Index of

Last updated : Thu Mar 23 01:58:55 JST 2017
Total : 58 (50) in this page
040826514.b3lyp_6-31g(d).inp

040826514.b3lyp_6-31g(d).qchem.inp (generated)

040826514.b3lyp_6-31g(d).gjf (generated)

040826514.b3lyp_6-31g(d).firefly.inp (generated)

040826514.b3lyp_6-31g(d).smash.inp (generated)

040826514.b3lyp_6-31g(d).nwchem.inp (generated) 040826514.b3lyp_6-31g(d).log.xz 040826514.td-b3lyp_6-31g+(d).inp 040826514.td-b3lyp_6-31g+(d).log.xz

040826514.td-b3lyp_6-31+g(d).qchem.inp (generated)

040826514.td-b3lyp_6-31+g(d).gjf (generated)

040826514.td-b3lyp_6-31+g(d).firefly.inp (generated)

040826514.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040826514.mol 040826514.PUBCHEM 040826514.mol (via Jmol)
040827584.b3lyp_6-31g(d).inp

040827584.b3lyp_6-31g(d).qchem.inp (generated)

040827584.b3lyp_6-31g(d).gjf (generated)

040827584.b3lyp_6-31g(d).firefly.inp (generated)

040827584.b3lyp_6-31g(d).smash.inp (generated)

040827584.b3lyp_6-31g(d).nwchem.inp (generated) 040827584.b3lyp_6-31g(d).log.xz 040827584.td-b3lyp_6-31g+(d).inp 040827584.td-b3lyp_6-31g+(d).log.xz

040827584.td-b3lyp_6-31+g(d).qchem.inp (generated)

040827584.td-b3lyp_6-31+g(d).gjf (generated)

040827584.td-b3lyp_6-31+g(d).firefly.inp (generated)

040827584.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040827584.mol 040827584.PUBCHEM 040827584.mol (via Jmol)
040827663.b3lyp_6-31g(d).inp

040827663.b3lyp_6-31g(d).qchem.inp (generated)

040827663.b3lyp_6-31g(d).gjf (generated)

040827663.b3lyp_6-31g(d).firefly.inp (generated)

040827663.b3lyp_6-31g(d).smash.inp (generated)

040827663.b3lyp_6-31g(d).nwchem.inp (generated) 040827663.b3lyp_6-31g(d).log.xz 040827663.td-b3lyp_6-31g+(d).inp 040827663.td-b3lyp_6-31g+(d).log.xz

040827663.td-b3lyp_6-31+g(d).qchem.inp (generated)

040827663.td-b3lyp_6-31+g(d).gjf (generated)

040827663.td-b3lyp_6-31+g(d).firefly.inp (generated)

040827663.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040827663.mol 040827663.PUBCHEM 040827663.mol (via Jmol)
040827664.b3lyp_6-31g(d).inp

040827664.b3lyp_6-31g(d).qchem.inp (generated)

040827664.b3lyp_6-31g(d).gjf (generated)

040827664.b3lyp_6-31g(d).firefly.inp (generated)

040827664.b3lyp_6-31g(d).smash.inp (generated)

040827664.b3lyp_6-31g(d).nwchem.inp (generated) 040827664.b3lyp_6-31g(d).log.xz 040827664.td-b3lyp_6-31g+(d).inp 040827664.td-b3lyp_6-31g+(d).log.xz

040827664.td-b3lyp_6-31+g(d).qchem.inp (generated)

040827664.td-b3lyp_6-31+g(d).gjf (generated)

040827664.td-b3lyp_6-31+g(d).firefly.inp (generated)

040827664.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040827664.mol 040827664.PUBCHEM 040827664.mol (via Jmol)
040829058.b3lyp_6-31g(d).inp

040829058.b3lyp_6-31g(d).qchem.inp (generated)

040829058.b3lyp_6-31g(d).gjf (generated)

040829058.b3lyp_6-31g(d).firefly.inp (generated)

040829058.b3lyp_6-31g(d).smash.inp (generated)

040829058.b3lyp_6-31g(d).nwchem.inp (generated) 040829058.b3lyp_6-31g(d).log.xz 040829058.mol 040829058.PUBCHEM 040829058.mol (via Jmol)
040829079.b3lyp_6-31g(d).inp

040829079.b3lyp_6-31g(d).qchem.inp (generated)

040829079.b3lyp_6-31g(d).gjf (generated)

040829079.b3lyp_6-31g(d).firefly.inp (generated)

040829079.b3lyp_6-31g(d).smash.inp (generated)

040829079.b3lyp_6-31g(d).nwchem.inp (generated) 040829079.b3lyp_6-31g(d).log.xz 040829079.mol 040829079.PUBCHEM 040829079.mol (via Jmol)
040829089.b3lyp_6-31g(d).inp

040829089.b3lyp_6-31g(d).qchem.inp (generated)

040829089.b3lyp_6-31g(d).gjf (generated)

040829089.b3lyp_6-31g(d).firefly.inp (generated)

040829089.b3lyp_6-31g(d).smash.inp (generated)

040829089.b3lyp_6-31g(d).nwchem.inp (generated) 040829089.b3lyp_6-31g(d).log.xz 040829089.mol 040829089.PUBCHEM 040829089.mol (via Jmol)
040829101.b3lyp_6-31g(d).inp

040829101.b3lyp_6-31g(d).qchem.inp (generated)

040829101.b3lyp_6-31g(d).gjf (generated)

040829101.b3lyp_6-31g(d).firefly.inp (generated)

040829101.b3lyp_6-31g(d).smash.inp (generated)

040829101.b3lyp_6-31g(d).nwchem.inp (generated) 040829101.b3lyp_6-31g(d).log.xz 040829101.td-b3lyp_6-31g+(d).inp 040829101.td-b3lyp_6-31g+(d).log.xz

040829101.td-b3lyp_6-31+g(d).qchem.inp (generated)

040829101.td-b3lyp_6-31+g(d).gjf (generated)

040829101.td-b3lyp_6-31+g(d).firefly.inp (generated)

040829101.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040829101.mol 040829101.PUBCHEM 040829101.mol (via Jmol)
040829103.b3lyp_6-31g(d).inp

040829103.b3lyp_6-31g(d).qchem.inp (generated)

040829103.b3lyp_6-31g(d).gjf (generated)

040829103.b3lyp_6-31g(d).firefly.inp (generated)

040829103.b3lyp_6-31g(d).smash.inp (generated)

040829103.b3lyp_6-31g(d).nwchem.inp (generated) 040829103.b3lyp_6-31g(d).log.xz 040829103.td-b3lyp_6-31g+(d).inp 040829103.td-b3lyp_6-31g+(d).log.xz

040829103.td-b3lyp_6-31+g(d).qchem.inp (generated)

040829103.td-b3lyp_6-31+g(d).gjf (generated)

040829103.td-b3lyp_6-31+g(d).firefly.inp (generated)

040829103.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040829103.mol 040829103.PUBCHEM 040829103.mol (via Jmol)
040829113.b3lyp_6-31g(d).inp

040829113.b3lyp_6-31g(d).qchem.inp (generated)

040829113.b3lyp_6-31g(d).gjf (generated)

040829113.b3lyp_6-31g(d).firefly.inp (generated)

040829113.b3lyp_6-31g(d).smash.inp (generated)

040829113.b3lyp_6-31g(d).nwchem.inp (generated) 040829113.b3lyp_6-31g(d).log.xz 040829113.td-b3lyp_6-31g+(d).inp 040829113.td-b3lyp_6-31g+(d).log.xz

040829113.td-b3lyp_6-31+g(d).qchem.inp (generated)

040829113.td-b3lyp_6-31+g(d).gjf (generated)

040829113.td-b3lyp_6-31+g(d).firefly.inp (generated)

040829113.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040829113.mol 040829113.PUBCHEM 040829113.mol (via Jmol)
040829185.b3lyp_6-31g(d).inp

040829185.b3lyp_6-31g(d).qchem.inp (generated)

040829185.b3lyp_6-31g(d).gjf (generated)

040829185.b3lyp_6-31g(d).firefly.inp (generated)

040829185.b3lyp_6-31g(d).smash.inp (generated)

040829185.b3lyp_6-31g(d).nwchem.inp (generated) 040829185.b3lyp_6-31g(d).log.xz 040829185.mol 040829185.PUBCHEM 040829185.mol (via Jmol)
040829186.b3lyp_6-31g(d).inp

040829186.b3lyp_6-31g(d).qchem.inp (generated)

040829186.b3lyp_6-31g(d).gjf (generated)

040829186.b3lyp_6-31g(d).firefly.inp (generated)

040829186.b3lyp_6-31g(d).smash.inp (generated)

040829186.b3lyp_6-31g(d).nwchem.inp (generated) 040829186.b3lyp_6-31g(d).log.xz 040829186.mol 040829186.PUBCHEM 040829186.mol (via Jmol)
040829190.b3lyp_6-31g(d).inp

040829190.b3lyp_6-31g(d).qchem.inp (generated)

040829190.b3lyp_6-31g(d).gjf (generated)

040829190.b3lyp_6-31g(d).firefly.inp (generated)

040829190.b3lyp_6-31g(d).smash.inp (generated)

040829190.b3lyp_6-31g(d).nwchem.inp (generated) 040829190.b3lyp_6-31g(d).log.xz 040829190.td-b3lyp_6-31g+(d).inp 040829190.td-b3lyp_6-31g+(d).log.xz

040829190.td-b3lyp_6-31+g(d).qchem.inp (generated)

040829190.td-b3lyp_6-31+g(d).gjf (generated)

040829190.td-b3lyp_6-31+g(d).firefly.inp (generated)

040829190.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040829190.mol 040829190.PUBCHEM 040829190.mol (via Jmol)
040829195.b3lyp_6-31g(d).inp

040829195.b3lyp_6-31g(d).qchem.inp (generated)

040829195.b3lyp_6-31g(d).gjf (generated)

040829195.b3lyp_6-31g(d).firefly.inp (generated)

040829195.b3lyp_6-31g(d).smash.inp (generated)

040829195.b3lyp_6-31g(d).nwchem.inp (generated) 040829195.b3lyp_6-31g(d).log.xz 040829195.td-b3lyp_6-31g+(d).inp 040829195.td-b3lyp_6-31g+(d).log.xz

040829195.td-b3lyp_6-31+g(d).qchem.inp (generated)

040829195.td-b3lyp_6-31+g(d).gjf (generated)

040829195.td-b3lyp_6-31+g(d).firefly.inp (generated)

040829195.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040829195.mol 040829195.PUBCHEM 040829195.mol (via Jmol)
040829202.b3lyp_6-31g(d).inp

040829202.b3lyp_6-31g(d).qchem.inp (generated)

040829202.b3lyp_6-31g(d).gjf (generated)

040829202.b3lyp_6-31g(d).firefly.inp (generated)

040829202.b3lyp_6-31g(d).smash.inp (generated)

040829202.b3lyp_6-31g(d).nwchem.inp (generated) 040829202.b3lyp_6-31g(d).log.xz 040829202.td-b3lyp_6-31g+(d).inp 040829202.td-b3lyp_6-31g+(d).log.xz

040829202.td-b3lyp_6-31+g(d).qchem.inp (generated)

040829202.td-b3lyp_6-31+g(d).gjf (generated)

040829202.td-b3lyp_6-31+g(d).firefly.inp (generated)

040829202.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040829202.mol 040829202.PUBCHEM 040829202.mol (via Jmol)
040829203.b3lyp_6-31g(d).inp

040829203.b3lyp_6-31g(d).qchem.inp (generated)

040829203.b3lyp_6-31g(d).gjf (generated)

040829203.b3lyp_6-31g(d).firefly.inp (generated)

040829203.b3lyp_6-31g(d).smash.inp (generated)

040829203.b3lyp_6-31g(d).nwchem.inp (generated) 040829203.b3lyp_6-31g(d).log.xz 040829203.td-b3lyp_6-31g+(d).inp 040829203.td-b3lyp_6-31g+(d).log.xz

040829203.td-b3lyp_6-31+g(d).qchem.inp (generated)

040829203.td-b3lyp_6-31+g(d).gjf (generated)

040829203.td-b3lyp_6-31+g(d).firefly.inp (generated)

040829203.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040829203.mol 040829203.PUBCHEM 040829203.mol (via Jmol)
040829204.b3lyp_6-31g(d).inp

040829204.b3lyp_6-31g(d).qchem.inp (generated)

040829204.b3lyp_6-31g(d).gjf (generated)

040829204.b3lyp_6-31g(d).firefly.inp (generated)

040829204.b3lyp_6-31g(d).smash.inp (generated)

040829204.b3lyp_6-31g(d).nwchem.inp (generated) 040829204.b3lyp_6-31g(d).log.xz 040829204.td-b3lyp_6-31g+(d).inp 040829204.td-b3lyp_6-31g+(d).log.xz

040829204.td-b3lyp_6-31+g(d).qchem.inp (generated)

040829204.td-b3lyp_6-31+g(d).gjf (generated)

040829204.td-b3lyp_6-31+g(d).firefly.inp (generated)

040829204.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040829204.mol 040829204.PUBCHEM 040829204.mol (via Jmol)
040829917.b3lyp_6-31g(d).inp

040829917.b3lyp_6-31g(d).qchem.inp (generated)

040829917.b3lyp_6-31g(d).gjf (generated)

040829917.b3lyp_6-31g(d).firefly.inp (generated)

040829917.b3lyp_6-31g(d).smash.inp (generated)

040829917.b3lyp_6-31g(d).nwchem.inp (generated) 040829917.b3lyp_6-31g(d).log.xz 040829917.td-b3lyp_6-31g+(d).inp 040829917.td-b3lyp_6-31g+(d).log.xz

040829917.td-b3lyp_6-31+g(d).qchem.inp (generated)

040829917.td-b3lyp_6-31+g(d).gjf (generated)

040829917.td-b3lyp_6-31+g(d).firefly.inp (generated)

040829917.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040829917.mol 040829917.PUBCHEM 040829917.mol (via Jmol)
040829918.b3lyp_6-31g(d).inp

040829918.b3lyp_6-31g(d).qchem.inp (generated)

040829918.b3lyp_6-31g(d).gjf (generated)

040829918.b3lyp_6-31g(d).firefly.inp (generated)

040829918.b3lyp_6-31g(d).smash.inp (generated)

040829918.b3lyp_6-31g(d).nwchem.inp (generated) 040829918.b3lyp_6-31g(d).log.xz 040829918.td-b3lyp_6-31g+(d).inp 040829918.td-b3lyp_6-31g+(d).log.xz

040829918.td-b3lyp_6-31+g(d).qchem.inp (generated)

040829918.td-b3lyp_6-31+g(d).gjf (generated)

040829918.td-b3lyp_6-31+g(d).firefly.inp (generated)

040829918.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040829918.mol 040829918.PUBCHEM 040829918.mol (via Jmol)
040830405.b3lyp_6-31g(d).inp

040830405.b3lyp_6-31g(d).qchem.inp (generated)

040830405.b3lyp_6-31g(d).gjf (generated)

040830405.b3lyp_6-31g(d).firefly.inp (generated)

040830405.b3lyp_6-31g(d).smash.inp (generated)

040830405.b3lyp_6-31g(d).nwchem.inp (generated) 040830405.b3lyp_6-31g(d).log.xz 040830405.td-b3lyp_6-31g+(d).inp 040830405.td-b3lyp_6-31g+(d).log.xz

040830405.td-b3lyp_6-31+g(d).qchem.inp (generated)

040830405.td-b3lyp_6-31+g(d).gjf (generated)

040830405.td-b3lyp_6-31+g(d).firefly.inp (generated)

040830405.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040830405.mol 040830405.PUBCHEM 040830405.mol (via Jmol)
040830652.b3lyp_6-31g(d).inp

040830652.b3lyp_6-31g(d).qchem.inp (generated)

040830652.b3lyp_6-31g(d).gjf (generated)

040830652.b3lyp_6-31g(d).firefly.inp (generated)

040830652.b3lyp_6-31g(d).smash.inp (generated)

040830652.b3lyp_6-31g(d).nwchem.inp (generated) 040830652.b3lyp_6-31g(d).log.xz 040830652.td-b3lyp_6-31g+(d).inp 040830652.td-b3lyp_6-31g+(d).log.xz

040830652.td-b3lyp_6-31+g(d).qchem.inp (generated)

040830652.td-b3lyp_6-31+g(d).gjf (generated)

040830652.td-b3lyp_6-31+g(d).firefly.inp (generated)

040830652.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040830652.mol 040830652.PUBCHEM 040830652.mol (via Jmol)
040830682.b3lyp_6-31g(d).inp

040830682.b3lyp_6-31g(d).qchem.inp (generated)

040830682.b3lyp_6-31g(d).gjf (generated)

040830682.b3lyp_6-31g(d).firefly.inp (generated)

040830682.b3lyp_6-31g(d).smash.inp (generated)

040830682.b3lyp_6-31g(d).nwchem.inp (generated) 040830682.b3lyp_6-31g(d).log.xz 040830682.mol 040830682.PUBCHEM 040830682.mol (via Jmol)
040830691.b3lyp_6-31g(d).inp

040830691.b3lyp_6-31g(d).qchem.inp (generated)

040830691.b3lyp_6-31g(d).gjf (generated)

040830691.b3lyp_6-31g(d).firefly.inp (generated)

040830691.b3lyp_6-31g(d).smash.inp (generated)

040830691.b3lyp_6-31g(d).nwchem.inp (generated) 040830691.b3lyp_6-31g(d).log.xz 040830691.td-b3lyp_6-31g+(d).inp 040830691.td-b3lyp_6-31g+(d).log.xz

040830691.td-b3lyp_6-31+g(d).qchem.inp (generated)

040830691.td-b3lyp_6-31+g(d).gjf (generated)

040830691.td-b3lyp_6-31+g(d).firefly.inp (generated)

040830691.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040830691.mol 040830691.PUBCHEM 040830691.mol (via Jmol)
040830692.b3lyp_6-31g(d).inp

040830692.b3lyp_6-31g(d).qchem.inp (generated)

040830692.b3lyp_6-31g(d).gjf (generated)

040830692.b3lyp_6-31g(d).firefly.inp (generated)

040830692.b3lyp_6-31g(d).smash.inp (generated)

040830692.b3lyp_6-31g(d).nwchem.inp (generated) 040830692.b3lyp_6-31g(d).log.xz 040830692.td-b3lyp_6-31g+(d).inp 040830692.td-b3lyp_6-31g+(d).log.xz

040830692.td-b3lyp_6-31+g(d).qchem.inp (generated)

040830692.td-b3lyp_6-31+g(d).gjf (generated)

040830692.td-b3lyp_6-31+g(d).firefly.inp (generated)

040830692.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040830692.mol 040830692.PUBCHEM 040830692.mol (via Jmol)
040830724.b3lyp_6-31g(d).inp

040830724.b3lyp_6-31g(d).qchem.inp (generated)

040830724.b3lyp_6-31g(d).gjf (generated)

040830724.b3lyp_6-31g(d).firefly.inp (generated)

040830724.b3lyp_6-31g(d).smash.inp (generated)

040830724.b3lyp_6-31g(d).nwchem.inp (generated) 040830724.b3lyp_6-31g(d).log.xz 040830724.td-b3lyp_6-31g+(d).inp 040830724.td-b3lyp_6-31g+(d).log.xz

040830724.td-b3lyp_6-31+g(d).qchem.inp (generated)

040830724.td-b3lyp_6-31+g(d).gjf (generated)

040830724.td-b3lyp_6-31+g(d).firefly.inp (generated)

040830724.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040830724.mol 040830724.PUBCHEM 040830724.mol (via Jmol)
040834936.b3lyp_6-31g(d).inp

040834936.b3lyp_6-31g(d).qchem.inp (generated)

040834936.b3lyp_6-31g(d).gjf (generated)

040834936.b3lyp_6-31g(d).firefly.inp (generated)

040834936.b3lyp_6-31g(d).smash.inp (generated)

040834936.b3lyp_6-31g(d).nwchem.inp (generated) 040834936.b3lyp_6-31g(d).log.xz 040834936.td-b3lyp_6-31g+(d).inp 040834936.td-b3lyp_6-31g+(d).log.xz

040834936.td-b3lyp_6-31+g(d).qchem.inp (generated)

040834936.td-b3lyp_6-31+g(d).gjf (generated)

040834936.td-b3lyp_6-31+g(d).firefly.inp (generated)

040834936.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040834936.mol 040834936.PUBCHEM 040834936.mol (via Jmol)
040836431.b3lyp_6-31g(d).inp

040836431.b3lyp_6-31g(d).qchem.inp (generated)

040836431.b3lyp_6-31g(d).gjf (generated)

040836431.b3lyp_6-31g(d).firefly.inp (generated)

040836431.b3lyp_6-31g(d).smash.inp (generated)

040836431.b3lyp_6-31g(d).nwchem.inp (generated) 040836431.b3lyp_6-31g(d).log.xz 040836431.td-b3lyp_6-31g+(d).inp 040836431.td-b3lyp_6-31g+(d).log.xz

040836431.td-b3lyp_6-31+g(d).qchem.inp (generated)

040836431.td-b3lyp_6-31+g(d).gjf (generated)

040836431.td-b3lyp_6-31+g(d).firefly.inp (generated)

040836431.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040836431.mol 040836431.PUBCHEM 040836431.mol (via Jmol)
040836497.b3lyp_6-31g(d).inp

040836497.b3lyp_6-31g(d).qchem.inp (generated)

040836497.b3lyp_6-31g(d).gjf (generated)

040836497.b3lyp_6-31g(d).firefly.inp (generated)

040836497.b3lyp_6-31g(d).smash.inp (generated)

040836497.b3lyp_6-31g(d).nwchem.inp (generated) 040836497.b3lyp_6-31g(d).log.xz 040836497.td-b3lyp_6-31g+(d).inp 040836497.td-b3lyp_6-31g+(d).log.xz

040836497.td-b3lyp_6-31+g(d).qchem.inp (generated)

040836497.td-b3lyp_6-31+g(d).gjf (generated)

040836497.td-b3lyp_6-31+g(d).firefly.inp (generated)

040836497.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040836497.mol 040836497.PUBCHEM 040836497.mol (via Jmol)
040836595.b3lyp_6-31g(d).inp

040836595.b3lyp_6-31g(d).qchem.inp (generated)

040836595.b3lyp_6-31g(d).gjf (generated)

040836595.b3lyp_6-31g(d).firefly.inp (generated)

040836595.b3lyp_6-31g(d).smash.inp (generated)

040836595.b3lyp_6-31g(d).nwchem.inp (generated) 040836595.b3lyp_6-31g(d).log.xz 040836595.td-b3lyp_6-31g+(d).inp 040836595.td-b3lyp_6-31g+(d).log.xz

040836595.td-b3lyp_6-31+g(d).qchem.inp (generated)

040836595.td-b3lyp_6-31+g(d).gjf (generated)

040836595.td-b3lyp_6-31+g(d).firefly.inp (generated)

040836595.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040836595.mol 040836595.PUBCHEM 040836595.mol (via Jmol)
040837261.b3lyp_6-31g(d).inp

040837261.b3lyp_6-31g(d).qchem.inp (generated)

040837261.b3lyp_6-31g(d).gjf (generated)

040837261.b3lyp_6-31g(d).firefly.inp (generated)

040837261.b3lyp_6-31g(d).smash.inp (generated)

040837261.b3lyp_6-31g(d).nwchem.inp (generated) 040837261.b3lyp_6-31g(d).log.xz 040837261.td-b3lyp_6-31g+(d).inp 040837261.td-b3lyp_6-31g+(d).log.xz

040837261.td-b3lyp_6-31+g(d).qchem.inp (generated)

040837261.td-b3lyp_6-31+g(d).gjf (generated)

040837261.td-b3lyp_6-31+g(d).firefly.inp (generated)

040837261.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040837261.mol 040837261.PUBCHEM 040837261.mol (via Jmol)
040838718.b3lyp_6-31g(d).inp

040838718.b3lyp_6-31g(d).qchem.inp (generated)

040838718.b3lyp_6-31g(d).gjf (generated)

040838718.b3lyp_6-31g(d).firefly.inp (generated)

040838718.b3lyp_6-31g(d).smash.inp (generated)

040838718.b3lyp_6-31g(d).nwchem.inp (generated) 040838718.b3lyp_6-31g(d).log.xz 040838718.td-b3lyp_6-31g+(d).inp 040838718.td-b3lyp_6-31g+(d).log.xz

040838718.td-b3lyp_6-31+g(d).qchem.inp (generated)

040838718.td-b3lyp_6-31+g(d).gjf (generated)

040838718.td-b3lyp_6-31+g(d).firefly.inp (generated)

040838718.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040838718.mol 040838718.PUBCHEM 040838718.mol (via Jmol)
040840833.b3lyp_6-31g(d).inp

040840833.b3lyp_6-31g(d).qchem.inp (generated)

040840833.b3lyp_6-31g(d).gjf (generated)

040840833.b3lyp_6-31g(d).firefly.inp (generated)

040840833.b3lyp_6-31g(d).smash.inp (generated)

040840833.b3lyp_6-31g(d).nwchem.inp (generated) 040840833.b3lyp_6-31g(d).log.xz 040840833.td-b3lyp_6-31g+(d).inp 040840833.td-b3lyp_6-31g+(d).log.xz

040840833.td-b3lyp_6-31+g(d).qchem.inp (generated)

040840833.td-b3lyp_6-31+g(d).gjf (generated)

040840833.td-b3lyp_6-31+g(d).firefly.inp (generated)

040840833.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040840833.mol 040840833.PUBCHEM 040840833.mol (via Jmol)
040840834.b3lyp_6-31g(d).inp

040840834.b3lyp_6-31g(d).qchem.inp (generated)

040840834.b3lyp_6-31g(d).gjf (generated)

040840834.b3lyp_6-31g(d).firefly.inp (generated)

040840834.b3lyp_6-31g(d).smash.inp (generated)

040840834.b3lyp_6-31g(d).nwchem.inp (generated) 040840834.b3lyp_6-31g(d).log.xz 040840834.td-b3lyp_6-31g+(d).inp 040840834.td-b3lyp_6-31g+(d).log.xz

040840834.td-b3lyp_6-31+g(d).qchem.inp (generated)

040840834.td-b3lyp_6-31+g(d).gjf (generated)

040840834.td-b3lyp_6-31+g(d).firefly.inp (generated)

040840834.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040840834.mol 040840834.PUBCHEM 040840834.mol (via Jmol)
040840835.b3lyp_6-31g(d).inp

040840835.b3lyp_6-31g(d).qchem.inp (generated)

040840835.b3lyp_6-31g(d).gjf (generated)

040840835.b3lyp_6-31g(d).firefly.inp (generated)

040840835.b3lyp_6-31g(d).smash.inp (generated)

040840835.b3lyp_6-31g(d).nwchem.inp (generated) 040840835.b3lyp_6-31g(d).log.xz 040840835.td-b3lyp_6-31g+(d).inp 040840835.td-b3lyp_6-31g+(d).log.xz

040840835.td-b3lyp_6-31+g(d).qchem.inp (generated)

040840835.td-b3lyp_6-31+g(d).gjf (generated)

040840835.td-b3lyp_6-31+g(d).firefly.inp (generated)

040840835.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040840835.mol 040840835.PUBCHEM 040840835.mol (via Jmol)
040840836.b3lyp_6-31g(d).inp

040840836.b3lyp_6-31g(d).qchem.inp (generated)

040840836.b3lyp_6-31g(d).gjf (generated)

040840836.b3lyp_6-31g(d).firefly.inp (generated)

040840836.b3lyp_6-31g(d).smash.inp (generated)

040840836.b3lyp_6-31g(d).nwchem.inp (generated) 040840836.b3lyp_6-31g(d).log.xz 040840836.td-b3lyp_6-31g+(d).inp 040840836.td-b3lyp_6-31g+(d).log.xz

040840836.td-b3lyp_6-31+g(d).qchem.inp (generated)

040840836.td-b3lyp_6-31+g(d).gjf (generated)

040840836.td-b3lyp_6-31+g(d).firefly.inp (generated)

040840836.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040840836.mol 040840836.PUBCHEM 040840836.mol (via Jmol)
040840837.b3lyp_6-31g(d).inp

040840837.b3lyp_6-31g(d).qchem.inp (generated)

040840837.b3lyp_6-31g(d).gjf (generated)

040840837.b3lyp_6-31g(d).firefly.inp (generated)

040840837.b3lyp_6-31g(d).smash.inp (generated)

040840837.b3lyp_6-31g(d).nwchem.inp (generated) 040840837.b3lyp_6-31g(d).log.xz 040840837.td-b3lyp_6-31g+(d).inp 040840837.td-b3lyp_6-31g+(d).log.xz

040840837.td-b3lyp_6-31+g(d).qchem.inp (generated)

040840837.td-b3lyp_6-31+g(d).gjf (generated)

040840837.td-b3lyp_6-31+g(d).firefly.inp (generated)

040840837.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040840837.mol 040840837.PUBCHEM 040840837.mol (via Jmol)
040840860.b3lyp_6-31g(d).inp

040840860.b3lyp_6-31g(d).qchem.inp (generated)

040840860.b3lyp_6-31g(d).gjf (generated)

040840860.b3lyp_6-31g(d).firefly.inp (generated)

040840860.b3lyp_6-31g(d).smash.inp (generated)

040840860.b3lyp_6-31g(d).nwchem.inp (generated) 040840860.b3lyp_6-31g(d).log.xz 040840860.td-b3lyp_6-31g+(d).inp 040840860.td-b3lyp_6-31g+(d).log.xz

040840860.td-b3lyp_6-31+g(d).qchem.inp (generated)

040840860.td-b3lyp_6-31+g(d).gjf (generated)

040840860.td-b3lyp_6-31+g(d).firefly.inp (generated)

040840860.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040840860.mol 040840860.PUBCHEM 040840860.mol (via Jmol)
040840861.b3lyp_6-31g(d).inp

040840861.b3lyp_6-31g(d).qchem.inp (generated)

040840861.b3lyp_6-31g(d).gjf (generated)

040840861.b3lyp_6-31g(d).firefly.inp (generated)

040840861.b3lyp_6-31g(d).smash.inp (generated)

040840861.b3lyp_6-31g(d).nwchem.inp (generated) 040840861.b3lyp_6-31g(d).log.xz 040840861.td-b3lyp_6-31g+(d).inp 040840861.td-b3lyp_6-31g+(d).log.xz

040840861.td-b3lyp_6-31+g(d).qchem.inp (generated)

040840861.td-b3lyp_6-31+g(d).gjf (generated)

040840861.td-b3lyp_6-31+g(d).firefly.inp (generated)

040840861.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040840861.mol 040840861.PUBCHEM 040840861.mol (via Jmol)
040840863.b3lyp_6-31g(d).inp

040840863.b3lyp_6-31g(d).qchem.inp (generated)

040840863.b3lyp_6-31g(d).gjf (generated)

040840863.b3lyp_6-31g(d).firefly.inp (generated)

040840863.b3lyp_6-31g(d).smash.inp (generated)

040840863.b3lyp_6-31g(d).nwchem.inp (generated) 040840863.b3lyp_6-31g(d).log.xz 040840863.td-b3lyp_6-31g+(d).inp 040840863.td-b3lyp_6-31g+(d).log.xz

040840863.td-b3lyp_6-31+g(d).qchem.inp (generated)

040840863.td-b3lyp_6-31+g(d).gjf (generated)

040840863.td-b3lyp_6-31+g(d).firefly.inp (generated)

040840863.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040840863.mol 040840863.PUBCHEM 040840863.mol (via Jmol)
040840864.b3lyp_6-31g(d).inp

040840864.b3lyp_6-31g(d).qchem.inp (generated)

040840864.b3lyp_6-31g(d).gjf (generated)

040840864.b3lyp_6-31g(d).firefly.inp (generated)

040840864.b3lyp_6-31g(d).smash.inp (generated)

040840864.b3lyp_6-31g(d).nwchem.inp (generated) 040840864.b3lyp_6-31g(d).log.xz 040840864.td-b3lyp_6-31g+(d).inp 040840864.td-b3lyp_6-31g+(d).log.xz

040840864.td-b3lyp_6-31+g(d).qchem.inp (generated)

040840864.td-b3lyp_6-31+g(d).gjf (generated)

040840864.td-b3lyp_6-31+g(d).firefly.inp (generated)

040840864.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040840864.mol 040840864.PUBCHEM 040840864.mol (via Jmol)
040843272.b3lyp_6-31g(d).inp

040843272.b3lyp_6-31g(d).qchem.inp (generated)

040843272.b3lyp_6-31g(d).gjf (generated)

040843272.b3lyp_6-31g(d).firefly.inp (generated)

040843272.b3lyp_6-31g(d).smash.inp (generated)

040843272.b3lyp_6-31g(d).nwchem.inp (generated) 040843272.b3lyp_6-31g(d).log.xz 040843272.td-b3lyp_6-31g+(d).inp 040843272.td-b3lyp_6-31g+(d).log.xz

040843272.td-b3lyp_6-31+g(d).qchem.inp (generated)

040843272.td-b3lyp_6-31+g(d).gjf (generated)

040843272.td-b3lyp_6-31+g(d).firefly.inp (generated)

040843272.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040843272.mol 040843272.PUBCHEM 040843272.mol (via Jmol)
040843906.b3lyp_6-31g(d).inp

040843906.b3lyp_6-31g(d).qchem.inp (generated)

040843906.b3lyp_6-31g(d).gjf (generated)

040843906.b3lyp_6-31g(d).firefly.inp (generated)

040843906.b3lyp_6-31g(d).smash.inp (generated)

040843906.b3lyp_6-31g(d).nwchem.inp (generated) 040843906.b3lyp_6-31g(d).log.xz 040843906.td-b3lyp_6-31g+(d).inp 040843906.td-b3lyp_6-31g+(d).log.xz

040843906.td-b3lyp_6-31+g(d).qchem.inp (generated)

040843906.td-b3lyp_6-31+g(d).gjf (generated)

040843906.td-b3lyp_6-31+g(d).firefly.inp (generated)

040843906.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040843906.mol 040843906.PUBCHEM 040843906.mol (via Jmol)
040844336.b3lyp_6-31g(d).inp

040844336.b3lyp_6-31g(d).qchem.inp (generated)

040844336.b3lyp_6-31g(d).gjf (generated)

040844336.b3lyp_6-31g(d).firefly.inp (generated)

040844336.b3lyp_6-31g(d).smash.inp (generated)

040844336.b3lyp_6-31g(d).nwchem.inp (generated) 040844336.b3lyp_6-31g(d).log.xz 040844336.td-b3lyp_6-31g+(d).inp 040844336.td-b3lyp_6-31g+(d).log.xz

040844336.td-b3lyp_6-31+g(d).qchem.inp (generated)

040844336.td-b3lyp_6-31+g(d).gjf (generated)

040844336.td-b3lyp_6-31+g(d).firefly.inp (generated)

040844336.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040844336.mol 040844336.PUBCHEM 040844336.mol (via Jmol)
040844355.b3lyp_6-31g(d).inp

040844355.b3lyp_6-31g(d).qchem.inp (generated)

040844355.b3lyp_6-31g(d).gjf (generated)

040844355.b3lyp_6-31g(d).firefly.inp (generated)

040844355.b3lyp_6-31g(d).smash.inp (generated)

040844355.b3lyp_6-31g(d).nwchem.inp (generated) 040844355.b3lyp_6-31g(d).log.xz 040844355.td-b3lyp_6-31g+(d).inp 040844355.td-b3lyp_6-31g+(d).log.xz

040844355.td-b3lyp_6-31+g(d).qchem.inp (generated)

040844355.td-b3lyp_6-31+g(d).gjf (generated)

040844355.td-b3lyp_6-31+g(d).firefly.inp (generated)

040844355.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040844355.mol 040844355.PUBCHEM 040844355.mol (via Jmol)
040844416.b3lyp_6-31g(d).inp

040844416.b3lyp_6-31g(d).qchem.inp (generated)

040844416.b3lyp_6-31g(d).gjf (generated)

040844416.b3lyp_6-31g(d).firefly.inp (generated)

040844416.b3lyp_6-31g(d).smash.inp (generated)

040844416.b3lyp_6-31g(d).nwchem.inp (generated) 040844416.b3lyp_6-31g(d).log.xz 040844416.td-b3lyp_6-31g+(d).inp 040844416.td-b3lyp_6-31g+(d).log.xz

040844416.td-b3lyp_6-31+g(d).qchem.inp (generated)

040844416.td-b3lyp_6-31+g(d).gjf (generated)

040844416.td-b3lyp_6-31+g(d).firefly.inp (generated)

040844416.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040844416.mol 040844416.PUBCHEM 040844416.mol (via Jmol)
040844620.b3lyp_6-31g(d).inp

040844620.b3lyp_6-31g(d).qchem.inp (generated)

040844620.b3lyp_6-31g(d).gjf (generated)

040844620.b3lyp_6-31g(d).firefly.inp (generated)

040844620.b3lyp_6-31g(d).smash.inp (generated)

040844620.b3lyp_6-31g(d).nwchem.inp (generated) 040844620.b3lyp_6-31g(d).log.xz 040844620.td-b3lyp_6-31g+(d).inp 040844620.td-b3lyp_6-31g+(d).log.xz

040844620.td-b3lyp_6-31+g(d).qchem.inp (generated)

040844620.td-b3lyp_6-31+g(d).gjf (generated)

040844620.td-b3lyp_6-31+g(d).firefly.inp (generated)

040844620.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040844620.mol 040844620.PUBCHEM 040844620.mol (via Jmol)
040844622.b3lyp_6-31g(d).inp

040844622.b3lyp_6-31g(d).qchem.inp (generated)

040844622.b3lyp_6-31g(d).gjf (generated)

040844622.b3lyp_6-31g(d).firefly.inp (generated)

040844622.b3lyp_6-31g(d).smash.inp (generated)

040844622.b3lyp_6-31g(d).nwchem.inp (generated) 040844622.b3lyp_6-31g(d).log.xz 040844622.mol 040844622.PUBCHEM 040844622.mol (via Jmol)
040844623.b3lyp_6-31g(d).inp

040844623.b3lyp_6-31g(d).qchem.inp (generated)

040844623.b3lyp_6-31g(d).gjf (generated)

040844623.b3lyp_6-31g(d).firefly.inp (generated)

040844623.b3lyp_6-31g(d).smash.inp (generated)

040844623.b3lyp_6-31g(d).nwchem.inp (generated) 040844623.b3lyp_6-31g(d).log.xz 040844623.mol 040844623.PUBCHEM 040844623.mol (via Jmol)
040844633.b3lyp_6-31g(d).inp

040844633.b3lyp_6-31g(d).qchem.inp (generated)

040844633.b3lyp_6-31g(d).gjf (generated)

040844633.b3lyp_6-31g(d).firefly.inp (generated)

040844633.b3lyp_6-31g(d).smash.inp (generated)

040844633.b3lyp_6-31g(d).nwchem.inp (generated) 040844633.b3lyp_6-31g(d).log.xz 040844633.td-b3lyp_6-31g+(d).inp 040844633.td-b3lyp_6-31g+(d).log.xz

040844633.td-b3lyp_6-31+g(d).qchem.inp (generated)

040844633.td-b3lyp_6-31+g(d).gjf (generated)

040844633.td-b3lyp_6-31+g(d).firefly.inp (generated)

040844633.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040844633.mol 040844633.PUBCHEM 040844633.mol (via Jmol)
040844634.b3lyp_6-31g(d).inp

040844634.b3lyp_6-31g(d).qchem.inp (generated)

040844634.b3lyp_6-31g(d).gjf (generated)

040844634.b3lyp_6-31g(d).firefly.inp (generated)

040844634.b3lyp_6-31g(d).smash.inp (generated)

040844634.b3lyp_6-31g(d).nwchem.inp (generated) 040844634.b3lyp_6-31g(d).log.xz 040844634.td-b3lyp_6-31g+(d).inp 040844634.td-b3lyp_6-31g+(d).log.xz

040844634.td-b3lyp_6-31+g(d).qchem.inp (generated)

040844634.td-b3lyp_6-31+g(d).gjf (generated)

040844634.td-b3lyp_6-31+g(d).firefly.inp (generated)

040844634.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040844634.mol 040844634.PUBCHEM 040844634.mol (via Jmol)
040844635.b3lyp_6-31g(d).inp

040844635.b3lyp_6-31g(d).qchem.inp (generated)

040844635.b3lyp_6-31g(d).gjf (generated)

040844635.b3lyp_6-31g(d).firefly.inp (generated)

040844635.b3lyp_6-31g(d).smash.inp (generated)

040844635.b3lyp_6-31g(d).nwchem.inp (generated) 040844635.b3lyp_6-31g(d).log.xz 040844635.td-b3lyp_6-31g+(d).inp 040844635.td-b3lyp_6-31g+(d).log.xz

040844635.td-b3lyp_6-31+g(d).qchem.inp (generated)

040844635.td-b3lyp_6-31+g(d).gjf (generated)

040844635.td-b3lyp_6-31+g(d).firefly.inp (generated)

040844635.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040844635.mol 040844635.PUBCHEM 040844635.mol (via Jmol)
040844637.b3lyp_6-31g(d).inp

040844637.b3lyp_6-31g(d).qchem.inp (generated)

040844637.b3lyp_6-31g(d).gjf (generated)

040844637.b3lyp_6-31g(d).firefly.inp (generated)

040844637.b3lyp_6-31g(d).smash.inp (generated)

040844637.b3lyp_6-31g(d).nwchem.inp (generated) 040844637.b3lyp_6-31g(d).log.xz 040844637.td-b3lyp_6-31g+(d).inp 040844637.td-b3lyp_6-31g+(d).log.xz

040844637.td-b3lyp_6-31+g(d).qchem.inp (generated)

040844637.td-b3lyp_6-31+g(d).gjf (generated)

040844637.td-b3lyp_6-31+g(d).firefly.inp (generated)

040844637.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040844637.mol 040844637.PUBCHEM 040844637.mol (via Jmol)
040844796.b3lyp_6-31g(d).inp

040844796.b3lyp_6-31g(d).qchem.inp (generated)

040844796.b3lyp_6-31g(d).gjf (generated)

040844796.b3lyp_6-31g(d).firefly.inp (generated)

040844796.b3lyp_6-31g(d).smash.inp (generated)

040844796.b3lyp_6-31g(d).nwchem.inp (generated) 040844796.b3lyp_6-31g(d).log.xz 040844796.td-b3lyp_6-31g+(d).inp 040844796.td-b3lyp_6-31g+(d).log.xz

040844796.td-b3lyp_6-31+g(d).qchem.inp (generated)

040844796.td-b3lyp_6-31+g(d).gjf (generated)

040844796.td-b3lyp_6-31+g(d).firefly.inp (generated)

040844796.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040844796.mol 040844796.PUBCHEM 040844796.mol (via Jmol)
040844855.b3lyp_6-31g(d).inp

040844855.b3lyp_6-31g(d).qchem.inp (generated)

040844855.b3lyp_6-31g(d).gjf (generated)

040844855.b3lyp_6-31g(d).firefly.inp (generated)

040844855.b3lyp_6-31g(d).smash.inp (generated)

040844855.b3lyp_6-31g(d).nwchem.inp (generated) 040844855.b3lyp_6-31g(d).log.xz 040844855.td-b3lyp_6-31g+(d).inp 040844855.td-b3lyp_6-31g+(d).log.xz

040844855.td-b3lyp_6-31+g(d).qchem.inp (generated)

040844855.td-b3lyp_6-31+g(d).gjf (generated)

040844855.td-b3lyp_6-31+g(d).firefly.inp (generated)

040844855.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040844855.mol 040844855.PUBCHEM 040844855.mol (via Jmol)
040845136.b3lyp_6-31g(d).inp

040845136.b3lyp_6-31g(d).qchem.inp (generated)

040845136.b3lyp_6-31g(d).gjf (generated)

040845136.b3lyp_6-31g(d).firefly.inp (generated)

040845136.b3lyp_6-31g(d).smash.inp (generated)

040845136.b3lyp_6-31g(d).nwchem.inp (generated) 040845136.b3lyp_6-31g(d).log.xz 040845136.td-b3lyp_6-31g+(d).inp 040845136.td-b3lyp_6-31g+(d).log.xz

040845136.td-b3lyp_6-31+g(d).qchem.inp (generated)

040845136.td-b3lyp_6-31+g(d).gjf (generated)

040845136.td-b3lyp_6-31+g(d).firefly.inp (generated)

040845136.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040845136.mol 040845136.PUBCHEM 040845136.mol (via Jmol)
040845338.b3lyp_6-31g(d).inp

040845338.b3lyp_6-31g(d).qchem.inp (generated)

040845338.b3lyp_6-31g(d).gjf (generated)

040845338.b3lyp_6-31g(d).firefly.inp (generated)

040845338.b3lyp_6-31g(d).smash.inp (generated)

040845338.b3lyp_6-31g(d).nwchem.inp (generated) 040845338.b3lyp_6-31g(d).log.xz 040845338.td-b3lyp_6-31g+(d).inp 040845338.td-b3lyp_6-31g+(d).log.xz

040845338.td-b3lyp_6-31+g(d).qchem.inp (generated)

040845338.td-b3lyp_6-31+g(d).gjf (generated)

040845338.td-b3lyp_6-31+g(d).firefly.inp (generated)

040845338.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040845338.mol 040845338.PUBCHEM 040845338.mol (via Jmol)
040845339.b3lyp_6-31g(d).inp

040845339.b3lyp_6-31g(d).qchem.inp (generated)

040845339.b3lyp_6-31g(d).gjf (generated)

040845339.b3lyp_6-31g(d).firefly.inp (generated)

040845339.b3lyp_6-31g(d).smash.inp (generated)

040845339.b3lyp_6-31g(d).nwchem.inp (generated) 040845339.b3lyp_6-31g(d).log.xz 040845339.td-b3lyp_6-31g+(d).inp 040845339.td-b3lyp_6-31g+(d).log.xz

040845339.td-b3lyp_6-31+g(d).qchem.inp (generated)

040845339.td-b3lyp_6-31+g(d).gjf (generated)

040845339.td-b3lyp_6-31+g(d).firefly.inp (generated)

040845339.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040845339.mol 040845339.PUBCHEM 040845339.mol (via Jmol)
040845467.b3lyp_6-31g(d).inp

040845467.b3lyp_6-31g(d).qchem.inp (generated)

040845467.b3lyp_6-31g(d).gjf (generated)

040845467.b3lyp_6-31g(d).firefly.inp (generated)

040845467.b3lyp_6-31g(d).smash.inp (generated)

040845467.b3lyp_6-31g(d).nwchem.inp (generated) 040845467.b3lyp_6-31g(d).log.xz 040845467.td-b3lyp_6-31g+(d).inp 040845467.td-b3lyp_6-31g+(d).log.xz

040845467.td-b3lyp_6-31+g(d).qchem.inp (generated)

040845467.td-b3lyp_6-31+g(d).gjf (generated)

040845467.td-b3lyp_6-31+g(d).firefly.inp (generated)

040845467.td-b3lyp_6-31+g(d).nwchem.inp (generated) 040845467.mol 040845467.PUBCHEM 040845467.mol (via Jmol)


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