030114363.b3lyp_6-31g(d).log.xz 030114363.td-b3lyp_6-31g+(d).inp 030114363.td-b3lyp_6-31g+(d).log.xz

030114363.td-b3lyp_6-31+g(d).qchem.inp (generated)

030114363.td-b3lyp_6-31+g(d).gjf (generated)

030114363.td-b3lyp_6-31+g(d).firefly.inp (generated)

030114363.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030114363.mol 030114363.PUBCHEM 030114363.mol (via Jmol)
030114364.b3lyp_6-31g(d).inp

030114364.b3lyp_6-31g(d).qchem.inp (generated)

030114364.b3lyp_6-31g(d).gjf (generated)

030114364.b3lyp_6-31g(d).firefly.inp (generated)

030114364.b3lyp_6-31g(d).smash.inp (generated)

030114364.b3lyp_6-31g(d).nwchem.inp (generated) 030114364.b3lyp_6-31g(d).log.xz 030114364.td-b3lyp_6-31g+(d).inp 030114364.td-b3lyp_6-31g+(d).log.xz

030114364.td-b3lyp_6-31+g(d).qchem.inp (generated)

030114364.td-b3lyp_6-31+g(d).gjf (generated)

030114364.td-b3lyp_6-31+g(d).firefly.inp (generated)

030114364.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030114364.mol 030114364.PUBCHEM 030114364.mol (via Jmol)
030114374.b3lyp_6-31g(d).inp

030114374.b3lyp_6-31g(d).qchem.inp (generated)

030114374.b3lyp_6-31g(d).gjf (generated)

030114374.b3lyp_6-31g(d).firefly.inp (generated)

030114374.b3lyp_6-31g(d).smash.inp (generated)

030114374.b3lyp_6-31g(d).nwchem.inp (generated) 030114374.b3lyp_6-31g(d).log.xz 030114374.td-b3lyp_6-31g+(d).inp 030114374.td-b3lyp_6-31g+(d).log.xz

030114374.td-b3lyp_6-31+g(d).qchem.inp (generated)

030114374.td-b3lyp_6-31+g(d).gjf (generated)

030114374.td-b3lyp_6-31+g(d).firefly.inp (generated)

030114374.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030114374.mol 030114374.PUBCHEM 030114374.mol (via Jmol)
030114379.b3lyp_6-31g(d).inp

030114379.b3lyp_6-31g(d).qchem.inp (generated)

030114379.b3lyp_6-31g(d).gjf (generated)

030114379.b3lyp_6-31g(d).firefly.inp (generated)

030114379.b3lyp_6-31g(d).smash.inp (generated)

030114379.b3lyp_6-31g(d).nwchem.inp (generated) 030114379.b3lyp_6-31g(d).log.xz 030114379.mol 030114379.PUBCHEM 030114379.mol (via Jmol)
030114381.b3lyp_6-31g(d).inp

030114381.b3lyp_6-31g(d).qchem.inp (generated)

030114381.b3lyp_6-31g(d).gjf (generated)

030114381.b3lyp_6-31g(d).firefly.inp (generated)

030114381.b3lyp_6-31g(d).smash.inp (generated)

030114381.b3lyp_6-31g(d).nwchem.inp (generated) 030114381.b3lyp_6-31g(d).log.xz 030114381.td-b3lyp_6-31g+(d).inp 030114381.td-b3lyp_6-31g+(d).log.xz

030114381.td-b3lyp_6-31+g(d).qchem.inp (generated)

030114381.td-b3lyp_6-31+g(d).gjf (generated)

030114381.td-b3lyp_6-31+g(d).firefly.inp (generated)

030114381.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030114381.mol 030114381.PUBCHEM 030114381.mol (via Jmol)
030114382.b3lyp_6-31g(d).inp

030114382.b3lyp_6-31g(d).qchem.inp (generated)

030114382.b3lyp_6-31g(d).gjf (generated)

030114382.b3lyp_6-31g(d).firefly.inp (generated)

030114382.b3lyp_6-31g(d).smash.inp (generated)

030114382.b3lyp_6-31g(d).nwchem.inp (generated) 030114382.b3lyp_6-31g(d).log.xz 030114382.mol 030114382.PUBCHEM 030114382.mol (via Jmol)
030114627.b3lyp_6-31g(d).inp

030114627.b3lyp_6-31g(d).qchem.inp (generated)

030114627.b3lyp_6-31g(d).gjf (generated)

030114627.b3lyp_6-31g(d).firefly.inp (generated)

030114627.b3lyp_6-31g(d).smash.inp (generated)

030114627.b3lyp_6-31g(d).nwchem.inp (generated) 030114627.b3lyp_6-31g(d).log.xz 030114627.td-b3lyp_6-31g+(d).inp 030114627.td-b3lyp_6-31g+(d).log.xz

030114627.td-b3lyp_6-31+g(d).qchem.inp (generated)

030114627.td-b3lyp_6-31+g(d).gjf (generated)

030114627.td-b3lyp_6-31+g(d).firefly.inp (generated)

030114627.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030114627.mol 030114627.PUBCHEM 030114627.mol (via Jmol)
030114751.b3lyp_6-31g(d).inp

030114751.b3lyp_6-31g(d).qchem.inp (generated)

030114751.b3lyp_6-31g(d).gjf (generated)

030114751.b3lyp_6-31g(d).firefly.inp (generated)

030114751.b3lyp_6-31g(d).smash.inp (generated)

030114751.b3lyp_6-31g(d).nwchem.inp (generated) 030114751.b3lyp_6-31g(d).log.xz 030114751.td-b3lyp_6-31g+(d).inp 030114751.td-b3lyp_6-31g+(d).log.xz

030114751.td-b3lyp_6-31+g(d).qchem.inp (generated)

030114751.td-b3lyp_6-31+g(d).gjf (generated)

030114751.td-b3lyp_6-31+g(d).firefly.inp (generated)

030114751.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030114751.mol 030114751.PUBCHEM 030114751.mol (via Jmol)
030114754.b3lyp_6-31g(d).inp

030114754.b3lyp_6-31g(d).qchem.inp (generated)

030114754.b3lyp_6-31g(d).gjf (generated)

030114754.b3lyp_6-31g(d).firefly.inp (generated)

030114754.b3lyp_6-31g(d).smash.inp (generated)

030114754.b3lyp_6-31g(d).nwchem.inp (generated) 030114754.b3lyp_6-31g(d).log.xz 030114754.td-b3lyp_6-31g+(d).inp 030114754.td-b3lyp_6-31g+(d).log.xz

030114754.td-b3lyp_6-31+g(d).qchem.inp (generated)

030114754.td-b3lyp_6-31+g(d).gjf (generated)

030114754.td-b3lyp_6-31+g(d).firefly.inp (generated)

030114754.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030114754.mol 030114754.PUBCHEM 030114754.mol (via Jmol)
030114907.b3lyp_6-31g(d).inp

030114907.b3lyp_6-31g(d).qchem.inp (generated)

030114907.b3lyp_6-31g(d).gjf (generated)

030114907.b3lyp_6-31g(d).firefly.inp (generated)

030114907.b3lyp_6-31g(d).smash.inp (generated)

030114907.b3lyp_6-31g(d).nwchem.inp (generated) 030114907.b3lyp_6-31g(d).log.xz 030114907.td-b3lyp_6-31g+(d).inp 030114907.td-b3lyp_6-31g+(d).log.xz

030114907.td-b3lyp_6-31+g(d).qchem.inp (generated)

030114907.td-b3lyp_6-31+g(d).gjf (generated)

030114907.td-b3lyp_6-31+g(d).firefly.inp (generated)

030114907.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030114907.mol 030114907.PUBCHEM 030114907.mol (via Jmol)
030114908.b3lyp_6-31g(d).inp

030114908.b3lyp_6-31g(d).qchem.inp (generated)

030114908.b3lyp_6-31g(d).gjf (generated)

030114908.b3lyp_6-31g(d).firefly.inp (generated)

030114908.b3lyp_6-31g(d).smash.inp (generated)

030114908.b3lyp_6-31g(d).nwchem.inp (generated) 030114908.b3lyp_6-31g(d).log.xz 030114908.td-b3lyp_6-31g+(d).inp 030114908.td-b3lyp_6-31g+(d).log.xz

030114908.td-b3lyp_6-31+g(d).qchem.inp (generated)

030114908.td-b3lyp_6-31+g(d).gjf (generated)

030114908.td-b3lyp_6-31+g(d).firefly.inp (generated)

030114908.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030114908.mol 030114908.PUBCHEM 030114908.mol (via Jmol)
030114911.b3lyp_6-31g(d).inp

030114911.b3lyp_6-31g(d).qchem.inp (generated)

030114911.b3lyp_6-31g(d).gjf (generated)

030114911.b3lyp_6-31g(d).firefly.inp (generated)

030114911.b3lyp_6-31g(d).smash.inp (generated)

030114911.b3lyp_6-31g(d).nwchem.inp (generated) 030114911.b3lyp_6-31g(d).log.xz 030114911.td-b3lyp_6-31g+(d).inp 030114911.td-b3lyp_6-31g+(d).log.xz

030114911.td-b3lyp_6-31+g(d).qchem.inp (generated)

030114911.td-b3lyp_6-31+g(d).gjf (generated)

030114911.td-b3lyp_6-31+g(d).firefly.inp (generated)

030114911.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030114911.mol 030114911.PUBCHEM 030114911.mol (via Jmol)
030114912.b3lyp_6-31g(d).inp

030114912.b3lyp_6-31g(d).qchem.inp (generated)

030114912.b3lyp_6-31g(d).gjf (generated)

030114912.b3lyp_6-31g(d).firefly.inp (generated)

030114912.b3lyp_6-31g(d).smash.inp (generated)

030114912.b3lyp_6-31g(d).nwchem.inp (generated) 030114912.b3lyp_6-31g(d).log.xz 030114912.td-b3lyp_6-31g+(d).inp 030114912.td-b3lyp_6-31g+(d).log.xz

030114912.td-b3lyp_6-31+g(d).qchem.inp (generated)

030114912.td-b3lyp_6-31+g(d).gjf (generated)

030114912.td-b3lyp_6-31+g(d).firefly.inp (generated)

030114912.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030114912.mol 030114912.PUBCHEM 030114912.mol (via Jmol)
030115027.b3lyp_6-31g(d).inp

030115027.b3lyp_6-31g(d).qchem.inp (generated)

030115027.b3lyp_6-31g(d).gjf (generated)

030115027.b3lyp_6-31g(d).firefly.inp (generated)

030115027.b3lyp_6-31g(d).smash.inp (generated)

030115027.b3lyp_6-31g(d).nwchem.inp (generated) 030115027.b3lyp_6-31g(d).log.xz 030115027.td-b3lyp_6-31g+(d).inp 030115027.td-b3lyp_6-31g+(d).log.xz

030115027.td-b3lyp_6-31+g(d).qchem.inp (generated)

030115027.td-b3lyp_6-31+g(d).gjf (generated)

030115027.td-b3lyp_6-31+g(d).firefly.inp (generated)

030115027.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030115027.mol 030115027.PUBCHEM 030115027.mol (via Jmol)
030115072.b3lyp_6-31g(d).inp

030115072.b3lyp_6-31g(d).qchem.inp (generated)

030115072.b3lyp_6-31g(d).gjf (generated)

030115072.b3lyp_6-31g(d).firefly.inp (generated)

030115072.b3lyp_6-31g(d).smash.inp (generated)

030115072.b3lyp_6-31g(d).nwchem.inp (generated) 030115072.b3lyp_6-31g(d).log.xz 030115072.td-b3lyp_6-31g+(d).inp 030115072.td-b3lyp_6-31g+(d).log.xz

030115072.td-b3lyp_6-31+g(d).qchem.inp (generated)

030115072.td-b3lyp_6-31+g(d).gjf (generated)

030115072.td-b3lyp_6-31+g(d).firefly.inp (generated)

030115072.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030115072.mol 030115072.PUBCHEM 030115072.mol (via Jmol)
030115197.b3lyp_6-31g(d).inp

030115197.b3lyp_6-31g(d).qchem.inp (generated)

030115197.b3lyp_6-31g(d).gjf (generated)

030115197.b3lyp_6-31g(d).firefly.inp (generated)

030115197.b3lyp_6-31g(d).smash.inp (generated)

030115197.b3lyp_6-31g(d).nwchem.inp (generated) 030115197.b3lyp_6-31g(d).log.xz 030115197.td-b3lyp_6-31g+(d).inp 030115197.td-b3lyp_6-31g+(d).log.xz

030115197.td-b3lyp_6-31+g(d).qchem.inp (generated)

030115197.td-b3lyp_6-31+g(d).gjf (generated)

030115197.td-b3lyp_6-31+g(d).firefly.inp (generated)

030115197.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030115197.mol 030115197.PUBCHEM 030115197.mol (via Jmol)
030115204.b3lyp_6-31g(d).inp

030115204.b3lyp_6-31g(d).qchem.inp (generated)

030115204.b3lyp_6-31g(d).gjf (generated)

030115204.b3lyp_6-31g(d).firefly.inp (generated)

030115204.b3lyp_6-31g(d).smash.inp (generated)

030115204.b3lyp_6-31g(d).nwchem.inp (generated) 030115204.b3lyp_6-31g(d).log.xz 030115204.mol 030115204.PUBCHEM 030115204.mol (via Jmol)
030115327.b3lyp_6-31g(d).inp

030115327.b3lyp_6-31g(d).qchem.inp (generated)

030115327.b3lyp_6-31g(d).gjf (generated)

030115327.b3lyp_6-31g(d).firefly.inp (generated)

030115327.b3lyp_6-31g(d).smash.inp (generated)

030115327.b3lyp_6-31g(d).nwchem.inp (generated) 030115327.b3lyp_6-31g(d).log.xz 030115327.mol 030115327.PUBCHEM 030115327.mol (via Jmol)
030115330.b3lyp_6-31g(d).inp

030115330.b3lyp_6-31g(d).qchem.inp (generated)

030115330.b3lyp_6-31g(d).gjf (generated)

030115330.b3lyp_6-31g(d).firefly.inp (generated)

030115330.b3lyp_6-31g(d).smash.inp (generated)

030115330.b3lyp_6-31g(d).nwchem.inp (generated) 030115330.b3lyp_6-31g(d).log.xz 030115330.mol 030115330.PUBCHEM 030115330.mol (via Jmol)
030115397.b3lyp_6-31g(d).inp

030115397.b3lyp_6-31g(d).qchem.inp (generated)

030115397.b3lyp_6-31g(d).gjf (generated)

030115397.b3lyp_6-31g(d).firefly.inp (generated)

030115397.b3lyp_6-31g(d).smash.inp (generated)

030115397.b3lyp_6-31g(d).nwchem.inp (generated) 030115397.b3lyp_6-31g(d).log.xz 030115397.td-b3lyp_6-31g+(d).inp 030115397.td-b3lyp_6-31g+(d).log.xz

030115397.td-b3lyp_6-31+g(d).qchem.inp (generated)

030115397.td-b3lyp_6-31+g(d).gjf (generated)

030115397.td-b3lyp_6-31+g(d).firefly.inp (generated)

030115397.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030115397.mol 030115397.PUBCHEM 030115397.mol (via Jmol)
030115680.b3lyp_6-31g(d).inp

030115680.b3lyp_6-31g(d).qchem.inp (generated)

030115680.b3lyp_6-31g(d).gjf (generated)

030115680.b3lyp_6-31g(d).firefly.inp (generated)

030115680.b3lyp_6-31g(d).smash.inp (generated)

030115680.b3lyp_6-31g(d).nwchem.inp (generated) 030115680.b3lyp_6-31g(d).log.xz 030115680.td-b3lyp_6-31g+(d).inp 030115680.td-b3lyp_6-31g+(d).log.xz

030115680.td-b3lyp_6-31+g(d).qchem.inp (generated)

030115680.td-b3lyp_6-31+g(d).gjf (generated)

030115680.td-b3lyp_6-31+g(d).firefly.inp (generated)

030115680.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030115680.mol 030115680.PUBCHEM 030115680.mol (via Jmol)
030115687.b3lyp_6-31g(d).inp

030115687.b3lyp_6-31g(d).qchem.inp (generated)

030115687.b3lyp_6-31g(d).gjf (generated)

030115687.b3lyp_6-31g(d).firefly.inp (generated)

030115687.b3lyp_6-31g(d).smash.inp (generated)

030115687.b3lyp_6-31g(d).nwchem.inp (generated) 030115687.b3lyp_6-31g(d).log.xz 030115687.td-b3lyp_6-31g+(d).inp 030115687.td-b3lyp_6-31g+(d).log.xz

030115687.td-b3lyp_6-31+g(d).qchem.inp (generated)

030115687.td-b3lyp_6-31+g(d).gjf (generated)

030115687.td-b3lyp_6-31+g(d).firefly.inp (generated)

030115687.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030115687.mol 030115687.PUBCHEM 030115687.mol (via Jmol)
030115690.b3lyp_6-31g(d).inp

030115690.b3lyp_6-31g(d).qchem.inp (generated)

030115690.b3lyp_6-31g(d).gjf (generated)

030115690.b3lyp_6-31g(d).firefly.inp (generated)

030115690.b3lyp_6-31g(d).smash.inp (generated)

030115690.b3lyp_6-31g(d).nwchem.inp (generated) 030115690.b3lyp_6-31g(d).log.xz 030115690.td-b3lyp_6-31g+(d).inp 030115690.td-b3lyp_6-31g+(d).log.xz

030115690.td-b3lyp_6-31+g(d).qchem.inp (generated)

030115690.td-b3lyp_6-31+g(d).gjf (generated)

030115690.td-b3lyp_6-31+g(d).firefly.inp (generated)

030115690.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030115690.mol 030115690.PUBCHEM 030115690.mol (via Jmol)
030115707.b3lyp_6-31g(d).inp

030115707.b3lyp_6-31g(d).qchem.inp (generated)

030115707.b3lyp_6-31g(d).gjf (generated)

030115707.b3lyp_6-31g(d).firefly.inp (generated)

030115707.b3lyp_6-31g(d).smash.inp (generated)

030115707.b3lyp_6-31g(d).nwchem.inp (generated) 030115707.b3lyp_6-31g(d).log.xz 030115707.td-b3lyp_6-31g+(d).inp 030115707.td-b3lyp_6-31g+(d).log.xz

030115707.td-b3lyp_6-31+g(d).qchem.inp (generated)

030115707.td-b3lyp_6-31+g(d).gjf (generated)

030115707.td-b3lyp_6-31+g(d).firefly.inp (generated)

030115707.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030115707.mol 030115707.PUBCHEM 030115707.mol (via Jmol)
030115728.b3lyp_6-31g(d).inp

030115728.b3lyp_6-31g(d).qchem.inp (generated)

030115728.b3lyp_6-31g(d).gjf (generated)

030115728.b3lyp_6-31g(d).firefly.inp (generated)

030115728.b3lyp_6-31g(d).smash.inp (generated)

030115728.b3lyp_6-31g(d).nwchem.inp (generated) 030115728.b3lyp_6-31g(d).log.xz 030115728.td-b3lyp_6-31g+(d).inp 030115728.td-b3lyp_6-31g+(d).log.xz

030115728.td-b3lyp_6-31+g(d).qchem.inp (generated)

030115728.td-b3lyp_6-31+g(d).gjf (generated)

030115728.td-b3lyp_6-31+g(d).firefly.inp (generated)

030115728.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030115728.mol 030115728.PUBCHEM 030115728.mol (via Jmol)
030115730.b3lyp_6-31g(d).inp

030115730.b3lyp_6-31g(d).qchem.inp (generated)

030115730.b3lyp_6-31g(d).gjf (generated)

030115730.b3lyp_6-31g(d).firefly.inp (generated)

030115730.b3lyp_6-31g(d).smash.inp (generated)

030115730.b3lyp_6-31g(d).nwchem.inp (generated) 030115730.b3lyp_6-31g(d).log.xz 030115730.td-b3lyp_6-31g+(d).inp 030115730.td-b3lyp_6-31g+(d).log.xz

030115730.td-b3lyp_6-31+g(d).qchem.inp (generated)

030115730.td-b3lyp_6-31+g(d).gjf (generated)

030115730.td-b3lyp_6-31+g(d).firefly.inp (generated)

030115730.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030115730.mol 030115730.PUBCHEM 030115730.mol (via Jmol)
030115882.b3lyp_6-31g(d).inp

030115882.b3lyp_6-31g(d).qchem.inp (generated)

030115882.b3lyp_6-31g(d).gjf (generated)

030115882.b3lyp_6-31g(d).firefly.inp (generated)

030115882.b3lyp_6-31g(d).smash.inp (generated)

030115882.b3lyp_6-31g(d).nwchem.inp (generated) 030115882.b3lyp_6-31g(d).log.xz 030115882.td-b3lyp_6-31g+(d).inp 030115882.td-b3lyp_6-31g+(d).log.xz

030115882.td-b3lyp_6-31+g(d).qchem.inp (generated)

030115882.td-b3lyp_6-31+g(d).gjf (generated)

030115882.td-b3lyp_6-31+g(d).firefly.inp (generated)

030115882.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030115882.mol 030115882.PUBCHEM 030115882.mol (via Jmol)
030115891.b3lyp_6-31g(d).inp

030115891.b3lyp_6-31g(d).qchem.inp (generated)

030115891.b3lyp_6-31g(d).gjf (generated)

030115891.b3lyp_6-31g(d).firefly.inp (generated)

030115891.b3lyp_6-31g(d).smash.inp (generated)

030115891.b3lyp_6-31g(d).nwchem.inp (generated) 030115891.b3lyp_6-31g(d).log.xz 030115891.td-b3lyp_6-31g+(d).inp 030115891.td-b3lyp_6-31g+(d).log.xz

030115891.td-b3lyp_6-31+g(d).qchem.inp (generated)

030115891.td-b3lyp_6-31+g(d).gjf (generated)

030115891.td-b3lyp_6-31+g(d).firefly.inp (generated)

030115891.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030115891.mol 030115891.PUBCHEM 030115891.mol (via Jmol)
030115893.b3lyp_6-31g(d).inp

030115893.b3lyp_6-31g(d).qchem.inp (generated)

030115893.b3lyp_6-31g(d).gjf (generated)

030115893.b3lyp_6-31g(d).firefly.inp (generated)

030115893.b3lyp_6-31g(d).smash.inp (generated)

030115893.b3lyp_6-31g(d).nwchem.inp (generated) 030115893.b3lyp_6-31g(d).log.xz 030115893.td-b3lyp_6-31g+(d).inp 030115893.td-b3lyp_6-31g+(d).log.xz

030115893.td-b3lyp_6-31+g(d).qchem.inp (generated)

030115893.td-b3lyp_6-31+g(d).gjf (generated)

030115893.td-b3lyp_6-31+g(d).firefly.inp (generated)

030115893.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030115893.mol 030115893.PUBCHEM 030115893.mol (via Jmol)
030115985.b3lyp_6-31g(d).inp

030115985.b3lyp_6-31g(d).qchem.inp (generated)

030115985.b3lyp_6-31g(d).gjf (generated)

030115985.b3lyp_6-31g(d).firefly.inp (generated)

030115985.b3lyp_6-31g(d).smash.inp (generated)

030115985.b3lyp_6-31g(d).nwchem.inp (generated) 030115985.b3lyp_6-31g(d).log.xz 030115985.mol 030115985.PUBCHEM 030115985.mol (via Jmol)
030115989.b3lyp_6-31g(d).inp

030115989.b3lyp_6-31g(d).qchem.inp (generated)

030115989.b3lyp_6-31g(d).gjf (generated)

030115989.b3lyp_6-31g(d).firefly.inp (generated)

030115989.b3lyp_6-31g(d).smash.inp (generated)

030115989.b3lyp_6-31g(d).nwchem.inp (generated) 030115989.b3lyp_6-31g(d).log.xz 030115989.mol 030115989.PUBCHEM 030115989.mol (via Jmol)
030116055.b3lyp_6-31g(d).inp

030116055.b3lyp_6-31g(d).qchem.inp (generated)

030116055.b3lyp_6-31g(d).gjf (generated)

030116055.b3lyp_6-31g(d).firefly.inp (generated)

030116055.b3lyp_6-31g(d).smash.inp (generated)

030116055.b3lyp_6-31g(d).nwchem.inp (generated) 030116055.b3lyp_6-31g(d).log.xz 030116055.td-b3lyp_6-31g+(d).inp 030116055.td-b3lyp_6-31g+(d).log.xz

030116055.td-b3lyp_6-31+g(d).qchem.inp (generated)

030116055.td-b3lyp_6-31+g(d).gjf (generated)

030116055.td-b3lyp_6-31+g(d).firefly.inp (generated)

030116055.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030116055.mol 030116055.PUBCHEM 030116055.mol (via Jmol)
030116124.b3lyp_6-31g(d).inp

030116124.b3lyp_6-31g(d).qchem.inp (generated)

030116124.b3lyp_6-31g(d).gjf (generated)

030116124.b3lyp_6-31g(d).firefly.inp (generated)

030116124.b3lyp_6-31g(d).smash.inp (generated)

030116124.b3lyp_6-31g(d).nwchem.inp (generated) 030116124.b3lyp_6-31g(d).log.xz 030116124.td-b3lyp_6-31g+(d).inp 030116124.td-b3lyp_6-31g+(d).log.xz

030116124.td-b3lyp_6-31+g(d).qchem.inp (generated)

030116124.td-b3lyp_6-31+g(d).gjf (generated)

030116124.td-b3lyp_6-31+g(d).firefly.inp (generated)

030116124.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030116124.mol 030116124.PUBCHEM 030116124.mol (via Jmol)
030116190.b3lyp_6-31g(d).inp

030116190.b3lyp_6-31g(d).qchem.inp (generated)

030116190.b3lyp_6-31g(d).gjf (generated)

030116190.b3lyp_6-31g(d).firefly.inp (generated)

030116190.b3lyp_6-31g(d).smash.inp (generated)

030116190.b3lyp_6-31g(d).nwchem.inp (generated) 030116190.b3lyp_6-31g(d).log.xz 030116190.td-b3lyp_6-31g+(d).inp 030116190.td-b3lyp_6-31g+(d).log.xz

030116190.td-b3lyp_6-31+g(d).qchem.inp (generated)

030116190.td-b3lyp_6-31+g(d).gjf (generated)

030116190.td-b3lyp_6-31+g(d).firefly.inp (generated)

030116190.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030116190.mol 030116190.PUBCHEM 030116190.mol (via Jmol)
030116204.b3lyp_6-31g(d).inp

030116204.b3lyp_6-31g(d).qchem.inp (generated)

030116204.b3lyp_6-31g(d).gjf (generated)

030116204.b3lyp_6-31g(d).firefly.inp (generated)

030116204.b3lyp_6-31g(d).smash.inp (generated)

030116204.b3lyp_6-31g(d).nwchem.inp (generated) 030116204.b3lyp_6-31g(d).log.xz 030116204.td-b3lyp_6-31g+(d).inp 030116204.td-b3lyp_6-31g+(d).log.xz

030116204.td-b3lyp_6-31+g(d).qchem.inp (generated)

030116204.td-b3lyp_6-31+g(d).gjf (generated)

030116204.td-b3lyp_6-31+g(d).firefly.inp (generated)

030116204.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030116204.mol 030116204.PUBCHEM 030116204.mol (via Jmol)
030116269.b3lyp_6-31g(d).inp

030116269.b3lyp_6-31g(d).qchem.inp (generated)

030116269.b3lyp_6-31g(d).gjf (generated)

030116269.b3lyp_6-31g(d).firefly.inp (generated)

030116269.b3lyp_6-31g(d).smash.inp (generated)

030116269.b3lyp_6-31g(d).nwchem.inp (generated) 030116269.b3lyp_6-31g(d).log.xz 030116269.td-b3lyp_6-31g+(d).inp 030116269.td-b3lyp_6-31g+(d).log.xz

030116269.td-b3lyp_6-31+g(d).qchem.inp (generated)

030116269.td-b3lyp_6-31+g(d).gjf (generated)

030116269.td-b3lyp_6-31+g(d).firefly.inp (generated)

030116269.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030116269.mol 030116269.PUBCHEM 030116269.mol (via Jmol)
030116285.b3lyp_6-31g(d).inp

030116285.b3lyp_6-31g(d).qchem.inp (generated)

030116285.b3lyp_6-31g(d).gjf (generated)

030116285.b3lyp_6-31g(d).firefly.inp (generated)

030116285.b3lyp_6-31g(d).smash.inp (generated)

030116285.b3lyp_6-31g(d).nwchem.inp (generated) 030116285.b3lyp_6-31g(d).log.xz 030116285.td-b3lyp_6-31g+(d).inp 030116285.td-b3lyp_6-31g+(d).log.xz

030116285.td-b3lyp_6-31+g(d).qchem.inp (generated)

030116285.td-b3lyp_6-31+g(d).gjf (generated)

030116285.td-b3lyp_6-31+g(d).firefly.inp (generated)

030116285.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030116285.mol 030116285.PUBCHEM 030116285.mol (via Jmol)
030116565.b3lyp_6-31g(d).inp

030116565.b3lyp_6-31g(d).qchem.inp (generated)

030116565.b3lyp_6-31g(d).gjf (generated)

030116565.b3lyp_6-31g(d).firefly.inp (generated)

030116565.b3lyp_6-31g(d).smash.inp (generated)

030116565.b3lyp_6-31g(d).nwchem.inp (generated) 030116565.b3lyp_6-31g(d).log.xz 030116565.td-b3lyp_6-31g+(d).inp 030116565.td-b3lyp_6-31g+(d).log.xz

030116565.td-b3lyp_6-31+g(d).qchem.inp (generated)

030116565.td-b3lyp_6-31+g(d).gjf (generated)

030116565.td-b3lyp_6-31+g(d).firefly.inp (generated)

030116565.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030116565.mol 030116565.PUBCHEM 030116565.mol (via Jmol)
030116566.b3lyp_6-31g(d).inp

030116566.b3lyp_6-31g(d).qchem.inp (generated)

030116566.b3lyp_6-31g(d).gjf (generated)

030116566.b3lyp_6-31g(d).firefly.inp (generated)

030116566.b3lyp_6-31g(d).smash.inp (generated)

030116566.b3lyp_6-31g(d).nwchem.inp (generated) 030116566.b3lyp_6-31g(d).log.xz 030116566.td-b3lyp_6-31g+(d).inp 030116566.td-b3lyp_6-31g+(d).log.xz

030116566.td-b3lyp_6-31+g(d).qchem.inp (generated)

030116566.td-b3lyp_6-31+g(d).gjf (generated)

030116566.td-b3lyp_6-31+g(d).firefly.inp (generated)

030116566.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030116566.mol 030116566.PUBCHEM 030116566.mol (via Jmol)
030116569.b3lyp_6-31g(d).inp

030116569.b3lyp_6-31g(d).qchem.inp (generated)

030116569.b3lyp_6-31g(d).gjf (generated)

030116569.b3lyp_6-31g(d).firefly.inp (generated)

030116569.b3lyp_6-31g(d).smash.inp (generated)

030116569.b3lyp_6-31g(d).nwchem.inp (generated) 030116569.b3lyp_6-31g(d).log.xz 030116569.td-b3lyp_6-31g+(d).inp 030116569.td-b3lyp_6-31g+(d).log.xz

030116569.td-b3lyp_6-31+g(d).qchem.inp (generated)

030116569.td-b3lyp_6-31+g(d).gjf (generated)

030116569.td-b3lyp_6-31+g(d).firefly.inp (generated)

030116569.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030116569.mol 030116569.PUBCHEM 030116569.mol (via Jmol)
030116572.b3lyp_6-31g(d).inp

030116572.b3lyp_6-31g(d).qchem.inp (generated)

030116572.b3lyp_6-31g(d).gjf (generated)

030116572.b3lyp_6-31g(d).firefly.inp (generated)

030116572.b3lyp_6-31g(d).smash.inp (generated)

030116572.b3lyp_6-31g(d).nwchem.inp (generated) 030116572.b3lyp_6-31g(d).log.xz 030116572.td-b3lyp_6-31g+(d).inp 030116572.td-b3lyp_6-31g+(d).log.xz

030116572.td-b3lyp_6-31+g(d).qchem.inp (generated)

030116572.td-b3lyp_6-31+g(d).gjf (generated)

030116572.td-b3lyp_6-31+g(d).firefly.inp (generated)

030116572.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030116572.mol 030116572.PUBCHEM 030116572.mol (via Jmol)
030116874.b3lyp_6-31g(d).inp

030116874.b3lyp_6-31g(d).qchem.inp (generated)

030116874.b3lyp_6-31g(d).gjf (generated)

030116874.b3lyp_6-31g(d).firefly.inp (generated)

030116874.b3lyp_6-31g(d).smash.inp (generated)

030116874.b3lyp_6-31g(d).nwchem.inp (generated) 030116874.b3lyp_6-31g(d).log.xz 030116874.mol 030116874.PUBCHEM 030116874.mol (via Jmol)
030116971.b3lyp_6-31g(d).inp

030116971.b3lyp_6-31g(d).qchem.inp (generated)

030116971.b3lyp_6-31g(d).gjf (generated)

030116971.b3lyp_6-31g(d).firefly.inp (generated)

030116971.b3lyp_6-31g(d).smash.inp (generated)

030116971.b3lyp_6-31g(d).nwchem.inp (generated) 030116971.b3lyp_6-31g(d).log.xz 030116971.td-b3lyp_6-31g+(d).inp 030116971.td-b3lyp_6-31g+(d).log.xz

030116971.td-b3lyp_6-31+g(d).qchem.inp (generated)

030116971.td-b3lyp_6-31+g(d).gjf (generated)

030116971.td-b3lyp_6-31+g(d).firefly.inp (generated)

030116971.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030116971.mol 030116971.PUBCHEM 030116971.mol (via Jmol)
030116977.b3lyp_6-31g(d).inp

030116977.b3lyp_6-31g(d).qchem.inp (generated)

030116977.b3lyp_6-31g(d).gjf (generated)

030116977.b3lyp_6-31g(d).firefly.inp (generated)

030116977.b3lyp_6-31g(d).smash.inp (generated)

030116977.b3lyp_6-31g(d).nwchem.inp (generated) 030116977.b3lyp_6-31g(d).log.xz 030116977.td-b3lyp_6-31g+(d).inp 030116977.td-b3lyp_6-31g+(d).log.xz

030116977.td-b3lyp_6-31+g(d).qchem.inp (generated)

030116977.td-b3lyp_6-31+g(d).gjf (generated)

030116977.td-b3lyp_6-31+g(d).firefly.inp (generated)

030116977.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030116977.mol 030116977.PUBCHEM 030116977.mol (via Jmol)
030117273.b3lyp_6-31g(d).inp

030117273.b3lyp_6-31g(d).qchem.inp (generated)

030117273.b3lyp_6-31g(d).gjf (generated)

030117273.b3lyp_6-31g(d).firefly.inp (generated)

030117273.b3lyp_6-31g(d).smash.inp (generated)

030117273.b3lyp_6-31g(d).nwchem.inp (generated) 030117273.b3lyp_6-31g(d).log.xz 030117273.td-b3lyp_6-31g+(d).inp 030117273.td-b3lyp_6-31g+(d).log.xz

030117273.td-b3lyp_6-31+g(d).qchem.inp (generated)

030117273.td-b3lyp_6-31+g(d).gjf (generated)

030117273.td-b3lyp_6-31+g(d).firefly.inp (generated)

030117273.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030117273.mol 030117273.PUBCHEM 030117273.mol (via Jmol)
030117276.b3lyp_6-31g(d).inp

030117276.b3lyp_6-31g(d).qchem.inp (generated)

030117276.b3lyp_6-31g(d).gjf (generated)

030117276.b3lyp_6-31g(d).firefly.inp (generated)

030117276.b3lyp_6-31g(d).smash.inp (generated)

030117276.b3lyp_6-31g(d).nwchem.inp (generated) 030117276.b3lyp_6-31g(d).log.xz 030117276.td-b3lyp_6-31g+(d).inp 030117276.td-b3lyp_6-31g+(d).log.xz

030117276.td-b3lyp_6-31+g(d).qchem.inp (generated)

030117276.td-b3lyp_6-31+g(d).gjf (generated)

030117276.td-b3lyp_6-31+g(d).firefly.inp (generated)

030117276.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030117276.mol 030117276.PUBCHEM 030117276.mol (via Jmol)
030117600.b3lyp_6-31g(d).inp

030117600.b3lyp_6-31g(d).qchem.inp (generated)

030117600.b3lyp_6-31g(d).gjf (generated)

030117600.b3lyp_6-31g(d).firefly.inp (generated)

030117600.b3lyp_6-31g(d).smash.inp (generated)

030117600.b3lyp_6-31g(d).nwchem.inp (generated) 030117600.b3lyp_6-31g(d).log.xz 030117600.td-b3lyp_6-31g+(d).inp 030117600.td-b3lyp_6-31g+(d).log.xz

030117600.td-b3lyp_6-31+g(d).qchem.inp (generated)

030117600.td-b3lyp_6-31+g(d).gjf (generated)

030117600.td-b3lyp_6-31+g(d).firefly.inp (generated)

030117600.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030117600.mol 030117600.PUBCHEM 030117600.mol (via Jmol)
030117640.b3lyp_6-31g(d).inp

030117640.b3lyp_6-31g(d).qchem.inp (generated)

030117640.b3lyp_6-31g(d).gjf (generated)

030117640.b3lyp_6-31g(d).firefly.inp (generated)

030117640.b3lyp_6-31g(d).smash.inp (generated)

030117640.b3lyp_6-31g(d).nwchem.inp (generated) 030117640.b3lyp_6-31g(d).log.xz 030117640.td-b3lyp_6-31g+(d).inp 030117640.td-b3lyp_6-31g+(d).log.xz

030117640.td-b3lyp_6-31+g(d).qchem.inp (generated)

030117640.td-b3lyp_6-31+g(d).gjf (generated)

030117640.td-b3lyp_6-31+g(d).firefly.inp (generated)

030117640.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030117640.mol 030117640.PUBCHEM 030117640.mol (via Jmol)
030117865.b3lyp_6-31g(d).inp

030117865.b3lyp_6-31g(d).qchem.inp (generated)

030117865.b3lyp_6-31g(d).gjf (generated)

030117865.b3lyp_6-31g(d).firefly.inp (generated)

030117865.b3lyp_6-31g(d).smash.inp (generated)

030117865.b3lyp_6-31g(d).nwchem.inp (generated) 030117865.b3lyp_6-31g(d).log.xz 030117865.td-b3lyp_6-31g+(d).inp 030117865.td-b3lyp_6-31g+(d).log.xz

030117865.td-b3lyp_6-31+g(d).qchem.inp (generated)

030117865.td-b3lyp_6-31+g(d).gjf (generated)

030117865.td-b3lyp_6-31+g(d).firefly.inp (generated)

030117865.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030117865.mol 030117865.PUBCHEM 030117865.mol (via Jmol)
030117868.b3lyp_6-31g(d).inp

030117868.b3lyp_6-31g(d).qchem.inp (generated)

030117868.b3lyp_6-31g(d).gjf (generated)

030117868.b3lyp_6-31g(d).firefly.inp (generated)

030117868.b3lyp_6-31g(d).smash.inp (generated)

030117868.b3lyp_6-31g(d).nwchem.inp (generated) 030117868.b3lyp_6-31g(d).log.xz 030117868.td-b3lyp_6-31g+(d).inp 030117868.td-b3lyp_6-31g+(d).log.xz

030117868.td-b3lyp_6-31+g(d).qchem.inp (generated)

030117868.td-b3lyp_6-31+g(d).gjf (generated)

030117868.td-b3lyp_6-31+g(d).firefly.inp (generated)

030117868.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030117868.mol 030117868.PUBCHEM 030117868.mol (via Jmol)
030118048.b3lyp_6-31g(d).inp

030118048.b3lyp_6-31g(d).qchem.inp (generated)

030118048.b3lyp_6-31g(d).gjf (generated)

030118048.b3lyp_6-31g(d).firefly.inp (generated)

030118048.b3lyp_6-31g(d).smash.inp (generated)

030118048.b3lyp_6-31g(d).nwchem.inp (generated) 030118048.b3lyp_6-31g(d).log.xz 030118048.mol 030118048.PUBCHEM 030118048.mol (via Jmol)
030118137.b3lyp_6-31g(d).inp

030118137.b3lyp_6-31g(d).qchem.inp (generated)

030118137.b3lyp_6-31g(d).gjf (generated)

030118137.b3lyp_6-31g(d).firefly.inp (generated)

030118137.b3lyp_6-31g(d).smash.inp (generated)

030118137.b3lyp_6-31g(d).nwchem.inp (generated) 030118137.b3lyp_6-31g(d).log.xz 030118137.mol 030118137.PUBCHEM 030118137.mol (via Jmol)
030118275.b3lyp_6-31g(d).inp

030118275.b3lyp_6-31g(d).qchem.inp (generated)

030118275.b3lyp_6-31g(d).gjf (generated)

030118275.b3lyp_6-31g(d).firefly.inp (generated)

030118275.b3lyp_6-31g(d).smash.inp (generated)

030118275.b3lyp_6-31g(d).nwchem.inp (generated) 030118275.b3lyp_6-31g(d).log.xz 030118275.td-b3lyp_6-31g+(d).inp 030118275.td-b3lyp_6-31g+(d).log.xz

030118275.td-b3lyp_6-31+g(d).qchem.inp (generated)

030118275.td-b3lyp_6-31+g(d).gjf (generated)

030118275.td-b3lyp_6-31+g(d).firefly.inp (generated)

030118275.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030118275.mol 030118275.PUBCHEM 030118275.mol (via Jmol)
030118320.b3lyp_6-31g(d).inp

030118320.b3lyp_6-31g(d).qchem.inp (generated)

030118320.b3lyp_6-31g(d).gjf (generated)

030118320.b3lyp_6-31g(d).firefly.inp (generated)

030118320.b3lyp_6-31g(d).smash.inp (generated)

030118320.b3lyp_6-31g(d).nwchem.inp (generated) 030118320.b3lyp_6-31g(d).log.xz 030118320.td-b3lyp_6-31g+(d).inp 030118320.td-b3lyp_6-31g+(d).log.xz

030118320.td-b3lyp_6-31+g(d).qchem.inp (generated)

030118320.td-b3lyp_6-31+g(d).gjf (generated)

030118320.td-b3lyp_6-31+g(d).firefly.inp (generated)

030118320.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030118320.mol 030118320.PUBCHEM 030118320.mol (via Jmol)
030118321.b3lyp_6-31g(d).inp

030118321.b3lyp_6-31g(d).qchem.inp (generated)

030118321.b3lyp_6-31g(d).gjf (generated)

030118321.b3lyp_6-31g(d).firefly.inp (generated)

030118321.b3lyp_6-31g(d).smash.inp (generated)

030118321.b3lyp_6-31g(d).nwchem.inp (generated) 030118321.b3lyp_6-31g(d).log.xz 030118321.td-b3lyp_6-31g+(d).inp 030118321.td-b3lyp_6-31g+(d).log.xz

030118321.td-b3lyp_6-31+g(d).qchem.inp (generated)

030118321.td-b3lyp_6-31+g(d).gjf (generated)

030118321.td-b3lyp_6-31+g(d).firefly.inp (generated)

030118321.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030118321.mol 030118321.PUBCHEM 030118321.mol (via Jmol)
030118323.b3lyp_6-31g(d).inp

030118323.b3lyp_6-31g(d).qchem.inp (generated)

030118323.b3lyp_6-31g(d).gjf (generated)

030118323.b3lyp_6-31g(d).firefly.inp (generated)

030118323.b3lyp_6-31g(d).smash.inp (generated)

030118323.b3lyp_6-31g(d).nwchem.inp (generated) 030118323.b3lyp_6-31g(d).log.xz 030118323.td-b3lyp_6-31g+(d).inp 030118323.td-b3lyp_6-31g+(d).log.xz

030118323.td-b3lyp_6-31+g(d).qchem.inp (generated)

030118323.td-b3lyp_6-31+g(d).gjf (generated)

030118323.td-b3lyp_6-31+g(d).firefly.inp (generated)

030118323.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030118323.mol 030118323.PUBCHEM 030118323.mol (via Jmol)
030118324.b3lyp_6-31g(d).inp

030118324.b3lyp_6-31g(d).qchem.inp (generated)

030118324.b3lyp_6-31g(d).gjf (generated)

030118324.b3lyp_6-31g(d).firefly.inp (generated)

030118324.b3lyp_6-31g(d).smash.inp (generated)

030118324.b3lyp_6-31g(d).nwchem.inp (generated) 030118324.b3lyp_6-31g(d).log.xz 030118324.td-b3lyp_6-31g+(d).inp 030118324.td-b3lyp_6-31g+(d).log.xz

030118324.td-b3lyp_6-31+g(d).qchem.inp (generated)

030118324.td-b3lyp_6-31+g(d).gjf (generated)

030118324.td-b3lyp_6-31+g(d).firefly.inp (generated)

030118324.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030118324.mol 030118324.PUBCHEM 030118324.mol (via Jmol)
030118332.b3lyp_6-31g(d).inp

030118332.b3lyp_6-31g(d).qchem.inp (generated)

030118332.b3lyp_6-31g(d).gjf (generated)

030118332.b3lyp_6-31g(d).firefly.inp (generated)

030118332.b3lyp_6-31g(d).smash.inp (generated)

030118332.b3lyp_6-31g(d).nwchem.inp (generated) 030118332.b3lyp_6-31g(d).log.xz 030118332.td-b3lyp_6-31g+(d).inp 030118332.td-b3lyp_6-31g+(d).log.xz

030118332.td-b3lyp_6-31+g(d).qchem.inp (generated)

030118332.td-b3lyp_6-31+g(d).gjf (generated)

030118332.td-b3lyp_6-31+g(d).firefly.inp (generated)

030118332.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030118332.mol 030118332.PUBCHEM 030118332.mol (via Jmol)
030118338.b3lyp_6-31g(d).inp

030118338.b3lyp_6-31g(d).qchem.inp (generated)

030118338.b3lyp_6-31g(d).gjf (generated)

030118338.b3lyp_6-31g(d).firefly.inp (generated)

030118338.b3lyp_6-31g(d).smash.inp (generated)

030118338.b3lyp_6-31g(d).nwchem.inp (generated) 030118338.b3lyp_6-31g(d).log.xz 030118338.td-b3lyp_6-31g+(d).inp 030118338.td-b3lyp_6-31g+(d).log.xz

030118338.td-b3lyp_6-31+g(d).qchem.inp (generated)

030118338.td-b3lyp_6-31+g(d).gjf (generated)

030118338.td-b3lyp_6-31+g(d).firefly.inp (generated)

030118338.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030118338.mol 030118338.PUBCHEM 030118338.mol (via Jmol)
030118456.b3lyp_6-31g(d).inp

030118456.b3lyp_6-31g(d).qchem.inp (generated)

030118456.b3lyp_6-31g(d).gjf (generated)

030118456.b3lyp_6-31g(d).firefly.inp (generated)

030118456.b3lyp_6-31g(d).smash.inp (generated)

030118456.b3lyp_6-31g(d).nwchem.inp (generated) 030118456.b3lyp_6-31g(d).log.xz 030118456.td-b3lyp_6-31g+(d).inp 030118456.td-b3lyp_6-31g+(d).log.xz

030118456.td-b3lyp_6-31+g(d).qchem.inp (generated)

030118456.td-b3lyp_6-31+g(d).gjf (generated)

030118456.td-b3lyp_6-31+g(d).firefly.inp (generated)

030118456.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030118456.mol 030118456.PUBCHEM 030118456.mol (via Jmol)
030118601.b3lyp_6-31g(d).inp

030118601.b3lyp_6-31g(d).qchem.inp (generated)

030118601.b3lyp_6-31g(d).gjf (generated)

030118601.b3lyp_6-31g(d).firefly.inp (generated)

030118601.b3lyp_6-31g(d).smash.inp (generated)

030118601.b3lyp_6-31g(d).nwchem.inp (generated) 030118601.b3lyp_6-31g(d).log.xz 030118601.td-b3lyp_6-31g+(d).inp 030118601.td-b3lyp_6-31g+(d).log.xz

030118601.td-b3lyp_6-31+g(d).qchem.inp (generated)

030118601.td-b3lyp_6-31+g(d).gjf (generated)

030118601.td-b3lyp_6-31+g(d).firefly.inp (generated)

030118601.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030118601.mol 030118601.PUBCHEM 030118601.mol (via Jmol)
030118625.b3lyp_6-31g(d).inp

030118625.b3lyp_6-31g(d).qchem.inp (generated)

030118625.b3lyp_6-31g(d).gjf (generated)

030118625.b3lyp_6-31g(d).firefly.inp (generated)

030118625.b3lyp_6-31g(d).smash.inp (generated)

030118625.b3lyp_6-31g(d).nwchem.inp (generated) 030118625.b3lyp_6-31g(d).log.xz 030118625.td-b3lyp_6-31g+(d).inp 030118625.td-b3lyp_6-31g+(d).log.xz

030118625.td-b3lyp_6-31+g(d).qchem.inp (generated)

030118625.td-b3lyp_6-31+g(d).gjf (generated)

030118625.td-b3lyp_6-31+g(d).firefly.inp (generated)

030118625.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030118625.mol 030118625.PUBCHEM 030118625.mol (via Jmol)
030118867.b3lyp_6-31g(d).inp

030118867.b3lyp_6-31g(d).qchem.inp (generated)

030118867.b3lyp_6-31g(d).gjf (generated)

030118867.b3lyp_6-31g(d).firefly.inp (generated)

030118867.b3lyp_6-31g(d).smash.inp (generated)

030118867.b3lyp_6-31g(d).nwchem.inp (generated) 030118867.b3lyp_6-31g(d).log.xz 030118867.td-b3lyp_6-31g+(d).inp 030118867.td-b3lyp_6-31g+(d).log.xz

030118867.td-b3lyp_6-31+g(d).qchem.inp (generated)

030118867.td-b3lyp_6-31+g(d).gjf (generated)

030118867.td-b3lyp_6-31+g(d).firefly.inp (generated)

030118867.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030118867.mol 030118867.PUBCHEM 030118867.mol (via Jmol)
030118954.b3lyp_6-31g(d).inp

030118954.b3lyp_6-31g(d).qchem.inp (generated)

030118954.b3lyp_6-31g(d).gjf (generated)

030118954.b3lyp_6-31g(d).firefly.inp (generated)

030118954.b3lyp_6-31g(d).smash.inp (generated)

030118954.b3lyp_6-31g(d).nwchem.inp (generated) 030118954.b3lyp_6-31g(d).log.xz 030118954.td-b3lyp_6-31g+(d).inp 030118954.td-b3lyp_6-31g+(d).log.xz

030118954.td-b3lyp_6-31+g(d).qchem.inp (generated)

030118954.td-b3lyp_6-31+g(d).gjf (generated)

030118954.td-b3lyp_6-31+g(d).firefly.inp (generated)

030118954.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030118954.mol 030118954.PUBCHEM 030118954.mol (via Jmol)
030119078.b3lyp_6-31g(d).inp

030119078.b3lyp_6-31g(d).qchem.inp (generated)

030119078.b3lyp_6-31g(d).gjf (generated)

030119078.b3lyp_6-31g(d).firefly.inp (generated)

030119078.b3lyp_6-31g(d).smash.inp (generated)

030119078.b3lyp_6-31g(d).nwchem.inp (generated) 030119078.b3lyp_6-31g(d).log.xz 030119078.td-b3lyp_6-31g+(d).inp 030119078.td-b3lyp_6-31g+(d).log.xz

030119078.td-b3lyp_6-31+g(d).qchem.inp (generated)

030119078.td-b3lyp_6-31+g(d).gjf (generated)

030119078.td-b3lyp_6-31+g(d).firefly.inp (generated)

030119078.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030119078.mol 030119078.PUBCHEM 030119078.mol (via Jmol)
030119109.b3lyp_6-31g(d).inp

030119109.b3lyp_6-31g(d).qchem.inp (generated)

030119109.b3lyp_6-31g(d).gjf (generated)

030119109.b3lyp_6-31g(d).firefly.inp (generated)

030119109.b3lyp_6-31g(d).smash.inp (generated)

030119109.b3lyp_6-31g(d).nwchem.inp (generated) 030119109.b3lyp_6-31g(d).log.xz 030119109.td-b3lyp_6-31g+(d).inp 030119109.td-b3lyp_6-31g+(d).log.xz

030119109.td-b3lyp_6-31+g(d).qchem.inp (generated)

030119109.td-b3lyp_6-31+g(d).gjf (generated)

030119109.td-b3lyp_6-31+g(d).firefly.inp (generated)

030119109.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030119109.mol 030119109.PUBCHEM 030119109.mol (via Jmol)
030119165.b3lyp_6-31g(d).inp

030119165.b3lyp_6-31g(d).qchem.inp (generated)

030119165.b3lyp_6-31g(d).gjf (generated)

030119165.b3lyp_6-31g(d).firefly.inp (generated)

030119165.b3lyp_6-31g(d).smash.inp (generated)

030119165.b3lyp_6-31g(d).nwchem.inp (generated) 030119165.b3lyp_6-31g(d).log.xz 030119165.td-b3lyp_6-31g+(d).inp 030119165.td-b3lyp_6-31g+(d).log.xz

030119165.td-b3lyp_6-31+g(d).qchem.inp (generated)

030119165.td-b3lyp_6-31+g(d).gjf (generated)

030119165.td-b3lyp_6-31+g(d).firefly.inp (generated)

030119165.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030119165.mol 030119165.PUBCHEM 030119165.mol (via Jmol)
030119180.b3lyp_6-31g(d).inp

030119180.b3lyp_6-31g(d).qchem.inp (generated)

030119180.b3lyp_6-31g(d).gjf (generated)

030119180.b3lyp_6-31g(d).firefly.inp (generated)

030119180.b3lyp_6-31g(d).smash.inp (generated)

030119180.b3lyp_6-31g(d).nwchem.inp (generated) 030119180.b3lyp_6-31g(d).log.xz 030119180.mol 030119180.PUBCHEM 030119180.mol (via Jmol)
030119184.b3lyp_6-31g(d).inp

030119184.b3lyp_6-31g(d).qchem.inp (generated)

030119184.b3lyp_6-31g(d).gjf (generated)

030119184.b3lyp_6-31g(d).firefly.inp (generated)

030119184.b3lyp_6-31g(d).smash.inp (generated)

030119184.b3lyp_6-31g(d).nwchem.inp (generated) 030119184.b3lyp_6-31g(d).log.xz 030119184.mol 030119184.PUBCHEM 030119184.mol (via Jmol)
030119297.b3lyp_6-31g(d).inp

030119297.b3lyp_6-31g(d).qchem.inp (generated)

030119297.b3lyp_6-31g(d).gjf (generated)

030119297.b3lyp_6-31g(d).firefly.inp (generated)

030119297.b3lyp_6-31g(d).smash.inp (generated)

030119297.b3lyp_6-31g(d).nwchem.inp (generated) 030119297.b3lyp_6-31g(d).log.xz 030119297.td-b3lyp_6-31g+(d).inp 030119297.td-b3lyp_6-31g+(d).log.xz

030119297.td-b3lyp_6-31+g(d).qchem.inp (generated)

030119297.td-b3lyp_6-31+g(d).gjf (generated)

030119297.td-b3lyp_6-31+g(d).firefly.inp (generated)

030119297.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030119297.mol 030119297.PUBCHEM 030119297.mol (via Jmol)
030119298.b3lyp_6-31g(d).inp

030119298.b3lyp_6-31g(d).qchem.inp (generated)

030119298.b3lyp_6-31g(d).gjf (generated)

030119298.b3lyp_6-31g(d).firefly.inp (generated)

030119298.b3lyp_6-31g(d).smash.inp (generated)

030119298.b3lyp_6-31g(d).nwchem.inp (generated) 030119298.b3lyp_6-31g(d).log.xz 030119298.td-b3lyp_6-31g+(d).inp 030119298.td-b3lyp_6-31g+(d).log.xz

030119298.td-b3lyp_6-31+g(d).qchem.inp (generated)

030119298.td-b3lyp_6-31+g(d).gjf (generated)

030119298.td-b3lyp_6-31+g(d).firefly.inp (generated)

030119298.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030119298.mol 030119298.PUBCHEM 030119298.mol (via Jmol)
030119356.b3lyp_6-31g(d).inp

030119356.b3lyp_6-31g(d).qchem.inp (generated)

030119356.b3lyp_6-31g(d).gjf (generated)

030119356.b3lyp_6-31g(d).firefly.inp (generated)

030119356.b3lyp_6-31g(d).smash.inp (generated)

030119356.b3lyp_6-31g(d).nwchem.inp (generated) 030119356.b3lyp_6-31g(d).log.xz 030119356.td-b3lyp_6-31g+(d).inp 030119356.td-b3lyp_6-31g+(d).log.xz

030119356.td-b3lyp_6-31+g(d).qchem.inp (generated)

030119356.td-b3lyp_6-31+g(d).gjf (generated)

030119356.td-b3lyp_6-31+g(d).firefly.inp (generated)

030119356.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030119356.mol 030119356.PUBCHEM 030119356.mol (via Jmol)
030119357.b3lyp_6-31g(d).inp

030119357.b3lyp_6-31g(d).qchem.inp (generated)

030119357.b3lyp_6-31g(d).gjf (generated)

030119357.b3lyp_6-31g(d).firefly.inp (generated)

030119357.b3lyp_6-31g(d).smash.inp (generated)

030119357.b3lyp_6-31g(d).nwchem.inp (generated) 030119357.b3lyp_6-31g(d).log.xz 030119357.td-b3lyp_6-31g+(d).inp 030119357.td-b3lyp_6-31g+(d).log.xz

030119357.td-b3lyp_6-31+g(d).qchem.inp (generated)

030119357.td-b3lyp_6-31+g(d).gjf (generated)

030119357.td-b3lyp_6-31+g(d).firefly.inp (generated)

030119357.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030119357.mol 030119357.PUBCHEM 030119357.mol (via Jmol)
030119359.b3lyp_6-31g(d).inp

030119359.b3lyp_6-31g(d).qchem.inp (generated)

030119359.b3lyp_6-31g(d).gjf (generated)

030119359.b3lyp_6-31g(d).firefly.inp (generated)

030119359.b3lyp_6-31g(d).smash.inp (generated)

030119359.b3lyp_6-31g(d).nwchem.inp (generated) 030119359.b3lyp_6-31g(d).log.xz 030119359.td-b3lyp_6-31g+(d).inp 030119359.td-b3lyp_6-31g+(d).log.xz

030119359.td-b3lyp_6-31+g(d).qchem.inp (generated)

030119359.td-b3lyp_6-31+g(d).gjf (generated)

030119359.td-b3lyp_6-31+g(d).firefly.inp (generated)

030119359.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030119359.mol 030119359.PUBCHEM 030119359.mol (via Jmol)
030119360.b3lyp_6-31g(d).inp

030119360.b3lyp_6-31g(d).qchem.inp (generated)

030119360.b3lyp_6-31g(d).gjf (generated)

030119360.b3lyp_6-31g(d).firefly.inp (generated)

030119360.b3lyp_6-31g(d).smash.inp (generated)

030119360.b3lyp_6-31g(d).nwchem.inp (generated) 030119360.b3lyp_6-31g(d).log.xz 030119360.td-b3lyp_6-31g+(d).inp 030119360.td-b3lyp_6-31g+(d).log.xz

030119360.td-b3lyp_6-31+g(d).qchem.inp (generated)

030119360.td-b3lyp_6-31+g(d).gjf (generated)

030119360.td-b3lyp_6-31+g(d).firefly.inp (generated)

030119360.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030119360.mol 030119360.PUBCHEM 030119360.mol (via Jmol)
030119611.b3lyp_6-31g(d).inp

030119611.b3lyp_6-31g(d).qchem.inp (generated)

030119611.b3lyp_6-31g(d).gjf (generated)

030119611.b3lyp_6-31g(d).firefly.inp (generated)

030119611.b3lyp_6-31g(d).smash.inp (generated)

030119611.b3lyp_6-31g(d).nwchem.inp (generated) 030119611.b3lyp_6-31g(d).log.xz 030119611.mol 030119611.PUBCHEM 030119611.mol (via Jmol)
030119705.b3lyp_6-31g(d).inp

030119705.b3lyp_6-31g(d).qchem.inp (generated)

030119705.b3lyp_6-31g(d).gjf (generated)

030119705.b3lyp_6-31g(d).firefly.inp (generated)

030119705.b3lyp_6-31g(d).smash.inp (generated)

030119705.b3lyp_6-31g(d).nwchem.inp (generated) 030119705.b3lyp_6-31g(d).log.xz 030119705.mol 030119705.PUBCHEM 030119705.mol (via Jmol)
030119776.b3lyp_6-31g(d).inp

030119776.b3lyp_6-31g(d).qchem.inp (generated)

030119776.b3lyp_6-31g(d).gjf (generated)

030119776.b3lyp_6-31g(d).firefly.inp (generated)

030119776.b3lyp_6-31g(d).smash.inp (generated)

030119776.b3lyp_6-31g(d).nwchem.inp (generated) 030119776.b3lyp_6-31g(d).log.xz 030119776.td-b3lyp_6-31g+(d).inp 030119776.td-b3lyp_6-31g+(d).log.xz

030119776.td-b3lyp_6-31+g(d).qchem.inp (generated)

030119776.td-b3lyp_6-31+g(d).gjf (generated)

030119776.td-b3lyp_6-31+g(d).firefly.inp (generated)

030119776.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030119776.mol 030119776.PUBCHEM 030119776.mol (via Jmol)
030119790.b3lyp_6-31g(d).inp

030119790.b3lyp_6-31g(d).qchem.inp (generated)

030119790.b3lyp_6-31g(d).gjf (generated)

030119790.b3lyp_6-31g(d).firefly.inp (generated)

030119790.b3lyp_6-31g(d).smash.inp (generated)

030119790.b3lyp_6-31g(d).nwchem.inp (generated) 030119790.b3lyp_6-31g(d).log.xz 030119790.td-b3lyp_6-31g+(d).inp 030119790.td-b3lyp_6-31g+(d).log.xz

030119790.td-b3lyp_6-31+g(d).qchem.inp (generated)

030119790.td-b3lyp_6-31+g(d).gjf (generated)

030119790.td-b3lyp_6-31+g(d).firefly.inp (generated)

030119790.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030119790.mol 030119790.PUBCHEM 030119790.mol (via Jmol)
030119791.b3lyp_6-31g(d).inp

030119791.b3lyp_6-31g(d).qchem.inp (generated)

030119791.b3lyp_6-31g(d).gjf (generated)

030119791.b3lyp_6-31g(d).firefly.inp (generated)

030119791.b3lyp_6-31g(d).smash.inp (generated)

030119791.b3lyp_6-31g(d).nwchem.inp (generated) 030119791.b3lyp_6-31g(d).log.xz 030119791.td-b3lyp_6-31g+(d).inp 030119791.td-b3lyp_6-31g+(d).log.xz

030119791.td-b3lyp_6-31+g(d).qchem.inp (generated)

030119791.td-b3lyp_6-31+g(d).gjf (generated)

030119791.td-b3lyp_6-31+g(d).firefly.inp (generated)

030119791.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030119791.mol 030119791.PUBCHEM 030119791.mol (via Jmol)
030119794.b3lyp_6-31g(d).inp

030119794.b3lyp_6-31g(d).qchem.inp (generated)

030119794.b3lyp_6-31g(d).gjf (generated)

030119794.b3lyp_6-31g(d).firefly.inp (generated)

030119794.b3lyp_6-31g(d).smash.inp (generated)

030119794.b3lyp_6-31g(d).nwchem.inp (generated) 030119794.b3lyp_6-31g(d).log.xz 030119794.td-b3lyp_6-31g+(d).inp 030119794.td-b3lyp_6-31g+(d).log.xz

030119794.td-b3lyp_6-31+g(d).qchem.inp (generated)

030119794.td-b3lyp_6-31+g(d).gjf (generated)

030119794.td-b3lyp_6-31+g(d).firefly.inp (generated)

030119794.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030119794.mol 030119794.PUBCHEM 030119794.mol (via Jmol)
030119795.b3lyp_6-31g(d).inp

030119795.b3lyp_6-31g(d).qchem.inp (generated)

030119795.b3lyp_6-31g(d).gjf (generated)

030119795.b3lyp_6-31g(d).firefly.inp (generated)

030119795.b3lyp_6-31g(d).smash.inp (generated)

030119795.b3lyp_6-31g(d).nwchem.inp (generated) 030119795.b3lyp_6-31g(d).log.xz 030119795.td-b3lyp_6-31g+(d).inp 030119795.td-b3lyp_6-31g+(d).log.xz

030119795.td-b3lyp_6-31+g(d).qchem.inp (generated)

030119795.td-b3lyp_6-31+g(d).gjf (generated)

030119795.td-b3lyp_6-31+g(d).firefly.inp (generated)

030119795.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030119795.mol 030119795.PUBCHEM 030119795.mol (via Jmol)
030119893.b3lyp_6-31g(d).inp

030119893.b3lyp_6-31g(d).qchem.inp (generated)

030119893.b3lyp_6-31g(d).gjf (generated)

030119893.b3lyp_6-31g(d).firefly.inp (generated)

030119893.b3lyp_6-31g(d).smash.inp (generated)

030119893.b3lyp_6-31g(d).nwchem.inp (generated) 030119893.b3lyp_6-31g(d).log.xz 030119893.td-b3lyp_6-31g+(d).inp 030119893.td-b3lyp_6-31g+(d).log.xz

030119893.td-b3lyp_6-31+g(d).qchem.inp (generated)

030119893.td-b3lyp_6-31+g(d).gjf (generated)

030119893.td-b3lyp_6-31+g(d).firefly.inp (generated)

030119893.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030119893.mol 030119893.PUBCHEM 030119893.mol (via Jmol)
030120037.b3lyp_6-31g(d).inp

030120037.b3lyp_6-31g(d).qchem.inp (generated)

030120037.b3lyp_6-31g(d).gjf (generated)

030120037.b3lyp_6-31g(d).firefly.inp (generated)

030120037.b3lyp_6-31g(d).smash.inp (generated)

030120037.b3lyp_6-31g(d).nwchem.inp (generated) 030120037.b3lyp_6-31g(d).log.xz 030120037.mol 030120037.PUBCHEM 030120037.mol (via Jmol)
030120039.b3lyp_6-31g(d).inp

030120039.b3lyp_6-31g(d).qchem.inp (generated)

030120039.b3lyp_6-31g(d).gjf (generated)

030120039.b3lyp_6-31g(d).firefly.inp (generated)

030120039.b3lyp_6-31g(d).smash.inp (generated)

030120039.b3lyp_6-31g(d).nwchem.inp (generated) 030120039.b3lyp_6-31g(d).log.xz 030120039.mol 030120039.PUBCHEM 030120039.mol (via Jmol)
030120080.b3lyp_6-31g(d).inp

030120080.b3lyp_6-31g(d).qchem.inp (generated)

030120080.b3lyp_6-31g(d).gjf (generated)

030120080.b3lyp_6-31g(d).firefly.inp (generated)

030120080.b3lyp_6-31g(d).smash.inp (generated)

030120080.b3lyp_6-31g(d).nwchem.inp (generated) 030120080.b3lyp_6-31g(d).log.xz 030120080.td-b3lyp_6-31g+(d).inp 030120080.td-b3lyp_6-31g+(d).log.xz

030120080.td-b3lyp_6-31+g(d).qchem.inp (generated)

030120080.td-b3lyp_6-31+g(d).gjf (generated)

030120080.td-b3lyp_6-31+g(d).firefly.inp (generated)

030120080.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030120080.mol 030120080.PUBCHEM 030120080.mol (via Jmol)
030120218.b3lyp_6-31g(d).inp

030120218.b3lyp_6-31g(d).qchem.inp (generated)

030120218.b3lyp_6-31g(d).gjf (generated)

030120218.b3lyp_6-31g(d).firefly.inp (generated)

030120218.b3lyp_6-31g(d).smash.inp (generated)

030120218.b3lyp_6-31g(d).nwchem.inp (generated) 030120218.b3lyp_6-31g(d).log.xz 030120218.td-b3lyp_6-31g+(d).inp 030120218.td-b3lyp_6-31g+(d).log.xz

030120218.td-b3lyp_6-31+g(d).qchem.inp (generated)

030120218.td-b3lyp_6-31+g(d).gjf (generated)

030120218.td-b3lyp_6-31+g(d).firefly.inp (generated)

030120218.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030120218.mol 030120218.PUBCHEM 030120218.mol (via Jmol)
030120222.b3lyp_6-31g(d).inp

030120222.b3lyp_6-31g(d).qchem.inp (generated)

030120222.b3lyp_6-31g(d).gjf (generated)

030120222.b3lyp_6-31g(d).firefly.inp (generated)

030120222.b3lyp_6-31g(d).smash.inp (generated)

030120222.b3lyp_6-31g(d).nwchem.inp (generated) 030120222.b3lyp_6-31g(d).log.xz 030120222.td-b3lyp_6-31g+(d).inp 030120222.td-b3lyp_6-31g+(d).log.xz

030120222.td-b3lyp_6-31+g(d).qchem.inp (generated)

030120222.td-b3lyp_6-31+g(d).gjf (generated)

030120222.td-b3lyp_6-31+g(d).firefly.inp (generated)

030120222.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030120222.mol 030120222.PUBCHEM 030120222.mol (via Jmol)
030120285.b3lyp_6-31g(d).inp

030120285.b3lyp_6-31g(d).qchem.inp (generated)

030120285.b3lyp_6-31g(d).gjf (generated)

030120285.b3lyp_6-31g(d).firefly.inp (generated)

030120285.b3lyp_6-31g(d).smash.inp (generated)

030120285.b3lyp_6-31g(d).nwchem.inp (generated) 030120285.b3lyp_6-31g(d).log.xz 030120285.td-b3lyp_6-31g+(d).inp 030120285.td-b3lyp_6-31g+(d).log.xz

030120285.td-b3lyp_6-31+g(d).qchem.inp (generated)

030120285.td-b3lyp_6-31+g(d).gjf (generated)

030120285.td-b3lyp_6-31+g(d).firefly.inp (generated)

030120285.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030120285.mol 030120285.PUBCHEM 030120285.mol (via Jmol)
030120429.b3lyp_6-31g(d).inp

030120429.b3lyp_6-31g(d).qchem.inp (generated)

030120429.b3lyp_6-31g(d).gjf (generated)

030120429.b3lyp_6-31g(d).firefly.inp (generated)

030120429.b3lyp_6-31g(d).smash.inp (generated)

030120429.b3lyp_6-31g(d).nwchem.inp (generated) 030120429.b3lyp_6-31g(d).log.xz 030120429.td-b3lyp_6-31g+(d).inp 030120429.td-b3lyp_6-31g+(d).log.xz

030120429.td-b3lyp_6-31+g(d).qchem.inp (generated)

030120429.td-b3lyp_6-31+g(d).gjf (generated)

030120429.td-b3lyp_6-31+g(d).firefly.inp (generated)

030120429.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030120429.mol 030120429.PUBCHEM 030120429.mol (via Jmol)
030120526.b3lyp_6-31g(d).inp

030120526.b3lyp_6-31g(d).qchem.inp (generated)

030120526.b3lyp_6-31g(d).gjf (generated)

030120526.b3lyp_6-31g(d).firefly.inp (generated)

030120526.b3lyp_6-31g(d).smash.inp (generated)

030120526.b3lyp_6-31g(d).nwchem.inp (generated) 030120526.b3lyp_6-31g(d).log.xz 030120526.td-b3lyp_6-31g+(d).inp 030120526.td-b3lyp_6-31g+(d).log.xz

030120526.td-b3lyp_6-31+g(d).qchem.inp (generated)

030120526.td-b3lyp_6-31+g(d).gjf (generated)

030120526.td-b3lyp_6-31+g(d).firefly.inp (generated)

030120526.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030120526.mol 030120526.PUBCHEM 030120526.mol (via Jmol)
030120527.b3lyp_6-31g(d).inp

030120527.b3lyp_6-31g(d).qchem.inp (generated)

030120527.b3lyp_6-31g(d).gjf (generated)

030120527.b3lyp_6-31g(d).firefly.inp (generated)

030120527.b3lyp_6-31g(d).smash.inp (generated)

030120527.b3lyp_6-31g(d).nwchem.inp (generated) 030120527.b3lyp_6-31g(d).log.xz 030120527.td-b3lyp_6-31g+(d).inp 030120527.td-b3lyp_6-31g+(d).log.xz

030120527.td-b3lyp_6-31+g(d).qchem.inp (generated)

030120527.td-b3lyp_6-31+g(d).gjf (generated)

030120527.td-b3lyp_6-31+g(d).firefly.inp (generated)

030120527.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030120527.mol 030120527.PUBCHEM 030120527.mol (via Jmol)
030120528.b3lyp_6-31g(d).inp

030120528.b3lyp_6-31g(d).qchem.inp (generated)

030120528.b3lyp_6-31g(d).gjf (generated)

030120528.b3lyp_6-31g(d).firefly.inp (generated)

030120528.b3lyp_6-31g(d).smash.inp (generated)

030120528.b3lyp_6-31g(d).nwchem.inp (generated) 030120528.b3lyp_6-31g(d).log.xz 030120528.td-b3lyp_6-31g+(d).inp 030120528.td-b3lyp_6-31g+(d).log.xz

030120528.td-b3lyp_6-31+g(d).qchem.inp (generated)

030120528.td-b3lyp_6-31+g(d).gjf (generated)

030120528.td-b3lyp_6-31+g(d).firefly.inp (generated)

030120528.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030120528.mol 030120528.PUBCHEM 030120528.mol (via Jmol)
030120529.b3lyp_6-31g(d).inp

030120529.b3lyp_6-31g(d).qchem.inp (generated)

030120529.b3lyp_6-31g(d).gjf (generated)

030120529.b3lyp_6-31g(d).firefly.inp (generated)

030120529.b3lyp_6-31g(d).smash.inp (generated)

030120529.b3lyp_6-31g(d).nwchem.inp (generated) 030120529.b3lyp_6-31g(d).log.xz 030120529.td-b3lyp_6-31g+(d).inp 030120529.td-b3lyp_6-31g+(d).log.xz

030120529.td-b3lyp_6-31+g(d).qchem.inp (generated)

030120529.td-b3lyp_6-31+g(d).gjf (generated)

030120529.td-b3lyp_6-31+g(d).firefly.inp (generated)

030120529.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030120529.mol 030120529.PUBCHEM 030120529.mol (via Jmol)
030120552.b3lyp_6-31g(d).inp

030120552.b3lyp_6-31g(d).qchem.inp (generated)

030120552.b3lyp_6-31g(d).gjf (generated)

030120552.b3lyp_6-31g(d).firefly.inp (generated)

030120552.b3lyp_6-31g(d).smash.inp (generated)

030120552.b3lyp_6-31g(d).nwchem.inp (generated) 030120552.b3lyp_6-31g(d).log.xz 030120552.td-b3lyp_6-31g+(d).inp 030120552.td-b3lyp_6-31g+(d).log.xz

030120552.td-b3lyp_6-31+g(d).qchem.inp (generated)

030120552.td-b3lyp_6-31+g(d).gjf (generated)

030120552.td-b3lyp_6-31+g(d).firefly.inp (generated)

030120552.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030120552.mol 030120552.PUBCHEM 030120552.mol (via Jmol)
030120620.b3lyp_6-31g(d).inp

030120620.b3lyp_6-31g(d).qchem.inp (generated)

030120620.b3lyp_6-31g(d).gjf (generated)

030120620.b3lyp_6-31g(d).firefly.inp (generated)

030120620.b3lyp_6-31g(d).smash.inp (generated)

030120620.b3lyp_6-31g(d).nwchem.inp (generated) 030120620.b3lyp_6-31g(d).log.xz 030120620.td-b3lyp_6-31g+(d).inp 030120620.td-b3lyp_6-31g+(d).log.xz

030120620.td-b3lyp_6-31+g(d).qchem.inp (generated)

030120620.td-b3lyp_6-31+g(d).gjf (generated)

030120620.td-b3lyp_6-31+g(d).firefly.inp (generated)

030120620.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030120620.mol 030120620.PUBCHEM 030120620.mol (via Jmol)
030120653.b3lyp_6-31g(d).inp

030120653.b3lyp_6-31g(d).qchem.inp (generated)

030120653.b3lyp_6-31g(d).gjf (generated)

030120653.b3lyp_6-31g(d).firefly.inp (generated)

030120653.b3lyp_6-31g(d).smash.inp (generated)

030120653.b3lyp_6-31g(d).nwchem.inp (generated) 030120653.b3lyp_6-31g(d).log.xz 030120653.td-b3lyp_6-31g+(d).inp 030120653.td-b3lyp_6-31g+(d).log.xz

030120653.td-b3lyp_6-31+g(d).qchem.inp (generated)

030120653.td-b3lyp_6-31+g(d).gjf (generated)

030120653.td-b3lyp_6-31+g(d).firefly.inp (generated)

030120653.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030120653.mol 030120653.PUBCHEM 030120653.mol (via Jmol)
030120696.b3lyp_6-31g(d).inp

030120696.b3lyp_6-31g(d).qchem.inp (generated)

030120696.b3lyp_6-31g(d).gjf (generated)

030120696.b3lyp_6-31g(d).firefly.inp (generated)

030120696.b3lyp_6-31g(d).smash.inp (generated)

030120696.b3lyp_6-31g(d).nwchem.inp (generated) 030120696.b3lyp_6-31g(d).log.xz 030120696.td-b3lyp_6-31g+(d).inp 030120696.td-b3lyp_6-31g+(d).log.xz

030120696.td-b3lyp_6-31+g(d).qchem.inp (generated)

030120696.td-b3lyp_6-31+g(d).gjf (generated)

030120696.td-b3lyp_6-31+g(d).firefly.inp (generated)

030120696.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030120696.mol 030120696.PUBCHEM 030120696.mol (via Jmol)
030120702.b3lyp_6-31g(d).inp

030120702.b3lyp_6-31g(d).qchem.inp (generated)

030120702.b3lyp_6-31g(d).gjf (generated)

030120702.b3lyp_6-31g(d).firefly.inp (generated)

030120702.b3lyp_6-31g(d).smash.inp (generated)

030120702.b3lyp_6-31g(d).nwchem.inp (generated) 030120702.b3lyp_6-31g(d).log.xz 030120702.td-b3lyp_6-31g+(d).inp 030120702.td-b3lyp_6-31g+(d).log.xz

030120702.td-b3lyp_6-31+g(d).qchem.inp (generated)

030120702.td-b3lyp_6-31+g(d).gjf (generated)

030120702.td-b3lyp_6-31+g(d).firefly.inp (generated)

030120702.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030120702.mol 030120702.PUBCHEM 030120702.mol (via Jmol)
030120734.b3lyp_6-31g(d).inp

030120734.b3lyp_6-31g(d).qchem.inp (generated)

030120734.b3lyp_6-31g(d).gjf (generated)

030120734.b3lyp_6-31g(d).firefly.inp (generated)

030120734.b3lyp_6-31g(d).smash.inp (generated)

030120734.b3lyp_6-31g(d).nwchem.inp (generated) 030120734.b3lyp_6-31g(d).log.xz 030120734.td-b3lyp_6-31g+(d).inp 030120734.td-b3lyp_6-31g+(d).log.xz

030120734.td-b3lyp_6-31+g(d).qchem.inp (generated)

030120734.td-b3lyp_6-31+g(d).gjf (generated)

030120734.td-b3lyp_6-31+g(d).firefly.inp (generated)

030120734.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030120734.mol 030120734.PUBCHEM 030120734.mol (via Jmol)
030120736.b3lyp_6-31g(d).inp

030120736.b3lyp_6-31g(d).qchem.inp (generated)

030120736.b3lyp_6-31g(d).gjf (generated)

030120736.b3lyp_6-31g(d).firefly.inp (generated)

030120736.b3lyp_6-31g(d).smash.inp (generated)

030120736.b3lyp_6-31g(d).nwchem.inp (generated) 030120736.b3lyp_6-31g(d).log.xz 030120736.td-b3lyp_6-31g+(d).inp 030120736.td-b3lyp_6-31g+(d).log.xz

030120736.td-b3lyp_6-31+g(d).qchem.inp (generated)

030120736.td-b3lyp_6-31+g(d).gjf (generated)

030120736.td-b3lyp_6-31+g(d).firefly.inp (generated)

030120736.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030120736.mol 030120736.PUBCHEM 030120736.mol (via Jmol)
030120742.b3lyp_6-31g(d).inp

030120742.b3lyp_6-31g(d).qchem.inp (generated)

030120742.b3lyp_6-31g(d).gjf (generated)

030120742.b3lyp_6-31g(d).firefly.inp (generated)

030120742.b3lyp_6-31g(d).smash.inp (generated)

030120742.b3lyp_6-31g(d).nwchem.inp (generated) 030120742.b3lyp_6-31g(d).log.xz 030120742.mol 030120742.PUBCHEM 030120742.mol (via Jmol)
030120854.b3lyp_6-31g(d).inp

030120854.b3lyp_6-31g(d).qchem.inp (generated)

030120854.b3lyp_6-31g(d).gjf (generated)

030120854.b3lyp_6-31g(d).firefly.inp (generated)

030120854.b3lyp_6-31g(d).smash.inp (generated)

030120854.b3lyp_6-31g(d).nwchem.inp (generated) 030120854.b3lyp_6-31g(d).log.xz 030120854.td-b3lyp_6-31g+(d).inp 030120854.td-b3lyp_6-31g+(d).log.xz

030120854.td-b3lyp_6-31+g(d).qchem.inp (generated)

030120854.td-b3lyp_6-31+g(d).gjf (generated)

030120854.td-b3lyp_6-31+g(d).firefly.inp (generated)

030120854.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030120854.mol 030120854.PUBCHEM 030120854.mol (via Jmol)
030120855.b3lyp_6-31g(d).inp

030120855.b3lyp_6-31g(d).qchem.inp (generated)

030120855.b3lyp_6-31g(d).gjf (generated)

030120855.b3lyp_6-31g(d).firefly.inp (generated)

030120855.b3lyp_6-31g(d).smash.inp (generated)

030120855.b3lyp_6-31g(d).nwchem.inp (generated) 030120855.b3lyp_6-31g(d).log.xz 030120855.td-b3lyp_6-31g+(d).inp 030120855.td-b3lyp_6-31g+(d).log.xz

030120855.td-b3lyp_6-31+g(d).qchem.inp (generated)

030120855.td-b3lyp_6-31+g(d).gjf (generated)

030120855.td-b3lyp_6-31+g(d).firefly.inp (generated)

030120855.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030120855.mol 030120855.PUBCHEM 030120855.mol (via Jmol)
030120865.b3lyp_6-31g(d).inp

030120865.b3lyp_6-31g(d).qchem.inp (generated)

030120865.b3lyp_6-31g(d).gjf (generated)

030120865.b3lyp_6-31g(d).firefly.inp (generated)

030120865.b3lyp_6-31g(d).smash.inp (generated)

030120865.b3lyp_6-31g(d).nwchem.inp (generated) 030120865.b3lyp_6-31g(d).log.xz 030120865.td-b3lyp_6-31g+(d).inp 030120865.td-b3lyp_6-31g+(d).log.xz

030120865.td-b3lyp_6-31+g(d).qchem.inp (generated)

030120865.td-b3lyp_6-31+g(d).gjf (generated)

030120865.td-b3lyp_6-31+g(d).firefly.inp (generated)

030120865.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030120865.mol 030120865.PUBCHEM 030120865.mol (via Jmol)
030120866.b3lyp_6-31g(d).inp

030120866.b3lyp_6-31g(d).qchem.inp (generated)

030120866.b3lyp_6-31g(d).gjf (generated)

030120866.b3lyp_6-31g(d).firefly.inp (generated)

030120866.b3lyp_6-31g(d).smash.inp (generated)

030120866.b3lyp_6-31g(d).nwchem.inp (generated) 030120866.b3lyp_6-31g(d).log.xz 030120866.td-b3lyp_6-31g+(d).inp 030120866.td-b3lyp_6-31g+(d).log.xz

030120866.td-b3lyp_6-31+g(d).qchem.inp (generated)

030120866.td-b3lyp_6-31+g(d).gjf (generated)

030120866.td-b3lyp_6-31+g(d).firefly.inp (generated)

030120866.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030120866.mol 030120866.PUBCHEM 030120866.mol (via Jmol)
030120868.b3lyp_6-31g(d).inp

030120868.b3lyp_6-31g(d).qchem.inp (generated)

030120868.b3lyp_6-31g(d).gjf (generated)

030120868.b3lyp_6-31g(d).firefly.inp (generated)

030120868.b3lyp_6-31g(d).smash.inp (generated)

030120868.b3lyp_6-31g(d).nwchem.inp (generated) 030120868.b3lyp_6-31g(d).log.xz 030120868.td-b3lyp_6-31g+(d).inp 030120868.td-b3lyp_6-31g+(d).log.xz

030120868.td-b3lyp_6-31+g(d).qchem.inp (generated)

030120868.td-b3lyp_6-31+g(d).gjf (generated)

030120868.td-b3lyp_6-31+g(d).firefly.inp (generated)

030120868.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030120868.mol 030120868.PUBCHEM 030120868.mol (via Jmol)
030120869.b3lyp_6-31g(d).inp

030120869.b3lyp_6-31g(d).qchem.inp (generated)

030120869.b3lyp_6-31g(d).gjf (generated)

030120869.b3lyp_6-31g(d).firefly.inp (generated)

030120869.b3lyp_6-31g(d).smash.inp (generated)

030120869.b3lyp_6-31g(d).nwchem.inp (generated) 030120869.b3lyp_6-31g(d).log.xz 030120869.td-b3lyp_6-31g+(d).inp 030120869.td-b3lyp_6-31g+(d).log.xz

030120869.td-b3lyp_6-31+g(d).qchem.inp (generated)

030120869.td-b3lyp_6-31+g(d).gjf (generated)

030120869.td-b3lyp_6-31+g(d).firefly.inp (generated)

030120869.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030120869.mol 030120869.PUBCHEM 030120869.mol (via Jmol)
030120918.b3lyp_6-31g(d).inp

030120918.b3lyp_6-31g(d).qchem.inp (generated)

030120918.b3lyp_6-31g(d).gjf (generated)

030120918.b3lyp_6-31g(d).firefly.inp (generated)

030120918.b3lyp_6-31g(d).smash.inp (generated)

030120918.b3lyp_6-31g(d).nwchem.inp (generated) 030120918.b3lyp_6-31g(d).log.xz 030120918.td-b3lyp_6-31g+(d).inp 030120918.td-b3lyp_6-31g+(d).log.xz

030120918.td-b3lyp_6-31+g(d).qchem.inp (generated)

030120918.td-b3lyp_6-31+g(d).gjf (generated)

030120918.td-b3lyp_6-31+g(d).firefly.inp (generated)

030120918.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030120918.mol 030120918.PUBCHEM 030120918.mol (via Jmol)
030120982.b3lyp_6-31g(d).inp

030120982.b3lyp_6-31g(d).qchem.inp (generated)

030120982.b3lyp_6-31g(d).gjf (generated)

030120982.b3lyp_6-31g(d).firefly.inp (generated)

030120982.b3lyp_6-31g(d).smash.inp (generated)

030120982.b3lyp_6-31g(d).nwchem.inp (generated) 030120982.b3lyp_6-31g(d).log.xz 030120982.td-b3lyp_6-31g+(d).inp 030120982.td-b3lyp_6-31g+(d).log.xz

030120982.td-b3lyp_6-31+g(d).qchem.inp (generated)

030120982.td-b3lyp_6-31+g(d).gjf (generated)

030120982.td-b3lyp_6-31+g(d).firefly.inp (generated)

030120982.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030120982.mol 030120982.PUBCHEM 030120982.mol (via Jmol)
030120984.b3lyp_6-31g(d).inp

030120984.b3lyp_6-31g(d).qchem.inp (generated)

030120984.b3lyp_6-31g(d).gjf (generated)

030120984.b3lyp_6-31g(d).firefly.inp (generated)

030120984.b3lyp_6-31g(d).smash.inp (generated)

030120984.b3lyp_6-31g(d).nwchem.inp (generated) 030120984.b3lyp_6-31g(d).log.xz 030120984.td-b3lyp_6-31g+(d).inp 030120984.td-b3lyp_6-31g+(d).log.xz

030120984.td-b3lyp_6-31+g(d).qchem.inp (generated)

030120984.td-b3lyp_6-31+g(d).gjf (generated)

030120984.td-b3lyp_6-31+g(d).firefly.inp (generated)

030120984.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030120984.mol 030120984.PUBCHEM 030120984.mol (via Jmol)
030121099.b3lyp_6-31g(d).inp

030121099.b3lyp_6-31g(d).qchem.inp (generated)

030121099.b3lyp_6-31g(d).gjf (generated)

030121099.b3lyp_6-31g(d).firefly.inp (generated)

030121099.b3lyp_6-31g(d).smash.inp (generated)

030121099.b3lyp_6-31g(d).nwchem.inp (generated) 030121099.b3lyp_6-31g(d).log.xz 030121099.td-b3lyp_6-31g+(d).inp 030121099.td-b3lyp_6-31g+(d).log.xz

030121099.td-b3lyp_6-31+g(d).qchem.inp (generated)

030121099.td-b3lyp_6-31+g(d).gjf (generated)

030121099.td-b3lyp_6-31+g(d).firefly.inp (generated)

030121099.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030121099.mol 030121099.PUBCHEM 030121099.mol (via Jmol)
030121108.b3lyp_6-31g(d).inp

030121108.b3lyp_6-31g(d).qchem.inp (generated)

030121108.b3lyp_6-31g(d).gjf (generated)

030121108.b3lyp_6-31g(d).firefly.inp (generated)

030121108.b3lyp_6-31g(d).smash.inp (generated)

030121108.b3lyp_6-31g(d).nwchem.inp (generated) 030121108.b3lyp_6-31g(d).log.xz 030121108.td-b3lyp_6-31g+(d).inp 030121108.td-b3lyp_6-31g+(d).log.xz

030121108.td-b3lyp_6-31+g(d).qchem.inp (generated)

030121108.td-b3lyp_6-31+g(d).gjf (generated)

030121108.td-b3lyp_6-31+g(d).firefly.inp (generated)

030121108.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030121108.mol 030121108.PUBCHEM 030121108.mol (via Jmol)
030121165.b3lyp_6-31g(d).inp

030121165.b3lyp_6-31g(d).qchem.inp (generated)

030121165.b3lyp_6-31g(d).gjf (generated)

030121165.b3lyp_6-31g(d).firefly.inp (generated)

030121165.b3lyp_6-31g(d).smash.inp (generated)

030121165.b3lyp_6-31g(d).nwchem.inp (generated) 030121165.b3lyp_6-31g(d).log.xz 030121165.td-b3lyp_6-31g+(d).inp 030121165.td-b3lyp_6-31g+(d).log.xz

030121165.td-b3lyp_6-31+g(d).qchem.inp (generated)

030121165.td-b3lyp_6-31+g(d).gjf (generated)

030121165.td-b3lyp_6-31+g(d).firefly.inp (generated)

030121165.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030121165.mol 030121165.PUBCHEM 030121165.mol (via Jmol)
030121335.b3lyp_6-31g(d).inp

030121335.b3lyp_6-31g(d).qchem.inp (generated)

030121335.b3lyp_6-31g(d).gjf (generated)

030121335.b3lyp_6-31g(d).firefly.inp (generated)

030121335.b3lyp_6-31g(d).smash.inp (generated)

030121335.b3lyp_6-31g(d).nwchem.inp (generated) 030121335.b3lyp_6-31g(d).log.xz 030121335.td-b3lyp_6-31g+(d).inp 030121335.td-b3lyp_6-31g+(d).log.xz

030121335.td-b3lyp_6-31+g(d).qchem.inp (generated)

030121335.td-b3lyp_6-31+g(d).gjf (generated)

030121335.td-b3lyp_6-31+g(d).firefly.inp (generated)

030121335.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030121335.mol 030121335.PUBCHEM 030121335.mol (via Jmol)
030121401.b3lyp_6-31g(d).inp

030121401.b3lyp_6-31g(d).qchem.inp (generated)

030121401.b3lyp_6-31g(d).gjf (generated)

030121401.b3lyp_6-31g(d).firefly.inp (generated)

030121401.b3lyp_6-31g(d).smash.inp (generated)

030121401.b3lyp_6-31g(d).nwchem.inp (generated) 030121401.b3lyp_6-31g(d).log.xz 030121401.td-b3lyp_6-31g+(d).inp 030121401.td-b3lyp_6-31g+(d).log.xz

030121401.td-b3lyp_6-31+g(d).qchem.inp (generated)

030121401.td-b3lyp_6-31+g(d).gjf (generated)

030121401.td-b3lyp_6-31+g(d).firefly.inp (generated)

030121401.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030121401.mol 030121401.PUBCHEM 030121401.mol (via Jmol)
030121411.b3lyp_6-31g(d).inp

030121411.b3lyp_6-31g(d).qchem.inp (generated)

030121411.b3lyp_6-31g(d).gjf (generated)

030121411.b3lyp_6-31g(d).firefly.inp (generated)

030121411.b3lyp_6-31g(d).smash.inp (generated)

030121411.b3lyp_6-31g(d).nwchem.inp (generated) 030121411.b3lyp_6-31g(d).log.xz 030121411.td-b3lyp_6-31g+(d).inp 030121411.td-b3lyp_6-31g+(d).log.xz

030121411.td-b3lyp_6-31+g(d).qchem.inp (generated)

030121411.td-b3lyp_6-31+g(d).gjf (generated)

030121411.td-b3lyp_6-31+g(d).firefly.inp (generated)

030121411.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030121411.mol 030121411.PUBCHEM 030121411.mol (via Jmol)
030121424.b3lyp_6-31g(d).inp

030121424.b3lyp_6-31g(d).qchem.inp (generated)

030121424.b3lyp_6-31g(d).gjf (generated)

030121424.b3lyp_6-31g(d).firefly.inp (generated)

030121424.b3lyp_6-31g(d).smash.inp (generated)

030121424.b3lyp_6-31g(d).nwchem.inp (generated) 030121424.b3lyp_6-31g(d).log.xz 030121424.td-b3lyp_6-31g+(d).inp 030121424.td-b3lyp_6-31g+(d).log.xz

030121424.td-b3lyp_6-31+g(d).qchem.inp (generated)

030121424.td-b3lyp_6-31+g(d).gjf (generated)

030121424.td-b3lyp_6-31+g(d).firefly.inp (generated)

030121424.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030121424.mol 030121424.PUBCHEM 030121424.mol (via Jmol)
030121452.b3lyp_6-31g(d).inp

030121452.b3lyp_6-31g(d).qchem.inp (generated)

030121452.b3lyp_6-31g(d).gjf (generated)

030121452.b3lyp_6-31g(d).firefly.inp (generated)

030121452.b3lyp_6-31g(d).smash.inp (generated)

030121452.b3lyp_6-31g(d).nwchem.inp (generated) 030121452.b3lyp_6-31g(d).log.xz 030121452.td-b3lyp_6-31g+(d).inp 030121452.td-b3lyp_6-31g+(d).log.xz

030121452.td-b3lyp_6-31+g(d).qchem.inp (generated)

030121452.td-b3lyp_6-31+g(d).gjf (generated)

030121452.td-b3lyp_6-31+g(d).firefly.inp (generated)

030121452.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030121452.mol 030121452.PUBCHEM 030121452.mol (via Jmol)
030121453.b3lyp_6-31g(d).inp

030121453.b3lyp_6-31g(d).qchem.inp (generated)

030121453.b3lyp_6-31g(d).gjf (generated)

030121453.b3lyp_6-31g(d).firefly.inp (generated)

030121453.b3lyp_6-31g(d).smash.inp (generated)

030121453.b3lyp_6-31g(d).nwchem.inp (generated) 030121453.b3lyp_6-31g(d).log.xz 030121453.td-b3lyp_6-31g+(d).inp 030121453.td-b3lyp_6-31g+(d).log.xz

030121453.td-b3lyp_6-31+g(d).qchem.inp (generated)

030121453.td-b3lyp_6-31+g(d).gjf (generated)

030121453.td-b3lyp_6-31+g(d).firefly.inp (generated)

030121453.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030121453.mol 030121453.PUBCHEM 030121453.mol (via Jmol)
030121455.b3lyp_6-31g(d).inp

030121455.b3lyp_6-31g(d).qchem.inp (generated)

030121455.b3lyp_6-31g(d).gjf (generated)

030121455.b3lyp_6-31g(d).firefly.inp (generated)

030121455.b3lyp_6-31g(d).smash.inp (generated)

030121455.b3lyp_6-31g(d).nwchem.inp (generated) 030121455.b3lyp_6-31g(d).log.xz 030121455.td-b3lyp_6-31g+(d).inp 030121455.td-b3lyp_6-31g+(d).log.xz

030121455.td-b3lyp_6-31+g(d).qchem.inp (generated)

030121455.td-b3lyp_6-31+g(d).gjf (generated)

030121455.td-b3lyp_6-31+g(d).firefly.inp (generated)

030121455.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030121455.mol 030121455.PUBCHEM 030121455.mol (via Jmol)
030121458.b3lyp_6-31g(d).inp

030121458.b3lyp_6-31g(d).qchem.inp (generated)

030121458.b3lyp_6-31g(d).gjf (generated)

030121458.b3lyp_6-31g(d).firefly.inp (generated)

030121458.b3lyp_6-31g(d).smash.inp (generated)

030121458.b3lyp_6-31g(d).nwchem.inp (generated) 030121458.b3lyp_6-31g(d).log.xz 030121458.td-b3lyp_6-31g+(d).inp 030121458.td-b3lyp_6-31g+(d).log.xz

030121458.td-b3lyp_6-31+g(d).qchem.inp (generated)

030121458.td-b3lyp_6-31+g(d).gjf (generated)

030121458.td-b3lyp_6-31+g(d).firefly.inp (generated)

030121458.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030121458.mol 030121458.PUBCHEM 030121458.mol (via Jmol)
030121459.b3lyp_6-31g(d).inp

030121459.b3lyp_6-31g(d).qchem.inp (generated)

030121459.b3lyp_6-31g(d).gjf (generated)

030121459.b3lyp_6-31g(d).firefly.inp (generated)

030121459.b3lyp_6-31g(d).smash.inp (generated)

030121459.b3lyp_6-31g(d).nwchem.inp (generated) 030121459.b3lyp_6-31g(d).log.xz 030121459.td-b3lyp_6-31g+(d).inp 030121459.td-b3lyp_6-31g+(d).log.xz

030121459.td-b3lyp_6-31+g(d).qchem.inp (generated)

030121459.td-b3lyp_6-31+g(d).gjf (generated)

030121459.td-b3lyp_6-31+g(d).firefly.inp (generated)

030121459.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030121459.mol 030121459.PUBCHEM 030121459.mol (via Jmol)
030121461.b3lyp_6-31g(d).inp

030121461.b3lyp_6-31g(d).qchem.inp (generated)

030121461.b3lyp_6-31g(d).gjf (generated)

030121461.b3lyp_6-31g(d).firefly.inp (generated)

030121461.b3lyp_6-31g(d).smash.inp (generated)

030121461.b3lyp_6-31g(d).nwchem.inp (generated) 030121461.b3lyp_6-31g(d).log.xz 030121461.td-b3lyp_6-31g+(d).inp 030121461.td-b3lyp_6-31g+(d).log.xz

030121461.td-b3lyp_6-31+g(d).qchem.inp (generated)

030121461.td-b3lyp_6-31+g(d).gjf (generated)

030121461.td-b3lyp_6-31+g(d).firefly.inp (generated)

030121461.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030121461.mol 030121461.PUBCHEM 030121461.mol (via Jmol)
030121824.b3lyp_6-31g(d).inp

030121824.b3lyp_6-31g(d).qchem.inp (generated)

030121824.b3lyp_6-31g(d).gjf (generated)

030121824.b3lyp_6-31g(d).firefly.inp (generated)

030121824.b3lyp_6-31g(d).smash.inp (generated)

030121824.b3lyp_6-31g(d).nwchem.inp (generated) 030121824.b3lyp_6-31g(d).log.xz 030121824.td-b3lyp_6-31g+(d).inp 030121824.td-b3lyp_6-31g+(d).log.xz

030121824.td-b3lyp_6-31+g(d).qchem.inp (generated)

030121824.td-b3lyp_6-31+g(d).gjf (generated)

030121824.td-b3lyp_6-31+g(d).firefly.inp (generated)

030121824.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030121824.mol 030121824.PUBCHEM 030121824.mol (via Jmol)
030121825.b3lyp_6-31g(d).inp

030121825.b3lyp_6-31g(d).qchem.inp (generated)

030121825.b3lyp_6-31g(d).gjf (generated)

030121825.b3lyp_6-31g(d).firefly.inp (generated)

030121825.b3lyp_6-31g(d).smash.inp (generated)

030121825.b3lyp_6-31g(d).nwchem.inp (generated) 030121825.b3lyp_6-31g(d).log.xz 030121825.td-b3lyp_6-31g+(d).inp 030121825.td-b3lyp_6-31g+(d).log.xz

030121825.td-b3lyp_6-31+g(d).qchem.inp (generated)

030121825.td-b3lyp_6-31+g(d).gjf (generated)

030121825.td-b3lyp_6-31+g(d).firefly.inp (generated)

030121825.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030121825.mol 030121825.PUBCHEM 030121825.mol (via Jmol)
030121826.b3lyp_6-31g(d).inp

030121826.b3lyp_6-31g(d).qchem.inp (generated)

030121826.b3lyp_6-31g(d).gjf (generated)

030121826.b3lyp_6-31g(d).firefly.inp (generated)

030121826.b3lyp_6-31g(d).smash.inp (generated)

030121826.b3lyp_6-31g(d).nwchem.inp (generated) 030121826.b3lyp_6-31g(d).log.xz 030121826.td-b3lyp_6-31g+(d).inp 030121826.td-b3lyp_6-31g+(d).log.xz

030121826.td-b3lyp_6-31+g(d).qchem.inp (generated)

030121826.td-b3lyp_6-31+g(d).gjf (generated)

030121826.td-b3lyp_6-31+g(d).firefly.inp (generated)

030121826.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030121826.mol 030121826.PUBCHEM 030121826.mol (via Jmol)
030121905.b3lyp_6-31g(d).inp

030121905.b3lyp_6-31g(d).qchem.inp (generated)

030121905.b3lyp_6-31g(d).gjf (generated)

030121905.b3lyp_6-31g(d).firefly.inp (generated)

030121905.b3lyp_6-31g(d).smash.inp (generated)

030121905.b3lyp_6-31g(d).nwchem.inp (generated) 030121905.b3lyp_6-31g(d).log.xz 030121905.td-b3lyp_6-31g+(d).inp 030121905.td-b3lyp_6-31g+(d).log.xz

030121905.td-b3lyp_6-31+g(d).qchem.inp (generated)

030121905.td-b3lyp_6-31+g(d).gjf (generated)

030121905.td-b3lyp_6-31+g(d).firefly.inp (generated)

030121905.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030121905.mol 030121905.PUBCHEM 030121905.mol (via Jmol)
030121931.b3lyp_6-31g(d).inp

030121931.b3lyp_6-31g(d).qchem.inp (generated)

030121931.b3lyp_6-31g(d).gjf (generated)

030121931.b3lyp_6-31g(d).firefly.inp (generated)

030121931.b3lyp_6-31g(d).smash.inp (generated)

030121931.b3lyp_6-31g(d).nwchem.inp (generated) 030121931.b3lyp_6-31g(d).log.xz 030121931.td-b3lyp_6-31g+(d).inp 030121931.td-b3lyp_6-31g+(d).log.xz

030121931.td-b3lyp_6-31+g(d).qchem.inp (generated)

030121931.td-b3lyp_6-31+g(d).gjf (generated)

030121931.td-b3lyp_6-31+g(d).firefly.inp (generated)

030121931.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030121931.mol 030121931.PUBCHEM 030121931.mol (via Jmol)
030121987.b3lyp_6-31g(d).inp

030121987.b3lyp_6-31g(d).qchem.inp (generated)

030121987.b3lyp_6-31g(d).gjf (generated)

030121987.b3lyp_6-31g(d).firefly.inp (generated)

030121987.b3lyp_6-31g(d).smash.inp (generated)

030121987.b3lyp_6-31g(d).nwchem.inp (generated) 030121987.b3lyp_6-31g(d).log.xz 030121987.td-b3lyp_6-31g+(d).inp 030121987.td-b3lyp_6-31g+(d).log.xz

030121987.td-b3lyp_6-31+g(d).qchem.inp (generated)

030121987.td-b3lyp_6-31+g(d).gjf (generated)

030121987.td-b3lyp_6-31+g(d).firefly.inp (generated)

030121987.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030121987.mol 030121987.PUBCHEM 030121987.mol (via Jmol)
030122127.b3lyp_6-31g(d).inp

030122127.b3lyp_6-31g(d).qchem.inp (generated)

030122127.b3lyp_6-31g(d).gjf (generated)

030122127.b3lyp_6-31g(d).firefly.inp (generated)

030122127.b3lyp_6-31g(d).smash.inp (generated)

030122127.b3lyp_6-31g(d).nwchem.inp (generated) 030122127.b3lyp_6-31g(d).log.xz 030122127.td-b3lyp_6-31g+(d).inp 030122127.td-b3lyp_6-31g+(d).log.xz

030122127.td-b3lyp_6-31+g(d).qchem.inp (generated)

030122127.td-b3lyp_6-31+g(d).gjf (generated)

030122127.td-b3lyp_6-31+g(d).firefly.inp (generated)

030122127.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030122127.mol 030122127.PUBCHEM 030122127.mol (via Jmol)
030122252.b3lyp_6-31g(d).inp

030122252.b3lyp_6-31g(d).qchem.inp (generated)

030122252.b3lyp_6-31g(d).gjf (generated)

030122252.b3lyp_6-31g(d).firefly.inp (generated)

030122252.b3lyp_6-31g(d).smash.inp (generated)

030122252.b3lyp_6-31g(d).nwchem.inp (generated) 030122252.b3lyp_6-31g(d).log.xz 030122252.td-b3lyp_6-31g+(d).inp 030122252.td-b3lyp_6-31g+(d).log.xz

030122252.td-b3lyp_6-31+g(d).qchem.inp (generated)

030122252.td-b3lyp_6-31+g(d).gjf (generated)

030122252.td-b3lyp_6-31+g(d).firefly.inp (generated)

030122252.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030122252.mol 030122252.PUBCHEM 030122252.mol (via Jmol)
030122258.b3lyp_6-31g(d).inp

030122258.b3lyp_6-31g(d).qchem.inp (generated)

030122258.b3lyp_6-31g(d).gjf (generated)

030122258.b3lyp_6-31g(d).firefly.inp (generated)

030122258.b3lyp_6-31g(d).smash.inp (generated)

030122258.b3lyp_6-31g(d).nwchem.inp (generated) 030122258.b3lyp_6-31g(d).log.xz 030122258.td-b3lyp_6-31g+(d).inp 030122258.td-b3lyp_6-31g+(d).log.xz

030122258.td-b3lyp_6-31+g(d).qchem.inp (generated)

030122258.td-b3lyp_6-31+g(d).gjf (generated)

030122258.td-b3lyp_6-31+g(d).firefly.inp (generated)

030122258.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030122258.mol 030122258.PUBCHEM 030122258.mol (via Jmol)
030122303.b3lyp_6-31g(d).inp

030122303.b3lyp_6-31g(d).qchem.inp (generated)

030122303.b3lyp_6-31g(d).gjf (generated)

030122303.b3lyp_6-31g(d).firefly.inp (generated)

030122303.b3lyp_6-31g(d).smash.inp (generated)

030122303.b3lyp_6-31g(d).nwchem.inp (generated) 030122303.b3lyp_6-31g(d).log.xz 030122303.td-b3lyp_6-31g+(d).inp 030122303.td-b3lyp_6-31g+(d).log.xz

030122303.td-b3lyp_6-31+g(d).qchem.inp (generated)

030122303.td-b3lyp_6-31+g(d).gjf (generated)

030122303.td-b3lyp_6-31+g(d).firefly.inp (generated)

030122303.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030122303.mol 030122303.PUBCHEM 030122303.mol (via Jmol)
030122543.b3lyp_6-31g(d).inp

030122543.b3lyp_6-31g(d).qchem.inp (generated)

030122543.b3lyp_6-31g(d).gjf (generated)

030122543.b3lyp_6-31g(d).firefly.inp (generated)

030122543.b3lyp_6-31g(d).smash.inp (generated)

030122543.b3lyp_6-31g(d).nwchem.inp (generated) 030122543.b3lyp_6-31g(d).log.xz 030122543.td-b3lyp_6-31g+(d).inp 030122543.td-b3lyp_6-31g+(d).log.xz

030122543.td-b3lyp_6-31+g(d).qchem.inp (generated)

030122543.td-b3lyp_6-31+g(d).gjf (generated)

030122543.td-b3lyp_6-31+g(d).firefly.inp (generated)

030122543.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030122543.mol 030122543.PUBCHEM 030122543.mol (via Jmol)
030122579.b3lyp_6-31g(d).inp

030122579.b3lyp_6-31g(d).qchem.inp (generated)

030122579.b3lyp_6-31g(d).gjf (generated)

030122579.b3lyp_6-31g(d).firefly.inp (generated)

030122579.b3lyp_6-31g(d).smash.inp (generated)

030122579.b3lyp_6-31g(d).nwchem.inp (generated) 030122579.b3lyp_6-31g(d).log.xz 030122579.td-b3lyp_6-31g+(d).inp 030122579.td-b3lyp_6-31g+(d).log.xz

030122579.td-b3lyp_6-31+g(d).qchem.inp (generated)

030122579.td-b3lyp_6-31+g(d).gjf (generated)

030122579.td-b3lyp_6-31+g(d).firefly.inp (generated)

030122579.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030122579.mol 030122579.PUBCHEM 030122579.mol (via Jmol)
030122724.b3lyp_6-31g(d).inp

030122724.b3lyp_6-31g(d).qchem.inp (generated)

030122724.b3lyp_6-31g(d).gjf (generated)

030122724.b3lyp_6-31g(d).firefly.inp (generated)

030122724.b3lyp_6-31g(d).smash.inp (generated)

030122724.b3lyp_6-31g(d).nwchem.inp (generated) 030122724.b3lyp_6-31g(d).log.xz 030122724.td-b3lyp_6-31g+(d).inp 030122724.td-b3lyp_6-31g+(d).log.xz

030122724.td-b3lyp_6-31+g(d).qchem.inp (generated)

030122724.td-b3lyp_6-31+g(d).gjf (generated)

030122724.td-b3lyp_6-31+g(d).firefly.inp (generated)

030122724.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030122724.mol 030122724.PUBCHEM 030122724.mol (via Jmol)
030122810.b3lyp_6-31g(d).inp

030122810.b3lyp_6-31g(d).qchem.inp (generated)

030122810.b3lyp_6-31g(d).gjf (generated)

030122810.b3lyp_6-31g(d).firefly.inp (generated)

030122810.b3lyp_6-31g(d).smash.inp (generated)

030122810.b3lyp_6-31g(d).nwchem.inp (generated) 030122810.b3lyp_6-31g(d).log.xz 030122810.td-b3lyp_6-31g+(d).inp 030122810.td-b3lyp_6-31g+(d).log.xz

030122810.td-b3lyp_6-31+g(d).qchem.inp (generated)

030122810.td-b3lyp_6-31+g(d).gjf (generated)

030122810.td-b3lyp_6-31+g(d).firefly.inp (generated)

030122810.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030122810.mol 030122810.PUBCHEM 030122810.mol (via Jmol)
030122811.b3lyp_6-31g(d).inp

030122811.b3lyp_6-31g(d).qchem.inp (generated)

030122811.b3lyp_6-31g(d).gjf (generated)

030122811.b3lyp_6-31g(d).firefly.inp (generated)

030122811.b3lyp_6-31g(d).smash.inp (generated)

030122811.b3lyp_6-31g(d).nwchem.inp (generated) 030122811.b3lyp_6-31g(d).log.xz 030122811.td-b3lyp_6-31g+(d).inp 030122811.td-b3lyp_6-31g+(d).log.xz

030122811.td-b3lyp_6-31+g(d).qchem.inp (generated)

030122811.td-b3lyp_6-31+g(d).gjf (generated)

030122811.td-b3lyp_6-31+g(d).firefly.inp (generated)

030122811.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030122811.mol 030122811.PUBCHEM 030122811.mol (via Jmol)
030122813.b3lyp_6-31g(d).inp

030122813.b3lyp_6-31g(d).qchem.inp (generated)

030122813.b3lyp_6-31g(d).gjf (generated)

030122813.b3lyp_6-31g(d).firefly.inp (generated)

030122813.b3lyp_6-31g(d).smash.inp (generated)

030122813.b3lyp_6-31g(d).nwchem.inp (generated) 030122813.b3lyp_6-31g(d).log.xz 030122813.td-b3lyp_6-31g+(d).inp 030122813.td-b3lyp_6-31g+(d).log.xz

030122813.td-b3lyp_6-31+g(d).qchem.inp (generated)

030122813.td-b3lyp_6-31+g(d).gjf (generated)

030122813.td-b3lyp_6-31+g(d).firefly.inp (generated)

030122813.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030122813.mol 030122813.PUBCHEM 030122813.mol (via Jmol)
030122814.b3lyp_6-31g(d).inp

030122814.b3lyp_6-31g(d).qchem.inp (generated)

030122814.b3lyp_6-31g(d).gjf (generated)

030122814.b3lyp_6-31g(d).firefly.inp (generated)

030122814.b3lyp_6-31g(d).smash.inp (generated)

030122814.b3lyp_6-31g(d).nwchem.inp (generated) 030122814.b3lyp_6-31g(d).log.xz 030122814.td-b3lyp_6-31g+(d).inp 030122814.td-b3lyp_6-31g+(d).log.xz

030122814.td-b3lyp_6-31+g(d).qchem.inp (generated)

030122814.td-b3lyp_6-31+g(d).gjf (generated)

030122814.td-b3lyp_6-31+g(d).firefly.inp (generated)

030122814.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030122814.mol 030122814.PUBCHEM 030122814.mol (via Jmol)
030122994.b3lyp_6-31g(d).inp

030122994.b3lyp_6-31g(d).qchem.inp (generated)

030122994.b3lyp_6-31g(d).gjf (generated)

030122994.b3lyp_6-31g(d).firefly.inp (generated)

030122994.b3lyp_6-31g(d).smash.inp (generated)

030122994.b3lyp_6-31g(d).nwchem.inp (generated) 030122994.b3lyp_6-31g(d).log.xz 030122994.td-b3lyp_6-31g+(d).inp 030122994.td-b3lyp_6-31g+(d).log.xz

030122994.td-b3lyp_6-31+g(d).qchem.inp (generated)

030122994.td-b3lyp_6-31+g(d).gjf (generated)

030122994.td-b3lyp_6-31+g(d).firefly.inp (generated)

030122994.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030122994.mol 030122994.PUBCHEM 030122994.mol (via Jmol)
030123057.b3lyp_6-31g(d).inp

030123057.b3lyp_6-31g(d).qchem.inp (generated)

030123057.b3lyp_6-31g(d).gjf (generated)

030123057.b3lyp_6-31g(d).firefly.inp (generated)

030123057.b3lyp_6-31g(d).smash.inp (generated)

030123057.b3lyp_6-31g(d).nwchem.inp (generated) 030123057.b3lyp_6-31g(d).log.xz 030123057.td-b3lyp_6-31g+(d).inp 030123057.td-b3lyp_6-31g+(d).log.xz

030123057.td-b3lyp_6-31+g(d).qchem.inp (generated)

030123057.td-b3lyp_6-31+g(d).gjf (generated)

030123057.td-b3lyp_6-31+g(d).firefly.inp (generated)

030123057.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030123057.mol 030123057.PUBCHEM 030123057.mol (via Jmol)
030123058.b3lyp_6-31g(d).inp

030123058.b3lyp_6-31g(d).qchem.inp (generated)

030123058.b3lyp_6-31g(d).gjf (generated)

030123058.b3lyp_6-31g(d).firefly.inp (generated)

030123058.b3lyp_6-31g(d).smash.inp (generated)

030123058.b3lyp_6-31g(d).nwchem.inp (generated) 030123058.b3lyp_6-31g(d).log.xz 030123058.td-b3lyp_6-31g+(d).inp 030123058.td-b3lyp_6-31g+(d).log.xz

030123058.td-b3lyp_6-31+g(d).qchem.inp (generated)

030123058.td-b3lyp_6-31+g(d).gjf (generated)

030123058.td-b3lyp_6-31+g(d).firefly.inp (generated)

030123058.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030123058.mol 030123058.PUBCHEM 030123058.mol (via Jmol)
030123142.b3lyp_6-31g(d).inp

030123142.b3lyp_6-31g(d).qchem.inp (generated)

030123142.b3lyp_6-31g(d).gjf (generated)

030123142.b3lyp_6-31g(d).firefly.inp (generated)

030123142.b3lyp_6-31g(d).smash.inp (generated)

030123142.b3lyp_6-31g(d).nwchem.inp (generated) 030123142.b3lyp_6-31g(d).log.xz 030123142.td-b3lyp_6-31g+(d).inp 030123142.td-b3lyp_6-31g+(d).log.xz

030123142.td-b3lyp_6-31+g(d).qchem.inp (generated)

030123142.td-b3lyp_6-31+g(d).gjf (generated)

030123142.td-b3lyp_6-31+g(d).firefly.inp (generated)

030123142.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030123142.mol 030123142.PUBCHEM 030123142.mol (via Jmol)
030123346.b3lyp_6-31g(d).inp

030123346.b3lyp_6-31g(d).qchem.inp (generated)

030123346.b3lyp_6-31g(d).gjf (generated)

030123346.b3lyp_6-31g(d).firefly.inp (generated)

030123346.b3lyp_6-31g(d).smash.inp (generated)

030123346.b3lyp_6-31g(d).nwchem.inp (generated) 030123346.b3lyp_6-31g(d).log.xz 030123346.td-b3lyp_6-31g+(d).inp 030123346.td-b3lyp_6-31g+(d).log.xz

030123346.td-b3lyp_6-31+g(d).qchem.inp (generated)

030123346.td-b3lyp_6-31+g(d).gjf (generated)

030123346.td-b3lyp_6-31+g(d).firefly.inp (generated)

030123346.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030123346.mol 030123346.PUBCHEM 030123346.mol (via Jmol)


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