Index of

Last updated : Thu Jul 20 01:46:41 JST 2017
Total : 282 (253) in this page
002500373.b3lyp_6-31g(d).inp

002500373.b3lyp_6-31g(d).qchem.inp (generated)

002500373.b3lyp_6-31g(d).gjf (generated)

002500373.b3lyp_6-31g(d).firefly.inp (generated)

002500373.b3lyp_6-31g(d).smash.inp (generated)

002500373.b3lyp_6-31g(d).nwchem.inp (generated) 002500373.b3lyp_6-31g(d).log.xz 002500373.td-b3lyp_6-31g+(d).inp 002500373.td-b3lyp_6-31g+(d).log.xz

002500373.td-b3lyp_6-31+g(d).qchem.inp (generated)

002500373.td-b3lyp_6-31+g(d).gjf (generated)

002500373.td-b3lyp_6-31+g(d).firefly.inp (generated)

002500373.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002500373.mol 002500373.PUBCHEM 002500373.mol (via Jmol)
002500383.b3lyp_6-31g(d).inp

002500383.b3lyp_6-31g(d).qchem.inp (generated)

002500383.b3lyp_6-31g(d).gjf (generated)

002500383.b3lyp_6-31g(d).firefly.inp (generated)

002500383.b3lyp_6-31g(d).smash.inp (generated)

002500383.b3lyp_6-31g(d).nwchem.inp (generated) 002500383.b3lyp_6-31g(d).log.xz 002500383.mol 002500383.PUBCHEM 002500383.mol (via Jmol)
002500409.b3lyp_6-31g(d).inp

002500409.b3lyp_6-31g(d).qchem.inp (generated)

002500409.b3lyp_6-31g(d).gjf (generated)

002500409.b3lyp_6-31g(d).firefly.inp (generated)

002500409.b3lyp_6-31g(d).smash.inp (generated)

002500409.b3lyp_6-31g(d).nwchem.inp (generated) 002500409.b3lyp_6-31g(d).log.xz 002500409.td-b3lyp_6-31g+(d).inp 002500409.td-b3lyp_6-31g+(d).log.xz

002500409.td-b3lyp_6-31+g(d).qchem.inp (generated)

002500409.td-b3lyp_6-31+g(d).gjf (generated)

002500409.td-b3lyp_6-31+g(d).firefly.inp (generated)

002500409.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002500409.mol 002500409.PUBCHEM 002500409.mol (via Jmol)
002500428.b3lyp_6-31g(d).inp

002500428.b3lyp_6-31g(d).qchem.inp (generated)

002500428.b3lyp_6-31g(d).gjf (generated)

002500428.b3lyp_6-31g(d).firefly.inp (generated)

002500428.b3lyp_6-31g(d).smash.inp (generated)

002500428.b3lyp_6-31g(d).nwchem.inp (generated) 002500428.b3lyp_6-31g(d).log.xz 002500428.td-b3lyp_6-31g+(d).inp 002500428.td-b3lyp_6-31g+(d).log.xz

002500428.td-b3lyp_6-31+g(d).qchem.inp (generated)

002500428.td-b3lyp_6-31+g(d).gjf (generated)

002500428.td-b3lyp_6-31+g(d).firefly.inp (generated)

002500428.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002500428.mol 002500428.PUBCHEM 002500428.mol (via Jmol)
002500572.b3lyp_6-31g(d).inp

002500572.b3lyp_6-31g(d).qchem.inp (generated)

002500572.b3lyp_6-31g(d).gjf (generated)

002500572.b3lyp_6-31g(d).firefly.inp (generated)

002500572.b3lyp_6-31g(d).smash.inp (generated)

002500572.b3lyp_6-31g(d).nwchem.inp (generated) 002500572.b3lyp_6-31g(d).log.xz 002500572.td-b3lyp_6-31g+(d).inp 002500572.td-b3lyp_6-31g+(d).log.xz

002500572.td-b3lyp_6-31+g(d).qchem.inp (generated)

002500572.td-b3lyp_6-31+g(d).gjf (generated)

002500572.td-b3lyp_6-31+g(d).firefly.inp (generated)

002500572.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002500572.mol 002500572.PUBCHEM 002500572.mol (via Jmol)
002500790.b3lyp_6-31g(d).inp

002500790.b3lyp_6-31g(d).qchem.inp (generated)

002500790.b3lyp_6-31g(d).gjf (generated)

002500790.b3lyp_6-31g(d).firefly.inp (generated)

002500790.b3lyp_6-31g(d).smash.inp (generated)

002500790.b3lyp_6-31g(d).nwchem.inp (generated) 002500790.b3lyp_6-31g(d).log.xz 002500790.mol 002500790.PUBCHEM 002500790.mol (via Jmol)
002500850.b3lyp_6-31g(d).inp

002500850.b3lyp_6-31g(d).qchem.inp (generated)

002500850.b3lyp_6-31g(d).gjf (generated)

002500850.b3lyp_6-31g(d).firefly.inp (generated)

002500850.b3lyp_6-31g(d).smash.inp (generated)

002500850.b3lyp_6-31g(d).nwchem.inp (generated) 002500850.b3lyp_6-31g(d).log.xz 002500850.td-b3lyp_6-31g+(d).inp 002500850.td-b3lyp_6-31g+(d).log.xz

002500850.td-b3lyp_6-31+g(d).qchem.inp (generated)

002500850.td-b3lyp_6-31+g(d).gjf (generated)

002500850.td-b3lyp_6-31+g(d).firefly.inp (generated)

002500850.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002500850.mol 002500850.PUBCHEM 002500850.mol (via Jmol)
002501092.b3lyp_6-31g(d).inp

002501092.b3lyp_6-31g(d).qchem.inp (generated)

002501092.b3lyp_6-31g(d).gjf (generated)

002501092.b3lyp_6-31g(d).firefly.inp (generated)

002501092.b3lyp_6-31g(d).smash.inp (generated)

002501092.b3lyp_6-31g(d).nwchem.inp (generated) 002501092.b3lyp_6-31g(d).log.xz 002501092.mol 002501092.PUBCHEM 002501092.mol (via Jmol)
002501107.b3lyp_6-31g(d).inp

002501107.b3lyp_6-31g(d).qchem.inp (generated)

002501107.b3lyp_6-31g(d).gjf (generated)

002501107.b3lyp_6-31g(d).firefly.inp (generated)

002501107.b3lyp_6-31g(d).smash.inp (generated)

002501107.b3lyp_6-31g(d).nwchem.inp (generated) 002501107.b3lyp_6-31g(d).log.xz 002501107.td-b3lyp_6-31g+(d).inp 002501107.td-b3lyp_6-31g+(d).log.xz

002501107.td-b3lyp_6-31+g(d).qchem.inp (generated)

002501107.td-b3lyp_6-31+g(d).gjf (generated)

002501107.td-b3lyp_6-31+g(d).firefly.inp (generated)

002501107.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002501107.mol 002501107.PUBCHEM 002501107.mol (via Jmol)
002501109.b3lyp_6-31g(d).inp

002501109.b3lyp_6-31g(d).qchem.inp (generated)

002501109.b3lyp_6-31g(d).gjf (generated)

002501109.b3lyp_6-31g(d).firefly.inp (generated)

002501109.b3lyp_6-31g(d).smash.inp (generated)

002501109.b3lyp_6-31g(d).nwchem.inp (generated) 002501109.b3lyp_6-31g(d).log.xz 002501109.td-b3lyp_6-31g+(d).inp 002501109.td-b3lyp_6-31g+(d).log.xz

002501109.td-b3lyp_6-31+g(d).qchem.inp (generated)

002501109.td-b3lyp_6-31+g(d).gjf (generated)

002501109.td-b3lyp_6-31+g(d).firefly.inp (generated)

002501109.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002501109.mol 002501109.PUBCHEM 002501109.mol (via Jmol)
002501112.b3lyp_6-31g(d).inp

002501112.b3lyp_6-31g(d).qchem.inp (generated)

002501112.b3lyp_6-31g(d).gjf (generated)

002501112.b3lyp_6-31g(d).firefly.inp (generated)

002501112.b3lyp_6-31g(d).smash.inp (generated)

002501112.b3lyp_6-31g(d).nwchem.inp (generated) 002501112.b3lyp_6-31g(d).log.xz 002501112.td-b3lyp_6-31g+(d).inp 002501112.td-b3lyp_6-31g+(d).log.xz

002501112.td-b3lyp_6-31+g(d).qchem.inp (generated)

002501112.td-b3lyp_6-31+g(d).gjf (generated)

002501112.td-b3lyp_6-31+g(d).firefly.inp (generated)

002501112.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002501112.mol 002501112.PUBCHEM 002501112.mol (via Jmol)
002501540.b3lyp_6-31g(d).inp

002501540.b3lyp_6-31g(d).qchem.inp (generated)

002501540.b3lyp_6-31g(d).gjf (generated)

002501540.b3lyp_6-31g(d).firefly.inp (generated)

002501540.b3lyp_6-31g(d).smash.inp (generated)

002501540.b3lyp_6-31g(d).nwchem.inp (generated) 002501540.b3lyp_6-31g(d).log.xz 002501540.td-b3lyp_6-31g+(d).inp 002501540.td-b3lyp_6-31g+(d).log.xz

002501540.td-b3lyp_6-31+g(d).qchem.inp (generated)

002501540.td-b3lyp_6-31+g(d).gjf (generated)

002501540.td-b3lyp_6-31+g(d).firefly.inp (generated)

002501540.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002501540.mol 002501540.PUBCHEM 002501540.mol (via Jmol)
002501717.b3lyp_6-31g(d).inp

002501717.b3lyp_6-31g(d).qchem.inp (generated)

002501717.b3lyp_6-31g(d).gjf (generated)

002501717.b3lyp_6-31g(d).firefly.inp (generated)

002501717.b3lyp_6-31g(d).smash.inp (generated)

002501717.b3lyp_6-31g(d).nwchem.inp (generated) 002501717.b3lyp_6-31g(d).log.xz 002501717.mol 002501717.PUBCHEM 002501717.mol (via Jmol)
002501990.b3lyp_6-31g(d).inp

002501990.b3lyp_6-31g(d).qchem.inp (generated)

002501990.b3lyp_6-31g(d).gjf (generated)

002501990.b3lyp_6-31g(d).firefly.inp (generated)

002501990.b3lyp_6-31g(d).smash.inp (generated)

002501990.b3lyp_6-31g(d).nwchem.inp (generated) 002501990.b3lyp_6-31g(d).log.xz 002501990.td-b3lyp_6-31g+(d).inp 002501990.td-b3lyp_6-31g+(d).log.xz

002501990.td-b3lyp_6-31+g(d).qchem.inp (generated)

002501990.td-b3lyp_6-31+g(d).gjf (generated)

002501990.td-b3lyp_6-31+g(d).firefly.inp (generated)

002501990.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002501990.mol 002501990.PUBCHEM 002501990.mol (via Jmol)
002502363.b3lyp_6-31g(d).inp

002502363.b3lyp_6-31g(d).qchem.inp (generated)

002502363.b3lyp_6-31g(d).gjf (generated)

002502363.b3lyp_6-31g(d).firefly.inp (generated)

002502363.b3lyp_6-31g(d).smash.inp (generated)

002502363.b3lyp_6-31g(d).nwchem.inp (generated) 002502363.b3lyp_6-31g(d).log.xz 002502363.td-b3lyp_6-31g+(d).inp 002502363.td-b3lyp_6-31g+(d).log.xz

002502363.td-b3lyp_6-31+g(d).qchem.inp (generated)

002502363.td-b3lyp_6-31+g(d).gjf (generated)

002502363.td-b3lyp_6-31+g(d).firefly.inp (generated)

002502363.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002502363.mol 002502363.PUBCHEM 002502363.mol (via Jmol)
002502367.b3lyp_6-31g(d).inp

002502367.b3lyp_6-31g(d).qchem.inp (generated)

002502367.b3lyp_6-31g(d).gjf (generated)

002502367.b3lyp_6-31g(d).firefly.inp (generated)

002502367.b3lyp_6-31g(d).smash.inp (generated)

002502367.b3lyp_6-31g(d).nwchem.inp (generated) 002502367.b3lyp_6-31g(d).log.xz 002502367.td-b3lyp_6-31g+(d).inp 002502367.td-b3lyp_6-31g+(d).log.xz

002502367.td-b3lyp_6-31+g(d).qchem.inp (generated)

002502367.td-b3lyp_6-31+g(d).gjf (generated)

002502367.td-b3lyp_6-31+g(d).firefly.inp (generated)

002502367.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002502367.mol 002502367.PUBCHEM 002502367.mol (via Jmol)
002502412.b3lyp_6-31g(d).inp

002502412.b3lyp_6-31g(d).qchem.inp (generated)

002502412.b3lyp_6-31g(d).gjf (generated)

002502412.b3lyp_6-31g(d).firefly.inp (generated)

002502412.b3lyp_6-31g(d).smash.inp (generated)

002502412.b3lyp_6-31g(d).nwchem.inp (generated) 002502412.b3lyp_6-31g(d).log.xz 002502412.td-b3lyp_6-31g+(d).inp 002502412.td-b3lyp_6-31g+(d).log.xz

002502412.td-b3lyp_6-31+g(d).qchem.inp (generated)

002502412.td-b3lyp_6-31+g(d).gjf (generated)

002502412.td-b3lyp_6-31+g(d).firefly.inp (generated)

002502412.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002502412.mol 002502412.PUBCHEM 002502412.mol (via Jmol)
002502419.b3lyp_6-31g(d).inp

002502419.b3lyp_6-31g(d).qchem.inp (generated)

002502419.b3lyp_6-31g(d).gjf (generated)

002502419.b3lyp_6-31g(d).firefly.inp (generated)

002502419.b3lyp_6-31g(d).smash.inp (generated)

002502419.b3lyp_6-31g(d).nwchem.inp (generated) 002502419.b3lyp_6-31g(d).log.xz 002502419.td-b3lyp_6-31g+(d).inp 002502419.td-b3lyp_6-31g+(d).log.xz

002502419.td-b3lyp_6-31+g(d).qchem.inp (generated)

002502419.td-b3lyp_6-31+g(d).gjf (generated)

002502419.td-b3lyp_6-31+g(d).firefly.inp (generated)

002502419.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002502419.mol 002502419.PUBCHEM 002502419.mol (via Jmol)
002502420.b3lyp_6-31g(d).inp

002502420.b3lyp_6-31g(d).qchem.inp (generated)

002502420.b3lyp_6-31g(d).gjf (generated)

002502420.b3lyp_6-31g(d).firefly.inp (generated)

002502420.b3lyp_6-31g(d).smash.inp (generated)

002502420.b3lyp_6-31g(d).nwchem.inp (generated) 002502420.b3lyp_6-31g(d).log.xz 002502420.td-b3lyp_6-31g+(d).inp 002502420.td-b3lyp_6-31g+(d).log.xz

002502420.td-b3lyp_6-31+g(d).qchem.inp (generated)

002502420.td-b3lyp_6-31+g(d).gjf (generated)

002502420.td-b3lyp_6-31+g(d).firefly.inp (generated)

002502420.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002502420.mol 002502420.PUBCHEM 002502420.mol (via Jmol)
002502423.b3lyp_6-31g(d).inp

002502423.b3lyp_6-31g(d).qchem.inp (generated)

002502423.b3lyp_6-31g(d).gjf (generated)

002502423.b3lyp_6-31g(d).firefly.inp (generated)

002502423.b3lyp_6-31g(d).smash.inp (generated)

002502423.b3lyp_6-31g(d).nwchem.inp (generated) 002502423.b3lyp_6-31g(d).log.xz 002502423.td-b3lyp_6-31g+(d).inp 002502423.td-b3lyp_6-31g+(d).log.xz

002502423.td-b3lyp_6-31+g(d).qchem.inp (generated)

002502423.td-b3lyp_6-31+g(d).gjf (generated)

002502423.td-b3lyp_6-31+g(d).firefly.inp (generated)

002502423.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002502423.mol 002502423.PUBCHEM 002502423.mol (via Jmol)
002502530.b3lyp_6-31g(d).inp

002502530.b3lyp_6-31g(d).qchem.inp (generated)

002502530.b3lyp_6-31g(d).gjf (generated)

002502530.b3lyp_6-31g(d).firefly.inp (generated)

002502530.b3lyp_6-31g(d).smash.inp (generated)

002502530.b3lyp_6-31g(d).nwchem.inp (generated) 002502530.b3lyp_6-31g(d).log.xz 002502530.td-b3lyp_6-31g+(d).inp 002502530.td-b3lyp_6-31g+(d).log.xz

002502530.td-b3lyp_6-31+g(d).qchem.inp (generated)

002502530.td-b3lyp_6-31+g(d).gjf (generated)

002502530.td-b3lyp_6-31+g(d).firefly.inp (generated)

002502530.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002502530.mol 002502530.PUBCHEM 002502530.mol (via Jmol)
002502547.b3lyp_6-31g(d).inp

002502547.b3lyp_6-31g(d).qchem.inp (generated)

002502547.b3lyp_6-31g(d).gjf (generated)

002502547.b3lyp_6-31g(d).firefly.inp (generated)

002502547.b3lyp_6-31g(d).smash.inp (generated)

002502547.b3lyp_6-31g(d).nwchem.inp (generated) 002502547.b3lyp_6-31g(d).log.xz 002502547.td-b3lyp_6-31g+(d).inp 002502547.td-b3lyp_6-31g+(d).log.xz

002502547.td-b3lyp_6-31+g(d).qchem.inp (generated)

002502547.td-b3lyp_6-31+g(d).gjf (generated)

002502547.td-b3lyp_6-31+g(d).firefly.inp (generated)

002502547.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002502547.mol 002502547.PUBCHEM 002502547.mol (via Jmol)
002502548.b3lyp_6-31g(d).inp

002502548.b3lyp_6-31g(d).qchem.inp (generated)

002502548.b3lyp_6-31g(d).gjf (generated)

002502548.b3lyp_6-31g(d).firefly.inp (generated)

002502548.b3lyp_6-31g(d).smash.inp (generated)

002502548.b3lyp_6-31g(d).nwchem.inp (generated) 002502548.b3lyp_6-31g(d).log.xz 002502548.td-b3lyp_6-31g+(d).inp 002502548.td-b3lyp_6-31g+(d).log.xz

002502548.td-b3lyp_6-31+g(d).qchem.inp (generated)

002502548.td-b3lyp_6-31+g(d).gjf (generated)

002502548.td-b3lyp_6-31+g(d).firefly.inp (generated)

002502548.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002502548.mol 002502548.PUBCHEM 002502548.mol (via Jmol)
002502633.b3lyp_6-31g(d).inp

002502633.b3lyp_6-31g(d).qchem.inp (generated)

002502633.b3lyp_6-31g(d).gjf (generated)

002502633.b3lyp_6-31g(d).firefly.inp (generated)

002502633.b3lyp_6-31g(d).smash.inp (generated)

002502633.b3lyp_6-31g(d).nwchem.inp (generated) 002502633.b3lyp_6-31g(d).log.xz 002502633.td-b3lyp_6-31g+(d).inp 002502633.td-b3lyp_6-31g+(d).log.xz

002502633.td-b3lyp_6-31+g(d).qchem.inp (generated)

002502633.td-b3lyp_6-31+g(d).gjf (generated)

002502633.td-b3lyp_6-31+g(d).firefly.inp (generated)

002502633.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002502633.mol 002502633.PUBCHEM 002502633.mol (via Jmol)
002502634.b3lyp_6-31g(d).inp

002502634.b3lyp_6-31g(d).qchem.inp (generated)

002502634.b3lyp_6-31g(d).gjf (generated)

002502634.b3lyp_6-31g(d).firefly.inp (generated)

002502634.b3lyp_6-31g(d).smash.inp (generated)

002502634.b3lyp_6-31g(d).nwchem.inp (generated) 002502634.b3lyp_6-31g(d).log.xz 002502634.td-b3lyp_6-31g+(d).inp 002502634.td-b3lyp_6-31g+(d).log.xz

002502634.td-b3lyp_6-31+g(d).qchem.inp (generated)

002502634.td-b3lyp_6-31+g(d).gjf (generated)

002502634.td-b3lyp_6-31+g(d).firefly.inp (generated)

002502634.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002502634.mol 002502634.PUBCHEM 002502634.mol (via Jmol)
002502663.b3lyp_6-31g(d).inp

002502663.b3lyp_6-31g(d).qchem.inp (generated)

002502663.b3lyp_6-31g(d).gjf (generated)

002502663.b3lyp_6-31g(d).firefly.inp (generated)

002502663.b3lyp_6-31g(d).smash.inp (generated)

002502663.b3lyp_6-31g(d).nwchem.inp (generated) 002502663.b3lyp_6-31g(d).log.xz 002502663.td-b3lyp_6-31g+(d).inp 002502663.td-b3lyp_6-31g+(d).log.xz

002502663.td-b3lyp_6-31+g(d).qchem.inp (generated)

002502663.td-b3lyp_6-31+g(d).gjf (generated)

002502663.td-b3lyp_6-31+g(d).firefly.inp (generated)

002502663.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002502663.mol 002502663.PUBCHEM 002502663.mol (via Jmol)
002502720.b3lyp_6-31g(d).inp

002502720.b3lyp_6-31g(d).qchem.inp (generated)

002502720.b3lyp_6-31g(d).gjf (generated)

002502720.b3lyp_6-31g(d).firefly.inp (generated)

002502720.b3lyp_6-31g(d).smash.inp (generated)

002502720.b3lyp_6-31g(d).nwchem.inp (generated) 002502720.b3lyp_6-31g(d).log.xz 002502720.mol 002502720.PUBCHEM 002502720.mol (via Jmol)
002502837.b3lyp_6-31g(d).inp

002502837.b3lyp_6-31g(d).qchem.inp (generated)

002502837.b3lyp_6-31g(d).gjf (generated)

002502837.b3lyp_6-31g(d).firefly.inp (generated)

002502837.b3lyp_6-31g(d).smash.inp (generated)

002502837.b3lyp_6-31g(d).nwchem.inp (generated) 002502837.b3lyp_6-31g(d).log.xz 002502837.td-b3lyp_6-31g+(d).inp 002502837.td-b3lyp_6-31g+(d).log.xz

002502837.td-b3lyp_6-31+g(d).qchem.inp (generated)

002502837.td-b3lyp_6-31+g(d).gjf (generated)

002502837.td-b3lyp_6-31+g(d).firefly.inp (generated)

002502837.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002502837.mol 002502837.PUBCHEM 002502837.mol (via Jmol)
002502839.b3lyp_6-31g(d).inp

002502839.b3lyp_6-31g(d).qchem.inp (generated)

002502839.b3lyp_6-31g(d).gjf (generated)

002502839.b3lyp_6-31g(d).firefly.inp (generated)

002502839.b3lyp_6-31g(d).smash.inp (generated)

002502839.b3lyp_6-31g(d).nwchem.inp (generated) 002502839.b3lyp_6-31g(d).log.xz 002502839.td-b3lyp_6-31g+(d).inp 002502839.td-b3lyp_6-31g+(d).log.xz

002502839.td-b3lyp_6-31+g(d).qchem.inp (generated)

002502839.td-b3lyp_6-31+g(d).gjf (generated)

002502839.td-b3lyp_6-31+g(d).firefly.inp (generated)

002502839.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002502839.mol 002502839.PUBCHEM 002502839.mol (via Jmol)
002503429.b3lyp_6-31g(d).inp

002503429.b3lyp_6-31g(d).qchem.inp (generated)

002503429.b3lyp_6-31g(d).gjf (generated)

002503429.b3lyp_6-31g(d).firefly.inp (generated)

002503429.b3lyp_6-31g(d).smash.inp (generated)

002503429.b3lyp_6-31g(d).nwchem.inp (generated) 002503429.b3lyp_6-31g(d).log.xz 002503429.td-b3lyp_6-31g+(d).inp 002503429.td-b3lyp_6-31g+(d).log.xz

002503429.td-b3lyp_6-31+g(d).qchem.inp (generated)

002503429.td-b3lyp_6-31+g(d).gjf (generated)

002503429.td-b3lyp_6-31+g(d).firefly.inp (generated)

002503429.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002503429.mol 002503429.PUBCHEM 002503429.mol (via Jmol)
002503498.b3lyp_6-31g(d).inp

002503498.b3lyp_6-31g(d).qchem.inp (generated)

002503498.b3lyp_6-31g(d).gjf (generated)

002503498.b3lyp_6-31g(d).firefly.inp (generated)

002503498.b3lyp_6-31g(d).smash.inp (generated)

002503498.b3lyp_6-31g(d).nwchem.inp (generated) 002503498.b3lyp_6-31g(d).log.xz 002503498.td-b3lyp_6-31g+(d).inp 002503498.td-b3lyp_6-31g+(d).log.xz

002503498.td-b3lyp_6-31+g(d).qchem.inp (generated)

002503498.td-b3lyp_6-31+g(d).gjf (generated)

002503498.td-b3lyp_6-31+g(d).firefly.inp (generated)

002503498.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002503498.mol 002503498.PUBCHEM 002503498.mol (via Jmol)
002504298.b3lyp_6-31g(d).inp

002504298.b3lyp_6-31g(d).qchem.inp (generated)

002504298.b3lyp_6-31g(d).gjf (generated)

002504298.b3lyp_6-31g(d).firefly.inp (generated)

002504298.b3lyp_6-31g(d).smash.inp (generated)

002504298.b3lyp_6-31g(d).nwchem.inp (generated) 002504298.b3lyp_6-31g(d).log.xz 002504298.td-b3lyp_6-31g+(d).inp 002504298.td-b3lyp_6-31g+(d).log.xz

002504298.td-b3lyp_6-31+g(d).qchem.inp (generated)

002504298.td-b3lyp_6-31+g(d).gjf (generated)

002504298.td-b3lyp_6-31+g(d).firefly.inp (generated)

002504298.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002504298.mol 002504298.PUBCHEM 002504298.mol (via Jmol)
002504837.b3lyp_6-31g(d).inp

002504837.b3lyp_6-31g(d).qchem.inp (generated)

002504837.b3lyp_6-31g(d).gjf (generated)

002504837.b3lyp_6-31g(d).firefly.inp (generated)

002504837.b3lyp_6-31g(d).smash.inp (generated)

002504837.b3lyp_6-31g(d).nwchem.inp (generated) 002504837.b3lyp_6-31g(d).log.xz 002504837.td-b3lyp_6-31g+(d).inp 002504837.td-b3lyp_6-31g+(d).log.xz

002504837.td-b3lyp_6-31+g(d).qchem.inp (generated)

002504837.td-b3lyp_6-31+g(d).gjf (generated)

002504837.td-b3lyp_6-31+g(d).firefly.inp (generated)

002504837.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002504837.mol 002504837.PUBCHEM 002504837.mol (via Jmol)
002504841.b3lyp_6-31g(d).inp

002504841.b3lyp_6-31g(d).qchem.inp (generated)

002504841.b3lyp_6-31g(d).gjf (generated)

002504841.b3lyp_6-31g(d).firefly.inp (generated)

002504841.b3lyp_6-31g(d).smash.inp (generated)

002504841.b3lyp_6-31g(d).nwchem.inp (generated) 002504841.b3lyp_6-31g(d).log.xz 002504841.td-b3lyp_6-31g+(d).inp 002504841.td-b3lyp_6-31g+(d).log.xz

002504841.td-b3lyp_6-31+g(d).qchem.inp (generated)

002504841.td-b3lyp_6-31+g(d).gjf (generated)

002504841.td-b3lyp_6-31+g(d).firefly.inp (generated)

002504841.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002504841.mol 002504841.PUBCHEM 002504841.mol (via Jmol)
002505446.b3lyp_6-31g(d).inp

002505446.b3lyp_6-31g(d).qchem.inp (generated)

002505446.b3lyp_6-31g(d).gjf (generated)

002505446.b3lyp_6-31g(d).firefly.inp (generated)

002505446.b3lyp_6-31g(d).smash.inp (generated)

002505446.b3lyp_6-31g(d).nwchem.inp (generated) 002505446.b3lyp_6-31g(d).log.xz 002505446.td-b3lyp_6-31g+(d).inp 002505446.td-b3lyp_6-31g+(d).log.xz

002505446.td-b3lyp_6-31+g(d).qchem.inp (generated)

002505446.td-b3lyp_6-31+g(d).gjf (generated)

002505446.td-b3lyp_6-31+g(d).firefly.inp (generated)

002505446.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002505446.mol 002505446.PUBCHEM 002505446.mol (via Jmol)
002505447.b3lyp_6-31g(d).inp

002505447.b3lyp_6-31g(d).qchem.inp (generated)

002505447.b3lyp_6-31g(d).gjf (generated)

002505447.b3lyp_6-31g(d).firefly.inp (generated)

002505447.b3lyp_6-31g(d).smash.inp (generated)

002505447.b3lyp_6-31g(d).nwchem.inp (generated) 002505447.b3lyp_6-31g(d).log.xz 002505447.td-b3lyp_6-31g+(d).inp 002505447.td-b3lyp_6-31g+(d).log.xz

002505447.td-b3lyp_6-31+g(d).qchem.inp (generated)

002505447.td-b3lyp_6-31+g(d).gjf (generated)

002505447.td-b3lyp_6-31+g(d).firefly.inp (generated)

002505447.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002505447.mol 002505447.PUBCHEM 002505447.mol (via Jmol)
002505465.b3lyp_6-31g(d).inp

002505465.b3lyp_6-31g(d).qchem.inp (generated)

002505465.b3lyp_6-31g(d).gjf (generated)

002505465.b3lyp_6-31g(d).firefly.inp (generated)

002505465.b3lyp_6-31g(d).smash.inp (generated)

002505465.b3lyp_6-31g(d).nwchem.inp (generated) 002505465.b3lyp_6-31g(d).log.xz 002505465.mol 002505465.PUBCHEM 002505465.mol (via Jmol)
002505990.b3lyp_6-31g(d).inp

002505990.b3lyp_6-31g(d).qchem.inp (generated)

002505990.b3lyp_6-31g(d).gjf (generated)

002505990.b3lyp_6-31g(d).firefly.inp (generated)

002505990.b3lyp_6-31g(d).smash.inp (generated)

002505990.b3lyp_6-31g(d).nwchem.inp (generated) 002505990.b3lyp_6-31g(d).log.xz 002505990.td-b3lyp_6-31g+(d).inp 002505990.td-b3lyp_6-31g+(d).log.xz

002505990.td-b3lyp_6-31+g(d).qchem.inp (generated)

002505990.td-b3lyp_6-31+g(d).gjf (generated)

002505990.td-b3lyp_6-31+g(d).firefly.inp (generated)

002505990.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002505990.mol 002505990.PUBCHEM 002505990.mol (via Jmol)
002506317.b3lyp_6-31g(d).inp

002506317.b3lyp_6-31g(d).qchem.inp (generated)

002506317.b3lyp_6-31g(d).gjf (generated)

002506317.b3lyp_6-31g(d).firefly.inp (generated)

002506317.b3lyp_6-31g(d).smash.inp (generated)

002506317.b3lyp_6-31g(d).nwchem.inp (generated) 002506317.b3lyp_6-31g(d).log.xz 002506317.td-b3lyp_6-31g+(d).inp 002506317.td-b3lyp_6-31g+(d).log.xz

002506317.td-b3lyp_6-31+g(d).qchem.inp (generated)

002506317.td-b3lyp_6-31+g(d).gjf (generated)

002506317.td-b3lyp_6-31+g(d).firefly.inp (generated)

002506317.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002506317.mol 002506317.PUBCHEM 002506317.mol (via Jmol)
002506335.b3lyp_6-31g(d).inp

002506335.b3lyp_6-31g(d).qchem.inp (generated)

002506335.b3lyp_6-31g(d).gjf (generated)

002506335.b3lyp_6-31g(d).firefly.inp (generated)

002506335.b3lyp_6-31g(d).smash.inp (generated)

002506335.b3lyp_6-31g(d).nwchem.inp (generated) 002506335.b3lyp_6-31g(d).log.xz 002506335.td-b3lyp_6-31g+(d).inp 002506335.td-b3lyp_6-31g+(d).log.xz

002506335.td-b3lyp_6-31+g(d).qchem.inp (generated)

002506335.td-b3lyp_6-31+g(d).gjf (generated)

002506335.td-b3lyp_6-31+g(d).firefly.inp (generated)

002506335.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002506335.mol 002506335.PUBCHEM 002506335.mol (via Jmol)
002506417.b3lyp_6-31g(d).inp

002506417.b3lyp_6-31g(d).qchem.inp (generated)

002506417.b3lyp_6-31g(d).gjf (generated)

002506417.b3lyp_6-31g(d).firefly.inp (generated)

002506417.b3lyp_6-31g(d).smash.inp (generated)

002506417.b3lyp_6-31g(d).nwchem.inp (generated) 002506417.b3lyp_6-31g(d).log.xz 002506417.td-b3lyp_6-31g+(d).inp 002506417.td-b3lyp_6-31g+(d).log.xz

002506417.td-b3lyp_6-31+g(d).qchem.inp (generated)

002506417.td-b3lyp_6-31+g(d).gjf (generated)

002506417.td-b3lyp_6-31+g(d).firefly.inp (generated)

002506417.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002506417.mol 002506417.PUBCHEM 002506417.mol (via Jmol)
002506419.b3lyp_6-31g(d).inp

002506419.b3lyp_6-31g(d).qchem.inp (generated)

002506419.b3lyp_6-31g(d).gjf (generated)

002506419.b3lyp_6-31g(d).firefly.inp (generated)

002506419.b3lyp_6-31g(d).smash.inp (generated)

002506419.b3lyp_6-31g(d).nwchem.inp (generated) 002506419.b3lyp_6-31g(d).log.xz 002506419.td-b3lyp_6-31g+(d).inp 002506419.td-b3lyp_6-31g+(d).log.xz

002506419.td-b3lyp_6-31+g(d).qchem.inp (generated)

002506419.td-b3lyp_6-31+g(d).gjf (generated)

002506419.td-b3lyp_6-31+g(d).firefly.inp (generated)

002506419.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002506419.mol 002506419.PUBCHEM 002506419.mol (via Jmol)
002506548.b3lyp_6-31g(d).inp

002506548.b3lyp_6-31g(d).qchem.inp (generated)

002506548.b3lyp_6-31g(d).gjf (generated)

002506548.b3lyp_6-31g(d).firefly.inp (generated)

002506548.b3lyp_6-31g(d).smash.inp (generated)

002506548.b3lyp_6-31g(d).nwchem.inp (generated) 002506548.b3lyp_6-31g(d).log.xz 002506548.td-b3lyp_6-31g+(d).inp 002506548.td-b3lyp_6-31g+(d).log.xz

002506548.td-b3lyp_6-31+g(d).qchem.inp (generated)

002506548.td-b3lyp_6-31+g(d).gjf (generated)

002506548.td-b3lyp_6-31+g(d).firefly.inp (generated)

002506548.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002506548.mol 002506548.PUBCHEM 002506548.mol (via Jmol)
002506551.b3lyp_6-31g(d).inp

002506551.b3lyp_6-31g(d).qchem.inp (generated)

002506551.b3lyp_6-31g(d).gjf (generated)

002506551.b3lyp_6-31g(d).firefly.inp (generated)

002506551.b3lyp_6-31g(d).smash.inp (generated)

002506551.b3lyp_6-31g(d).nwchem.inp (generated) 002506551.b3lyp_6-31g(d).log.xz 002506551.td-b3lyp_6-31g+(d).inp 002506551.td-b3lyp_6-31g+(d).log.xz

002506551.td-b3lyp_6-31+g(d).qchem.inp (generated)

002506551.td-b3lyp_6-31+g(d).gjf (generated)

002506551.td-b3lyp_6-31+g(d).firefly.inp (generated)

002506551.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002506551.mol 002506551.PUBCHEM 002506551.mol (via Jmol)
002506563.b3lyp_6-31g(d).inp

002506563.b3lyp_6-31g(d).qchem.inp (generated)

002506563.b3lyp_6-31g(d).gjf (generated)

002506563.b3lyp_6-31g(d).firefly.inp (generated)

002506563.b3lyp_6-31g(d).smash.inp (generated)

002506563.b3lyp_6-31g(d).nwchem.inp (generated) 002506563.b3lyp_6-31g(d).log.xz 002506563.td-b3lyp_6-31g+(d).inp 002506563.td-b3lyp_6-31g+(d).log.xz

002506563.td-b3lyp_6-31+g(d).qchem.inp (generated)

002506563.td-b3lyp_6-31+g(d).gjf (generated)

002506563.td-b3lyp_6-31+g(d).firefly.inp (generated)

002506563.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002506563.mol 002506563.PUBCHEM 002506563.mol (via Jmol)
002506587.b3lyp_6-31g(d).inp

002506587.b3lyp_6-31g(d).qchem.inp (generated)

002506587.b3lyp_6-31g(d).gjf (generated)

002506587.b3lyp_6-31g(d).firefly.inp (generated)

002506587.b3lyp_6-31g(d).smash.inp (generated)

002506587.b3lyp_6-31g(d).nwchem.inp (generated) 002506587.b3lyp_6-31g(d).log.xz 002506587.td-b3lyp_6-31g+(d).inp 002506587.td-b3lyp_6-31g+(d).log.xz

002506587.td-b3lyp_6-31+g(d).qchem.inp (generated)

002506587.td-b3lyp_6-31+g(d).gjf (generated)

002506587.td-b3lyp_6-31+g(d).firefly.inp (generated)

002506587.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002506587.mol 002506587.PUBCHEM 002506587.mol (via Jmol)
002506948.b3lyp_6-31g(d).inp

002506948.b3lyp_6-31g(d).qchem.inp (generated)

002506948.b3lyp_6-31g(d).gjf (generated)

002506948.b3lyp_6-31g(d).firefly.inp (generated)

002506948.b3lyp_6-31g(d).smash.inp (generated)

002506948.b3lyp_6-31g(d).nwchem.inp (generated) 002506948.b3lyp_6-31g(d).log.xz 002506948.td-b3lyp_6-31g+(d).inp 002506948.td-b3lyp_6-31g+(d).log.xz

002506948.td-b3lyp_6-31+g(d).qchem.inp (generated)

002506948.td-b3lyp_6-31+g(d).gjf (generated)

002506948.td-b3lyp_6-31+g(d).firefly.inp (generated)

002506948.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002506948.mol 002506948.PUBCHEM 002506948.mol (via Jmol)
002507542.b3lyp_6-31g(d).inp

002507542.b3lyp_6-31g(d).qchem.inp (generated)

002507542.b3lyp_6-31g(d).gjf (generated)

002507542.b3lyp_6-31g(d).firefly.inp (generated)

002507542.b3lyp_6-31g(d).smash.inp (generated)

002507542.b3lyp_6-31g(d).nwchem.inp (generated) 002507542.b3lyp_6-31g(d).log.xz 002507542.td-b3lyp_6-31g+(d).inp 002507542.td-b3lyp_6-31g+(d).log.xz

002507542.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507542.td-b3lyp_6-31+g(d).gjf (generated)

002507542.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507542.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507542.mol 002507542.PUBCHEM 002507542.mol (via Jmol)
002507682.b3lyp_6-31g(d).inp

002507682.b3lyp_6-31g(d).qchem.inp (generated)

002507682.b3lyp_6-31g(d).gjf (generated)

002507682.b3lyp_6-31g(d).firefly.inp (generated)

002507682.b3lyp_6-31g(d).smash.inp (generated)

002507682.b3lyp_6-31g(d).nwchem.inp (generated) 002507682.b3lyp_6-31g(d).log.xz 002507682.mol 002507682.PUBCHEM 002507682.mol (via Jmol)
002507685.b3lyp_6-31g(d).inp

002507685.b3lyp_6-31g(d).qchem.inp (generated)

002507685.b3lyp_6-31g(d).gjf (generated)

002507685.b3lyp_6-31g(d).firefly.inp (generated)

002507685.b3lyp_6-31g(d).smash.inp (generated)

002507685.b3lyp_6-31g(d).nwchem.inp (generated) 002507685.b3lyp_6-31g(d).log.xz 002507685.td-b3lyp_6-31g+(d).inp 002507685.td-b3lyp_6-31g+(d).log.xz

002507685.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507685.td-b3lyp_6-31+g(d).gjf (generated)

002507685.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507685.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507685.mol 002507685.PUBCHEM 002507685.mol (via Jmol)
002507686.b3lyp_6-31g(d).inp

002507686.b3lyp_6-31g(d).qchem.inp (generated)

002507686.b3lyp_6-31g(d).gjf (generated)

002507686.b3lyp_6-31g(d).firefly.inp (generated)

002507686.b3lyp_6-31g(d).smash.inp (generated)

002507686.b3lyp_6-31g(d).nwchem.inp (generated) 002507686.b3lyp_6-31g(d).log.xz 002507686.td-b3lyp_6-31g+(d).inp 002507686.td-b3lyp_6-31g+(d).log.xz

002507686.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507686.td-b3lyp_6-31+g(d).gjf (generated)

002507686.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507686.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507686.mol 002507686.PUBCHEM 002507686.mol (via Jmol)
002507689.b3lyp_6-31g(d).inp

002507689.b3lyp_6-31g(d).qchem.inp (generated)

002507689.b3lyp_6-31g(d).gjf (generated)

002507689.b3lyp_6-31g(d).firefly.inp (generated)

002507689.b3lyp_6-31g(d).smash.inp (generated)

002507689.b3lyp_6-31g(d).nwchem.inp (generated) 002507689.b3lyp_6-31g(d).log.xz 002507689.td-b3lyp_6-31g+(d).inp 002507689.td-b3lyp_6-31g+(d).log.xz

002507689.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507689.td-b3lyp_6-31+g(d).gjf (generated)

002507689.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507689.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507689.mol 002507689.PUBCHEM 002507689.mol (via Jmol)
002507690.b3lyp_6-31g(d).inp

002507690.b3lyp_6-31g(d).qchem.inp (generated)

002507690.b3lyp_6-31g(d).gjf (generated)

002507690.b3lyp_6-31g(d).firefly.inp (generated)

002507690.b3lyp_6-31g(d).smash.inp (generated)

002507690.b3lyp_6-31g(d).nwchem.inp (generated) 002507690.b3lyp_6-31g(d).log.xz 002507690.td-b3lyp_6-31g+(d).inp 002507690.td-b3lyp_6-31g+(d).log.xz

002507690.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507690.td-b3lyp_6-31+g(d).gjf (generated)

002507690.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507690.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507690.mol 002507690.PUBCHEM 002507690.mol (via Jmol)
002507691.b3lyp_6-31g(d).inp

002507691.b3lyp_6-31g(d).qchem.inp (generated)

002507691.b3lyp_6-31g(d).gjf (generated)

002507691.b3lyp_6-31g(d).firefly.inp (generated)

002507691.b3lyp_6-31g(d).smash.inp (generated)

002507691.b3lyp_6-31g(d).nwchem.inp (generated) 002507691.b3lyp_6-31g(d).log.xz 002507691.td-b3lyp_6-31g+(d).inp 002507691.td-b3lyp_6-31g+(d).log.xz

002507691.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507691.td-b3lyp_6-31+g(d).gjf (generated)

002507691.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507691.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507691.mol 002507691.PUBCHEM 002507691.mol (via Jmol)
002507697.b3lyp_6-31g(d).inp

002507697.b3lyp_6-31g(d).qchem.inp (generated)

002507697.b3lyp_6-31g(d).gjf (generated)

002507697.b3lyp_6-31g(d).firefly.inp (generated)

002507697.b3lyp_6-31g(d).smash.inp (generated)

002507697.b3lyp_6-31g(d).nwchem.inp (generated) 002507697.b3lyp_6-31g(d).log.xz 002507697.td-b3lyp_6-31g+(d).inp 002507697.td-b3lyp_6-31g+(d).log.xz

002507697.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507697.td-b3lyp_6-31+g(d).gjf (generated)

002507697.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507697.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507697.mol 002507697.PUBCHEM 002507697.mol (via Jmol)
002507704.b3lyp_6-31g(d).inp

002507704.b3lyp_6-31g(d).qchem.inp (generated)

002507704.b3lyp_6-31g(d).gjf (generated)

002507704.b3lyp_6-31g(d).firefly.inp (generated)

002507704.b3lyp_6-31g(d).smash.inp (generated)

002507704.b3lyp_6-31g(d).nwchem.inp (generated) 002507704.b3lyp_6-31g(d).log.xz 002507704.td-b3lyp_6-31g+(d).inp 002507704.td-b3lyp_6-31g+(d).log.xz

002507704.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507704.td-b3lyp_6-31+g(d).gjf (generated)

002507704.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507704.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507704.mol 002507704.PUBCHEM 002507704.mol (via Jmol)
002507706.b3lyp_6-31g(d).inp

002507706.b3lyp_6-31g(d).qchem.inp (generated)

002507706.b3lyp_6-31g(d).gjf (generated)

002507706.b3lyp_6-31g(d).firefly.inp (generated)

002507706.b3lyp_6-31g(d).smash.inp (generated)

002507706.b3lyp_6-31g(d).nwchem.inp (generated) 002507706.b3lyp_6-31g(d).log.xz 002507706.td-b3lyp_6-31g+(d).inp 002507706.td-b3lyp_6-31g+(d).log.xz

002507706.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507706.td-b3lyp_6-31+g(d).gjf (generated)

002507706.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507706.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507706.mol 002507706.PUBCHEM 002507706.mol (via Jmol)
002507709.b3lyp_6-31g(d).inp

002507709.b3lyp_6-31g(d).qchem.inp (generated)

002507709.b3lyp_6-31g(d).gjf (generated)

002507709.b3lyp_6-31g(d).firefly.inp (generated)

002507709.b3lyp_6-31g(d).smash.inp (generated)

002507709.b3lyp_6-31g(d).nwchem.inp (generated) 002507709.b3lyp_6-31g(d).log.xz 002507709.td-b3lyp_6-31g+(d).inp 002507709.td-b3lyp_6-31g+(d).log.xz

002507709.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507709.td-b3lyp_6-31+g(d).gjf (generated)

002507709.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507709.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507709.mol 002507709.PUBCHEM 002507709.mol (via Jmol)
002507712.b3lyp_6-31g(d).inp

002507712.b3lyp_6-31g(d).qchem.inp (generated)

002507712.b3lyp_6-31g(d).gjf (generated)

002507712.b3lyp_6-31g(d).firefly.inp (generated)

002507712.b3lyp_6-31g(d).smash.inp (generated)

002507712.b3lyp_6-31g(d).nwchem.inp (generated) 002507712.b3lyp_6-31g(d).log.xz 002507712.td-b3lyp_6-31g+(d).inp 002507712.td-b3lyp_6-31g+(d).log.xz

002507712.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507712.td-b3lyp_6-31+g(d).gjf (generated)

002507712.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507712.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507712.mol 002507712.PUBCHEM 002507712.mol (via Jmol)
002507720.b3lyp_6-31g(d).inp

002507720.b3lyp_6-31g(d).qchem.inp (generated)

002507720.b3lyp_6-31g(d).gjf (generated)

002507720.b3lyp_6-31g(d).firefly.inp (generated)

002507720.b3lyp_6-31g(d).smash.inp (generated)

002507720.b3lyp_6-31g(d).nwchem.inp (generated) 002507720.b3lyp_6-31g(d).log.xz 002507720.td-b3lyp_6-31g+(d).inp 002507720.td-b3lyp_6-31g+(d).log.xz

002507720.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507720.td-b3lyp_6-31+g(d).gjf (generated)

002507720.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507720.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507720.mol 002507720.PUBCHEM 002507720.mol (via Jmol)
002507735.b3lyp_6-31g(d).inp

002507735.b3lyp_6-31g(d).qchem.inp (generated)

002507735.b3lyp_6-31g(d).gjf (generated)

002507735.b3lyp_6-31g(d).firefly.inp (generated)

002507735.b3lyp_6-31g(d).smash.inp (generated)

002507735.b3lyp_6-31g(d).nwchem.inp (generated) 002507735.b3lyp_6-31g(d).log.xz 002507735.td-b3lyp_6-31g+(d).inp 002507735.td-b3lyp_6-31g+(d).log.xz

002507735.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507735.td-b3lyp_6-31+g(d).gjf (generated)

002507735.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507735.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507735.mol 002507735.PUBCHEM 002507735.mol (via Jmol)
002507736.b3lyp_6-31g(d).inp

002507736.b3lyp_6-31g(d).qchem.inp (generated)

002507736.b3lyp_6-31g(d).gjf (generated)

002507736.b3lyp_6-31g(d).firefly.inp (generated)

002507736.b3lyp_6-31g(d).smash.inp (generated)

002507736.b3lyp_6-31g(d).nwchem.inp (generated) 002507736.b3lyp_6-31g(d).log.xz 002507736.td-b3lyp_6-31g+(d).inp 002507736.td-b3lyp_6-31g+(d).log.xz

002507736.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507736.td-b3lyp_6-31+g(d).gjf (generated)

002507736.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507736.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507736.mol 002507736.PUBCHEM 002507736.mol (via Jmol)
002507739.b3lyp_6-31g(d).inp

002507739.b3lyp_6-31g(d).qchem.inp (generated)

002507739.b3lyp_6-31g(d).gjf (generated)

002507739.b3lyp_6-31g(d).firefly.inp (generated)

002507739.b3lyp_6-31g(d).smash.inp (generated)

002507739.b3lyp_6-31g(d).nwchem.inp (generated) 002507739.b3lyp_6-31g(d).log.xz 002507739.td-b3lyp_6-31g+(d).inp 002507739.td-b3lyp_6-31g+(d).log.xz

002507739.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507739.td-b3lyp_6-31+g(d).gjf (generated)

002507739.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507739.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507739.mol 002507739.PUBCHEM 002507739.mol (via Jmol)
002507742.b3lyp_6-31g(d).inp

002507742.b3lyp_6-31g(d).qchem.inp (generated)

002507742.b3lyp_6-31g(d).gjf (generated)

002507742.b3lyp_6-31g(d).firefly.inp (generated)

002507742.b3lyp_6-31g(d).smash.inp (generated)

002507742.b3lyp_6-31g(d).nwchem.inp (generated) 002507742.b3lyp_6-31g(d).log.xz 002507742.td-b3lyp_6-31g+(d).inp 002507742.td-b3lyp_6-31g+(d).log.xz

002507742.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507742.td-b3lyp_6-31+g(d).gjf (generated)

002507742.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507742.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507742.mol 002507742.PUBCHEM 002507742.mol (via Jmol)
002507753.b3lyp_6-31g(d).inp

002507753.b3lyp_6-31g(d).qchem.inp (generated)

002507753.b3lyp_6-31g(d).gjf (generated)

002507753.b3lyp_6-31g(d).firefly.inp (generated)

002507753.b3lyp_6-31g(d).smash.inp (generated)

002507753.b3lyp_6-31g(d).nwchem.inp (generated) 002507753.b3lyp_6-31g(d).log.xz 002507753.td-b3lyp_6-31g+(d).inp 002507753.td-b3lyp_6-31g+(d).log.xz

002507753.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507753.td-b3lyp_6-31+g(d).gjf (generated)

002507753.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507753.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507753.mol 002507753.PUBCHEM 002507753.mol (via Jmol)
002507795.b3lyp_6-31g(d).inp

002507795.b3lyp_6-31g(d).qchem.inp (generated)

002507795.b3lyp_6-31g(d).gjf (generated)

002507795.b3lyp_6-31g(d).firefly.inp (generated)

002507795.b3lyp_6-31g(d).smash.inp (generated)

002507795.b3lyp_6-31g(d).nwchem.inp (generated) 002507795.b3lyp_6-31g(d).log.xz 002507795.mol 002507795.PUBCHEM 002507795.mol (via Jmol)
002507797.b3lyp_6-31g(d).inp

002507797.b3lyp_6-31g(d).qchem.inp (generated)

002507797.b3lyp_6-31g(d).gjf (generated)

002507797.b3lyp_6-31g(d).firefly.inp (generated)

002507797.b3lyp_6-31g(d).smash.inp (generated)

002507797.b3lyp_6-31g(d).nwchem.inp (generated) 002507797.b3lyp_6-31g(d).log.xz 002507797.mol 002507797.PUBCHEM 002507797.mol (via Jmol)
002507801.b3lyp_6-31g(d).inp

002507801.b3lyp_6-31g(d).qchem.inp (generated)

002507801.b3lyp_6-31g(d).gjf (generated)

002507801.b3lyp_6-31g(d).firefly.inp (generated)

002507801.b3lyp_6-31g(d).smash.inp (generated)

002507801.b3lyp_6-31g(d).nwchem.inp (generated) 002507801.b3lyp_6-31g(d).log.xz 002507801.td-b3lyp_6-31g+(d).inp 002507801.td-b3lyp_6-31g+(d).log.xz

002507801.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507801.td-b3lyp_6-31+g(d).gjf (generated)

002507801.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507801.mol 002507801.PUBCHEM 002507801.mol (via Jmol)
002507807.b3lyp_6-31g(d).inp

002507807.b3lyp_6-31g(d).qchem.inp (generated)

002507807.b3lyp_6-31g(d).gjf (generated)

002507807.b3lyp_6-31g(d).firefly.inp (generated)

002507807.b3lyp_6-31g(d).smash.inp (generated)

002507807.b3lyp_6-31g(d).nwchem.inp (generated) 002507807.b3lyp_6-31g(d).log.xz 002507807.td-b3lyp_6-31g+(d).inp 002507807.td-b3lyp_6-31g+(d).log.xz

002507807.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507807.td-b3lyp_6-31+g(d).gjf (generated)

002507807.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507807.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507807.mol 002507807.PUBCHEM 002507807.mol (via Jmol)
002507813.b3lyp_6-31g(d).inp

002507813.b3lyp_6-31g(d).qchem.inp (generated)

002507813.b3lyp_6-31g(d).gjf (generated)

002507813.b3lyp_6-31g(d).firefly.inp (generated)

002507813.b3lyp_6-31g(d).smash.inp (generated)

002507813.b3lyp_6-31g(d).nwchem.inp (generated) 002507813.b3lyp_6-31g(d).log.xz 002507813.td-b3lyp_6-31g+(d).inp 002507813.td-b3lyp_6-31g+(d).log.xz

002507813.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507813.td-b3lyp_6-31+g(d).gjf (generated)

002507813.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507813.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507813.mol 002507813.PUBCHEM 002507813.mol (via Jmol)
002507816.b3lyp_6-31g(d).inp

002507816.b3lyp_6-31g(d).qchem.inp (generated)

002507816.b3lyp_6-31g(d).gjf (generated)

002507816.b3lyp_6-31g(d).firefly.inp (generated)

002507816.b3lyp_6-31g(d).smash.inp (generated)

002507816.b3lyp_6-31g(d).nwchem.inp (generated) 002507816.b3lyp_6-31g(d).log.xz 002507816.td-b3lyp_6-31g+(d).inp 002507816.td-b3lyp_6-31g+(d).log.xz

002507816.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507816.td-b3lyp_6-31+g(d).gjf (generated)

002507816.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507816.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507816.mol 002507816.PUBCHEM 002507816.mol (via Jmol)
002507820.b3lyp_6-31g(d).inp

002507820.b3lyp_6-31g(d).qchem.inp (generated)

002507820.b3lyp_6-31g(d).gjf (generated)

002507820.b3lyp_6-31g(d).firefly.inp (generated)

002507820.b3lyp_6-31g(d).smash.inp (generated)

002507820.b3lyp_6-31g(d).nwchem.inp (generated) 002507820.b3lyp_6-31g(d).log.xz 002507820.td-b3lyp_6-31g+(d).inp 002507820.td-b3lyp_6-31g+(d).log.xz

002507820.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507820.td-b3lyp_6-31+g(d).gjf (generated)

002507820.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507820.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507820.mol 002507820.PUBCHEM 002507820.mol (via Jmol)
002507827.b3lyp_6-31g(d).inp

002507827.b3lyp_6-31g(d).qchem.inp (generated)

002507827.b3lyp_6-31g(d).gjf (generated)

002507827.b3lyp_6-31g(d).firefly.inp (generated)

002507827.b3lyp_6-31g(d).smash.inp (generated)

002507827.b3lyp_6-31g(d).nwchem.inp (generated) 002507827.b3lyp_6-31g(d).log.xz 002507827.td-b3lyp_6-31g+(d).inp 002507827.td-b3lyp_6-31g+(d).log.xz

002507827.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507827.td-b3lyp_6-31+g(d).gjf (generated)

002507827.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507827.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507827.mol 002507827.PUBCHEM 002507827.mol (via Jmol)
002507831.b3lyp_6-31g(d).inp

002507831.b3lyp_6-31g(d).qchem.inp (generated)

002507831.b3lyp_6-31g(d).gjf (generated)

002507831.b3lyp_6-31g(d).firefly.inp (generated)

002507831.b3lyp_6-31g(d).smash.inp (generated)

002507831.b3lyp_6-31g(d).nwchem.inp (generated) 002507831.b3lyp_6-31g(d).log.xz 002507831.td-b3lyp_6-31g+(d).inp 002507831.td-b3lyp_6-31g+(d).log.xz

002507831.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507831.td-b3lyp_6-31+g(d).gjf (generated)

002507831.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507831.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507831.mol 002507831.PUBCHEM 002507831.mol (via Jmol)
002507834.b3lyp_6-31g(d).inp

002507834.b3lyp_6-31g(d).qchem.inp (generated)

002507834.b3lyp_6-31g(d).gjf (generated)

002507834.b3lyp_6-31g(d).firefly.inp (generated)

002507834.b3lyp_6-31g(d).smash.inp (generated)

002507834.b3lyp_6-31g(d).nwchem.inp (generated) 002507834.b3lyp_6-31g(d).log.xz 002507834.td-b3lyp_6-31g+(d).inp 002507834.td-b3lyp_6-31g+(d).log.xz

002507834.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507834.td-b3lyp_6-31+g(d).gjf (generated)

002507834.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507834.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507834.mol 002507834.PUBCHEM 002507834.mol (via Jmol)
002507835.b3lyp_6-31g(d).inp

002507835.b3lyp_6-31g(d).qchem.inp (generated)

002507835.b3lyp_6-31g(d).gjf (generated)

002507835.b3lyp_6-31g(d).firefly.inp (generated)

002507835.b3lyp_6-31g(d).smash.inp (generated)

002507835.b3lyp_6-31g(d).nwchem.inp (generated) 002507835.b3lyp_6-31g(d).log.xz 002507835.td-b3lyp_6-31g+(d).inp 002507835.td-b3lyp_6-31g+(d).log.xz

002507835.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507835.td-b3lyp_6-31+g(d).gjf (generated)

002507835.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507835.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507835.mol 002507835.PUBCHEM 002507835.mol (via Jmol)
002507842.b3lyp_6-31g(d).inp

002507842.b3lyp_6-31g(d).qchem.inp (generated)

002507842.b3lyp_6-31g(d).gjf (generated)

002507842.b3lyp_6-31g(d).firefly.inp (generated)

002507842.b3lyp_6-31g(d).smash.inp (generated)

002507842.b3lyp_6-31g(d).nwchem.inp (generated) 002507842.b3lyp_6-31g(d).log.xz 002507842.td-b3lyp_6-31g+(d).inp 002507842.td-b3lyp_6-31g+(d).log.xz

002507842.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507842.td-b3lyp_6-31+g(d).gjf (generated)

002507842.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507842.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507842.mol 002507842.PUBCHEM 002507842.mol (via Jmol)
002507845.b3lyp_6-31g(d).inp

002507845.b3lyp_6-31g(d).qchem.inp (generated)

002507845.b3lyp_6-31g(d).gjf (generated)

002507845.b3lyp_6-31g(d).firefly.inp (generated)

002507845.b3lyp_6-31g(d).smash.inp (generated)

002507845.b3lyp_6-31g(d).nwchem.inp (generated) 002507845.b3lyp_6-31g(d).log.xz 002507845.td-b3lyp_6-31g+(d).inp 002507845.td-b3lyp_6-31g+(d).log.xz

002507845.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507845.td-b3lyp_6-31+g(d).gjf (generated)

002507845.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507845.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507845.mol 002507845.PUBCHEM 002507845.mol (via Jmol)
002507846.b3lyp_6-31g(d).inp

002507846.b3lyp_6-31g(d).qchem.inp (generated)

002507846.b3lyp_6-31g(d).gjf (generated)

002507846.b3lyp_6-31g(d).firefly.inp (generated)

002507846.b3lyp_6-31g(d).smash.inp (generated)

002507846.b3lyp_6-31g(d).nwchem.inp (generated) 002507846.b3lyp_6-31g(d).log.xz 002507846.td-b3lyp_6-31g+(d).inp 002507846.td-b3lyp_6-31g+(d).log.xz

002507846.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507846.td-b3lyp_6-31+g(d).gjf (generated)

002507846.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507846.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507846.mol 002507846.PUBCHEM 002507846.mol (via Jmol)
002507848.b3lyp_6-31g(d).inp

002507848.b3lyp_6-31g(d).qchem.inp (generated)

002507848.b3lyp_6-31g(d).gjf (generated)

002507848.b3lyp_6-31g(d).firefly.inp (generated)

002507848.b3lyp_6-31g(d).smash.inp (generated)

002507848.b3lyp_6-31g(d).nwchem.inp (generated) 002507848.b3lyp_6-31g(d).log.xz 002507848.td-b3lyp_6-31g+(d).inp 002507848.td-b3lyp_6-31g+(d).log.xz

002507848.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507848.td-b3lyp_6-31+g(d).gjf (generated)

002507848.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507848.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507848.mol 002507848.PUBCHEM 002507848.mol (via Jmol)
002507849.b3lyp_6-31g(d).inp

002507849.b3lyp_6-31g(d).qchem.inp (generated)

002507849.b3lyp_6-31g(d).gjf (generated)

002507849.b3lyp_6-31g(d).firefly.inp (generated)

002507849.b3lyp_6-31g(d).smash.inp (generated)

002507849.b3lyp_6-31g(d).nwchem.inp (generated) 002507849.b3lyp_6-31g(d).log.xz 002507849.td-b3lyp_6-31g+(d).inp 002507849.td-b3lyp_6-31g+(d).log.xz

002507849.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507849.td-b3lyp_6-31+g(d).gjf (generated)

002507849.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507849.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507849.mol 002507849.PUBCHEM 002507849.mol (via Jmol)
002507852.b3lyp_6-31g(d).inp

002507852.b3lyp_6-31g(d).qchem.inp (generated)

002507852.b3lyp_6-31g(d).gjf (generated)

002507852.b3lyp_6-31g(d).firefly.inp (generated)

002507852.b3lyp_6-31g(d).smash.inp (generated)

002507852.b3lyp_6-31g(d).nwchem.inp (generated) 002507852.b3lyp_6-31g(d).log.xz 002507852.td-b3lyp_6-31g+(d).inp 002507852.td-b3lyp_6-31g+(d).log.xz

002507852.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507852.td-b3lyp_6-31+g(d).gjf (generated)

002507852.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507852.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507852.mol 002507852.PUBCHEM 002507852.mol (via Jmol)
002507853.b3lyp_6-31g(d).inp

002507853.b3lyp_6-31g(d).qchem.inp (generated)

002507853.b3lyp_6-31g(d).gjf (generated)

002507853.b3lyp_6-31g(d).firefly.inp (generated)

002507853.b3lyp_6-31g(d).smash.inp (generated)

002507853.b3lyp_6-31g(d).nwchem.inp (generated) 002507853.b3lyp_6-31g(d).log.xz 002507853.td-b3lyp_6-31g+(d).inp 002507853.td-b3lyp_6-31g+(d).log.xz

002507853.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507853.td-b3lyp_6-31+g(d).gjf (generated)

002507853.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507853.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507853.mol 002507853.PUBCHEM 002507853.mol (via Jmol)
002507855.b3lyp_6-31g(d).inp

002507855.b3lyp_6-31g(d).qchem.inp (generated)

002507855.b3lyp_6-31g(d).gjf (generated)

002507855.b3lyp_6-31g(d).firefly.inp (generated)

002507855.b3lyp_6-31g(d).smash.inp (generated)

002507855.b3lyp_6-31g(d).nwchem.inp (generated) 002507855.b3lyp_6-31g(d).log.xz 002507855.td-b3lyp_6-31g+(d).inp 002507855.td-b3lyp_6-31g+(d).log.xz

002507855.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507855.td-b3lyp_6-31+g(d).gjf (generated)

002507855.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507855.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507855.mol 002507855.PUBCHEM 002507855.mol (via Jmol)
002507856.b3lyp_6-31g(d).inp

002507856.b3lyp_6-31g(d).qchem.inp (generated)

002507856.b3lyp_6-31g(d).gjf (generated)

002507856.b3lyp_6-31g(d).firefly.inp (generated)

002507856.b3lyp_6-31g(d).smash.inp (generated)

002507856.b3lyp_6-31g(d).nwchem.inp (generated) 002507856.b3lyp_6-31g(d).log.xz 002507856.td-b3lyp_6-31g+(d).inp 002507856.td-b3lyp_6-31g+(d).log.xz

002507856.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507856.td-b3lyp_6-31+g(d).gjf (generated)

002507856.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507856.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507856.mol 002507856.PUBCHEM 002507856.mol (via Jmol)
002507862.b3lyp_6-31g(d).inp

002507862.b3lyp_6-31g(d).qchem.inp (generated)

002507862.b3lyp_6-31g(d).gjf (generated)

002507862.b3lyp_6-31g(d).firefly.inp (generated)

002507862.b3lyp_6-31g(d).smash.inp (generated)

002507862.b3lyp_6-31g(d).nwchem.inp (generated) 002507862.b3lyp_6-31g(d).log.xz 002507862.td-b3lyp_6-31g+(d).inp 002507862.td-b3lyp_6-31g+(d).log.xz

002507862.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507862.td-b3lyp_6-31+g(d).gjf (generated)

002507862.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507862.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507862.mol 002507862.PUBCHEM 002507862.mol (via Jmol)
002507863.b3lyp_6-31g(d).inp

002507863.b3lyp_6-31g(d).qchem.inp (generated)

002507863.b3lyp_6-31g(d).gjf (generated)

002507863.b3lyp_6-31g(d).firefly.inp (generated)

002507863.b3lyp_6-31g(d).smash.inp (generated)

002507863.b3lyp_6-31g(d).nwchem.inp (generated) 002507863.b3lyp_6-31g(d).log.xz 002507863.td-b3lyp_6-31g+(d).inp 002507863.td-b3lyp_6-31g+(d).log.xz

002507863.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507863.td-b3lyp_6-31+g(d).gjf (generated)

002507863.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507863.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507863.mol 002507863.PUBCHEM 002507863.mol (via Jmol)
002507867.b3lyp_6-31g(d).inp

002507867.b3lyp_6-31g(d).qchem.inp (generated)

002507867.b3lyp_6-31g(d).gjf (generated)

002507867.b3lyp_6-31g(d).firefly.inp (generated)

002507867.b3lyp_6-31g(d).smash.inp (generated)

002507867.b3lyp_6-31g(d).nwchem.inp (generated) 002507867.b3lyp_6-31g(d).log.xz 002507867.td-b3lyp_6-31g+(d).inp 002507867.td-b3lyp_6-31g+(d).log.xz

002507867.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507867.td-b3lyp_6-31+g(d).gjf (generated)

002507867.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507867.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507867.mol 002507867.PUBCHEM 002507867.mol (via Jmol)
002507870.b3lyp_6-31g(d).inp

002507870.b3lyp_6-31g(d).qchem.inp (generated)

002507870.b3lyp_6-31g(d).gjf (generated)

002507870.b3lyp_6-31g(d).firefly.inp (generated)

002507870.b3lyp_6-31g(d).smash.inp (generated)

002507870.b3lyp_6-31g(d).nwchem.inp (generated) 002507870.b3lyp_6-31g(d).log.xz 002507870.td-b3lyp_6-31g+(d).inp 002507870.td-b3lyp_6-31g+(d).log.xz

002507870.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507870.td-b3lyp_6-31+g(d).gjf (generated)

002507870.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507870.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507870.mol 002507870.PUBCHEM 002507870.mol (via Jmol)
002507871.b3lyp_6-31g(d).inp

002507871.b3lyp_6-31g(d).qchem.inp (generated)

002507871.b3lyp_6-31g(d).gjf (generated)

002507871.b3lyp_6-31g(d).firefly.inp (generated)

002507871.b3lyp_6-31g(d).smash.inp (generated)

002507871.b3lyp_6-31g(d).nwchem.inp (generated) 002507871.b3lyp_6-31g(d).log.xz 002507871.td-b3lyp_6-31g+(d).inp 002507871.td-b3lyp_6-31g+(d).log.xz

002507871.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507871.td-b3lyp_6-31+g(d).gjf (generated)

002507871.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507871.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507871.mol 002507871.PUBCHEM 002507871.mol (via Jmol)
002507876.b3lyp_6-31g(d).inp

002507876.b3lyp_6-31g(d).qchem.inp (generated)

002507876.b3lyp_6-31g(d).gjf (generated)

002507876.b3lyp_6-31g(d).firefly.inp (generated)

002507876.b3lyp_6-31g(d).smash.inp (generated)

002507876.b3lyp_6-31g(d).nwchem.inp (generated) 002507876.b3lyp_6-31g(d).log.xz 002507876.td-b3lyp_6-31g+(d).inp 002507876.td-b3lyp_6-31g+(d).log.xz

002507876.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507876.td-b3lyp_6-31+g(d).gjf (generated)

002507876.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507876.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507876.mol 002507876.PUBCHEM 002507876.mol (via Jmol)
002507877.b3lyp_6-31g(d).inp

002507877.b3lyp_6-31g(d).qchem.inp (generated)

002507877.b3lyp_6-31g(d).gjf (generated)

002507877.b3lyp_6-31g(d).firefly.inp (generated)

002507877.b3lyp_6-31g(d).smash.inp (generated)

002507877.b3lyp_6-31g(d).nwchem.inp (generated) 002507877.b3lyp_6-31g(d).log.xz 002507877.td-b3lyp_6-31g+(d).inp 002507877.td-b3lyp_6-31g+(d).log.xz

002507877.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507877.td-b3lyp_6-31+g(d).gjf (generated)

002507877.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507877.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507877.mol 002507877.PUBCHEM 002507877.mol (via Jmol)
002507881.b3lyp_6-31g(d).inp

002507881.b3lyp_6-31g(d).qchem.inp (generated)

002507881.b3lyp_6-31g(d).gjf (generated)

002507881.b3lyp_6-31g(d).firefly.inp (generated)

002507881.b3lyp_6-31g(d).smash.inp (generated)

002507881.b3lyp_6-31g(d).nwchem.inp (generated) 002507881.b3lyp_6-31g(d).log.xz 002507881.td-b3lyp_6-31g+(d).inp 002507881.td-b3lyp_6-31g+(d).log.xz

002507881.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507881.td-b3lyp_6-31+g(d).gjf (generated)

002507881.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507881.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507881.mol 002507881.PUBCHEM 002507881.mol (via Jmol)
002507885.b3lyp_6-31g(d).inp

002507885.b3lyp_6-31g(d).qchem.inp (generated)

002507885.b3lyp_6-31g(d).gjf (generated)

002507885.b3lyp_6-31g(d).firefly.inp (generated)

002507885.b3lyp_6-31g(d).smash.inp (generated)

002507885.b3lyp_6-31g(d).nwchem.inp (generated) 002507885.b3lyp_6-31g(d).log.xz 002507885.td-b3lyp_6-31g+(d).inp 002507885.td-b3lyp_6-31g+(d).log.xz

002507885.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507885.td-b3lyp_6-31+g(d).gjf (generated)

002507885.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507885.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507885.mol 002507885.PUBCHEM 002507885.mol (via Jmol)
002507886.b3lyp_6-31g(d).inp

002507886.b3lyp_6-31g(d).qchem.inp (generated)

002507886.b3lyp_6-31g(d).gjf (generated)

002507886.b3lyp_6-31g(d).firefly.inp (generated)

002507886.b3lyp_6-31g(d).smash.inp (generated)

002507886.b3lyp_6-31g(d).nwchem.inp (generated) 002507886.b3lyp_6-31g(d).log.xz 002507886.td-b3lyp_6-31g+(d).inp 002507886.td-b3lyp_6-31g+(d).log.xz

002507886.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507886.td-b3lyp_6-31+g(d).gjf (generated)

002507886.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507886.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507886.mol 002507886.PUBCHEM 002507886.mol (via Jmol)
002507889.b3lyp_6-31g(d).inp

002507889.b3lyp_6-31g(d).qchem.inp (generated)

002507889.b3lyp_6-31g(d).gjf (generated)

002507889.b3lyp_6-31g(d).firefly.inp (generated)

002507889.b3lyp_6-31g(d).smash.inp (generated)

002507889.b3lyp_6-31g(d).nwchem.inp (generated) 002507889.b3lyp_6-31g(d).log.xz 002507889.td-b3lyp_6-31g+(d).inp 002507889.td-b3lyp_6-31g+(d).log.xz

002507889.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507889.td-b3lyp_6-31+g(d).gjf (generated)

002507889.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507889.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507889.mol 002507889.PUBCHEM 002507889.mol (via Jmol)
002507890.b3lyp_6-31g(d).inp

002507890.b3lyp_6-31g(d).qchem.inp (generated)

002507890.b3lyp_6-31g(d).gjf (generated)

002507890.b3lyp_6-31g(d).firefly.inp (generated)

002507890.b3lyp_6-31g(d).smash.inp (generated)

002507890.b3lyp_6-31g(d).nwchem.inp (generated) 002507890.b3lyp_6-31g(d).log.xz 002507890.td-b3lyp_6-31g+(d).inp 002507890.td-b3lyp_6-31g+(d).log.xz

002507890.td-b3lyp_6-31+g(d).qchem.inp (generated)

002507890.td-b3lyp_6-31+g(d).gjf (generated)

002507890.td-b3lyp_6-31+g(d).firefly.inp (generated)

002507890.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002507890.mol 002507890.PUBCHEM 002507890.mol (via Jmol)
002507894.b3lyp_6-31g(d).inp

002507894.b3lyp_6-31g(d).qchem.inp (generated)

002507894.b3lyp_6-31g(d).gjf (generated)

002507894.b3lyp_6-31g(d).firefly.inp (generated)

002507894.b3lyp_6-31g(d).smash.inp (generated)

002507894.b3lyp_6-31g(d).nwchem.inp (generated) 002507894.b3lyp_6-31g(d).log.xz 002507894.mol 002507894.PUBCHEM 002507894.mol (via Jmol)
002508140.b3lyp_6-31g(d).inp

002508140.b3lyp_6-31g(d).qchem.inp (generated)

002508140.b3lyp_6-31g(d).gjf (generated)

002508140.b3lyp_6-31g(d).firefly.inp (generated)

002508140.b3lyp_6-31g(d).smash.inp (generated)

002508140.b3lyp_6-31g(d).nwchem.inp (generated) 002508140.b3lyp_6-31g(d).log.xz 002508140.td-b3lyp_6-31g+(d).inp 002508140.td-b3lyp_6-31g+(d).log.xz

002508140.td-b3lyp_6-31+g(d).qchem.inp (generated)

002508140.td-b3lyp_6-31+g(d).gjf (generated)

002508140.td-b3lyp_6-31+g(d).firefly.inp (generated)

002508140.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002508140.mol 002508140.PUBCHEM 002508140.mol (via Jmol)
002508171.b3lyp_6-31g(d).inp

002508171.b3lyp_6-31g(d).qchem.inp (generated)

002508171.b3lyp_6-31g(d).gjf (generated)

002508171.b3lyp_6-31g(d).firefly.inp (generated)

002508171.b3lyp_6-31g(d).smash.inp (generated)

002508171.b3lyp_6-31g(d).nwchem.inp (generated) 002508171.b3lyp_6-31g(d).log.xz 002508171.td-b3lyp_6-31g+(d).inp 002508171.td-b3lyp_6-31g+(d).log.xz

002508171.td-b3lyp_6-31+g(d).qchem.inp (generated)

002508171.td-b3lyp_6-31+g(d).gjf (generated)

002508171.td-b3lyp_6-31+g(d).firefly.inp (generated)

002508171.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002508171.mol 002508171.PUBCHEM 002508171.mol (via Jmol)
002508179.b3lyp_6-31g(d).inp

002508179.b3lyp_6-31g(d).qchem.inp (generated)

002508179.b3lyp_6-31g(d).gjf (generated)

002508179.b3lyp_6-31g(d).firefly.inp (generated)

002508179.b3lyp_6-31g(d).smash.inp (generated)

002508179.b3lyp_6-31g(d).nwchem.inp (generated) 002508179.b3lyp_6-31g(d).log.xz 002508179.td-b3lyp_6-31g+(d).inp 002508179.td-b3lyp_6-31g+(d).log.xz

002508179.td-b3lyp_6-31+g(d).qchem.inp (generated)

002508179.td-b3lyp_6-31+g(d).gjf (generated)

002508179.td-b3lyp_6-31+g(d).firefly.inp (generated)

002508179.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002508179.mol 002508179.PUBCHEM 002508179.mol (via Jmol)
002508292.b3lyp_6-31g(d).inp

002508292.b3lyp_6-31g(d).qchem.inp (generated)

002508292.b3lyp_6-31g(d).gjf (generated)

002508292.b3lyp_6-31g(d).firefly.inp (generated)

002508292.b3lyp_6-31g(d).smash.inp (generated)

002508292.b3lyp_6-31g(d).nwchem.inp (generated) 002508292.b3lyp_6-31g(d).log.xz 002508292.mol 002508292.PUBCHEM 002508292.mol (via Jmol)
002508298.b3lyp_6-31g(d).inp

002508298.b3lyp_6-31g(d).qchem.inp (generated)

002508298.b3lyp_6-31g(d).gjf (generated)

002508298.b3lyp_6-31g(d).firefly.inp (generated)

002508298.b3lyp_6-31g(d).smash.inp (generated)

002508298.b3lyp_6-31g(d).nwchem.inp (generated) 002508298.b3lyp_6-31g(d).log.xz 002508298.td-b3lyp_6-31g+(d).inp 002508298.td-b3lyp_6-31g+(d).log.xz

002508298.td-b3lyp_6-31+g(d).qchem.inp (generated)

002508298.td-b3lyp_6-31+g(d).gjf (generated)

002508298.td-b3lyp_6-31+g(d).firefly.inp (generated)

002508298.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002508298.mol 002508298.PUBCHEM 002508298.mol (via Jmol)
002508301.b3lyp_6-31g(d).inp

002508301.b3lyp_6-31g(d).qchem.inp (generated)

002508301.b3lyp_6-31g(d).gjf (generated)

002508301.b3lyp_6-31g(d).firefly.inp (generated)

002508301.b3lyp_6-31g(d).smash.inp (generated)

002508301.b3lyp_6-31g(d).nwchem.inp (generated) 002508301.b3lyp_6-31g(d).log.xz 002508301.td-b3lyp_6-31g+(d).inp 002508301.td-b3lyp_6-31g+(d).log.xz

002508301.td-b3lyp_6-31+g(d).qchem.inp (generated)

002508301.td-b3lyp_6-31+g(d).gjf (generated)

002508301.td-b3lyp_6-31+g(d).firefly.inp (generated)

002508301.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002508301.mol 002508301.PUBCHEM 002508301.mol (via Jmol)
002508417.b3lyp_6-31g(d).inp

002508417.b3lyp_6-31g(d).qchem.inp (generated)

002508417.b3lyp_6-31g(d).gjf (generated)

002508417.b3lyp_6-31g(d).firefly.inp (generated)

002508417.b3lyp_6-31g(d).smash.inp (generated)

002508417.b3lyp_6-31g(d).nwchem.inp (generated) 002508417.b3lyp_6-31g(d).log.xz 002508417.td-b3lyp_6-31g+(d).inp 002508417.td-b3lyp_6-31g+(d).log.xz

002508417.td-b3lyp_6-31+g(d).qchem.inp (generated)

002508417.td-b3lyp_6-31+g(d).gjf (generated)

002508417.td-b3lyp_6-31+g(d).firefly.inp (generated)

002508417.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002508417.mol 002508417.PUBCHEM 002508417.mol (via Jmol)
002508927.b3lyp_6-31g(d).inp

002508927.b3lyp_6-31g(d).qchem.inp (generated)

002508927.b3lyp_6-31g(d).gjf (generated)

002508927.b3lyp_6-31g(d).firefly.inp (generated)

002508927.b3lyp_6-31g(d).smash.inp (generated)

002508927.b3lyp_6-31g(d).nwchem.inp (generated) 002508927.b3lyp_6-31g(d).log.xz 002508927.td-b3lyp_6-31g+(d).inp 002508927.td-b3lyp_6-31g+(d).log.xz

002508927.td-b3lyp_6-31+g(d).qchem.inp (generated)

002508927.td-b3lyp_6-31+g(d).gjf (generated)

002508927.td-b3lyp_6-31+g(d).firefly.inp (generated)

002508927.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002508927.mol 002508927.PUBCHEM 002508927.mol (via Jmol)
002509065.b3lyp_6-31g(d).inp

002509065.b3lyp_6-31g(d).qchem.inp (generated)

002509065.b3lyp_6-31g(d).gjf (generated)

002509065.b3lyp_6-31g(d).firefly.inp (generated)

002509065.b3lyp_6-31g(d).smash.inp (generated)

002509065.b3lyp_6-31g(d).nwchem.inp (generated) 002509065.b3lyp_6-31g(d).log.xz 002509065.td-b3lyp_6-31g+(d).inp 002509065.td-b3lyp_6-31g+(d).log.xz

002509065.td-b3lyp_6-31+g(d).qchem.inp (generated)

002509065.td-b3lyp_6-31+g(d).gjf (generated)

002509065.td-b3lyp_6-31+g(d).firefly.inp (generated)

002509065.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002509065.mol 002509065.PUBCHEM 002509065.mol (via Jmol)
002509853.b3lyp_6-31g(d).inp

002509853.b3lyp_6-31g(d).qchem.inp (generated)

002509853.b3lyp_6-31g(d).gjf (generated)

002509853.b3lyp_6-31g(d).firefly.inp (generated)

002509853.b3lyp_6-31g(d).smash.inp (generated)

002509853.b3lyp_6-31g(d).nwchem.inp (generated) 002509853.b3lyp_6-31g(d).log.xz 002509853.td-b3lyp_6-31g+(d).inp 002509853.td-b3lyp_6-31g+(d).log.xz

002509853.td-b3lyp_6-31+g(d).qchem.inp (generated)

002509853.td-b3lyp_6-31+g(d).gjf (generated)

002509853.td-b3lyp_6-31+g(d).firefly.inp (generated)

002509853.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002509853.mol 002509853.PUBCHEM 002509853.mol (via Jmol)
002510353.b3lyp_6-31g(d).inp

002510353.b3lyp_6-31g(d).qchem.inp (generated)

002510353.b3lyp_6-31g(d).gjf (generated)

002510353.b3lyp_6-31g(d).firefly.inp (generated)

002510353.b3lyp_6-31g(d).smash.inp (generated)

002510353.b3lyp_6-31g(d).nwchem.inp (generated) 002510353.b3lyp_6-31g(d).log.xz 002510353.td-b3lyp_6-31g+(d).inp 002510353.td-b3lyp_6-31g+(d).log.xz

002510353.td-b3lyp_6-31+g(d).qchem.inp (generated)

002510353.td-b3lyp_6-31+g(d).gjf (generated)

002510353.td-b3lyp_6-31+g(d).firefly.inp (generated)

002510353.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002510353.mol 002510353.PUBCHEM 002510353.mol (via Jmol)
002510513.b3lyp_6-31g(d).inp

002510513.b3lyp_6-31g(d).qchem.inp (generated)

002510513.b3lyp_6-31g(d).gjf (generated)

002510513.b3lyp_6-31g(d).firefly.inp (generated)

002510513.b3lyp_6-31g(d).smash.inp (generated)

002510513.b3lyp_6-31g(d).nwchem.inp (generated) 002510513.b3lyp_6-31g(d).log.xz 002510513.mol 002510513.PUBCHEM 002510513.mol (via Jmol)
002510915.b3lyp_6-31g(d).inp

002510915.b3lyp_6-31g(d).qchem.inp (generated)

002510915.b3lyp_6-31g(d).gjf (generated)

002510915.b3lyp_6-31g(d).firefly.inp (generated)

002510915.b3lyp_6-31g(d).smash.inp (generated)

002510915.b3lyp_6-31g(d).nwchem.inp (generated) 002510915.b3lyp_6-31g(d).log.xz 002510915.td-b3lyp_6-31g+(d).inp 002510915.td-b3lyp_6-31g+(d).log.xz

002510915.td-b3lyp_6-31+g(d).qchem.inp (generated)

002510915.td-b3lyp_6-31+g(d).gjf (generated)

002510915.td-b3lyp_6-31+g(d).firefly.inp (generated)

002510915.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002510915.mol 002510915.PUBCHEM 002510915.mol (via Jmol)
002510918.b3lyp_6-31g(d).inp

002510918.b3lyp_6-31g(d).qchem.inp (generated)

002510918.b3lyp_6-31g(d).gjf (generated)

002510918.b3lyp_6-31g(d).firefly.inp (generated)

002510918.b3lyp_6-31g(d).smash.inp (generated)

002510918.b3lyp_6-31g(d).nwchem.inp (generated) 002510918.b3lyp_6-31g(d).log.xz 002510918.td-b3lyp_6-31g+(d).inp 002510918.td-b3lyp_6-31g+(d).log.xz

002510918.td-b3lyp_6-31+g(d).qchem.inp (generated)

002510918.td-b3lyp_6-31+g(d).gjf (generated)

002510918.td-b3lyp_6-31+g(d).firefly.inp (generated)

002510918.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002510918.mol 002510918.PUBCHEM 002510918.mol (via Jmol)
002510919.b3lyp_6-31g(d).inp

002510919.b3lyp_6-31g(d).qchem.inp (generated)

002510919.b3lyp_6-31g(d).gjf (generated)

002510919.b3lyp_6-31g(d).firefly.inp (generated)

002510919.b3lyp_6-31g(d).smash.inp (generated)

002510919.b3lyp_6-31g(d).nwchem.inp (generated) 002510919.b3lyp_6-31g(d).log.xz 002510919.mol 002510919.PUBCHEM 002510919.mol (via Jmol)
002510964.b3lyp_6-31g(d).inp

002510964.b3lyp_6-31g(d).qchem.inp (generated)

002510964.b3lyp_6-31g(d).gjf (generated)

002510964.b3lyp_6-31g(d).firefly.inp (generated)

002510964.b3lyp_6-31g(d).smash.inp (generated)

002510964.b3lyp_6-31g(d).nwchem.inp (generated) 002510964.b3lyp_6-31g(d).log.xz 002510964.td-b3lyp_6-31g+(d).inp 002510964.td-b3lyp_6-31g+(d).log.xz

002510964.td-b3lyp_6-31+g(d).qchem.inp (generated)

002510964.td-b3lyp_6-31+g(d).gjf (generated)

002510964.td-b3lyp_6-31+g(d).firefly.inp (generated)

002510964.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002510964.mol 002510964.PUBCHEM 002510964.mol (via Jmol)
002511036.b3lyp_6-31g(d).inp

002511036.b3lyp_6-31g(d).qchem.inp (generated)

002511036.b3lyp_6-31g(d).gjf (generated)

002511036.b3lyp_6-31g(d).firefly.inp (generated)

002511036.b3lyp_6-31g(d).smash.inp (generated)

002511036.b3lyp_6-31g(d).nwchem.inp (generated) 002511036.b3lyp_6-31g(d).log.xz 002511036.td-b3lyp_6-31g+(d).inp 002511036.td-b3lyp_6-31g+(d).log.xz

002511036.td-b3lyp_6-31+g(d).qchem.inp (generated)

002511036.td-b3lyp_6-31+g(d).gjf (generated)

002511036.td-b3lyp_6-31+g(d).firefly.inp (generated)

002511036.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002511036.mol 002511036.PUBCHEM 002511036.mol (via Jmol)
002511115.b3lyp_6-31g(d).inp

002511115.b3lyp_6-31g(d).qchem.inp (generated)

002511115.b3lyp_6-31g(d).gjf (generated)

002511115.b3lyp_6-31g(d).firefly.inp (generated)

002511115.b3lyp_6-31g(d).smash.inp (generated)

002511115.b3lyp_6-31g(d).nwchem.inp (generated) 002511115.b3lyp_6-31g(d).log.xz 002511115.td-b3lyp_6-31g+(d).inp 002511115.td-b3lyp_6-31g+(d).log.xz

002511115.td-b3lyp_6-31+g(d).qchem.inp (generated)

002511115.td-b3lyp_6-31+g(d).gjf (generated)

002511115.td-b3lyp_6-31+g(d).firefly.inp (generated)

002511115.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002511115.mol 002511115.PUBCHEM 002511115.mol (via Jmol)
002511120.b3lyp_6-31g(d).inp

002511120.b3lyp_6-31g(d).qchem.inp (generated)

002511120.b3lyp_6-31g(d).gjf (generated)

002511120.b3lyp_6-31g(d).firefly.inp (generated)

002511120.b3lyp_6-31g(d).smash.inp (generated)

002511120.b3lyp_6-31g(d).nwchem.inp (generated) 002511120.b3lyp_6-31g(d).log.xz 002511120.td-b3lyp_6-31g+(d).inp 002511120.td-b3lyp_6-31g+(d).log.xz

002511120.td-b3lyp_6-31+g(d).qchem.inp (generated)

002511120.td-b3lyp_6-31+g(d).gjf (generated)

002511120.td-b3lyp_6-31+g(d).firefly.inp (generated)

002511120.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002511120.mol 002511120.PUBCHEM 002511120.mol (via Jmol)
002511126.b3lyp_6-31g(d).inp

002511126.b3lyp_6-31g(d).qchem.inp (generated)

002511126.b3lyp_6-31g(d).gjf (generated)

002511126.b3lyp_6-31g(d).firefly.inp (generated)

002511126.b3lyp_6-31g(d).smash.inp (generated)

002511126.b3lyp_6-31g(d).nwchem.inp (generated) 002511126.b3lyp_6-31g(d).log.xz 002511126.td-b3lyp_6-31g+(d).inp 002511126.td-b3lyp_6-31g+(d).log.xz

002511126.td-b3lyp_6-31+g(d).qchem.inp (generated)

002511126.td-b3lyp_6-31+g(d).gjf (generated)

002511126.td-b3lyp_6-31+g(d).firefly.inp (generated)

002511126.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002511126.mol 002511126.PUBCHEM 002511126.mol (via Jmol)
002511161.b3lyp_6-31g(d).inp

002511161.b3lyp_6-31g(d).qchem.inp (generated)

002511161.b3lyp_6-31g(d).gjf (generated)

002511161.b3lyp_6-31g(d).firefly.inp (generated)

002511161.b3lyp_6-31g(d).smash.inp (generated)

002511161.b3lyp_6-31g(d).nwchem.inp (generated) 002511161.b3lyp_6-31g(d).log.xz 002511161.td-b3lyp_6-31g+(d).inp 002511161.td-b3lyp_6-31g+(d).log.xz

002511161.td-b3lyp_6-31+g(d).qchem.inp (generated)

002511161.td-b3lyp_6-31+g(d).gjf (generated)

002511161.td-b3lyp_6-31+g(d).firefly.inp (generated)

002511161.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002511161.mol 002511161.PUBCHEM 002511161.mol (via Jmol)
002511212.b3lyp_6-31g(d).inp

002511212.b3lyp_6-31g(d).qchem.inp (generated)

002511212.b3lyp_6-31g(d).gjf (generated)

002511212.b3lyp_6-31g(d).firefly.inp (generated)

002511212.b3lyp_6-31g(d).smash.inp (generated)

002511212.b3lyp_6-31g(d).nwchem.inp (generated) 002511212.b3lyp_6-31g(d).log.xz 002511212.td-b3lyp_6-31g+(d).inp 002511212.td-b3lyp_6-31g+(d).log.xz

002511212.td-b3lyp_6-31+g(d).qchem.inp (generated)

002511212.td-b3lyp_6-31+g(d).gjf (generated)

002511212.td-b3lyp_6-31+g(d).firefly.inp (generated)

002511212.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002511212.mol 002511212.PUBCHEM 002511212.mol (via Jmol)
002511434.b3lyp_6-31g(d).inp

002511434.b3lyp_6-31g(d).qchem.inp (generated)

002511434.b3lyp_6-31g(d).gjf (generated)

002511434.b3lyp_6-31g(d).firefly.inp (generated)

002511434.b3lyp_6-31g(d).smash.inp (generated)

002511434.b3lyp_6-31g(d).nwchem.inp (generated) 002511434.b3lyp_6-31g(d).log.xz 002511434.td-b3lyp_6-31g+(d).inp 002511434.td-b3lyp_6-31g+(d).log.xz

002511434.td-b3lyp_6-31+g(d).qchem.inp (generated)

002511434.td-b3lyp_6-31+g(d).gjf (generated)

002511434.td-b3lyp_6-31+g(d).firefly.inp (generated)

002511434.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002511434.mol 002511434.PUBCHEM 002511434.mol (via Jmol)
002511559.b3lyp_6-31g(d).inp

002511559.b3lyp_6-31g(d).qchem.inp (generated)

002511559.b3lyp_6-31g(d).gjf (generated)

002511559.b3lyp_6-31g(d).firefly.inp (generated)

002511559.b3lyp_6-31g(d).smash.inp (generated)

002511559.b3lyp_6-31g(d).nwchem.inp (generated) 002511559.b3lyp_6-31g(d).log.xz 002511559.td-b3lyp_6-31g+(d).inp 002511559.td-b3lyp_6-31g+(d).log.xz

002511559.td-b3lyp_6-31+g(d).qchem.inp (generated)

002511559.td-b3lyp_6-31+g(d).gjf (generated)

002511559.td-b3lyp_6-31+g(d).firefly.inp (generated)

002511559.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002511559.mol 002511559.PUBCHEM 002511559.mol (via Jmol)
002512357.b3lyp_6-31g(d).inp

002512357.b3lyp_6-31g(d).qchem.inp (generated)

002512357.b3lyp_6-31g(d).gjf (generated)

002512357.b3lyp_6-31g(d).firefly.inp (generated)

002512357.b3lyp_6-31g(d).smash.inp (generated)

002512357.b3lyp_6-31g(d).nwchem.inp (generated) 002512357.b3lyp_6-31g(d).log.xz 002512357.td-b3lyp_6-31g+(d).inp 002512357.td-b3lyp_6-31g+(d).log.xz

002512357.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512357.td-b3lyp_6-31+g(d).gjf (generated)

002512357.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512357.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512357.mol 002512357.PUBCHEM 002512357.mol (via Jmol)
002512362.b3lyp_6-31g(d).inp

002512362.b3lyp_6-31g(d).qchem.inp (generated)

002512362.b3lyp_6-31g(d).gjf (generated)

002512362.b3lyp_6-31g(d).firefly.inp (generated)

002512362.b3lyp_6-31g(d).smash.inp (generated)

002512362.b3lyp_6-31g(d).nwchem.inp (generated) 002512362.b3lyp_6-31g(d).log.xz 002512362.td-b3lyp_6-31g+(d).inp 002512362.td-b3lyp_6-31g+(d).log.xz

002512362.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512362.td-b3lyp_6-31+g(d).gjf (generated)

002512362.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512362.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512362.mol 002512362.PUBCHEM 002512362.mol (via Jmol)
002512364.b3lyp_6-31g(d).inp

002512364.b3lyp_6-31g(d).qchem.inp (generated)

002512364.b3lyp_6-31g(d).gjf (generated)

002512364.b3lyp_6-31g(d).firefly.inp (generated)

002512364.b3lyp_6-31g(d).smash.inp (generated)

002512364.b3lyp_6-31g(d).nwchem.inp (generated) 002512364.b3lyp_6-31g(d).log.xz 002512364.td-b3lyp_6-31g+(d).inp 002512364.td-b3lyp_6-31g+(d).log.xz

002512364.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512364.td-b3lyp_6-31+g(d).gjf (generated)

002512364.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512364.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512364.mol 002512364.PUBCHEM 002512364.mol (via Jmol)
002512381.b3lyp_6-31g(d).inp

002512381.b3lyp_6-31g(d).qchem.inp (generated)

002512381.b3lyp_6-31g(d).gjf (generated)

002512381.b3lyp_6-31g(d).firefly.inp (generated)

002512381.b3lyp_6-31g(d).smash.inp (generated)

002512381.b3lyp_6-31g(d).nwchem.inp (generated) 002512381.b3lyp_6-31g(d).log.xz 002512381.td-b3lyp_6-31g+(d).inp 002512381.td-b3lyp_6-31g+(d).log.xz

002512381.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512381.td-b3lyp_6-31+g(d).gjf (generated)

002512381.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512381.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512381.mol 002512381.PUBCHEM 002512381.mol (via Jmol)
002512386.b3lyp_6-31g(d).inp

002512386.b3lyp_6-31g(d).qchem.inp (generated)

002512386.b3lyp_6-31g(d).gjf (generated)

002512386.b3lyp_6-31g(d).firefly.inp (generated)

002512386.b3lyp_6-31g(d).smash.inp (generated)

002512386.b3lyp_6-31g(d).nwchem.inp (generated) 002512386.b3lyp_6-31g(d).log.xz 002512386.td-b3lyp_6-31g+(d).inp 002512386.td-b3lyp_6-31g+(d).log.xz

002512386.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512386.td-b3lyp_6-31+g(d).gjf (generated)

002512386.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512386.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512386.mol 002512386.PUBCHEM 002512386.mol (via Jmol)
002512404.b3lyp_6-31g(d).inp

002512404.b3lyp_6-31g(d).qchem.inp (generated)

002512404.b3lyp_6-31g(d).gjf (generated)

002512404.b3lyp_6-31g(d).firefly.inp (generated)

002512404.b3lyp_6-31g(d).smash.inp (generated)

002512404.b3lyp_6-31g(d).nwchem.inp (generated) 002512404.b3lyp_6-31g(d).log.xz 002512404.td-b3lyp_6-31g+(d).inp 002512404.td-b3lyp_6-31g+(d).log.xz

002512404.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512404.td-b3lyp_6-31+g(d).gjf (generated)

002512404.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512404.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512404.mol 002512404.PUBCHEM 002512404.mol (via Jmol)
002512407.b3lyp_6-31g(d).inp

002512407.b3lyp_6-31g(d).qchem.inp (generated)

002512407.b3lyp_6-31g(d).gjf (generated)

002512407.b3lyp_6-31g(d).firefly.inp (generated)

002512407.b3lyp_6-31g(d).smash.inp (generated)

002512407.b3lyp_6-31g(d).nwchem.inp (generated) 002512407.b3lyp_6-31g(d).log.xz 002512407.td-b3lyp_6-31g+(d).inp 002512407.td-b3lyp_6-31g+(d).log.xz

002512407.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512407.td-b3lyp_6-31+g(d).gjf (generated)

002512407.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512407.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512407.mol 002512407.PUBCHEM 002512407.mol (via Jmol)
002512429.b3lyp_6-31g(d).inp

002512429.b3lyp_6-31g(d).qchem.inp (generated)

002512429.b3lyp_6-31g(d).gjf (generated)

002512429.b3lyp_6-31g(d).firefly.inp (generated)

002512429.b3lyp_6-31g(d).smash.inp (generated)

002512429.b3lyp_6-31g(d).nwchem.inp (generated) 002512429.b3lyp_6-31g(d).log.xz 002512429.td-b3lyp_6-31g+(d).inp 002512429.td-b3lyp_6-31g+(d).log.xz

002512429.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512429.td-b3lyp_6-31+g(d).gjf (generated)

002512429.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512429.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512429.mol 002512429.PUBCHEM 002512429.mol (via Jmol)
002512430.b3lyp_6-31g(d).inp

002512430.b3lyp_6-31g(d).qchem.inp (generated)

002512430.b3lyp_6-31g(d).gjf (generated)

002512430.b3lyp_6-31g(d).firefly.inp (generated)

002512430.b3lyp_6-31g(d).smash.inp (generated)

002512430.b3lyp_6-31g(d).nwchem.inp (generated) 002512430.b3lyp_6-31g(d).log.xz 002512430.td-b3lyp_6-31g+(d).inp 002512430.td-b3lyp_6-31g+(d).log.xz

002512430.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512430.td-b3lyp_6-31+g(d).gjf (generated)

002512430.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512430.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512430.mol 002512430.PUBCHEM 002512430.mol (via Jmol)
002512435.b3lyp_6-31g(d).inp

002512435.b3lyp_6-31g(d).qchem.inp (generated)

002512435.b3lyp_6-31g(d).gjf (generated)

002512435.b3lyp_6-31g(d).firefly.inp (generated)

002512435.b3lyp_6-31g(d).smash.inp (generated)

002512435.b3lyp_6-31g(d).nwchem.inp (generated) 002512435.b3lyp_6-31g(d).log.xz 002512435.td-b3lyp_6-31g+(d).inp 002512435.td-b3lyp_6-31g+(d).log.xz

002512435.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512435.td-b3lyp_6-31+g(d).gjf (generated)

002512435.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512435.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512435.mol 002512435.PUBCHEM 002512435.mol (via Jmol)
002512437.b3lyp_6-31g(d).inp

002512437.b3lyp_6-31g(d).qchem.inp (generated)

002512437.b3lyp_6-31g(d).gjf (generated)

002512437.b3lyp_6-31g(d).firefly.inp (generated)

002512437.b3lyp_6-31g(d).smash.inp (generated)

002512437.b3lyp_6-31g(d).nwchem.inp (generated) 002512437.b3lyp_6-31g(d).log.xz 002512437.td-b3lyp_6-31g+(d).inp 002512437.td-b3lyp_6-31g+(d).log.xz

002512437.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512437.td-b3lyp_6-31+g(d).gjf (generated)

002512437.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512437.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512437.mol 002512437.PUBCHEM 002512437.mol (via Jmol)
002512442.b3lyp_6-31g(d).inp

002512442.b3lyp_6-31g(d).qchem.inp (generated)

002512442.b3lyp_6-31g(d).gjf (generated)

002512442.b3lyp_6-31g(d).firefly.inp (generated)

002512442.b3lyp_6-31g(d).smash.inp (generated)

002512442.b3lyp_6-31g(d).nwchem.inp (generated) 002512442.b3lyp_6-31g(d).log.xz 002512442.td-b3lyp_6-31g+(d).inp 002512442.td-b3lyp_6-31g+(d).log.xz

002512442.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512442.td-b3lyp_6-31+g(d).gjf (generated)

002512442.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512442.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512442.mol 002512442.PUBCHEM 002512442.mol (via Jmol)
002512443.b3lyp_6-31g(d).inp

002512443.b3lyp_6-31g(d).qchem.inp (generated)

002512443.b3lyp_6-31g(d).gjf (generated)

002512443.b3lyp_6-31g(d).firefly.inp (generated)

002512443.b3lyp_6-31g(d).smash.inp (generated)

002512443.b3lyp_6-31g(d).nwchem.inp (generated) 002512443.b3lyp_6-31g(d).log.xz 002512443.td-b3lyp_6-31g+(d).inp 002512443.td-b3lyp_6-31g+(d).log.xz

002512443.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512443.td-b3lyp_6-31+g(d).gjf (generated)

002512443.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512443.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512443.mol 002512443.PUBCHEM 002512443.mol (via Jmol)
002512472.b3lyp_6-31g(d).inp

002512472.b3lyp_6-31g(d).qchem.inp (generated)

002512472.b3lyp_6-31g(d).gjf (generated)

002512472.b3lyp_6-31g(d).firefly.inp (generated)

002512472.b3lyp_6-31g(d).smash.inp (generated)

002512472.b3lyp_6-31g(d).nwchem.inp (generated) 002512472.b3lyp_6-31g(d).log.xz 002512472.td-b3lyp_6-31g+(d).inp 002512472.td-b3lyp_6-31g+(d).log.xz

002512472.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512472.td-b3lyp_6-31+g(d).gjf (generated)

002512472.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512472.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512472.mol 002512472.PUBCHEM 002512472.mol (via Jmol)
002512480.b3lyp_6-31g(d).inp

002512480.b3lyp_6-31g(d).qchem.inp (generated)

002512480.b3lyp_6-31g(d).gjf (generated)

002512480.b3lyp_6-31g(d).firefly.inp (generated)

002512480.b3lyp_6-31g(d).smash.inp (generated)

002512480.b3lyp_6-31g(d).nwchem.inp (generated) 002512480.b3lyp_6-31g(d).log.xz 002512480.td-b3lyp_6-31g+(d).inp 002512480.td-b3lyp_6-31g+(d).log.xz

002512480.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512480.td-b3lyp_6-31+g(d).gjf (generated)

002512480.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512480.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512480.mol 002512480.PUBCHEM 002512480.mol (via Jmol)
002512481.b3lyp_6-31g(d).inp

002512481.b3lyp_6-31g(d).qchem.inp (generated)

002512481.b3lyp_6-31g(d).gjf (generated)

002512481.b3lyp_6-31g(d).firefly.inp (generated)

002512481.b3lyp_6-31g(d).smash.inp (generated)

002512481.b3lyp_6-31g(d).nwchem.inp (generated) 002512481.b3lyp_6-31g(d).log.xz 002512481.td-b3lyp_6-31g+(d).inp 002512481.td-b3lyp_6-31g+(d).log.xz

002512481.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512481.td-b3lyp_6-31+g(d).gjf (generated)

002512481.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512481.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512481.mol 002512481.PUBCHEM 002512481.mol (via Jmol)
002512520.b3lyp_6-31g(d).inp

002512520.b3lyp_6-31g(d).qchem.inp (generated)

002512520.b3lyp_6-31g(d).gjf (generated)

002512520.b3lyp_6-31g(d).firefly.inp (generated)

002512520.b3lyp_6-31g(d).smash.inp (generated)

002512520.b3lyp_6-31g(d).nwchem.inp (generated) 002512520.b3lyp_6-31g(d).log.xz 002512520.td-b3lyp_6-31g+(d).inp 002512520.td-b3lyp_6-31g+(d).log.xz

002512520.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512520.td-b3lyp_6-31+g(d).gjf (generated)

002512520.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512520.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512520.mol 002512520.PUBCHEM 002512520.mol (via Jmol)
002512551.b3lyp_6-31g(d).inp

002512551.b3lyp_6-31g(d).qchem.inp (generated)

002512551.b3lyp_6-31g(d).gjf (generated)

002512551.b3lyp_6-31g(d).firefly.inp (generated)

002512551.b3lyp_6-31g(d).smash.inp (generated)

002512551.b3lyp_6-31g(d).nwchem.inp (generated) 002512551.b3lyp_6-31g(d).log.xz 002512551.td-b3lyp_6-31g+(d).inp 002512551.td-b3lyp_6-31g+(d).log.xz

002512551.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512551.td-b3lyp_6-31+g(d).gjf (generated)

002512551.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512551.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512551.mol 002512551.PUBCHEM 002512551.mol (via Jmol)
002512552.b3lyp_6-31g(d).inp

002512552.b3lyp_6-31g(d).qchem.inp (generated)

002512552.b3lyp_6-31g(d).gjf (generated)

002512552.b3lyp_6-31g(d).firefly.inp (generated)

002512552.b3lyp_6-31g(d).smash.inp (generated)

002512552.b3lyp_6-31g(d).nwchem.inp (generated) 002512552.b3lyp_6-31g(d).log.xz 002512552.td-b3lyp_6-31g+(d).inp 002512552.td-b3lyp_6-31g+(d).log.xz

002512552.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512552.td-b3lyp_6-31+g(d).gjf (generated)

002512552.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512552.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512552.mol 002512552.PUBCHEM 002512552.mol (via Jmol)
002512554.b3lyp_6-31g(d).inp

002512554.b3lyp_6-31g(d).qchem.inp (generated)

002512554.b3lyp_6-31g(d).gjf (generated)

002512554.b3lyp_6-31g(d).firefly.inp (generated)

002512554.b3lyp_6-31g(d).smash.inp (generated)

002512554.b3lyp_6-31g(d).nwchem.inp (generated) 002512554.b3lyp_6-31g(d).log.xz 002512554.td-b3lyp_6-31g+(d).inp 002512554.td-b3lyp_6-31g+(d).log.xz

002512554.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512554.td-b3lyp_6-31+g(d).gjf (generated)

002512554.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512554.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512554.mol 002512554.PUBCHEM 002512554.mol (via Jmol)
002512564.b3lyp_6-31g(d).inp

002512564.b3lyp_6-31g(d).qchem.inp (generated)

002512564.b3lyp_6-31g(d).gjf (generated)

002512564.b3lyp_6-31g(d).firefly.inp (generated)

002512564.b3lyp_6-31g(d).smash.inp (generated)

002512564.b3lyp_6-31g(d).nwchem.inp (generated) 002512564.b3lyp_6-31g(d).log.xz 002512564.td-b3lyp_6-31g+(d).inp 002512564.td-b3lyp_6-31g+(d).log.xz

002512564.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512564.td-b3lyp_6-31+g(d).gjf (generated)

002512564.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512564.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512564.mol 002512564.PUBCHEM 002512564.mol (via Jmol)
002512565.b3lyp_6-31g(d).inp

002512565.b3lyp_6-31g(d).qchem.inp (generated)

002512565.b3lyp_6-31g(d).gjf (generated)

002512565.b3lyp_6-31g(d).firefly.inp (generated)

002512565.b3lyp_6-31g(d).smash.inp (generated)

002512565.b3lyp_6-31g(d).nwchem.inp (generated) 002512565.b3lyp_6-31g(d).log.xz 002512565.td-b3lyp_6-31g+(d).inp 002512565.td-b3lyp_6-31g+(d).log.xz

002512565.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512565.td-b3lyp_6-31+g(d).gjf (generated)

002512565.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512565.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512565.mol 002512565.PUBCHEM 002512565.mol (via Jmol)
002512577.b3lyp_6-31g(d).inp

002512577.b3lyp_6-31g(d).qchem.inp (generated)

002512577.b3lyp_6-31g(d).gjf (generated)

002512577.b3lyp_6-31g(d).firefly.inp (generated)

002512577.b3lyp_6-31g(d).smash.inp (generated)

002512577.b3lyp_6-31g(d).nwchem.inp (generated) 002512577.b3lyp_6-31g(d).log.xz 002512577.td-b3lyp_6-31g+(d).inp 002512577.td-b3lyp_6-31g+(d).log.xz

002512577.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512577.td-b3lyp_6-31+g(d).gjf (generated)

002512577.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512577.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512577.mol 002512577.PUBCHEM 002512577.mol (via Jmol)
002512601.b3lyp_6-31g(d).inp

002512601.b3lyp_6-31g(d).qchem.inp (generated)

002512601.b3lyp_6-31g(d).gjf (generated)

002512601.b3lyp_6-31g(d).firefly.inp (generated)

002512601.b3lyp_6-31g(d).smash.inp (generated)

002512601.b3lyp_6-31g(d).nwchem.inp (generated) 002512601.b3lyp_6-31g(d).log.xz 002512601.td-b3lyp_6-31g+(d).inp 002512601.td-b3lyp_6-31g+(d).log.xz

002512601.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512601.td-b3lyp_6-31+g(d).gjf (generated)

002512601.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512601.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512601.mol 002512601.PUBCHEM 002512601.mol (via Jmol)
002512603.b3lyp_6-31g(d).inp

002512603.b3lyp_6-31g(d).qchem.inp (generated)

002512603.b3lyp_6-31g(d).gjf (generated)

002512603.b3lyp_6-31g(d).firefly.inp (generated)

002512603.b3lyp_6-31g(d).smash.inp (generated)

002512603.b3lyp_6-31g(d).nwchem.inp (generated) 002512603.b3lyp_6-31g(d).log.xz 002512603.td-b3lyp_6-31g+(d).inp 002512603.td-b3lyp_6-31g+(d).log.xz

002512603.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512603.td-b3lyp_6-31+g(d).gjf (generated)

002512603.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512603.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512603.mol 002512603.PUBCHEM 002512603.mol (via Jmol)
002512614.b3lyp_6-31g(d).inp

002512614.b3lyp_6-31g(d).qchem.inp (generated)

002512614.b3lyp_6-31g(d).gjf (generated)

002512614.b3lyp_6-31g(d).firefly.inp (generated)

002512614.b3lyp_6-31g(d).smash.inp (generated)

002512614.b3lyp_6-31g(d).nwchem.inp (generated) 002512614.b3lyp_6-31g(d).log.xz 002512614.td-b3lyp_6-31g+(d).inp 002512614.td-b3lyp_6-31g+(d).log.xz

002512614.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512614.td-b3lyp_6-31+g(d).gjf (generated)

002512614.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512614.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512614.mol 002512614.PUBCHEM 002512614.mol (via Jmol)
002512620.b3lyp_6-31g(d).inp

002512620.b3lyp_6-31g(d).qchem.inp (generated)

002512620.b3lyp_6-31g(d).gjf (generated)

002512620.b3lyp_6-31g(d).firefly.inp (generated)

002512620.b3lyp_6-31g(d).smash.inp (generated)

002512620.b3lyp_6-31g(d).nwchem.inp (generated) 002512620.b3lyp_6-31g(d).log.xz 002512620.td-b3lyp_6-31g+(d).inp 002512620.td-b3lyp_6-31g+(d).log.xz

002512620.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512620.td-b3lyp_6-31+g(d).gjf (generated)

002512620.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512620.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512620.mol 002512620.PUBCHEM 002512620.mol (via Jmol)
002512733.b3lyp_6-31g(d).inp

002512733.b3lyp_6-31g(d).qchem.inp (generated)

002512733.b3lyp_6-31g(d).gjf (generated)

002512733.b3lyp_6-31g(d).firefly.inp (generated)

002512733.b3lyp_6-31g(d).smash.inp (generated)

002512733.b3lyp_6-31g(d).nwchem.inp (generated) 002512733.b3lyp_6-31g(d).log.xz 002512733.td-b3lyp_6-31g+(d).inp 002512733.td-b3lyp_6-31g+(d).log.xz

002512733.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512733.td-b3lyp_6-31+g(d).gjf (generated)

002512733.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512733.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512733.mol 002512733.PUBCHEM 002512733.mol (via Jmol)
002512744.b3lyp_6-31g(d).inp

002512744.b3lyp_6-31g(d).qchem.inp (generated)

002512744.b3lyp_6-31g(d).gjf (generated)

002512744.b3lyp_6-31g(d).firefly.inp (generated)

002512744.b3lyp_6-31g(d).smash.inp (generated)

002512744.b3lyp_6-31g(d).nwchem.inp (generated) 002512744.b3lyp_6-31g(d).log.xz 002512744.td-b3lyp_6-31g+(d).inp 002512744.td-b3lyp_6-31g+(d).log.xz

002512744.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512744.td-b3lyp_6-31+g(d).gjf (generated)

002512744.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512744.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512744.mol 002512744.PUBCHEM 002512744.mol (via Jmol)
002512745.b3lyp_6-31g(d).inp

002512745.b3lyp_6-31g(d).qchem.inp (generated)

002512745.b3lyp_6-31g(d).gjf (generated)

002512745.b3lyp_6-31g(d).firefly.inp (generated)

002512745.b3lyp_6-31g(d).smash.inp (generated)

002512745.b3lyp_6-31g(d).nwchem.inp (generated) 002512745.b3lyp_6-31g(d).log.xz 002512745.td-b3lyp_6-31g+(d).inp 002512745.td-b3lyp_6-31g+(d).log.xz

002512745.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512745.td-b3lyp_6-31+g(d).gjf (generated)

002512745.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512745.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512745.mol 002512745.PUBCHEM 002512745.mol (via Jmol)
002512757.b3lyp_6-31g(d).inp

002512757.b3lyp_6-31g(d).qchem.inp (generated)

002512757.b3lyp_6-31g(d).gjf (generated)

002512757.b3lyp_6-31g(d).firefly.inp (generated)

002512757.b3lyp_6-31g(d).smash.inp (generated)

002512757.b3lyp_6-31g(d).nwchem.inp (generated) 002512757.b3lyp_6-31g(d).log.xz 002512757.td-b3lyp_6-31g+(d).inp 002512757.td-b3lyp_6-31g+(d).log.xz

002512757.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512757.td-b3lyp_6-31+g(d).gjf (generated)

002512757.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512757.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512757.mol 002512757.PUBCHEM 002512757.mol (via Jmol)
002512761.b3lyp_6-31g(d).inp

002512761.b3lyp_6-31g(d).qchem.inp (generated)

002512761.b3lyp_6-31g(d).gjf (generated)

002512761.b3lyp_6-31g(d).firefly.inp (generated)

002512761.b3lyp_6-31g(d).smash.inp (generated)

002512761.b3lyp_6-31g(d).nwchem.inp (generated) 002512761.b3lyp_6-31g(d).log.xz 002512761.td-b3lyp_6-31g+(d).inp 002512761.td-b3lyp_6-31g+(d).log.xz

002512761.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512761.td-b3lyp_6-31+g(d).gjf (generated)

002512761.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512761.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512761.mol 002512761.PUBCHEM 002512761.mol (via Jmol)
002512772.b3lyp_6-31g(d).inp

002512772.b3lyp_6-31g(d).qchem.inp (generated)

002512772.b3lyp_6-31g(d).gjf (generated)

002512772.b3lyp_6-31g(d).firefly.inp (generated)

002512772.b3lyp_6-31g(d).smash.inp (generated)

002512772.b3lyp_6-31g(d).nwchem.inp (generated) 002512772.b3lyp_6-31g(d).log.xz 002512772.td-b3lyp_6-31g+(d).inp 002512772.td-b3lyp_6-31g+(d).log.xz

002512772.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512772.td-b3lyp_6-31+g(d).gjf (generated)

002512772.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512772.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512772.mol 002512772.PUBCHEM 002512772.mol (via Jmol)
002512785.b3lyp_6-31g(d).inp

002512785.b3lyp_6-31g(d).qchem.inp (generated)

002512785.b3lyp_6-31g(d).gjf (generated)

002512785.b3lyp_6-31g(d).firefly.inp (generated)

002512785.b3lyp_6-31g(d).smash.inp (generated)

002512785.b3lyp_6-31g(d).nwchem.inp (generated) 002512785.b3lyp_6-31g(d).log.xz 002512785.td-b3lyp_6-31g+(d).inp 002512785.td-b3lyp_6-31g+(d).log.xz

002512785.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512785.td-b3lyp_6-31+g(d).gjf (generated)

002512785.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512785.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512785.mol 002512785.PUBCHEM 002512785.mol (via Jmol)
002512786.b3lyp_6-31g(d).inp

002512786.b3lyp_6-31g(d).qchem.inp (generated)

002512786.b3lyp_6-31g(d).gjf (generated)

002512786.b3lyp_6-31g(d).firefly.inp (generated)

002512786.b3lyp_6-31g(d).smash.inp (generated)

002512786.b3lyp_6-31g(d).nwchem.inp (generated) 002512786.b3lyp_6-31g(d).log.xz 002512786.td-b3lyp_6-31g+(d).inp 002512786.td-b3lyp_6-31g+(d).log.xz

002512786.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512786.td-b3lyp_6-31+g(d).gjf (generated)

002512786.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512786.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512786.mol 002512786.PUBCHEM 002512786.mol (via Jmol)
002512810.b3lyp_6-31g(d).inp

002512810.b3lyp_6-31g(d).qchem.inp (generated)

002512810.b3lyp_6-31g(d).gjf (generated)

002512810.b3lyp_6-31g(d).firefly.inp (generated)

002512810.b3lyp_6-31g(d).smash.inp (generated)

002512810.b3lyp_6-31g(d).nwchem.inp (generated) 002512810.b3lyp_6-31g(d).log.xz 002512810.td-b3lyp_6-31g+(d).inp 002512810.td-b3lyp_6-31g+(d).log.xz

002512810.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512810.td-b3lyp_6-31+g(d).gjf (generated)

002512810.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512810.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512810.mol 002512810.PUBCHEM 002512810.mol (via Jmol)
002512811.b3lyp_6-31g(d).inp

002512811.b3lyp_6-31g(d).qchem.inp (generated)

002512811.b3lyp_6-31g(d).gjf (generated)

002512811.b3lyp_6-31g(d).firefly.inp (generated)

002512811.b3lyp_6-31g(d).smash.inp (generated)

002512811.b3lyp_6-31g(d).nwchem.inp (generated) 002512811.b3lyp_6-31g(d).log.xz 002512811.mol 002512811.PUBCHEM 002512811.mol (via Jmol)
002512814.b3lyp_6-31g(d).inp

002512814.b3lyp_6-31g(d).qchem.inp (generated)

002512814.b3lyp_6-31g(d).gjf (generated)

002512814.b3lyp_6-31g(d).firefly.inp (generated)

002512814.b3lyp_6-31g(d).smash.inp (generated)

002512814.b3lyp_6-31g(d).nwchem.inp (generated) 002512814.b3lyp_6-31g(d).log.xz 002512814.td-b3lyp_6-31g+(d).inp 002512814.td-b3lyp_6-31g+(d).log.xz

002512814.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512814.td-b3lyp_6-31+g(d).gjf (generated)

002512814.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512814.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512814.mol 002512814.PUBCHEM 002512814.mol (via Jmol)
002512815.b3lyp_6-31g(d).inp

002512815.b3lyp_6-31g(d).qchem.inp (generated)

002512815.b3lyp_6-31g(d).gjf (generated)

002512815.b3lyp_6-31g(d).firefly.inp (generated)

002512815.b3lyp_6-31g(d).smash.inp (generated)

002512815.b3lyp_6-31g(d).nwchem.inp (generated) 002512815.b3lyp_6-31g(d).log.xz 002512815.mol 002512815.PUBCHEM 002512815.mol (via Jmol)
002512817.b3lyp_6-31g(d).inp

002512817.b3lyp_6-31g(d).qchem.inp (generated)

002512817.b3lyp_6-31g(d).gjf (generated)

002512817.b3lyp_6-31g(d).firefly.inp (generated)

002512817.b3lyp_6-31g(d).smash.inp (generated)

002512817.b3lyp_6-31g(d).nwchem.inp (generated) 002512817.b3lyp_6-31g(d).log.xz 002512817.td-b3lyp_6-31g+(d).inp 002512817.td-b3lyp_6-31g+(d).log.xz

002512817.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512817.td-b3lyp_6-31+g(d).gjf (generated)

002512817.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512817.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512817.mol 002512817.PUBCHEM 002512817.mol (via Jmol)
002512818.b3lyp_6-31g(d).inp

002512818.b3lyp_6-31g(d).qchem.inp (generated)

002512818.b3lyp_6-31g(d).gjf (generated)

002512818.b3lyp_6-31g(d).firefly.inp (generated)

002512818.b3lyp_6-31g(d).smash.inp (generated)

002512818.b3lyp_6-31g(d).nwchem.inp (generated) 002512818.b3lyp_6-31g(d).log.xz 002512818.td-b3lyp_6-31g+(d).inp 002512818.td-b3lyp_6-31g+(d).log.xz

002512818.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512818.td-b3lyp_6-31+g(d).gjf (generated)

002512818.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512818.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512818.mol 002512818.PUBCHEM 002512818.mol (via Jmol)
002512840.b3lyp_6-31g(d).inp

002512840.b3lyp_6-31g(d).qchem.inp (generated)

002512840.b3lyp_6-31g(d).gjf (generated)

002512840.b3lyp_6-31g(d).firefly.inp (generated)

002512840.b3lyp_6-31g(d).smash.inp (generated)

002512840.b3lyp_6-31g(d).nwchem.inp (generated) 002512840.b3lyp_6-31g(d).log.xz 002512840.td-b3lyp_6-31g+(d).inp 002512840.td-b3lyp_6-31g+(d).log.xz

002512840.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512840.td-b3lyp_6-31+g(d).gjf (generated)

002512840.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512840.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512840.mol 002512840.PUBCHEM 002512840.mol (via Jmol)
002512843.b3lyp_6-31g(d).inp

002512843.b3lyp_6-31g(d).qchem.inp (generated)

002512843.b3lyp_6-31g(d).gjf (generated)

002512843.b3lyp_6-31g(d).firefly.inp (generated)

002512843.b3lyp_6-31g(d).smash.inp (generated)

002512843.b3lyp_6-31g(d).nwchem.inp (generated) 002512843.b3lyp_6-31g(d).log.xz 002512843.td-b3lyp_6-31g+(d).inp 002512843.td-b3lyp_6-31g+(d).log.xz

002512843.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512843.td-b3lyp_6-31+g(d).gjf (generated)

002512843.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512843.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512843.mol 002512843.PUBCHEM 002512843.mol (via Jmol)
002512854.b3lyp_6-31g(d).inp

002512854.b3lyp_6-31g(d).qchem.inp (generated)

002512854.b3lyp_6-31g(d).gjf (generated)

002512854.b3lyp_6-31g(d).firefly.inp (generated)

002512854.b3lyp_6-31g(d).smash.inp (generated)

002512854.b3lyp_6-31g(d).nwchem.inp (generated) 002512854.b3lyp_6-31g(d).log.xz 002512854.td-b3lyp_6-31g+(d).inp 002512854.td-b3lyp_6-31g+(d).log.xz

002512854.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512854.td-b3lyp_6-31+g(d).gjf (generated)

002512854.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512854.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512854.mol 002512854.PUBCHEM 002512854.mol (via Jmol)
002512856.b3lyp_6-31g(d).inp

002512856.b3lyp_6-31g(d).qchem.inp (generated)

002512856.b3lyp_6-31g(d).gjf (generated)

002512856.b3lyp_6-31g(d).firefly.inp (generated)

002512856.b3lyp_6-31g(d).smash.inp (generated)

002512856.b3lyp_6-31g(d).nwchem.inp (generated) 002512856.b3lyp_6-31g(d).log.xz 002512856.td-b3lyp_6-31g+(d).inp 002512856.td-b3lyp_6-31g+(d).log.xz

002512856.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512856.td-b3lyp_6-31+g(d).gjf (generated)

002512856.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512856.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512856.mol 002512856.PUBCHEM 002512856.mol (via Jmol)
002512884.b3lyp_6-31g(d).inp

002512884.b3lyp_6-31g(d).qchem.inp (generated)

002512884.b3lyp_6-31g(d).gjf (generated)

002512884.b3lyp_6-31g(d).firefly.inp (generated)

002512884.b3lyp_6-31g(d).smash.inp (generated)

002512884.b3lyp_6-31g(d).nwchem.inp (generated) 002512884.b3lyp_6-31g(d).log.xz 002512884.td-b3lyp_6-31g+(d).inp 002512884.td-b3lyp_6-31g+(d).log.xz

002512884.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512884.td-b3lyp_6-31+g(d).gjf (generated)

002512884.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512884.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512884.mol 002512884.PUBCHEM 002512884.mol (via Jmol)
002512885.b3lyp_6-31g(d).inp

002512885.b3lyp_6-31g(d).qchem.inp (generated)

002512885.b3lyp_6-31g(d).gjf (generated)

002512885.b3lyp_6-31g(d).firefly.inp (generated)

002512885.b3lyp_6-31g(d).smash.inp (generated)

002512885.b3lyp_6-31g(d).nwchem.inp (generated) 002512885.b3lyp_6-31g(d).log.xz 002512885.td-b3lyp_6-31g+(d).inp 002512885.td-b3lyp_6-31g+(d).log.xz

002512885.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512885.td-b3lyp_6-31+g(d).gjf (generated)

002512885.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512885.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512885.mol 002512885.PUBCHEM 002512885.mol (via Jmol)
002512888.b3lyp_6-31g(d).inp

002512888.b3lyp_6-31g(d).qchem.inp (generated)

002512888.b3lyp_6-31g(d).gjf (generated)

002512888.b3lyp_6-31g(d).firefly.inp (generated)

002512888.b3lyp_6-31g(d).smash.inp (generated)

002512888.b3lyp_6-31g(d).nwchem.inp (generated) 002512888.b3lyp_6-31g(d).log.xz 002512888.td-b3lyp_6-31g+(d).inp 002512888.td-b3lyp_6-31g+(d).log.xz

002512888.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512888.td-b3lyp_6-31+g(d).gjf (generated)

002512888.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512888.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512888.mol 002512888.PUBCHEM 002512888.mol (via Jmol)
002512892.b3lyp_6-31g(d).inp

002512892.b3lyp_6-31g(d).qchem.inp (generated)

002512892.b3lyp_6-31g(d).gjf (generated)

002512892.b3lyp_6-31g(d).firefly.inp (generated)

002512892.b3lyp_6-31g(d).smash.inp (generated)

002512892.b3lyp_6-31g(d).nwchem.inp (generated) 002512892.b3lyp_6-31g(d).log.xz 002512892.td-b3lyp_6-31g+(d).inp 002512892.td-b3lyp_6-31g+(d).log.xz

002512892.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512892.td-b3lyp_6-31+g(d).gjf (generated)

002512892.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512892.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512892.mol 002512892.PUBCHEM 002512892.mol (via Jmol)
002512893.b3lyp_6-31g(d).inp

002512893.b3lyp_6-31g(d).qchem.inp (generated)

002512893.b3lyp_6-31g(d).gjf (generated)

002512893.b3lyp_6-31g(d).firefly.inp (generated)

002512893.b3lyp_6-31g(d).smash.inp (generated)

002512893.b3lyp_6-31g(d).nwchem.inp (generated) 002512893.b3lyp_6-31g(d).log.xz 002512893.td-b3lyp_6-31g+(d).inp 002512893.td-b3lyp_6-31g+(d).log.xz

002512893.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512893.td-b3lyp_6-31+g(d).gjf (generated)

002512893.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512893.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512893.mol 002512893.PUBCHEM 002512893.mol (via Jmol)
002512903.b3lyp_6-31g(d).inp

002512903.b3lyp_6-31g(d).qchem.inp (generated)

002512903.b3lyp_6-31g(d).gjf (generated)

002512903.b3lyp_6-31g(d).firefly.inp (generated)

002512903.b3lyp_6-31g(d).smash.inp (generated)

002512903.b3lyp_6-31g(d).nwchem.inp (generated) 002512903.b3lyp_6-31g(d).log.xz 002512903.td-b3lyp_6-31g+(d).inp 002512903.td-b3lyp_6-31g+(d).log.xz

002512903.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512903.td-b3lyp_6-31+g(d).gjf (generated)

002512903.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512903.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512903.mol 002512903.PUBCHEM 002512903.mol (via Jmol)
002512919.b3lyp_6-31g(d).inp

002512919.b3lyp_6-31g(d).qchem.inp (generated)

002512919.b3lyp_6-31g(d).gjf (generated)

002512919.b3lyp_6-31g(d).firefly.inp (generated)

002512919.b3lyp_6-31g(d).smash.inp (generated)

002512919.b3lyp_6-31g(d).nwchem.inp (generated) 002512919.b3lyp_6-31g(d).log.xz 002512919.td-b3lyp_6-31g+(d).inp 002512919.td-b3lyp_6-31g+(d).log.xz

002512919.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512919.td-b3lyp_6-31+g(d).gjf (generated)

002512919.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512919.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512919.mol 002512919.PUBCHEM 002512919.mol (via Jmol)
002512962.b3lyp_6-31g(d).inp

002512962.b3lyp_6-31g(d).qchem.inp (generated)

002512962.b3lyp_6-31g(d).gjf (generated)

002512962.b3lyp_6-31g(d).firefly.inp (generated)

002512962.b3lyp_6-31g(d).smash.inp (generated)

002512962.b3lyp_6-31g(d).nwchem.inp (generated) 002512962.b3lyp_6-31g(d).log.xz 002512962.td-b3lyp_6-31g+(d).inp 002512962.td-b3lyp_6-31g+(d).log.xz

002512962.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512962.td-b3lyp_6-31+g(d).gjf (generated)

002512962.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512962.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512962.mol 002512962.PUBCHEM 002512962.mol (via Jmol)
002512963.b3lyp_6-31g(d).inp

002512963.b3lyp_6-31g(d).qchem.inp (generated)

002512963.b3lyp_6-31g(d).gjf (generated)

002512963.b3lyp_6-31g(d).firefly.inp (generated)

002512963.b3lyp_6-31g(d).smash.inp (generated)

002512963.b3lyp_6-31g(d).nwchem.inp (generated) 002512963.b3lyp_6-31g(d).log.xz 002512963.td-b3lyp_6-31g+(d).inp 002512963.td-b3lyp_6-31g+(d).log.xz

002512963.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512963.td-b3lyp_6-31+g(d).gjf (generated)

002512963.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512963.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512963.mol 002512963.PUBCHEM 002512963.mol (via Jmol)
002512965.b3lyp_6-31g(d).inp

002512965.b3lyp_6-31g(d).qchem.inp (generated)

002512965.b3lyp_6-31g(d).gjf (generated)

002512965.b3lyp_6-31g(d).firefly.inp (generated)

002512965.b3lyp_6-31g(d).smash.inp (generated)

002512965.b3lyp_6-31g(d).nwchem.inp (generated) 002512965.b3lyp_6-31g(d).log.xz 002512965.td-b3lyp_6-31g+(d).inp 002512965.td-b3lyp_6-31g+(d).log.xz

002512965.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512965.td-b3lyp_6-31+g(d).gjf (generated)

002512965.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512965.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512965.mol 002512965.PUBCHEM 002512965.mol (via Jmol)
002512967.b3lyp_6-31g(d).inp

002512967.b3lyp_6-31g(d).qchem.inp (generated)

002512967.b3lyp_6-31g(d).gjf (generated)

002512967.b3lyp_6-31g(d).firefly.inp (generated)

002512967.b3lyp_6-31g(d).smash.inp (generated)

002512967.b3lyp_6-31g(d).nwchem.inp (generated) 002512967.b3lyp_6-31g(d).log.xz 002512967.td-b3lyp_6-31g+(d).inp 002512967.td-b3lyp_6-31g+(d).log.xz

002512967.td-b3lyp_6-31+g(d).qchem.inp (generated)

002512967.td-b3lyp_6-31+g(d).gjf (generated)

002512967.td-b3lyp_6-31+g(d).firefly.inp (generated)

002512967.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002512967.mol 002512967.PUBCHEM 002512967.mol (via Jmol)
002513229.b3lyp_6-31g(d).inp

002513229.b3lyp_6-31g(d).qchem.inp (generated)

002513229.b3lyp_6-31g(d).gjf (generated)

002513229.b3lyp_6-31g(d).firefly.inp (generated)

002513229.b3lyp_6-31g(d).smash.inp (generated)

002513229.b3lyp_6-31g(d).nwchem.inp (generated) 002513229.b3lyp_6-31g(d).log.xz 002513229.td-b3lyp_6-31g+(d).inp 002513229.td-b3lyp_6-31g+(d).log.xz

002513229.td-b3lyp_6-31+g(d).qchem.inp (generated)

002513229.td-b3lyp_6-31+g(d).gjf (generated)

002513229.td-b3lyp_6-31+g(d).firefly.inp (generated)

002513229.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002513229.mol 002513229.PUBCHEM 002513229.mol (via Jmol)
002513233.b3lyp_6-31g(d).inp

002513233.b3lyp_6-31g(d).qchem.inp (generated)

002513233.b3lyp_6-31g(d).gjf (generated)

002513233.b3lyp_6-31g(d).firefly.inp (generated)

002513233.b3lyp_6-31g(d).smash.inp (generated)

002513233.b3lyp_6-31g(d).nwchem.inp (generated) 002513233.b3lyp_6-31g(d).log.xz 002513233.mol 002513233.PUBCHEM 002513233.mol (via Jmol)
002513235.b3lyp_6-31g(d).inp

002513235.b3lyp_6-31g(d).qchem.inp (generated)

002513235.b3lyp_6-31g(d).gjf (generated)

002513235.b3lyp_6-31g(d).firefly.inp (generated)

002513235.b3lyp_6-31g(d).smash.inp (generated)

002513235.b3lyp_6-31g(d).nwchem.inp (generated) 002513235.b3lyp_6-31g(d).log.xz 002513235.mol 002513235.PUBCHEM 002513235.mol (via Jmol)
002513311.b3lyp_6-31g(d).inp

002513311.b3lyp_6-31g(d).qchem.inp (generated)

002513311.b3lyp_6-31g(d).gjf (generated)

002513311.b3lyp_6-31g(d).firefly.inp (generated)

002513311.b3lyp_6-31g(d).smash.inp (generated)

002513311.b3lyp_6-31g(d).nwchem.inp (generated) 002513311.b3lyp_6-31g(d).log.xz 002513311.td-b3lyp_6-31g+(d).inp 002513311.td-b3lyp_6-31g+(d).log.xz

002513311.td-b3lyp_6-31+g(d).qchem.inp (generated)

002513311.td-b3lyp_6-31+g(d).gjf (generated)

002513311.td-b3lyp_6-31+g(d).firefly.inp (generated)

002513311.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002513311.mol 002513311.PUBCHEM 002513311.mol (via Jmol)
002513349.b3lyp_6-31g(d).inp

002513349.b3lyp_6-31g(d).qchem.inp (generated)

002513349.b3lyp_6-31g(d).gjf (generated)

002513349.b3lyp_6-31g(d).firefly.inp (generated)

002513349.b3lyp_6-31g(d).smash.inp (generated)

002513349.b3lyp_6-31g(d).nwchem.inp (generated) 002513349.b3lyp_6-31g(d).log.xz 002513349.td-b3lyp_6-31g+(d).inp 002513349.td-b3lyp_6-31g+(d).log.xz

002513349.td-b3lyp_6-31+g(d).qchem.inp (generated)

002513349.td-b3lyp_6-31+g(d).gjf (generated)

002513349.td-b3lyp_6-31+g(d).firefly.inp (generated)

002513349.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002513349.mol 002513349.PUBCHEM 002513349.mol (via Jmol)
002513350.b3lyp_6-31g(d).inp

002513350.b3lyp_6-31g(d).qchem.inp (generated)

002513350.b3lyp_6-31g(d).gjf (generated)

002513350.b3lyp_6-31g(d).firefly.inp (generated)

002513350.b3lyp_6-31g(d).smash.inp (generated)

002513350.b3lyp_6-31g(d).nwchem.inp (generated) 002513350.b3lyp_6-31g(d).log.xz 002513350.td-b3lyp_6-31g+(d).inp 002513350.td-b3lyp_6-31g+(d).log.xz

002513350.td-b3lyp_6-31+g(d).qchem.inp (generated)

002513350.td-b3lyp_6-31+g(d).gjf (generated)

002513350.td-b3lyp_6-31+g(d).firefly.inp (generated)

002513350.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002513350.mol 002513350.PUBCHEM 002513350.mol (via Jmol)
002513394.b3lyp_6-31g(d).inp

002513394.b3lyp_6-31g(d).qchem.inp (generated)

002513394.b3lyp_6-31g(d).gjf (generated)

002513394.b3lyp_6-31g(d).firefly.inp (generated)

002513394.b3lyp_6-31g(d).smash.inp (generated)

002513394.b3lyp_6-31g(d).nwchem.inp (generated) 002513394.b3lyp_6-31g(d).log.xz 002513394.td-b3lyp_6-31g+(d).inp 002513394.td-b3lyp_6-31g+(d).log.xz

002513394.td-b3lyp_6-31+g(d).qchem.inp (generated)

002513394.td-b3lyp_6-31+g(d).gjf (generated)

002513394.td-b3lyp_6-31+g(d).firefly.inp (generated)

002513394.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002513394.mol 002513394.PUBCHEM 002513394.mol (via Jmol)
002513396.b3lyp_6-31g(d).inp

002513396.b3lyp_6-31g(d).qchem.inp (generated)

002513396.b3lyp_6-31g(d).gjf (generated)

002513396.b3lyp_6-31g(d).firefly.inp (generated)

002513396.b3lyp_6-31g(d).smash.inp (generated)

002513396.b3lyp_6-31g(d).nwchem.inp (generated) 002513396.b3lyp_6-31g(d).log.xz 002513396.td-b3lyp_6-31g+(d).inp 002513396.td-b3lyp_6-31g+(d).log.xz

002513396.td-b3lyp_6-31+g(d).qchem.inp (generated)

002513396.td-b3lyp_6-31+g(d).gjf (generated)

002513396.td-b3lyp_6-31+g(d).firefly.inp (generated)

002513396.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002513396.mol 002513396.PUBCHEM 002513396.mol (via Jmol)
002513402.b3lyp_6-31g(d).inp

002513402.b3lyp_6-31g(d).qchem.inp (generated)

002513402.b3lyp_6-31g(d).gjf (generated)

002513402.b3lyp_6-31g(d).firefly.inp (generated)

002513402.b3lyp_6-31g(d).smash.inp (generated)

002513402.b3lyp_6-31g(d).nwchem.inp (generated) 002513402.b3lyp_6-31g(d).log.xz 002513402.td-b3lyp_6-31g+(d).inp 002513402.td-b3lyp_6-31g+(d).log.xz

002513402.td-b3lyp_6-31+g(d).qchem.inp (generated)

002513402.td-b3lyp_6-31+g(d).gjf (generated)

002513402.td-b3lyp_6-31+g(d).firefly.inp (generated)

002513402.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002513402.mol 002513402.PUBCHEM 002513402.mol (via Jmol)
002513423.b3lyp_6-31g(d).inp

002513423.b3lyp_6-31g(d).qchem.inp (generated)

002513423.b3lyp_6-31g(d).gjf (generated)

002513423.b3lyp_6-31g(d).firefly.inp (generated)

002513423.b3lyp_6-31g(d).smash.inp (generated)

002513423.b3lyp_6-31g(d).nwchem.inp (generated) 002513423.b3lyp_6-31g(d).log.xz 002513423.td-b3lyp_6-31g+(d).inp 002513423.td-b3lyp_6-31g+(d).log.xz

002513423.td-b3lyp_6-31+g(d).qchem.inp (generated)

002513423.td-b3lyp_6-31+g(d).gjf (generated)

002513423.td-b3lyp_6-31+g(d).firefly.inp (generated)

002513423.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002513423.mol 002513423.PUBCHEM 002513423.mol (via Jmol)
002513424.b3lyp_6-31g(d).inp

002513424.b3lyp_6-31g(d).qchem.inp (generated)

002513424.b3lyp_6-31g(d).gjf (generated)

002513424.b3lyp_6-31g(d).firefly.inp (generated)

002513424.b3lyp_6-31g(d).smash.inp (generated)

002513424.b3lyp_6-31g(d).nwchem.inp (generated) 002513424.b3lyp_6-31g(d).log.xz 002513424.td-b3lyp_6-31g+(d).inp 002513424.td-b3lyp_6-31g+(d).log.xz

002513424.td-b3lyp_6-31+g(d).qchem.inp (generated)

002513424.td-b3lyp_6-31+g(d).gjf (generated)

002513424.td-b3lyp_6-31+g(d).firefly.inp (generated)

002513424.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002513424.mol 002513424.PUBCHEM 002513424.mol (via Jmol)
002513435.b3lyp_6-31g(d).inp

002513435.b3lyp_6-31g(d).qchem.inp (generated)

002513435.b3lyp_6-31g(d).gjf (generated)

002513435.b3lyp_6-31g(d).firefly.inp (generated)

002513435.b3lyp_6-31g(d).smash.inp (generated)

002513435.b3lyp_6-31g(d).nwchem.inp (generated) 002513435.b3lyp_6-31g(d).log.xz 002513435.td-b3lyp_6-31g+(d).inp 002513435.td-b3lyp_6-31g+(d).log.xz

002513435.td-b3lyp_6-31+g(d).qchem.inp (generated)

002513435.td-b3lyp_6-31+g(d).gjf (generated)

002513435.td-b3lyp_6-31+g(d).firefly.inp (generated)

002513435.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002513435.mol 002513435.PUBCHEM 002513435.mol (via Jmol)
002513439.b3lyp_6-31g(d).inp

002513439.b3lyp_6-31g(d).qchem.inp (generated)

002513439.b3lyp_6-31g(d).gjf (generated)

002513439.b3lyp_6-31g(d).firefly.inp (generated)

002513439.b3lyp_6-31g(d).smash.inp (generated)

002513439.b3lyp_6-31g(d).nwchem.inp (generated) 002513439.b3lyp_6-31g(d).log.xz 002513439.td-b3lyp_6-31g+(d).inp 002513439.td-b3lyp_6-31g+(d).log.xz

002513439.td-b3lyp_6-31+g(d).qchem.inp (generated)

002513439.td-b3lyp_6-31+g(d).gjf (generated)

002513439.td-b3lyp_6-31+g(d).firefly.inp (generated)

002513439.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002513439.mol 002513439.PUBCHEM 002513439.mol (via Jmol)
002513461.b3lyp_6-31g(d).inp

002513461.b3lyp_6-31g(d).qchem.inp (generated)

002513461.b3lyp_6-31g(d).gjf (generated)

002513461.b3lyp_6-31g(d).firefly.inp (generated)

002513461.b3lyp_6-31g(d).smash.inp (generated)

002513461.b3lyp_6-31g(d).nwchem.inp (generated) 002513461.b3lyp_6-31g(d).log.xz 002513461.td-b3lyp_6-31g+(d).inp 002513461.td-b3lyp_6-31g+(d).log.xz

002513461.td-b3lyp_6-31+g(d).qchem.inp (generated)

002513461.td-b3lyp_6-31+g(d).gjf (generated)

002513461.td-b3lyp_6-31+g(d).firefly.inp (generated)

002513461.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002513461.mol 002513461.PUBCHEM 002513461.mol (via Jmol)
002513464.b3lyp_6-31g(d).inp

002513464.b3lyp_6-31g(d).qchem.inp (generated)

002513464.b3lyp_6-31g(d).gjf (generated)

002513464.b3lyp_6-31g(d).firefly.inp (generated)

002513464.b3lyp_6-31g(d).smash.inp (generated)

002513464.b3lyp_6-31g(d).nwchem.inp (generated) 002513464.b3lyp_6-31g(d).log.xz 002513464.td-b3lyp_6-31g+(d).inp 002513464.td-b3lyp_6-31g+(d).log.xz

002513464.td-b3lyp_6-31+g(d).qchem.inp (generated)

002513464.td-b3lyp_6-31+g(d).gjf (generated)

002513464.td-b3lyp_6-31+g(d).firefly.inp (generated)

002513464.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002513464.mol 002513464.PUBCHEM 002513464.mol (via Jmol)
002513466.b3lyp_6-31g(d).inp

002513466.b3lyp_6-31g(d).qchem.inp (generated)

002513466.b3lyp_6-31g(d).gjf (generated)

002513466.b3lyp_6-31g(d).firefly.inp (generated)

002513466.b3lyp_6-31g(d).smash.inp (generated)

002513466.b3lyp_6-31g(d).nwchem.inp (generated) 002513466.b3lyp_6-31g(d).log.xz 002513466.td-b3lyp_6-31g+(d).inp 002513466.td-b3lyp_6-31g+(d).log.xz

002513466.td-b3lyp_6-31+g(d).qchem.inp (generated)

002513466.td-b3lyp_6-31+g(d).gjf (generated)

002513466.td-b3lyp_6-31+g(d).firefly.inp (generated)

002513466.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002513466.mol 002513466.PUBCHEM 002513466.mol (via Jmol)
002513469.b3lyp_6-31g(d).inp

002513469.b3lyp_6-31g(d).qchem.inp (generated)

002513469.b3lyp_6-31g(d).gjf (generated)

002513469.b3lyp_6-31g(d).firefly.inp (generated)

002513469.b3lyp_6-31g(d).smash.inp (generated)

002513469.b3lyp_6-31g(d).nwchem.inp (generated) 002513469.b3lyp_6-31g(d).log.xz 002513469.td-b3lyp_6-31g+(d).inp 002513469.td-b3lyp_6-31g+(d).log.xz

002513469.td-b3lyp_6-31+g(d).qchem.inp (generated)

002513469.td-b3lyp_6-31+g(d).gjf (generated)

002513469.td-b3lyp_6-31+g(d).firefly.inp (generated)

002513469.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002513469.mol 002513469.PUBCHEM 002513469.mol (via Jmol)
002513533.b3lyp_6-31g(d).inp

002513533.b3lyp_6-31g(d).qchem.inp (generated)

002513533.b3lyp_6-31g(d).gjf (generated)

002513533.b3lyp_6-31g(d).firefly.inp (generated)

002513533.b3lyp_6-31g(d).smash.inp (generated)

002513533.b3lyp_6-31g(d).nwchem.inp (generated) 002513533.b3lyp_6-31g(d).log.xz 002513533.td-b3lyp_6-31g+(d).inp 002513533.td-b3lyp_6-31g+(d).log.xz

002513533.td-b3lyp_6-31+g(d).qchem.inp (generated)

002513533.td-b3lyp_6-31+g(d).gjf (generated)

002513533.td-b3lyp_6-31+g(d).firefly.inp (generated)

002513533.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002513533.mol 002513533.PUBCHEM 002513533.mol (via Jmol)
002513536.b3lyp_6-31g(d).inp

002513536.b3lyp_6-31g(d).qchem.inp (generated)

002513536.b3lyp_6-31g(d).gjf (generated)

002513536.b3lyp_6-31g(d).firefly.inp (generated)

002513536.b3lyp_6-31g(d).smash.inp (generated)

002513536.b3lyp_6-31g(d).nwchem.inp (generated) 002513536.b3lyp_6-31g(d).log.xz 002513536.td-b3lyp_6-31g+(d).inp 002513536.td-b3lyp_6-31g+(d).log.xz

002513536.td-b3lyp_6-31+g(d).qchem.inp (generated)

002513536.td-b3lyp_6-31+g(d).gjf (generated)

002513536.td-b3lyp_6-31+g(d).firefly.inp (generated)

002513536.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002513536.mol 002513536.PUBCHEM 002513536.mol (via Jmol)
002513610.b3lyp_6-31g(d).inp

002513610.b3lyp_6-31g(d).qchem.inp (generated)

002513610.b3lyp_6-31g(d).gjf (generated)

002513610.b3lyp_6-31g(d).firefly.inp (generated)

002513610.b3lyp_6-31g(d).smash.inp (generated)

002513610.b3lyp_6-31g(d).nwchem.inp (generated) 002513610.b3lyp_6-31g(d).log.xz 002513610.td-b3lyp_6-31g+(d).inp 002513610.td-b3lyp_6-31g+(d).log.xz

002513610.td-b3lyp_6-31+g(d).qchem.inp (generated)

002513610.td-b3lyp_6-31+g(d).gjf (generated)

002513610.td-b3lyp_6-31+g(d).firefly.inp (generated)

002513610.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002513610.mol 002513610.PUBCHEM 002513610.mol (via Jmol)
002513611.b3lyp_6-31g(d).inp

002513611.b3lyp_6-31g(d).qchem.inp (generated)

002513611.b3lyp_6-31g(d).gjf (generated)

002513611.b3lyp_6-31g(d).firefly.inp (generated)

002513611.b3lyp_6-31g(d).smash.inp (generated)

002513611.b3lyp_6-31g(d).nwchem.inp (generated) 002513611.b3lyp_6-31g(d).log.xz 002513611.td-b3lyp_6-31g+(d).inp 002513611.td-b3lyp_6-31g+(d).log.xz

002513611.td-b3lyp_6-31+g(d).qchem.inp (generated)

002513611.td-b3lyp_6-31+g(d).gjf (generated)

002513611.td-b3lyp_6-31+g(d).firefly.inp (generated)

002513611.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002513611.mol 002513611.PUBCHEM 002513611.mol (via Jmol)
002513645.b3lyp_6-31g(d).inp

002513645.b3lyp_6-31g(d).qchem.inp (generated)

002513645.b3lyp_6-31g(d).gjf (generated)

002513645.b3lyp_6-31g(d).firefly.inp (generated)

002513645.b3lyp_6-31g(d).smash.inp (generated)

002513645.b3lyp_6-31g(d).nwchem.inp (generated) 002513645.b3lyp_6-31g(d).log.xz 002513645.td-b3lyp_6-31g+(d).inp 002513645.td-b3lyp_6-31g+(d).log.xz

002513645.td-b3lyp_6-31+g(d).qchem.inp (generated)

002513645.td-b3lyp_6-31+g(d).gjf (generated)

002513645.td-b3lyp_6-31+g(d).firefly.inp (generated)

002513645.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002513645.mol 002513645.PUBCHEM 002513645.mol (via Jmol)
002513843.b3lyp_6-31g(d).inp

002513843.b3lyp_6-31g(d).qchem.inp (generated)

002513843.b3lyp_6-31g(d).gjf (generated)

002513843.b3lyp_6-31g(d).firefly.inp (generated)

002513843.b3lyp_6-31g(d).smash.inp (generated)

002513843.b3lyp_6-31g(d).nwchem.inp (generated) 002513843.b3lyp_6-31g(d).log.xz 002513843.td-b3lyp_6-31g+(d).inp 002513843.td-b3lyp_6-31g+(d).log.xz

002513843.td-b3lyp_6-31+g(d).qchem.inp (generated)

002513843.td-b3lyp_6-31+g(d).gjf (generated)

002513843.td-b3lyp_6-31+g(d).firefly.inp (generated)

002513843.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002513843.mol 002513843.PUBCHEM 002513843.mol (via Jmol)
002514776.b3lyp_6-31g(d).inp

002514776.b3lyp_6-31g(d).qchem.inp (generated)

002514776.b3lyp_6-31g(d).gjf (generated)

002514776.b3lyp_6-31g(d).firefly.inp (generated)

002514776.b3lyp_6-31g(d).smash.inp (generated)

002514776.b3lyp_6-31g(d).nwchem.inp (generated) 002514776.b3lyp_6-31g(d).log.xz 002514776.td-b3lyp_6-31g+(d).inp 002514776.td-b3lyp_6-31g+(d).log.xz

002514776.td-b3lyp_6-31+g(d).qchem.inp (generated)

002514776.td-b3lyp_6-31+g(d).gjf (generated)

002514776.td-b3lyp_6-31+g(d).firefly.inp (generated)

002514776.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002514776.mol 002514776.PUBCHEM 002514776.mol (via Jmol)
002515237.b3lyp_6-31g(d).inp

002515237.b3lyp_6-31g(d).qchem.inp (generated)

002515237.b3lyp_6-31g(d).gjf (generated)

002515237.b3lyp_6-31g(d).firefly.inp (generated)

002515237.b3lyp_6-31g(d).smash.inp (generated)

002515237.b3lyp_6-31g(d).nwchem.inp (generated) 002515237.b3lyp_6-31g(d).log.xz 002515237.td-b3lyp_6-31g+(d).inp 002515237.td-b3lyp_6-31g+(d).log.xz

002515237.td-b3lyp_6-31+g(d).qchem.inp (generated)

002515237.td-b3lyp_6-31+g(d).gjf (generated)

002515237.td-b3lyp_6-31+g(d).firefly.inp (generated)

002515237.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002515237.mol 002515237.PUBCHEM 002515237.mol (via Jmol)
002515442.b3lyp_6-31g(d).inp

002515442.b3lyp_6-31g(d).qchem.inp (generated)

002515442.b3lyp_6-31g(d).gjf (generated)

002515442.b3lyp_6-31g(d).firefly.inp (generated)

002515442.b3lyp_6-31g(d).smash.inp (generated)

002515442.b3lyp_6-31g(d).nwchem.inp (generated) 002515442.b3lyp_6-31g(d).log.xz 002515442.td-b3lyp_6-31g+(d).inp 002515442.td-b3lyp_6-31g+(d).log.xz

002515442.td-b3lyp_6-31+g(d).qchem.inp (generated)

002515442.td-b3lyp_6-31+g(d).gjf (generated)

002515442.td-b3lyp_6-31+g(d).firefly.inp (generated)

002515442.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002515442.mol 002515442.PUBCHEM 002515442.mol (via Jmol)
002516198.b3lyp_6-31g(d).inp

002516198.b3lyp_6-31g(d).qchem.inp (generated)

002516198.b3lyp_6-31g(d).gjf (generated)

002516198.b3lyp_6-31g(d).firefly.inp (generated)

002516198.b3lyp_6-31g(d).smash.inp (generated)

002516198.b3lyp_6-31g(d).nwchem.inp (generated) 002516198.b3lyp_6-31g(d).log.xz 002516198.mol 002516198.PUBCHEM 002516198.mol (via Jmol)
002516486.b3lyp_6-31g(d).inp

002516486.b3lyp_6-31g(d).qchem.inp (generated)

002516486.b3lyp_6-31g(d).gjf (generated)

002516486.b3lyp_6-31g(d).firefly.inp (generated)

002516486.b3lyp_6-31g(d).smash.inp (generated)

002516486.b3lyp_6-31g(d).nwchem.inp (generated) 002516486.b3lyp_6-31g(d).log.xz 002516486.td-b3lyp_6-31g+(d).inp 002516486.td-b3lyp_6-31g+(d).log.xz

002516486.td-b3lyp_6-31+g(d).qchem.inp (generated)

002516486.td-b3lyp_6-31+g(d).gjf (generated)

002516486.td-b3lyp_6-31+g(d).firefly.inp (generated)

002516486.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002516486.mol 002516486.PUBCHEM 002516486.mol (via Jmol)
002516488.b3lyp_6-31g(d).inp

002516488.b3lyp_6-31g(d).qchem.inp (generated)

002516488.b3lyp_6-31g(d).gjf (generated)

002516488.b3lyp_6-31g(d).firefly.inp (generated)

002516488.b3lyp_6-31g(d).smash.inp (generated)

002516488.b3lyp_6-31g(d).nwchem.inp (generated) 002516488.b3lyp_6-31g(d).log.xz 002516488.td-b3lyp_6-31g+(d).inp 002516488.td-b3lyp_6-31g+(d).log.xz

002516488.td-b3lyp_6-31+g(d).qchem.inp (generated)

002516488.td-b3lyp_6-31+g(d).gjf (generated)

002516488.td-b3lyp_6-31+g(d).firefly.inp (generated)

002516488.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002516488.mol 002516488.PUBCHEM 002516488.mol (via Jmol)
002516547.b3lyp_6-31g(d).inp

002516547.b3lyp_6-31g(d).qchem.inp (generated)

002516547.b3lyp_6-31g(d).gjf (generated)

002516547.b3lyp_6-31g(d).firefly.inp (generated)

002516547.b3lyp_6-31g(d).smash.inp (generated)

002516547.b3lyp_6-31g(d).nwchem.inp (generated) 002516547.b3lyp_6-31g(d).log.xz 002516547.td-b3lyp_6-31g+(d).inp 002516547.td-b3lyp_6-31g+(d).log.xz

002516547.td-b3lyp_6-31+g(d).qchem.inp (generated)

002516547.td-b3lyp_6-31+g(d).gjf (generated)

002516547.td-b3lyp_6-31+g(d).firefly.inp (generated)

002516547.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002516547.mol 002516547.PUBCHEM 002516547.mol (via Jmol)
002516892.b3lyp_6-31g(d).inp

002516892.b3lyp_6-31g(d).qchem.inp (generated)

002516892.b3lyp_6-31g(d).gjf (generated)

002516892.b3lyp_6-31g(d).firefly.inp (generated)

002516892.b3lyp_6-31g(d).smash.inp (generated)

002516892.b3lyp_6-31g(d).nwchem.inp (generated) 002516892.b3lyp_6-31g(d).log.xz 002516892.td-b3lyp_6-31g+(d).inp 002516892.td-b3lyp_6-31g+(d).log.xz

002516892.td-b3lyp_6-31+g(d).qchem.inp (generated)

002516892.td-b3lyp_6-31+g(d).gjf (generated)

002516892.td-b3lyp_6-31+g(d).firefly.inp (generated)

002516892.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002516892.mol 002516892.PUBCHEM 002516892.mol (via Jmol)
002516894.b3lyp_6-31g(d).inp

002516894.b3lyp_6-31g(d).qchem.inp (generated)

002516894.b3lyp_6-31g(d).gjf (generated)

002516894.b3lyp_6-31g(d).firefly.inp (generated)

002516894.b3lyp_6-31g(d).smash.inp (generated)

002516894.b3lyp_6-31g(d).nwchem.inp (generated) 002516894.b3lyp_6-31g(d).log.xz 002516894.td-b3lyp_6-31g+(d).inp 002516894.td-b3lyp_6-31g+(d).log.xz

002516894.td-b3lyp_6-31+g(d).qchem.inp (generated)

002516894.td-b3lyp_6-31+g(d).gjf (generated)

002516894.td-b3lyp_6-31+g(d).firefly.inp (generated)

002516894.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002516894.mol 002516894.PUBCHEM 002516894.mol (via Jmol)
002516925.b3lyp_6-31g(d).inp

002516925.b3lyp_6-31g(d).qchem.inp (generated)

002516925.b3lyp_6-31g(d).gjf (generated)

002516925.b3lyp_6-31g(d).firefly.inp (generated)

002516925.b3lyp_6-31g(d).smash.inp (generated)

002516925.b3lyp_6-31g(d).nwchem.inp (generated) 002516925.b3lyp_6-31g(d).log.xz 002516925.mol 002516925.PUBCHEM 002516925.mol (via Jmol)
002516940.b3lyp_6-31g(d).inp

002516940.b3lyp_6-31g(d).qchem.inp (generated)

002516940.b3lyp_6-31g(d).gjf (generated)

002516940.b3lyp_6-31g(d).firefly.inp (generated)

002516940.b3lyp_6-31g(d).smash.inp (generated)

002516940.b3lyp_6-31g(d).nwchem.inp (generated) 002516940.b3lyp_6-31g(d).log.xz 002516940.td-b3lyp_6-31g+(d).inp 002516940.td-b3lyp_6-31g+(d).log.xz

002516940.td-b3lyp_6-31+g(d).qchem.inp (generated)

002516940.td-b3lyp_6-31+g(d).gjf (generated)

002516940.td-b3lyp_6-31+g(d).firefly.inp (generated)

002516940.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002516940.mol 002516940.PUBCHEM 002516940.mol (via Jmol)
002517028.b3lyp_6-31g(d).inp

002517028.b3lyp_6-31g(d).qchem.inp (generated)

002517028.b3lyp_6-31g(d).gjf (generated)

002517028.b3lyp_6-31g(d).firefly.inp (generated)

002517028.b3lyp_6-31g(d).smash.inp (generated)

002517028.b3lyp_6-31g(d).nwchem.inp (generated) 002517028.b3lyp_6-31g(d).log.xz 002517028.td-b3lyp_6-31g+(d).inp 002517028.td-b3lyp_6-31g+(d).log.xz

002517028.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517028.td-b3lyp_6-31+g(d).gjf (generated)

002517028.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517028.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517028.mol 002517028.PUBCHEM 002517028.mol (via Jmol)
002517031.b3lyp_6-31g(d).inp

002517031.b3lyp_6-31g(d).qchem.inp (generated)

002517031.b3lyp_6-31g(d).gjf (generated)

002517031.b3lyp_6-31g(d).firefly.inp (generated)

002517031.b3lyp_6-31g(d).smash.inp (generated)

002517031.b3lyp_6-31g(d).nwchem.inp (generated) 002517031.b3lyp_6-31g(d).log.xz 002517031.td-b3lyp_6-31g+(d).inp 002517031.td-b3lyp_6-31g+(d).log.xz

002517031.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517031.td-b3lyp_6-31+g(d).gjf (generated)

002517031.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517031.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517031.mol 002517031.PUBCHEM 002517031.mol (via Jmol)
002517501.b3lyp_6-31g(d).inp

002517501.b3lyp_6-31g(d).qchem.inp (generated)

002517501.b3lyp_6-31g(d).gjf (generated)

002517501.b3lyp_6-31g(d).firefly.inp (generated)

002517501.b3lyp_6-31g(d).smash.inp (generated)

002517501.b3lyp_6-31g(d).nwchem.inp (generated) 002517501.b3lyp_6-31g(d).log.xz 002517501.mol 002517501.PUBCHEM 002517501.mol (via Jmol)
002517567.b3lyp_6-31g(d).inp

002517567.b3lyp_6-31g(d).qchem.inp (generated)

002517567.b3lyp_6-31g(d).gjf (generated)

002517567.b3lyp_6-31g(d).firefly.inp (generated)

002517567.b3lyp_6-31g(d).smash.inp (generated)

002517567.b3lyp_6-31g(d).nwchem.inp (generated) 002517567.b3lyp_6-31g(d).log.xz 002517567.td-b3lyp_6-31g+(d).inp 002517567.td-b3lyp_6-31g+(d).log.xz

002517567.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517567.td-b3lyp_6-31+g(d).gjf (generated)

002517567.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517567.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517567.mol 002517567.PUBCHEM 002517567.mol (via Jmol)
002517568.b3lyp_6-31g(d).inp

002517568.b3lyp_6-31g(d).qchem.inp (generated)

002517568.b3lyp_6-31g(d).gjf (generated)

002517568.b3lyp_6-31g(d).firefly.inp (generated)

002517568.b3lyp_6-31g(d).smash.inp (generated)

002517568.b3lyp_6-31g(d).nwchem.inp (generated) 002517568.b3lyp_6-31g(d).log.xz 002517568.td-b3lyp_6-31g+(d).inp 002517568.td-b3lyp_6-31g+(d).log.xz

002517568.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517568.td-b3lyp_6-31+g(d).gjf (generated)

002517568.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517568.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517568.mol 002517568.PUBCHEM 002517568.mol (via Jmol)
002517569.b3lyp_6-31g(d).inp

002517569.b3lyp_6-31g(d).qchem.inp (generated)

002517569.b3lyp_6-31g(d).gjf (generated)

002517569.b3lyp_6-31g(d).firefly.inp (generated)

002517569.b3lyp_6-31g(d).smash.inp (generated)

002517569.b3lyp_6-31g(d).nwchem.inp (generated) 002517569.b3lyp_6-31g(d).log.xz 002517569.td-b3lyp_6-31g+(d).inp 002517569.td-b3lyp_6-31g+(d).log.xz

002517569.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517569.td-b3lyp_6-31+g(d).gjf (generated)

002517569.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517569.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517569.mol 002517569.PUBCHEM 002517569.mol (via Jmol)
002517584.b3lyp_6-31g(d).inp

002517584.b3lyp_6-31g(d).qchem.inp (generated)

002517584.b3lyp_6-31g(d).gjf (generated)

002517584.b3lyp_6-31g(d).firefly.inp (generated)

002517584.b3lyp_6-31g(d).smash.inp (generated)

002517584.b3lyp_6-31g(d).nwchem.inp (generated) 002517584.b3lyp_6-31g(d).log.xz 002517584.td-b3lyp_6-31g+(d).inp 002517584.td-b3lyp_6-31g+(d).log.xz

002517584.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517584.td-b3lyp_6-31+g(d).gjf (generated)

002517584.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517584.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517584.mol 002517584.PUBCHEM 002517584.mol (via Jmol)
002517624.b3lyp_6-31g(d).inp

002517624.b3lyp_6-31g(d).qchem.inp (generated)

002517624.b3lyp_6-31g(d).gjf (generated)

002517624.b3lyp_6-31g(d).firefly.inp (generated)

002517624.b3lyp_6-31g(d).smash.inp (generated)

002517624.b3lyp_6-31g(d).nwchem.inp (generated) 002517624.b3lyp_6-31g(d).log.xz 002517624.td-b3lyp_6-31g+(d).inp 002517624.td-b3lyp_6-31g+(d).log.xz

002517624.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517624.td-b3lyp_6-31+g(d).gjf (generated)

002517624.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517624.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517624.mol 002517624.PUBCHEM 002517624.mol (via Jmol)
002517625.b3lyp_6-31g(d).inp

002517625.b3lyp_6-31g(d).qchem.inp (generated)

002517625.b3lyp_6-31g(d).gjf (generated)

002517625.b3lyp_6-31g(d).firefly.inp (generated)

002517625.b3lyp_6-31g(d).smash.inp (generated)

002517625.b3lyp_6-31g(d).nwchem.inp (generated) 002517625.b3lyp_6-31g(d).log.xz 002517625.td-b3lyp_6-31g+(d).inp 002517625.td-b3lyp_6-31g+(d).log.xz

002517625.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517625.td-b3lyp_6-31+g(d).gjf (generated)

002517625.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517625.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517625.mol 002517625.PUBCHEM 002517625.mol (via Jmol)
002517626.b3lyp_6-31g(d).inp

002517626.b3lyp_6-31g(d).qchem.inp (generated)

002517626.b3lyp_6-31g(d).gjf (generated)

002517626.b3lyp_6-31g(d).firefly.inp (generated)

002517626.b3lyp_6-31g(d).smash.inp (generated)

002517626.b3lyp_6-31g(d).nwchem.inp (generated) 002517626.b3lyp_6-31g(d).log.xz 002517626.td-b3lyp_6-31g+(d).inp 002517626.td-b3lyp_6-31g+(d).log.xz

002517626.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517626.td-b3lyp_6-31+g(d).gjf (generated)

002517626.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517626.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517626.mol 002517626.PUBCHEM 002517626.mol (via Jmol)
002517627.b3lyp_6-31g(d).inp

002517627.b3lyp_6-31g(d).qchem.inp (generated)

002517627.b3lyp_6-31g(d).gjf (generated)

002517627.b3lyp_6-31g(d).firefly.inp (generated)

002517627.b3lyp_6-31g(d).smash.inp (generated)

002517627.b3lyp_6-31g(d).nwchem.inp (generated) 002517627.b3lyp_6-31g(d).log.xz 002517627.td-b3lyp_6-31g+(d).inp 002517627.td-b3lyp_6-31g+(d).log.xz

002517627.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517627.td-b3lyp_6-31+g(d).gjf (generated)

002517627.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517627.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517627.mol 002517627.PUBCHEM 002517627.mol (via Jmol)
002517633.b3lyp_6-31g(d).inp

002517633.b3lyp_6-31g(d).qchem.inp (generated)

002517633.b3lyp_6-31g(d).gjf (generated)

002517633.b3lyp_6-31g(d).firefly.inp (generated)

002517633.b3lyp_6-31g(d).smash.inp (generated)

002517633.b3lyp_6-31g(d).nwchem.inp (generated) 002517633.b3lyp_6-31g(d).log.xz 002517633.td-b3lyp_6-31g+(d).inp 002517633.td-b3lyp_6-31g+(d).log.xz

002517633.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517633.td-b3lyp_6-31+g(d).gjf (generated)

002517633.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517633.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517633.mol 002517633.PUBCHEM 002517633.mol (via Jmol)
002517634.b3lyp_6-31g(d).inp

002517634.b3lyp_6-31g(d).qchem.inp (generated)

002517634.b3lyp_6-31g(d).gjf (generated)

002517634.b3lyp_6-31g(d).firefly.inp (generated)

002517634.b3lyp_6-31g(d).smash.inp (generated)

002517634.b3lyp_6-31g(d).nwchem.inp (generated) 002517634.b3lyp_6-31g(d).log.xz 002517634.td-b3lyp_6-31g+(d).inp 002517634.td-b3lyp_6-31g+(d).log.xz

002517634.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517634.td-b3lyp_6-31+g(d).gjf (generated)

002517634.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517634.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517634.mol 002517634.PUBCHEM 002517634.mol (via Jmol)
002517639.b3lyp_6-31g(d).inp

002517639.b3lyp_6-31g(d).qchem.inp (generated)

002517639.b3lyp_6-31g(d).gjf (generated)

002517639.b3lyp_6-31g(d).firefly.inp (generated)

002517639.b3lyp_6-31g(d).smash.inp (generated)

002517639.b3lyp_6-31g(d).nwchem.inp (generated) 002517639.b3lyp_6-31g(d).log.xz 002517639.td-b3lyp_6-31g+(d).inp 002517639.td-b3lyp_6-31g+(d).log.xz

002517639.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517639.td-b3lyp_6-31+g(d).gjf (generated)

002517639.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517639.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517639.mol 002517639.PUBCHEM 002517639.mol (via Jmol)
002517643.b3lyp_6-31g(d).inp

002517643.b3lyp_6-31g(d).qchem.inp (generated)

002517643.b3lyp_6-31g(d).gjf (generated)

002517643.b3lyp_6-31g(d).firefly.inp (generated)

002517643.b3lyp_6-31g(d).smash.inp (generated)

002517643.b3lyp_6-31g(d).nwchem.inp (generated) 002517643.b3lyp_6-31g(d).log.xz 002517643.td-b3lyp_6-31g+(d).inp 002517643.td-b3lyp_6-31g+(d).log.xz

002517643.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517643.td-b3lyp_6-31+g(d).gjf (generated)

002517643.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517643.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517643.mol 002517643.PUBCHEM 002517643.mol (via Jmol)
002517644.b3lyp_6-31g(d).inp

002517644.b3lyp_6-31g(d).qchem.inp (generated)

002517644.b3lyp_6-31g(d).gjf (generated)

002517644.b3lyp_6-31g(d).firefly.inp (generated)

002517644.b3lyp_6-31g(d).smash.inp (generated)

002517644.b3lyp_6-31g(d).nwchem.inp (generated) 002517644.b3lyp_6-31g(d).log.xz 002517644.td-b3lyp_6-31g+(d).inp 002517644.td-b3lyp_6-31g+(d).log.xz

002517644.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517644.td-b3lyp_6-31+g(d).gjf (generated)

002517644.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517644.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517644.mol 002517644.PUBCHEM 002517644.mol (via Jmol)
002517646.b3lyp_6-31g(d).inp

002517646.b3lyp_6-31g(d).qchem.inp (generated)

002517646.b3lyp_6-31g(d).gjf (generated)

002517646.b3lyp_6-31g(d).firefly.inp (generated)

002517646.b3lyp_6-31g(d).smash.inp (generated)

002517646.b3lyp_6-31g(d).nwchem.inp (generated) 002517646.b3lyp_6-31g(d).log.xz 002517646.td-b3lyp_6-31g+(d).inp 002517646.td-b3lyp_6-31g+(d).log.xz

002517646.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517646.td-b3lyp_6-31+g(d).gjf (generated)

002517646.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517646.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517646.mol 002517646.PUBCHEM 002517646.mol (via Jmol)
002517647.b3lyp_6-31g(d).inp

002517647.b3lyp_6-31g(d).qchem.inp (generated)

002517647.b3lyp_6-31g(d).gjf (generated)

002517647.b3lyp_6-31g(d).firefly.inp (generated)

002517647.b3lyp_6-31g(d).smash.inp (generated)

002517647.b3lyp_6-31g(d).nwchem.inp (generated) 002517647.b3lyp_6-31g(d).log.xz 002517647.td-b3lyp_6-31g+(d).inp 002517647.td-b3lyp_6-31g+(d).log.xz

002517647.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517647.td-b3lyp_6-31+g(d).gjf (generated)

002517647.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517647.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517647.mol 002517647.PUBCHEM 002517647.mol (via Jmol)
002517650.b3lyp_6-31g(d).inp

002517650.b3lyp_6-31g(d).qchem.inp (generated)

002517650.b3lyp_6-31g(d).gjf (generated)

002517650.b3lyp_6-31g(d).firefly.inp (generated)

002517650.b3lyp_6-31g(d).smash.inp (generated)

002517650.b3lyp_6-31g(d).nwchem.inp (generated) 002517650.b3lyp_6-31g(d).log.xz 002517650.td-b3lyp_6-31g+(d).inp 002517650.td-b3lyp_6-31g+(d).log.xz

002517650.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517650.td-b3lyp_6-31+g(d).gjf (generated)

002517650.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517650.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517650.mol 002517650.PUBCHEM 002517650.mol (via Jmol)
002517651.b3lyp_6-31g(d).inp

002517651.b3lyp_6-31g(d).qchem.inp (generated)

002517651.b3lyp_6-31g(d).gjf (generated)

002517651.b3lyp_6-31g(d).firefly.inp (generated)

002517651.b3lyp_6-31g(d).smash.inp (generated)

002517651.b3lyp_6-31g(d).nwchem.inp (generated) 002517651.b3lyp_6-31g(d).log.xz 002517651.td-b3lyp_6-31g+(d).inp 002517651.td-b3lyp_6-31g+(d).log.xz

002517651.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517651.td-b3lyp_6-31+g(d).gjf (generated)

002517651.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517651.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517651.mol 002517651.PUBCHEM 002517651.mol (via Jmol)
002517654.b3lyp_6-31g(d).inp

002517654.b3lyp_6-31g(d).qchem.inp (generated)

002517654.b3lyp_6-31g(d).gjf (generated)

002517654.b3lyp_6-31g(d).firefly.inp (generated)

002517654.b3lyp_6-31g(d).smash.inp (generated)

002517654.b3lyp_6-31g(d).nwchem.inp (generated) 002517654.b3lyp_6-31g(d).log.xz 002517654.td-b3lyp_6-31g+(d).inp 002517654.td-b3lyp_6-31g+(d).log.xz

002517654.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517654.td-b3lyp_6-31+g(d).gjf (generated)

002517654.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517654.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517654.mol 002517654.PUBCHEM 002517654.mol (via Jmol)
002517655.b3lyp_6-31g(d).inp

002517655.b3lyp_6-31g(d).qchem.inp (generated)

002517655.b3lyp_6-31g(d).gjf (generated)

002517655.b3lyp_6-31g(d).firefly.inp (generated)

002517655.b3lyp_6-31g(d).smash.inp (generated)

002517655.b3lyp_6-31g(d).nwchem.inp (generated) 002517655.b3lyp_6-31g(d).log.xz 002517655.td-b3lyp_6-31g+(d).inp 002517655.td-b3lyp_6-31g+(d).log.xz

002517655.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517655.td-b3lyp_6-31+g(d).gjf (generated)

002517655.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517655.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517655.mol 002517655.PUBCHEM 002517655.mol (via Jmol)
002517656.b3lyp_6-31g(d).inp

002517656.b3lyp_6-31g(d).qchem.inp (generated)

002517656.b3lyp_6-31g(d).gjf (generated)

002517656.b3lyp_6-31g(d).firefly.inp (generated)

002517656.b3lyp_6-31g(d).smash.inp (generated)

002517656.b3lyp_6-31g(d).nwchem.inp (generated) 002517656.b3lyp_6-31g(d).log.xz 002517656.td-b3lyp_6-31g+(d).inp 002517656.td-b3lyp_6-31g+(d).log.xz

002517656.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517656.td-b3lyp_6-31+g(d).gjf (generated)

002517656.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517656.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517656.mol 002517656.PUBCHEM 002517656.mol (via Jmol)
002517659.b3lyp_6-31g(d).inp

002517659.b3lyp_6-31g(d).qchem.inp (generated)

002517659.b3lyp_6-31g(d).gjf (generated)

002517659.b3lyp_6-31g(d).firefly.inp (generated)

002517659.b3lyp_6-31g(d).smash.inp (generated)

002517659.b3lyp_6-31g(d).nwchem.inp (generated) 002517659.b3lyp_6-31g(d).log.xz 002517659.td-b3lyp_6-31g+(d).inp 002517659.td-b3lyp_6-31g+(d).log.xz

002517659.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517659.td-b3lyp_6-31+g(d).gjf (generated)

002517659.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517659.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517659.mol 002517659.PUBCHEM 002517659.mol (via Jmol)
002517663.b3lyp_6-31g(d).inp

002517663.b3lyp_6-31g(d).qchem.inp (generated)

002517663.b3lyp_6-31g(d).gjf (generated)

002517663.b3lyp_6-31g(d).firefly.inp (generated)

002517663.b3lyp_6-31g(d).smash.inp (generated)

002517663.b3lyp_6-31g(d).nwchem.inp (generated) 002517663.b3lyp_6-31g(d).log.xz 002517663.td-b3lyp_6-31g+(d).inp 002517663.td-b3lyp_6-31g+(d).log.xz

002517663.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517663.td-b3lyp_6-31+g(d).gjf (generated)

002517663.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517663.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517663.mol 002517663.PUBCHEM 002517663.mol (via Jmol)
002517671.b3lyp_6-31g(d).inp

002517671.b3lyp_6-31g(d).qchem.inp (generated)

002517671.b3lyp_6-31g(d).gjf (generated)

002517671.b3lyp_6-31g(d).firefly.inp (generated)

002517671.b3lyp_6-31g(d).smash.inp (generated)

002517671.b3lyp_6-31g(d).nwchem.inp (generated) 002517671.b3lyp_6-31g(d).log.xz 002517671.mol 002517671.PUBCHEM 002517671.mol (via Jmol)
002517682.b3lyp_6-31g(d).inp

002517682.b3lyp_6-31g(d).qchem.inp (generated)

002517682.b3lyp_6-31g(d).gjf (generated)

002517682.b3lyp_6-31g(d).firefly.inp (generated)

002517682.b3lyp_6-31g(d).smash.inp (generated)

002517682.b3lyp_6-31g(d).nwchem.inp (generated) 002517682.b3lyp_6-31g(d).log.xz 002517682.td-b3lyp_6-31g+(d).inp 002517682.td-b3lyp_6-31g+(d).log.xz

002517682.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517682.td-b3lyp_6-31+g(d).gjf (generated)

002517682.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517682.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517682.mol 002517682.PUBCHEM 002517682.mol (via Jmol)
002517683.b3lyp_6-31g(d).inp

002517683.b3lyp_6-31g(d).qchem.inp (generated)

002517683.b3lyp_6-31g(d).gjf (generated)

002517683.b3lyp_6-31g(d).firefly.inp (generated)

002517683.b3lyp_6-31g(d).smash.inp (generated)

002517683.b3lyp_6-31g(d).nwchem.inp (generated) 002517683.b3lyp_6-31g(d).log.xz 002517683.td-b3lyp_6-31g+(d).inp 002517683.td-b3lyp_6-31g+(d).log.xz

002517683.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517683.td-b3lyp_6-31+g(d).gjf (generated)

002517683.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517683.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517683.mol 002517683.PUBCHEM 002517683.mol (via Jmol)
002517686.b3lyp_6-31g(d).inp

002517686.b3lyp_6-31g(d).qchem.inp (generated)

002517686.b3lyp_6-31g(d).gjf (generated)

002517686.b3lyp_6-31g(d).firefly.inp (generated)

002517686.b3lyp_6-31g(d).smash.inp (generated)

002517686.b3lyp_6-31g(d).nwchem.inp (generated) 002517686.b3lyp_6-31g(d).log.xz 002517686.td-b3lyp_6-31g+(d).inp 002517686.td-b3lyp_6-31g+(d).log.xz

002517686.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517686.td-b3lyp_6-31+g(d).gjf (generated)

002517686.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517686.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517686.mol 002517686.PUBCHEM 002517686.mol (via Jmol)
002517687.b3lyp_6-31g(d).inp

002517687.b3lyp_6-31g(d).qchem.inp (generated)

002517687.b3lyp_6-31g(d).gjf (generated)

002517687.b3lyp_6-31g(d).firefly.inp (generated)

002517687.b3lyp_6-31g(d).smash.inp (generated)

002517687.b3lyp_6-31g(d).nwchem.inp (generated) 002517687.b3lyp_6-31g(d).log.xz 002517687.td-b3lyp_6-31g+(d).inp 002517687.td-b3lyp_6-31g+(d).log.xz

002517687.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517687.td-b3lyp_6-31+g(d).gjf (generated)

002517687.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517687.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517687.mol 002517687.PUBCHEM 002517687.mol (via Jmol)
002517689.b3lyp_6-31g(d).inp

002517689.b3lyp_6-31g(d).qchem.inp (generated)

002517689.b3lyp_6-31g(d).gjf (generated)

002517689.b3lyp_6-31g(d).firefly.inp (generated)

002517689.b3lyp_6-31g(d).smash.inp (generated)

002517689.b3lyp_6-31g(d).nwchem.inp (generated) 002517689.b3lyp_6-31g(d).log.xz 002517689.td-b3lyp_6-31g+(d).inp 002517689.td-b3lyp_6-31g+(d).log.xz

002517689.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517689.td-b3lyp_6-31+g(d).gjf (generated)

002517689.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517689.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517689.mol 002517689.PUBCHEM 002517689.mol (via Jmol)
002517690.b3lyp_6-31g(d).inp

002517690.b3lyp_6-31g(d).qchem.inp (generated)

002517690.b3lyp_6-31g(d).gjf (generated)

002517690.b3lyp_6-31g(d).firefly.inp (generated)

002517690.b3lyp_6-31g(d).smash.inp (generated)

002517690.b3lyp_6-31g(d).nwchem.inp (generated) 002517690.b3lyp_6-31g(d).log.xz 002517690.td-b3lyp_6-31g+(d).inp 002517690.td-b3lyp_6-31g+(d).log.xz

002517690.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517690.td-b3lyp_6-31+g(d).gjf (generated)

002517690.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517690.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517690.mol 002517690.PUBCHEM 002517690.mol (via Jmol)
002517696.b3lyp_6-31g(d).inp

002517696.b3lyp_6-31g(d).qchem.inp (generated)

002517696.b3lyp_6-31g(d).gjf (generated)

002517696.b3lyp_6-31g(d).firefly.inp (generated)

002517696.b3lyp_6-31g(d).smash.inp (generated)

002517696.b3lyp_6-31g(d).nwchem.inp (generated) 002517696.b3lyp_6-31g(d).log.xz 002517696.td-b3lyp_6-31g+(d).inp 002517696.td-b3lyp_6-31g+(d).log.xz

002517696.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517696.td-b3lyp_6-31+g(d).gjf (generated)

002517696.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517696.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517696.mol 002517696.PUBCHEM 002517696.mol (via Jmol)
002517697.b3lyp_6-31g(d).inp

002517697.b3lyp_6-31g(d).qchem.inp (generated)

002517697.b3lyp_6-31g(d).gjf (generated)

002517697.b3lyp_6-31g(d).firefly.inp (generated)

002517697.b3lyp_6-31g(d).smash.inp (generated)

002517697.b3lyp_6-31g(d).nwchem.inp (generated) 002517697.b3lyp_6-31g(d).log.xz 002517697.td-b3lyp_6-31g+(d).inp 002517697.td-b3lyp_6-31g+(d).log.xz

002517697.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517697.td-b3lyp_6-31+g(d).gjf (generated)

002517697.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517697.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517697.mol 002517697.PUBCHEM 002517697.mol (via Jmol)
002517737.b3lyp_6-31g(d).inp

002517737.b3lyp_6-31g(d).qchem.inp (generated)

002517737.b3lyp_6-31g(d).gjf (generated)

002517737.b3lyp_6-31g(d).firefly.inp (generated)

002517737.b3lyp_6-31g(d).smash.inp (generated)

002517737.b3lyp_6-31g(d).nwchem.inp (generated) 002517737.b3lyp_6-31g(d).log.xz 002517737.td-b3lyp_6-31g+(d).inp 002517737.td-b3lyp_6-31g+(d).log.xz

002517737.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517737.td-b3lyp_6-31+g(d).gjf (generated)

002517737.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517737.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517737.mol 002517737.PUBCHEM 002517737.mol (via Jmol)
002517739.b3lyp_6-31g(d).inp

002517739.b3lyp_6-31g(d).qchem.inp (generated)

002517739.b3lyp_6-31g(d).gjf (generated)

002517739.b3lyp_6-31g(d).firefly.inp (generated)

002517739.b3lyp_6-31g(d).smash.inp (generated)

002517739.b3lyp_6-31g(d).nwchem.inp (generated) 002517739.b3lyp_6-31g(d).log.xz 002517739.td-b3lyp_6-31g+(d).inp 002517739.td-b3lyp_6-31g+(d).log.xz

002517739.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517739.td-b3lyp_6-31+g(d).gjf (generated)

002517739.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517739.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517739.mol 002517739.PUBCHEM 002517739.mol (via Jmol)
002517834.b3lyp_6-31g(d).inp

002517834.b3lyp_6-31g(d).qchem.inp (generated)

002517834.b3lyp_6-31g(d).gjf (generated)

002517834.b3lyp_6-31g(d).firefly.inp (generated)

002517834.b3lyp_6-31g(d).smash.inp (generated)

002517834.b3lyp_6-31g(d).nwchem.inp (generated) 002517834.b3lyp_6-31g(d).log.xz 002517834.td-b3lyp_6-31g+(d).inp 002517834.td-b3lyp_6-31g+(d).log.xz

002517834.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517834.td-b3lyp_6-31+g(d).gjf (generated)

002517834.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517834.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517834.mol 002517834.PUBCHEM 002517834.mol (via Jmol)
002517948.b3lyp_6-31g(d).inp

002517948.b3lyp_6-31g(d).qchem.inp (generated)

002517948.b3lyp_6-31g(d).gjf (generated)

002517948.b3lyp_6-31g(d).firefly.inp (generated)

002517948.b3lyp_6-31g(d).smash.inp (generated)

002517948.b3lyp_6-31g(d).nwchem.inp (generated) 002517948.b3lyp_6-31g(d).log.xz 002517948.mol 002517948.PUBCHEM 002517948.mol (via Jmol)
002517958.b3lyp_6-31g(d).inp

002517958.b3lyp_6-31g(d).qchem.inp (generated)

002517958.b3lyp_6-31g(d).gjf (generated)

002517958.b3lyp_6-31g(d).firefly.inp (generated)

002517958.b3lyp_6-31g(d).smash.inp (generated)

002517958.b3lyp_6-31g(d).nwchem.inp (generated) 002517958.b3lyp_6-31g(d).log.xz 002517958.td-b3lyp_6-31g+(d).inp 002517958.td-b3lyp_6-31g+(d).log.xz

002517958.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517958.td-b3lyp_6-31+g(d).gjf (generated)

002517958.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517958.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517958.mol 002517958.PUBCHEM 002517958.mol (via Jmol)
002517963.b3lyp_6-31g(d).inp

002517963.b3lyp_6-31g(d).qchem.inp (generated)

002517963.b3lyp_6-31g(d).gjf (generated)

002517963.b3lyp_6-31g(d).firefly.inp (generated)

002517963.b3lyp_6-31g(d).smash.inp (generated)

002517963.b3lyp_6-31g(d).nwchem.inp (generated) 002517963.b3lyp_6-31g(d).log.xz 002517963.td-b3lyp_6-31g+(d).inp 002517963.td-b3lyp_6-31g+(d).log.xz

002517963.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517963.td-b3lyp_6-31+g(d).gjf (generated)

002517963.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517963.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517963.mol 002517963.PUBCHEM 002517963.mol (via Jmol)
002517974.b3lyp_6-31g(d).inp

002517974.b3lyp_6-31g(d).qchem.inp (generated)

002517974.b3lyp_6-31g(d).gjf (generated)

002517974.b3lyp_6-31g(d).firefly.inp (generated)

002517974.b3lyp_6-31g(d).smash.inp (generated)

002517974.b3lyp_6-31g(d).nwchem.inp (generated) 002517974.b3lyp_6-31g(d).log.xz 002517974.td-b3lyp_6-31g+(d).inp 002517974.td-b3lyp_6-31g+(d).log.xz

002517974.td-b3lyp_6-31+g(d).qchem.inp (generated)

002517974.td-b3lyp_6-31+g(d).gjf (generated)

002517974.td-b3lyp_6-31+g(d).firefly.inp (generated)

002517974.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002517974.mol 002517974.PUBCHEM 002517974.mol (via Jmol)
002518729.b3lyp_6-31g(d).inp

002518729.b3lyp_6-31g(d).qchem.inp (generated)

002518729.b3lyp_6-31g(d).gjf (generated)

002518729.b3lyp_6-31g(d).firefly.inp (generated)

002518729.b3lyp_6-31g(d).smash.inp (generated)

002518729.b3lyp_6-31g(d).nwchem.inp (generated) 002518729.b3lyp_6-31g(d).log.xz 002518729.td-b3lyp_6-31g+(d).inp 002518729.td-b3lyp_6-31g+(d).log.xz

002518729.td-b3lyp_6-31+g(d).qchem.inp (generated)

002518729.td-b3lyp_6-31+g(d).gjf (generated)

002518729.td-b3lyp_6-31+g(d).firefly.inp (generated)

002518729.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002518729.mol 002518729.PUBCHEM 002518729.mol (via Jmol)
002518731.b3lyp_6-31g(d).inp

002518731.b3lyp_6-31g(d).qchem.inp (generated)

002518731.b3lyp_6-31g(d).gjf (generated)

002518731.b3lyp_6-31g(d).firefly.inp (generated)

002518731.b3lyp_6-31g(d).smash.inp (generated)

002518731.b3lyp_6-31g(d).nwchem.inp (generated) 002518731.b3lyp_6-31g(d).log.xz 002518731.td-b3lyp_6-31g+(d).inp 002518731.td-b3lyp_6-31g+(d).log.xz

002518731.td-b3lyp_6-31+g(d).qchem.inp (generated)

002518731.td-b3lyp_6-31+g(d).gjf (generated)

002518731.td-b3lyp_6-31+g(d).firefly.inp (generated)

002518731.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002518731.mol 002518731.PUBCHEM 002518731.mol (via Jmol)
002519285.b3lyp_6-31g(d).inp

002519285.b3lyp_6-31g(d).qchem.inp (generated)

002519285.b3lyp_6-31g(d).gjf (generated)

002519285.b3lyp_6-31g(d).firefly.inp (generated)

002519285.b3lyp_6-31g(d).smash.inp (generated)

002519285.b3lyp_6-31g(d).nwchem.inp (generated) 002519285.b3lyp_6-31g(d).log.xz 002519285.td-b3lyp_6-31g+(d).inp 002519285.td-b3lyp_6-31g+(d).log.xz

002519285.td-b3lyp_6-31+g(d).qchem.inp (generated)

002519285.td-b3lyp_6-31+g(d).gjf (generated)

002519285.td-b3lyp_6-31+g(d).firefly.inp (generated)

002519285.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002519285.mol 002519285.PUBCHEM 002519285.mol (via Jmol)
002519286.b3lyp_6-31g(d).inp

002519286.b3lyp_6-31g(d).qchem.inp (generated)

002519286.b3lyp_6-31g(d).gjf (generated)

002519286.b3lyp_6-31g(d).firefly.inp (generated)

002519286.b3lyp_6-31g(d).smash.inp (generated)

002519286.b3lyp_6-31g(d).nwchem.inp (generated) 002519286.b3lyp_6-31g(d).log.xz 002519286.td-b3lyp_6-31g+(d).inp 002519286.td-b3lyp_6-31g+(d).log.xz

002519286.td-b3lyp_6-31+g(d).qchem.inp (generated)

002519286.td-b3lyp_6-31+g(d).gjf (generated)

002519286.td-b3lyp_6-31+g(d).firefly.inp (generated)

002519286.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002519286.mol 002519286.PUBCHEM 002519286.mol (via Jmol)
002519292.b3lyp_6-31g(d).inp

002519292.b3lyp_6-31g(d).qchem.inp (generated)

002519292.b3lyp_6-31g(d).gjf (generated)

002519292.b3lyp_6-31g(d).firefly.inp (generated)

002519292.b3lyp_6-31g(d).smash.inp (generated)

002519292.b3lyp_6-31g(d).nwchem.inp (generated) 002519292.b3lyp_6-31g(d).log.xz 002519292.td-b3lyp_6-31g+(d).inp 002519292.td-b3lyp_6-31g+(d).log.xz

002519292.td-b3lyp_6-31+g(d).qchem.inp (generated)

002519292.td-b3lyp_6-31+g(d).gjf (generated)

002519292.td-b3lyp_6-31+g(d).firefly.inp (generated)

002519292.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002519292.mol 002519292.PUBCHEM 002519292.mol (via Jmol)
002519331.b3lyp_6-31g(d).inp

002519331.b3lyp_6-31g(d).qchem.inp (generated)

002519331.b3lyp_6-31g(d).gjf (generated)

002519331.b3lyp_6-31g(d).firefly.inp (generated)

002519331.b3lyp_6-31g(d).smash.inp (generated)

002519331.b3lyp_6-31g(d).nwchem.inp (generated) 002519331.b3lyp_6-31g(d).log.xz 002519331.mol 002519331.PUBCHEM 002519331.mol (via Jmol)
002519668.b3lyp_6-31g(d).inp

002519668.b3lyp_6-31g(d).qchem.inp (generated)

002519668.b3lyp_6-31g(d).gjf (generated)

002519668.b3lyp_6-31g(d).firefly.inp (generated)

002519668.b3lyp_6-31g(d).smash.inp (generated)

002519668.b3lyp_6-31g(d).nwchem.inp (generated) 002519668.b3lyp_6-31g(d).log.xz 002519668.td-b3lyp_6-31g+(d).inp 002519668.td-b3lyp_6-31g+(d).log.xz

002519668.td-b3lyp_6-31+g(d).qchem.inp (generated)

002519668.td-b3lyp_6-31+g(d).gjf (generated)

002519668.td-b3lyp_6-31+g(d).firefly.inp (generated)

002519668.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002519668.mol 002519668.PUBCHEM 002519668.mol (via Jmol)
002519760.b3lyp_6-31g(d).inp

002519760.b3lyp_6-31g(d).qchem.inp (generated)

002519760.b3lyp_6-31g(d).gjf (generated)

002519760.b3lyp_6-31g(d).firefly.inp (generated)

002519760.b3lyp_6-31g(d).smash.inp (generated)

002519760.b3lyp_6-31g(d).nwchem.inp (generated) 002519760.b3lyp_6-31g(d).log.xz 002519760.mol 002519760.PUBCHEM 002519760.mol (via Jmol)
002519761.b3lyp_6-31g(d).inp

002519761.b3lyp_6-31g(d).qchem.inp (generated)

002519761.b3lyp_6-31g(d).gjf (generated)

002519761.b3lyp_6-31g(d).firefly.inp (generated)

002519761.b3lyp_6-31g(d).smash.inp (generated)

002519761.b3lyp_6-31g(d).nwchem.inp (generated) 002519761.b3lyp_6-31g(d).log.xz 002519761.mol 002519761.PUBCHEM 002519761.mol (via Jmol)
002520233.b3lyp_6-31g(d).inp

002520233.b3lyp_6-31g(d).qchem.inp (generated)

002520233.b3lyp_6-31g(d).gjf (generated)

002520233.b3lyp_6-31g(d).firefly.inp (generated)

002520233.b3lyp_6-31g(d).smash.inp (generated)

002520233.b3lyp_6-31g(d).nwchem.inp (generated) 002520233.b3lyp_6-31g(d).log.xz 002520233.td-b3lyp_6-31g+(d).inp 002520233.td-b3lyp_6-31g+(d).log.xz

002520233.td-b3lyp_6-31+g(d).qchem.inp (generated)

002520233.td-b3lyp_6-31+g(d).gjf (generated)

002520233.td-b3lyp_6-31+g(d).firefly.inp (generated)

002520233.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002520233.mol 002520233.PUBCHEM 002520233.mol (via Jmol)
002520286.b3lyp_6-31g(d).inp

002520286.b3lyp_6-31g(d).qchem.inp (generated)

002520286.b3lyp_6-31g(d).gjf (generated)

002520286.b3lyp_6-31g(d).firefly.inp (generated)

002520286.b3lyp_6-31g(d).smash.inp (generated)

002520286.b3lyp_6-31g(d).nwchem.inp (generated) 002520286.b3lyp_6-31g(d).log.xz 002520286.td-b3lyp_6-31g+(d).inp 002520286.td-b3lyp_6-31g+(d).log.xz

002520286.td-b3lyp_6-31+g(d).qchem.inp (generated)

002520286.td-b3lyp_6-31+g(d).gjf (generated)

002520286.td-b3lyp_6-31+g(d).firefly.inp (generated)

002520286.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002520286.mol 002520286.PUBCHEM 002520286.mol (via Jmol)
002520306.b3lyp_6-31g(d).inp

002520306.b3lyp_6-31g(d).qchem.inp (generated)

002520306.b3lyp_6-31g(d).gjf (generated)

002520306.b3lyp_6-31g(d).firefly.inp (generated)

002520306.b3lyp_6-31g(d).smash.inp (generated)

002520306.b3lyp_6-31g(d).nwchem.inp (generated) 002520306.b3lyp_6-31g(d).log.xz 002520306.mol 002520306.PUBCHEM 002520306.mol (via Jmol)
002520309.b3lyp_6-31g(d).inp

002520309.b3lyp_6-31g(d).qchem.inp (generated)

002520309.b3lyp_6-31g(d).gjf (generated)

002520309.b3lyp_6-31g(d).firefly.inp (generated)

002520309.b3lyp_6-31g(d).smash.inp (generated)

002520309.b3lyp_6-31g(d).nwchem.inp (generated) 002520309.b3lyp_6-31g(d).log.xz 002520309.mol 002520309.PUBCHEM 002520309.mol (via Jmol)
002520337.b3lyp_6-31g(d).inp

002520337.b3lyp_6-31g(d).qchem.inp (generated)

002520337.b3lyp_6-31g(d).gjf (generated)

002520337.b3lyp_6-31g(d).firefly.inp (generated)

002520337.b3lyp_6-31g(d).smash.inp (generated)

002520337.b3lyp_6-31g(d).nwchem.inp (generated) 002520337.b3lyp_6-31g(d).log.xz 002520337.td-b3lyp_6-31g+(d).inp 002520337.td-b3lyp_6-31g+(d).log.xz

002520337.td-b3lyp_6-31+g(d).qchem.inp (generated)

002520337.td-b3lyp_6-31+g(d).gjf (generated)

002520337.td-b3lyp_6-31+g(d).firefly.inp (generated)

002520337.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002520337.mol 002520337.PUBCHEM 002520337.mol (via Jmol)
002520589.b3lyp_6-31g(d).inp

002520589.b3lyp_6-31g(d).qchem.inp (generated)

002520589.b3lyp_6-31g(d).gjf (generated)

002520589.b3lyp_6-31g(d).firefly.inp (generated)

002520589.b3lyp_6-31g(d).smash.inp (generated)

002520589.b3lyp_6-31g(d).nwchem.inp (generated) 002520589.b3lyp_6-31g(d).log.xz 002520589.td-b3lyp_6-31g+(d).inp 002520589.td-b3lyp_6-31g+(d).log.xz

002520589.td-b3lyp_6-31+g(d).qchem.inp (generated)

002520589.td-b3lyp_6-31+g(d).gjf (generated)

002520589.td-b3lyp_6-31+g(d).firefly.inp (generated)

002520589.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002520589.mol 002520589.PUBCHEM 002520589.mol (via Jmol)
002520659.b3lyp_6-31g(d).inp

002520659.b3lyp_6-31g(d).qchem.inp (generated)

002520659.b3lyp_6-31g(d).gjf (generated)

002520659.b3lyp_6-31g(d).firefly.inp (generated)

002520659.b3lyp_6-31g(d).smash.inp (generated)

002520659.b3lyp_6-31g(d).nwchem.inp (generated) 002520659.b3lyp_6-31g(d).log.xz 002520659.td-b3lyp_6-31g+(d).inp 002520659.td-b3lyp_6-31g+(d).log.xz

002520659.td-b3lyp_6-31+g(d).qchem.inp (generated)

002520659.td-b3lyp_6-31+g(d).gjf (generated)

002520659.td-b3lyp_6-31+g(d).firefly.inp (generated)

002520659.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002520659.mol 002520659.PUBCHEM 002520659.mol (via Jmol)
002521521.b3lyp_6-31g(d).inp

002521521.b3lyp_6-31g(d).qchem.inp (generated)

002521521.b3lyp_6-31g(d).gjf (generated)

002521521.b3lyp_6-31g(d).firefly.inp (generated)

002521521.b3lyp_6-31g(d).smash.inp (generated)

002521521.b3lyp_6-31g(d).nwchem.inp (generated) 002521521.b3lyp_6-31g(d).log.xz 002521521.td-b3lyp_6-31g+(d).inp 002521521.td-b3lyp_6-31g+(d).log.xz

002521521.td-b3lyp_6-31+g(d).qchem.inp (generated)

002521521.td-b3lyp_6-31+g(d).gjf (generated)

002521521.td-b3lyp_6-31+g(d).firefly.inp (generated)

002521521.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002521521.mol 002521521.PUBCHEM 002521521.mol (via Jmol)
002521523.b3lyp_6-31g(d).inp

002521523.b3lyp_6-31g(d).qchem.inp (generated)

002521523.b3lyp_6-31g(d).gjf (generated)

002521523.b3lyp_6-31g(d).firefly.inp (generated)

002521523.b3lyp_6-31g(d).smash.inp (generated)

002521523.b3lyp_6-31g(d).nwchem.inp (generated) 002521523.b3lyp_6-31g(d).log.xz 002521523.td-b3lyp_6-31g+(d).inp 002521523.td-b3lyp_6-31g+(d).log.xz

002521523.td-b3lyp_6-31+g(d).qchem.inp (generated)

002521523.td-b3lyp_6-31+g(d).gjf (generated)

002521523.td-b3lyp_6-31+g(d).firefly.inp (generated)

002521523.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002521523.mol 002521523.PUBCHEM 002521523.mol (via Jmol)
002521973.b3lyp_6-31g(d).inp

002521973.b3lyp_6-31g(d).qchem.inp (generated)

002521973.b3lyp_6-31g(d).gjf (generated)

002521973.b3lyp_6-31g(d).firefly.inp (generated)

002521973.b3lyp_6-31g(d).smash.inp (generated)

002521973.b3lyp_6-31g(d).nwchem.inp (generated) 002521973.b3lyp_6-31g(d).log.xz 002521973.td-b3lyp_6-31g+(d).inp 002521973.td-b3lyp_6-31g+(d).log.xz

002521973.td-b3lyp_6-31+g(d).qchem.inp (generated)

002521973.td-b3lyp_6-31+g(d).gjf (generated)

002521973.td-b3lyp_6-31+g(d).firefly.inp (generated)

002521973.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002521973.mol 002521973.PUBCHEM 002521973.mol (via Jmol)
002521975.b3lyp_6-31g(d).inp

002521975.b3lyp_6-31g(d).qchem.inp (generated)

002521975.b3lyp_6-31g(d).gjf (generated)

002521975.b3lyp_6-31g(d).firefly.inp (generated)

002521975.b3lyp_6-31g(d).smash.inp (generated)

002521975.b3lyp_6-31g(d).nwchem.inp (generated) 002521975.b3lyp_6-31g(d).log.xz 002521975.td-b3lyp_6-31g+(d).inp 002521975.td-b3lyp_6-31g+(d).log.xz

002521975.td-b3lyp_6-31+g(d).qchem.inp (generated)

002521975.td-b3lyp_6-31+g(d).gjf (generated)

002521975.td-b3lyp_6-31+g(d).firefly.inp (generated)

002521975.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002521975.mol 002521975.PUBCHEM 002521975.mol (via Jmol)
002522014.b3lyp_6-31g(d).inp

002522014.b3lyp_6-31g(d).qchem.inp (generated)

002522014.b3lyp_6-31g(d).gjf (generated)

002522014.b3lyp_6-31g(d).firefly.inp (generated)

002522014.b3lyp_6-31g(d).smash.inp (generated)

002522014.b3lyp_6-31g(d).nwchem.inp (generated) 002522014.b3lyp_6-31g(d).log.xz 002522014.mol 002522014.PUBCHEM 002522014.mol (via Jmol)
002523095.b3lyp_6-31g(d).inp

002523095.b3lyp_6-31g(d).qchem.inp (generated)

002523095.b3lyp_6-31g(d).gjf (generated)

002523095.b3lyp_6-31g(d).firefly.inp (generated)

002523095.b3lyp_6-31g(d).smash.inp (generated)

002523095.b3lyp_6-31g(d).nwchem.inp (generated) 002523095.b3lyp_6-31g(d).log.xz 002523095.td-b3lyp_6-31g+(d).inp 002523095.td-b3lyp_6-31g+(d).log.xz

002523095.td-b3lyp_6-31+g(d).qchem.inp (generated)

002523095.td-b3lyp_6-31+g(d).gjf (generated)

002523095.td-b3lyp_6-31+g(d).firefly.inp (generated)

002523095.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002523095.mol 002523095.PUBCHEM 002523095.mol (via Jmol)
002523162.b3lyp_6-31g(d).inp

002523162.b3lyp_6-31g(d).qchem.inp (generated)

002523162.b3lyp_6-31g(d).gjf (generated)

002523162.b3lyp_6-31g(d).firefly.inp (generated)

002523162.b3lyp_6-31g(d).smash.inp (generated)

002523162.b3lyp_6-31g(d).nwchem.inp (generated) 002523162.b3lyp_6-31g(d).log.xz 002523162.td-b3lyp_6-31g+(d).inp 002523162.td-b3lyp_6-31g+(d).log.xz

002523162.td-b3lyp_6-31+g(d).qchem.inp (generated)

002523162.td-b3lyp_6-31+g(d).gjf (generated)

002523162.td-b3lyp_6-31+g(d).firefly.inp (generated)

002523162.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002523162.mol 002523162.PUBCHEM 002523162.mol (via Jmol)
002523169.b3lyp_6-31g(d).inp

002523169.b3lyp_6-31g(d).qchem.inp (generated)

002523169.b3lyp_6-31g(d).gjf (generated)

002523169.b3lyp_6-31g(d).firefly.inp (generated)

002523169.b3lyp_6-31g(d).smash.inp (generated)

002523169.b3lyp_6-31g(d).nwchem.inp (generated) 002523169.b3lyp_6-31g(d).log.xz 002523169.td-b3lyp_6-31g+(d).inp 002523169.td-b3lyp_6-31g+(d).log.xz

002523169.td-b3lyp_6-31+g(d).qchem.inp (generated)

002523169.td-b3lyp_6-31+g(d).gjf (generated)

002523169.td-b3lyp_6-31+g(d).firefly.inp (generated)

002523169.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002523169.mol 002523169.PUBCHEM 002523169.mol (via Jmol)
002523256.b3lyp_6-31g(d).inp

002523256.b3lyp_6-31g(d).qchem.inp (generated)

002523256.b3lyp_6-31g(d).gjf (generated)

002523256.b3lyp_6-31g(d).firefly.inp (generated)

002523256.b3lyp_6-31g(d).smash.inp (generated)

002523256.b3lyp_6-31g(d).nwchem.inp (generated) 002523256.b3lyp_6-31g(d).log.xz 002523256.td-b3lyp_6-31g+(d).inp 002523256.td-b3lyp_6-31g+(d).log.xz

002523256.td-b3lyp_6-31+g(d).qchem.inp (generated)

002523256.td-b3lyp_6-31+g(d).gjf (generated)

002523256.td-b3lyp_6-31+g(d).firefly.inp (generated)

002523256.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002523256.mol 002523256.PUBCHEM 002523256.mol (via Jmol)
002523763.b3lyp_6-31g(d).inp

002523763.b3lyp_6-31g(d).qchem.inp (generated)

002523763.b3lyp_6-31g(d).gjf (generated)

002523763.b3lyp_6-31g(d).firefly.inp (generated)

002523763.b3lyp_6-31g(d).smash.inp (generated)

002523763.b3lyp_6-31g(d).nwchem.inp (generated) 002523763.b3lyp_6-31g(d).log.xz 002523763.td-b3lyp_6-31g+(d).inp 002523763.td-b3lyp_6-31g+(d).log.xz

002523763.td-b3lyp_6-31+g(d).qchem.inp (generated)

002523763.td-b3lyp_6-31+g(d).gjf (generated)

002523763.td-b3lyp_6-31+g(d).firefly.inp (generated)

002523763.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002523763.mol 002523763.PUBCHEM 002523763.mol (via Jmol)
002523870.b3lyp_6-31g(d).inp

002523870.b3lyp_6-31g(d).qchem.inp (generated)

002523870.b3lyp_6-31g(d).gjf (generated)

002523870.b3lyp_6-31g(d).firefly.inp (generated)

002523870.b3lyp_6-31g(d).smash.inp (generated)

002523870.b3lyp_6-31g(d).nwchem.inp (generated) 002523870.b3lyp_6-31g(d).log.xz 002523870.td-b3lyp_6-31g+(d).inp 002523870.td-b3lyp_6-31g+(d).log.xz

002523870.td-b3lyp_6-31+g(d).qchem.inp (generated)

002523870.td-b3lyp_6-31+g(d).gjf (generated)

002523870.td-b3lyp_6-31+g(d).firefly.inp (generated)

002523870.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002523870.mol 002523870.PUBCHEM 002523870.mol (via Jmol)
002523873.b3lyp_6-31g(d).inp

002523873.b3lyp_6-31g(d).qchem.inp (generated)

002523873.b3lyp_6-31g(d).gjf (generated)

002523873.b3lyp_6-31g(d).firefly.inp (generated)

002523873.b3lyp_6-31g(d).smash.inp (generated)

002523873.b3lyp_6-31g(d).nwchem.inp (generated) 002523873.b3lyp_6-31g(d).log.xz 002523873.td-b3lyp_6-31g+(d).inp 002523873.td-b3lyp_6-31g+(d).log.xz

002523873.td-b3lyp_6-31+g(d).qchem.inp (generated)

002523873.td-b3lyp_6-31+g(d).gjf (generated)

002523873.td-b3lyp_6-31+g(d).firefly.inp (generated)

002523873.td-b3lyp_6-31+g(d).nwchem.inp (generated) 002523873.mol 002523873.PUBCHEM 002523873.mol (via Jmol)
002524921.b3lyp_6-31g(d).inp

002524921.b3lyp_6-31g(d).qchem.inp (generated)

002524921.b3lyp_6-31g(d).gjf (generated)

002524921.b3lyp_6-31g(d).firefly.inp (generated)

002524921.b3lyp_6-31g(d).smash.inp (generated)

002524921.b3lyp_6-31g(d).nwchem.inp (generated) 002524921.b3lyp_6-31g(d).log.xz 002524921.mol 002524921.PUBCHEM 002524921.mol (via Jmol)


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