Index of

Last updated : Thu Mar 23 01:58:55 JST 2017
Total : 773 (658) in this page
005125021.b3lyp_6-31g(d).inp

005125021.b3lyp_6-31g(d).qchem.inp (generated)

005125021.b3lyp_6-31g(d).gjf (generated)

005125021.b3lyp_6-31g(d).firefly.inp (generated)

005125021.b3lyp_6-31g(d).smash.inp (generated)

005125021.b3lyp_6-31g(d).nwchem.inp (generated) 005125021.b3lyp_6-31g(d).log.xz 005125021.td-b3lyp_6-31g+(d).inp 005125021.td-b3lyp_6-31g+(d).log.xz

005125021.td-b3lyp_6-31+g(d).qchem.inp (generated)

005125021.td-b3lyp_6-31+g(d).gjf (generated)

005125021.td-b3lyp_6-31+g(d).firefly.inp (generated)

005125021.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005125021.mol 005125021.PUBCHEM 005125021.mol (via Jmol)
005125273.b3lyp_6-31g(d).inp

005125273.b3lyp_6-31g(d).qchem.inp (generated)

005125273.b3lyp_6-31g(d).gjf (generated)

005125273.b3lyp_6-31g(d).firefly.inp (generated)

005125273.b3lyp_6-31g(d).smash.inp (generated)

005125273.b3lyp_6-31g(d).nwchem.inp (generated) 005125273.b3lyp_6-31g(d).log.xz 005125273.td-b3lyp_6-31g+(d).inp 005125273.td-b3lyp_6-31g+(d).log.xz

005125273.td-b3lyp_6-31+g(d).qchem.inp (generated)

005125273.td-b3lyp_6-31+g(d).gjf (generated)

005125273.td-b3lyp_6-31+g(d).firefly.inp (generated)

005125273.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005125273.mol 005125273.PUBCHEM 005125273.mol (via Jmol)
005125438.b3lyp_6-31g(d).inp

005125438.b3lyp_6-31g(d).qchem.inp (generated)

005125438.b3lyp_6-31g(d).gjf (generated)

005125438.b3lyp_6-31g(d).firefly.inp (generated)

005125438.b3lyp_6-31g(d).smash.inp (generated)

005125438.b3lyp_6-31g(d).nwchem.inp (generated) 005125438.b3lyp_6-31g(d).log.xz 005125438.td-b3lyp_6-31g+(d).inp 005125438.td-b3lyp_6-31g+(d).log.xz

005125438.td-b3lyp_6-31+g(d).qchem.inp (generated)

005125438.td-b3lyp_6-31+g(d).gjf (generated)

005125438.td-b3lyp_6-31+g(d).firefly.inp (generated)

005125438.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005125438.mol 005125438.PUBCHEM 005125438.mol (via Jmol)
005125443.b3lyp_6-31g(d).inp

005125443.b3lyp_6-31g(d).qchem.inp (generated)

005125443.b3lyp_6-31g(d).gjf (generated)

005125443.b3lyp_6-31g(d).firefly.inp (generated)

005125443.b3lyp_6-31g(d).smash.inp (generated)

005125443.b3lyp_6-31g(d).nwchem.inp (generated) 005125443.b3lyp_6-31g(d).log.xz 005125443.td-b3lyp_6-31g+(d).inp 005125443.td-b3lyp_6-31g+(d).log.xz

005125443.td-b3lyp_6-31+g(d).qchem.inp (generated)

005125443.td-b3lyp_6-31+g(d).gjf (generated)

005125443.td-b3lyp_6-31+g(d).firefly.inp (generated)

005125443.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005125443.mol 005125443.PUBCHEM 005125443.mol (via Jmol)
005125501.b3lyp_6-31g(d).inp

005125501.b3lyp_6-31g(d).qchem.inp (generated)

005125501.b3lyp_6-31g(d).gjf (generated)

005125501.b3lyp_6-31g(d).firefly.inp (generated)

005125501.b3lyp_6-31g(d).smash.inp (generated)

005125501.b3lyp_6-31g(d).nwchem.inp (generated) 005125501.b3lyp_6-31g(d).log.xz 005125501.mol 005125501.PUBCHEM 005125501.mol (via Jmol)
005125503.b3lyp_6-31g(d).inp

005125503.b3lyp_6-31g(d).qchem.inp (generated)

005125503.b3lyp_6-31g(d).gjf (generated)

005125503.b3lyp_6-31g(d).firefly.inp (generated)

005125503.b3lyp_6-31g(d).smash.inp (generated)

005125503.b3lyp_6-31g(d).nwchem.inp (generated) 005125503.b3lyp_6-31g(d).log.xz 005125503.mol 005125503.PUBCHEM 005125503.mol (via Jmol)
005125572.b3lyp_6-31g(d).inp

005125572.b3lyp_6-31g(d).qchem.inp (generated)

005125572.b3lyp_6-31g(d).gjf (generated)

005125572.b3lyp_6-31g(d).firefly.inp (generated)

005125572.b3lyp_6-31g(d).smash.inp (generated)

005125572.b3lyp_6-31g(d).nwchem.inp (generated) 005125572.b3lyp_6-31g(d).log.xz 005125572.td-b3lyp_6-31g+(d).inp 005125572.td-b3lyp_6-31g+(d).log.xz

005125572.td-b3lyp_6-31+g(d).qchem.inp (generated)

005125572.td-b3lyp_6-31+g(d).gjf (generated)

005125572.td-b3lyp_6-31+g(d).firefly.inp (generated)

005125572.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005125572.mol 005125572.PUBCHEM 005125572.mol (via Jmol)
005125851.b3lyp_6-31g(d).inp

005125851.b3lyp_6-31g(d).qchem.inp (generated)

005125851.b3lyp_6-31g(d).gjf (generated)

005125851.b3lyp_6-31g(d).firefly.inp (generated)

005125851.b3lyp_6-31g(d).smash.inp (generated)

005125851.b3lyp_6-31g(d).nwchem.inp (generated) 005125851.b3lyp_6-31g(d).log.xz 005125851.mol 005125851.PUBCHEM 005125851.mol (via Jmol)
005125865.b3lyp_6-31g(d).inp

005125865.b3lyp_6-31g(d).qchem.inp (generated)

005125865.b3lyp_6-31g(d).gjf (generated)

005125865.b3lyp_6-31g(d).firefly.inp (generated)

005125865.b3lyp_6-31g(d).smash.inp (generated)

005125865.b3lyp_6-31g(d).nwchem.inp (generated) 005125865.b3lyp_6-31g(d).log.xz 005125865.td-b3lyp_6-31g+(d).inp 005125865.td-b3lyp_6-31g+(d).log.xz

005125865.td-b3lyp_6-31+g(d).qchem.inp (generated)

005125865.td-b3lyp_6-31+g(d).gjf (generated)

005125865.td-b3lyp_6-31+g(d).firefly.inp (generated)

005125865.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005125865.mol 005125865.PUBCHEM 005125865.mol (via Jmol)
005125887.b3lyp_6-31g(d).inp

005125887.b3lyp_6-31g(d).qchem.inp (generated)

005125887.b3lyp_6-31g(d).gjf (generated)

005125887.b3lyp_6-31g(d).firefly.inp (generated)

005125887.b3lyp_6-31g(d).smash.inp (generated)

005125887.b3lyp_6-31g(d).nwchem.inp (generated) 005125887.b3lyp_6-31g(d).log.xz 005125887.td-b3lyp_6-31g+(d).inp 005125887.td-b3lyp_6-31g+(d).log.xz

005125887.td-b3lyp_6-31+g(d).qchem.inp (generated)

005125887.td-b3lyp_6-31+g(d).gjf (generated)

005125887.td-b3lyp_6-31+g(d).firefly.inp (generated)

005125887.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005125887.mol 005125887.PUBCHEM 005125887.mol (via Jmol)
005125897.b3lyp_6-31g(d).inp

005125897.b3lyp_6-31g(d).qchem.inp (generated)

005125897.b3lyp_6-31g(d).gjf (generated)

005125897.b3lyp_6-31g(d).firefly.inp (generated)

005125897.b3lyp_6-31g(d).smash.inp (generated)

005125897.b3lyp_6-31g(d).nwchem.inp (generated) 005125897.b3lyp_6-31g(d).log.xz 005125897.td-b3lyp_6-31g+(d).inp 005125897.td-b3lyp_6-31g+(d).log.xz

005125897.td-b3lyp_6-31+g(d).qchem.inp (generated)

005125897.td-b3lyp_6-31+g(d).gjf (generated)

005125897.td-b3lyp_6-31+g(d).firefly.inp (generated)

005125897.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005125897.mol 005125897.PUBCHEM 005125897.mol (via Jmol)
005126073.b3lyp_6-31g(d).inp

005126073.b3lyp_6-31g(d).qchem.inp (generated)

005126073.b3lyp_6-31g(d).gjf (generated)

005126073.b3lyp_6-31g(d).firefly.inp (generated)

005126073.b3lyp_6-31g(d).smash.inp (generated)

005126073.b3lyp_6-31g(d).nwchem.inp (generated) 005126073.b3lyp_6-31g(d).log.xz 005126073.td-b3lyp_6-31g+(d).inp 005126073.td-b3lyp_6-31g+(d).log.xz

005126073.td-b3lyp_6-31+g(d).qchem.inp (generated)

005126073.td-b3lyp_6-31+g(d).gjf (generated)

005126073.td-b3lyp_6-31+g(d).firefly.inp (generated)

005126073.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005126073.mol 005126073.PUBCHEM 005126073.mol (via Jmol)
005126105.b3lyp_6-31g(d).inp

005126105.b3lyp_6-31g(d).qchem.inp (generated)

005126105.b3lyp_6-31g(d).gjf (generated)

005126105.b3lyp_6-31g(d).firefly.inp (generated)

005126105.b3lyp_6-31g(d).smash.inp (generated)

005126105.b3lyp_6-31g(d).nwchem.inp (generated) 005126105.b3lyp_6-31g(d).log.xz 005126105.td-b3lyp_6-31g+(d).inp 005126105.td-b3lyp_6-31g+(d).log.xz

005126105.td-b3lyp_6-31+g(d).qchem.inp (generated)

005126105.td-b3lyp_6-31+g(d).gjf (generated)

005126105.td-b3lyp_6-31+g(d).firefly.inp (generated)

005126105.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005126105.mol 005126105.PUBCHEM 005126105.mol (via Jmol)
005126155.b3lyp_6-31g(d).inp

005126155.b3lyp_6-31g(d).qchem.inp (generated)

005126155.b3lyp_6-31g(d).gjf (generated)

005126155.b3lyp_6-31g(d).firefly.inp (generated)

005126155.b3lyp_6-31g(d).smash.inp (generated)

005126155.b3lyp_6-31g(d).nwchem.inp (generated) 005126155.b3lyp_6-31g(d).log.xz 005126155.td-b3lyp_6-31g+(d).inp 005126155.td-b3lyp_6-31g+(d).log.xz

005126155.td-b3lyp_6-31+g(d).qchem.inp (generated)

005126155.td-b3lyp_6-31+g(d).gjf (generated)

005126155.td-b3lyp_6-31+g(d).firefly.inp (generated)

005126155.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005126155.mol 005126155.PUBCHEM 005126155.mol (via Jmol)
005126157.b3lyp_6-31g(d).inp

005126157.b3lyp_6-31g(d).qchem.inp (generated)

005126157.b3lyp_6-31g(d).gjf (generated)

005126157.b3lyp_6-31g(d).firefly.inp (generated)

005126157.b3lyp_6-31g(d).smash.inp (generated)

005126157.b3lyp_6-31g(d).nwchem.inp (generated) 005126157.b3lyp_6-31g(d).log.xz 005126157.td-b3lyp_6-31g+(d).inp 005126157.td-b3lyp_6-31g+(d).log.xz

005126157.td-b3lyp_6-31+g(d).qchem.inp (generated)

005126157.td-b3lyp_6-31+g(d).gjf (generated)

005126157.td-b3lyp_6-31+g(d).firefly.inp (generated)

005126157.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005126157.mol 005126157.PUBCHEM 005126157.mol (via Jmol)
005126199.b3lyp_6-31g(d).inp

005126199.b3lyp_6-31g(d).qchem.inp (generated)

005126199.b3lyp_6-31g(d).gjf (generated)

005126199.b3lyp_6-31g(d).firefly.inp (generated)

005126199.b3lyp_6-31g(d).smash.inp (generated)

005126199.b3lyp_6-31g(d).nwchem.inp (generated) 005126199.b3lyp_6-31g(d).log.xz 005126199.td-b3lyp_6-31g+(d).inp 005126199.td-b3lyp_6-31g+(d).log.xz

005126199.td-b3lyp_6-31+g(d).qchem.inp (generated)

005126199.td-b3lyp_6-31+g(d).gjf (generated)

005126199.td-b3lyp_6-31+g(d).firefly.inp (generated)

005126199.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005126199.mol 005126199.PUBCHEM 005126199.mol (via Jmol)
005126277.b3lyp_6-31g(d).inp

005126277.b3lyp_6-31g(d).qchem.inp (generated)

005126277.b3lyp_6-31g(d).gjf (generated)

005126277.b3lyp_6-31g(d).firefly.inp (generated)

005126277.b3lyp_6-31g(d).smash.inp (generated)

005126277.b3lyp_6-31g(d).nwchem.inp (generated) 005126277.b3lyp_6-31g(d).log.xz 005126277.td-b3lyp_6-31g+(d).inp 005126277.td-b3lyp_6-31g+(d).log.xz

005126277.td-b3lyp_6-31+g(d).qchem.inp (generated)

005126277.td-b3lyp_6-31+g(d).gjf (generated)

005126277.td-b3lyp_6-31+g(d).firefly.inp (generated)

005126277.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005126277.mol 005126277.PUBCHEM 005126277.mol (via Jmol)
005126314.b3lyp_6-31g(d).inp

005126314.b3lyp_6-31g(d).qchem.inp (generated)

005126314.b3lyp_6-31g(d).gjf (generated)

005126314.b3lyp_6-31g(d).firefly.inp (generated)

005126314.b3lyp_6-31g(d).smash.inp (generated)

005126314.b3lyp_6-31g(d).nwchem.inp (generated) 005126314.b3lyp_6-31g(d).log.xz 005126314.td-b3lyp_6-31g+(d).inp 005126314.td-b3lyp_6-31g+(d).log.xz

005126314.td-b3lyp_6-31+g(d).qchem.inp (generated)

005126314.td-b3lyp_6-31+g(d).gjf (generated)

005126314.td-b3lyp_6-31+g(d).firefly.inp (generated)

005126314.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005126314.mol 005126314.PUBCHEM 005126314.mol (via Jmol)
005126319.b3lyp_6-31g(d).inp

005126319.b3lyp_6-31g(d).qchem.inp (generated)

005126319.b3lyp_6-31g(d).gjf (generated)

005126319.b3lyp_6-31g(d).firefly.inp (generated)

005126319.b3lyp_6-31g(d).smash.inp (generated)

005126319.b3lyp_6-31g(d).nwchem.inp (generated) 005126319.b3lyp_6-31g(d).log.xz 005126319.td-b3lyp_6-31g+(d).inp 005126319.td-b3lyp_6-31g+(d).log.xz

005126319.td-b3lyp_6-31+g(d).qchem.inp (generated)

005126319.td-b3lyp_6-31+g(d).gjf (generated)

005126319.td-b3lyp_6-31+g(d).firefly.inp (generated)

005126319.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005126319.mol 005126319.PUBCHEM 005126319.mol (via Jmol)
005126396.b3lyp_6-31g(d).inp

005126396.b3lyp_6-31g(d).qchem.inp (generated)

005126396.b3lyp_6-31g(d).gjf (generated)

005126396.b3lyp_6-31g(d).firefly.inp (generated)

005126396.b3lyp_6-31g(d).smash.inp (generated)

005126396.b3lyp_6-31g(d).nwchem.inp (generated) 005126396.b3lyp_6-31g(d).log.xz 005126396.td-b3lyp_6-31g+(d).inp 005126396.td-b3lyp_6-31g+(d).log.xz

005126396.td-b3lyp_6-31+g(d).qchem.inp (generated)

005126396.td-b3lyp_6-31+g(d).gjf (generated)

005126396.td-b3lyp_6-31+g(d).firefly.inp (generated)

005126396.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005126396.mol 005126396.PUBCHEM 005126396.mol (via Jmol)
005126548.b3lyp_6-31g(d).inp

005126548.b3lyp_6-31g(d).qchem.inp (generated)

005126548.b3lyp_6-31g(d).gjf (generated)

005126548.b3lyp_6-31g(d).firefly.inp (generated)

005126548.b3lyp_6-31g(d).smash.inp (generated)

005126548.b3lyp_6-31g(d).nwchem.inp (generated) 005126548.b3lyp_6-31g(d).log.xz 005126548.mol 005126548.PUBCHEM 005126548.mol (via Jmol)
005126585.b3lyp_6-31g(d).inp

005126585.b3lyp_6-31g(d).qchem.inp (generated)

005126585.b3lyp_6-31g(d).gjf (generated)

005126585.b3lyp_6-31g(d).firefly.inp (generated)

005126585.b3lyp_6-31g(d).smash.inp (generated)

005126585.b3lyp_6-31g(d).nwchem.inp (generated) 005126585.b3lyp_6-31g(d).log.xz 005126585.td-b3lyp_6-31g+(d).inp 005126585.td-b3lyp_6-31g+(d).log.xz

005126585.td-b3lyp_6-31+g(d).qchem.inp (generated)

005126585.td-b3lyp_6-31+g(d).gjf (generated)

005126585.td-b3lyp_6-31+g(d).firefly.inp (generated)

005126585.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005126585.mol 005126585.PUBCHEM 005126585.mol (via Jmol)
005126711.b3lyp_6-31g(d).inp

005126711.b3lyp_6-31g(d).qchem.inp (generated)

005126711.b3lyp_6-31g(d).gjf (generated)

005126711.b3lyp_6-31g(d).firefly.inp (generated)

005126711.b3lyp_6-31g(d).smash.inp (generated)

005126711.b3lyp_6-31g(d).nwchem.inp (generated) 005126711.b3lyp_6-31g(d).log.xz 005126711.td-b3lyp_6-31g+(d).inp 005126711.td-b3lyp_6-31g+(d).log.xz

005126711.td-b3lyp_6-31+g(d).qchem.inp (generated)

005126711.td-b3lyp_6-31+g(d).gjf (generated)

005126711.td-b3lyp_6-31+g(d).firefly.inp (generated)

005126711.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005126711.mol 005126711.PUBCHEM 005126711.mol (via Jmol)
005126863.b3lyp_6-31g(d).inp

005126863.b3lyp_6-31g(d).qchem.inp (generated)

005126863.b3lyp_6-31g(d).gjf (generated)

005126863.b3lyp_6-31g(d).firefly.inp (generated)

005126863.b3lyp_6-31g(d).smash.inp (generated)

005126863.b3lyp_6-31g(d).nwchem.inp (generated) 005126863.b3lyp_6-31g(d).log.xz 005126863.td-b3lyp_6-31g+(d).inp 005126863.td-b3lyp_6-31g+(d).log.xz

005126863.td-b3lyp_6-31+g(d).qchem.inp (generated)

005126863.td-b3lyp_6-31+g(d).gjf (generated)

005126863.td-b3lyp_6-31+g(d).firefly.inp (generated)

005126863.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005126863.mol 005126863.PUBCHEM 005126863.mol (via Jmol)
005127011.b3lyp_6-31g(d).inp

005127011.b3lyp_6-31g(d).qchem.inp (generated)

005127011.b3lyp_6-31g(d).gjf (generated)

005127011.b3lyp_6-31g(d).firefly.inp (generated)

005127011.b3lyp_6-31g(d).smash.inp (generated)

005127011.b3lyp_6-31g(d).nwchem.inp (generated) 005127011.b3lyp_6-31g(d).log.xz 005127011.mol 005127011.PUBCHEM 005127011.mol (via Jmol)
005127024.b3lyp_6-31g(d).inp

005127024.b3lyp_6-31g(d).qchem.inp (generated)

005127024.b3lyp_6-31g(d).gjf (generated)

005127024.b3lyp_6-31g(d).firefly.inp (generated)

005127024.b3lyp_6-31g(d).smash.inp (generated)

005127024.b3lyp_6-31g(d).nwchem.inp (generated) 005127024.b3lyp_6-31g(d).log.xz 005127024.td-b3lyp_6-31g+(d).inp 005127024.td-b3lyp_6-31g+(d).log.xz

005127024.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127024.td-b3lyp_6-31+g(d).gjf (generated)

005127024.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127024.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127024.mol 005127024.PUBCHEM 005127024.mol (via Jmol)
005127025.b3lyp_6-31g(d).inp

005127025.b3lyp_6-31g(d).qchem.inp (generated)

005127025.b3lyp_6-31g(d).gjf (generated)

005127025.b3lyp_6-31g(d).firefly.inp (generated)

005127025.b3lyp_6-31g(d).smash.inp (generated)

005127025.b3lyp_6-31g(d).nwchem.inp (generated) 005127025.b3lyp_6-31g(d).log.xz 005127025.td-b3lyp_6-31g+(d).inp 005127025.td-b3lyp_6-31g+(d).log.xz

005127025.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127025.td-b3lyp_6-31+g(d).gjf (generated)

005127025.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127025.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127025.mol 005127025.PUBCHEM 005127025.mol (via Jmol)
005127133.b3lyp_6-31g(d).inp

005127133.b3lyp_6-31g(d).qchem.inp (generated)

005127133.b3lyp_6-31g(d).gjf (generated)

005127133.b3lyp_6-31g(d).firefly.inp (generated)

005127133.b3lyp_6-31g(d).smash.inp (generated)

005127133.b3lyp_6-31g(d).nwchem.inp (generated) 005127133.b3lyp_6-31g(d).log.xz 005127133.td-b3lyp_6-31g+(d).inp 005127133.td-b3lyp_6-31g+(d).log.xz

005127133.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127133.td-b3lyp_6-31+g(d).gjf (generated)

005127133.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127133.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127133.mol 005127133.PUBCHEM 005127133.mol (via Jmol)
005127159.b3lyp_6-31g(d).inp

005127159.b3lyp_6-31g(d).qchem.inp (generated)

005127159.b3lyp_6-31g(d).gjf (generated)

005127159.b3lyp_6-31g(d).firefly.inp (generated)

005127159.b3lyp_6-31g(d).smash.inp (generated)

005127159.b3lyp_6-31g(d).nwchem.inp (generated) 005127159.b3lyp_6-31g(d).log.xz 005127159.td-b3lyp_6-31g+(d).inp 005127159.td-b3lyp_6-31g+(d).log.xz

005127159.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127159.td-b3lyp_6-31+g(d).gjf (generated)

005127159.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127159.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127159.mol 005127159.PUBCHEM 005127159.mol (via Jmol)
005127163.b3lyp_6-31g(d).inp

005127163.b3lyp_6-31g(d).qchem.inp (generated)

005127163.b3lyp_6-31g(d).gjf (generated)

005127163.b3lyp_6-31g(d).firefly.inp (generated)

005127163.b3lyp_6-31g(d).smash.inp (generated)

005127163.b3lyp_6-31g(d).nwchem.inp (generated) 005127163.b3lyp_6-31g(d).log.xz 005127163.td-b3lyp_6-31g+(d).inp 005127163.td-b3lyp_6-31g+(d).log.xz

005127163.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127163.td-b3lyp_6-31+g(d).gjf (generated)

005127163.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127163.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127163.mol 005127163.PUBCHEM 005127163.mol (via Jmol)
005127205.b3lyp_6-31g(d).inp

005127205.b3lyp_6-31g(d).qchem.inp (generated)

005127205.b3lyp_6-31g(d).gjf (generated)

005127205.b3lyp_6-31g(d).firefly.inp (generated)

005127205.b3lyp_6-31g(d).smash.inp (generated)

005127205.b3lyp_6-31g(d).nwchem.inp (generated) 005127205.b3lyp_6-31g(d).log.xz 005127205.td-b3lyp_6-31g+(d).inp 005127205.td-b3lyp_6-31g+(d).log.xz

005127205.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127205.td-b3lyp_6-31+g(d).gjf (generated)

005127205.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127205.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127205.mol 005127205.PUBCHEM 005127205.mol (via Jmol)
005127261.b3lyp_6-31g(d).inp

005127261.b3lyp_6-31g(d).qchem.inp (generated)

005127261.b3lyp_6-31g(d).gjf (generated)

005127261.b3lyp_6-31g(d).firefly.inp (generated)

005127261.b3lyp_6-31g(d).smash.inp (generated)

005127261.b3lyp_6-31g(d).nwchem.inp (generated) 005127261.b3lyp_6-31g(d).log.xz 005127261.mol 005127261.PUBCHEM 005127261.mol (via Jmol)
005127263.b3lyp_6-31g(d).inp

005127263.b3lyp_6-31g(d).qchem.inp (generated)

005127263.b3lyp_6-31g(d).gjf (generated)

005127263.b3lyp_6-31g(d).firefly.inp (generated)

005127263.b3lyp_6-31g(d).smash.inp (generated)

005127263.b3lyp_6-31g(d).nwchem.inp (generated) 005127263.b3lyp_6-31g(d).log.xz 005127263.mol 005127263.PUBCHEM 005127263.mol (via Jmol)
005127273.b3lyp_6-31g(d).inp

005127273.b3lyp_6-31g(d).qchem.inp (generated)

005127273.b3lyp_6-31g(d).gjf (generated)

005127273.b3lyp_6-31g(d).firefly.inp (generated)

005127273.b3lyp_6-31g(d).smash.inp (generated)

005127273.b3lyp_6-31g(d).nwchem.inp (generated) 005127273.b3lyp_6-31g(d).log.xz 005127273.td-b3lyp_6-31g+(d).inp 005127273.td-b3lyp_6-31g+(d).log.xz

005127273.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127273.td-b3lyp_6-31+g(d).gjf (generated)

005127273.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127273.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127273.mol 005127273.PUBCHEM 005127273.mol (via Jmol)
005127275.b3lyp_6-31g(d).inp

005127275.b3lyp_6-31g(d).qchem.inp (generated)

005127275.b3lyp_6-31g(d).gjf (generated)

005127275.b3lyp_6-31g(d).firefly.inp (generated)

005127275.b3lyp_6-31g(d).smash.inp (generated)

005127275.b3lyp_6-31g(d).nwchem.inp (generated) 005127275.b3lyp_6-31g(d).log.xz 005127275.td-b3lyp_6-31g+(d).inp 005127275.td-b3lyp_6-31g+(d).log.xz

005127275.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127275.td-b3lyp_6-31+g(d).gjf (generated)

005127275.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127275.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127275.mol 005127275.PUBCHEM 005127275.mol (via Jmol)
005127281.b3lyp_6-31g(d).inp

005127281.b3lyp_6-31g(d).qchem.inp (generated)

005127281.b3lyp_6-31g(d).gjf (generated)

005127281.b3lyp_6-31g(d).firefly.inp (generated)

005127281.b3lyp_6-31g(d).smash.inp (generated)

005127281.b3lyp_6-31g(d).nwchem.inp (generated) 005127281.b3lyp_6-31g(d).log.xz 005127281.mol 005127281.PUBCHEM 005127281.mol (via Jmol)
005127282.b3lyp_6-31g(d).inp

005127282.b3lyp_6-31g(d).qchem.inp (generated)

005127282.b3lyp_6-31g(d).gjf (generated)

005127282.b3lyp_6-31g(d).firefly.inp (generated)

005127282.b3lyp_6-31g(d).smash.inp (generated)

005127282.b3lyp_6-31g(d).nwchem.inp (generated) 005127282.b3lyp_6-31g(d).log.xz 005127282.mol 005127282.PUBCHEM 005127282.mol (via Jmol)
005127291.b3lyp_6-31g(d).inp

005127291.b3lyp_6-31g(d).qchem.inp (generated)

005127291.b3lyp_6-31g(d).gjf (generated)

005127291.b3lyp_6-31g(d).firefly.inp (generated)

005127291.b3lyp_6-31g(d).smash.inp (generated)

005127291.b3lyp_6-31g(d).nwchem.inp (generated) 005127291.b3lyp_6-31g(d).log.xz 005127291.td-b3lyp_6-31g+(d).inp 005127291.td-b3lyp_6-31g+(d).log.xz

005127291.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127291.td-b3lyp_6-31+g(d).gjf (generated)

005127291.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127291.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127291.mol 005127291.PUBCHEM 005127291.mol (via Jmol)
005127345.b3lyp_6-31g(d).inp

005127345.b3lyp_6-31g(d).qchem.inp (generated)

005127345.b3lyp_6-31g(d).gjf (generated)

005127345.b3lyp_6-31g(d).firefly.inp (generated)

005127345.b3lyp_6-31g(d).smash.inp (generated)

005127345.b3lyp_6-31g(d).nwchem.inp (generated) 005127345.b3lyp_6-31g(d).log.xz 005127345.td-b3lyp_6-31g+(d).inp 005127345.td-b3lyp_6-31g+(d).log.xz

005127345.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127345.td-b3lyp_6-31+g(d).gjf (generated)

005127345.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127345.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127345.mol 005127345.PUBCHEM 005127345.mol (via Jmol)
005127346.b3lyp_6-31g(d).inp

005127346.b3lyp_6-31g(d).qchem.inp (generated)

005127346.b3lyp_6-31g(d).gjf (generated)

005127346.b3lyp_6-31g(d).firefly.inp (generated)

005127346.b3lyp_6-31g(d).smash.inp (generated)

005127346.b3lyp_6-31g(d).nwchem.inp (generated) 005127346.b3lyp_6-31g(d).log.xz 005127346.td-b3lyp_6-31g+(d).inp 005127346.td-b3lyp_6-31g+(d).log.xz

005127346.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127346.td-b3lyp_6-31+g(d).gjf (generated)

005127346.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127346.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127346.mol 005127346.PUBCHEM 005127346.mol (via Jmol)
005127347.b3lyp_6-31g(d).inp

005127347.b3lyp_6-31g(d).qchem.inp (generated)

005127347.b3lyp_6-31g(d).gjf (generated)

005127347.b3lyp_6-31g(d).firefly.inp (generated)

005127347.b3lyp_6-31g(d).smash.inp (generated)

005127347.b3lyp_6-31g(d).nwchem.inp (generated) 005127347.b3lyp_6-31g(d).log.xz 005127347.td-b3lyp_6-31g+(d).inp 005127347.td-b3lyp_6-31g+(d).log.xz

005127347.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127347.td-b3lyp_6-31+g(d).gjf (generated)

005127347.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127347.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127347.mol 005127347.PUBCHEM 005127347.mol (via Jmol)
005127352.b3lyp_6-31g(d).inp

005127352.b3lyp_6-31g(d).qchem.inp (generated)

005127352.b3lyp_6-31g(d).gjf (generated)

005127352.b3lyp_6-31g(d).firefly.inp (generated)

005127352.b3lyp_6-31g(d).smash.inp (generated)

005127352.b3lyp_6-31g(d).nwchem.inp (generated) 005127352.b3lyp_6-31g(d).log.xz 005127352.td-b3lyp_6-31g+(d).inp 005127352.td-b3lyp_6-31g+(d).log.xz

005127352.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127352.td-b3lyp_6-31+g(d).gjf (generated)

005127352.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127352.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127352.mol 005127352.PUBCHEM 005127352.mol (via Jmol)
005127354.b3lyp_6-31g(d).inp

005127354.b3lyp_6-31g(d).qchem.inp (generated)

005127354.b3lyp_6-31g(d).gjf (generated)

005127354.b3lyp_6-31g(d).firefly.inp (generated)

005127354.b3lyp_6-31g(d).smash.inp (generated)

005127354.b3lyp_6-31g(d).nwchem.inp (generated) 005127354.b3lyp_6-31g(d).log.xz 005127354.mol 005127354.PUBCHEM 005127354.mol (via Jmol)
005127355.b3lyp_6-31g(d).inp

005127355.b3lyp_6-31g(d).qchem.inp (generated)

005127355.b3lyp_6-31g(d).gjf (generated)

005127355.b3lyp_6-31g(d).firefly.inp (generated)

005127355.b3lyp_6-31g(d).smash.inp (generated)

005127355.b3lyp_6-31g(d).nwchem.inp (generated) 005127355.b3lyp_6-31g(d).log.xz 005127355.td-b3lyp_6-31g+(d).inp 005127355.td-b3lyp_6-31g+(d).log.xz

005127355.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127355.td-b3lyp_6-31+g(d).gjf (generated)

005127355.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127355.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127355.mol 005127355.PUBCHEM 005127355.mol (via Jmol)
005127398.b3lyp_6-31g(d).inp

005127398.b3lyp_6-31g(d).qchem.inp (generated)

005127398.b3lyp_6-31g(d).gjf (generated)

005127398.b3lyp_6-31g(d).firefly.inp (generated)

005127398.b3lyp_6-31g(d).smash.inp (generated)

005127398.b3lyp_6-31g(d).nwchem.inp (generated) 005127398.b3lyp_6-31g(d).log.xz 005127398.td-b3lyp_6-31g+(d).inp 005127398.td-b3lyp_6-31g+(d).log.xz

005127398.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127398.td-b3lyp_6-31+g(d).gjf (generated)

005127398.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127398.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127398.mol 005127398.PUBCHEM 005127398.mol (via Jmol)
005127426.b3lyp_6-31g(d).inp

005127426.b3lyp_6-31g(d).qchem.inp (generated)

005127426.b3lyp_6-31g(d).gjf (generated)

005127426.b3lyp_6-31g(d).firefly.inp (generated)

005127426.b3lyp_6-31g(d).smash.inp (generated)

005127426.b3lyp_6-31g(d).nwchem.inp (generated) 005127426.b3lyp_6-31g(d).log.xz 005127426.td-b3lyp_6-31g+(d).inp 005127426.td-b3lyp_6-31g+(d).log.xz

005127426.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127426.td-b3lyp_6-31+g(d).gjf (generated)

005127426.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127426.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127426.mol 005127426.PUBCHEM 005127426.mol (via Jmol)
005127428.b3lyp_6-31g(d).inp

005127428.b3lyp_6-31g(d).qchem.inp (generated)

005127428.b3lyp_6-31g(d).gjf (generated)

005127428.b3lyp_6-31g(d).firefly.inp (generated)

005127428.b3lyp_6-31g(d).smash.inp (generated)

005127428.b3lyp_6-31g(d).nwchem.inp (generated) 005127428.b3lyp_6-31g(d).log.xz 005127428.td-b3lyp_6-31g+(d).inp 005127428.td-b3lyp_6-31g+(d).log.xz

005127428.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127428.td-b3lyp_6-31+g(d).gjf (generated)

005127428.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127428.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127428.mol 005127428.PUBCHEM 005127428.mol (via Jmol)
005127430.b3lyp_6-31g(d).inp

005127430.b3lyp_6-31g(d).qchem.inp (generated)

005127430.b3lyp_6-31g(d).gjf (generated)

005127430.b3lyp_6-31g(d).firefly.inp (generated)

005127430.b3lyp_6-31g(d).smash.inp (generated)

005127430.b3lyp_6-31g(d).nwchem.inp (generated) 005127430.b3lyp_6-31g(d).log.xz 005127430.td-b3lyp_6-31g+(d).inp 005127430.td-b3lyp_6-31g+(d).log.xz

005127430.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127430.td-b3lyp_6-31+g(d).gjf (generated)

005127430.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127430.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127430.mol 005127430.PUBCHEM 005127430.mol (via Jmol)
005127431.b3lyp_6-31g(d).inp

005127431.b3lyp_6-31g(d).qchem.inp (generated)

005127431.b3lyp_6-31g(d).gjf (generated)

005127431.b3lyp_6-31g(d).firefly.inp (generated)

005127431.b3lyp_6-31g(d).smash.inp (generated)

005127431.b3lyp_6-31g(d).nwchem.inp (generated) 005127431.b3lyp_6-31g(d).log.xz 005127431.td-b3lyp_6-31g+(d).inp 005127431.td-b3lyp_6-31g+(d).log.xz

005127431.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127431.td-b3lyp_6-31+g(d).gjf (generated)

005127431.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127431.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127431.mol 005127431.PUBCHEM 005127431.mol (via Jmol)
005127453.b3lyp_6-31g(d).inp

005127453.b3lyp_6-31g(d).qchem.inp (generated)

005127453.b3lyp_6-31g(d).gjf (generated)

005127453.b3lyp_6-31g(d).firefly.inp (generated)

005127453.b3lyp_6-31g(d).smash.inp (generated)

005127453.b3lyp_6-31g(d).nwchem.inp (generated) 005127453.b3lyp_6-31g(d).log.xz 005127453.td-b3lyp_6-31g+(d).inp 005127453.td-b3lyp_6-31g+(d).log.xz

005127453.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127453.td-b3lyp_6-31+g(d).gjf (generated)

005127453.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127453.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127453.mol 005127453.PUBCHEM 005127453.mol (via Jmol)
005127456.b3lyp_6-31g(d).inp

005127456.b3lyp_6-31g(d).qchem.inp (generated)

005127456.b3lyp_6-31g(d).gjf (generated)

005127456.b3lyp_6-31g(d).firefly.inp (generated)

005127456.b3lyp_6-31g(d).smash.inp (generated)

005127456.b3lyp_6-31g(d).nwchem.inp (generated) 005127456.b3lyp_6-31g(d).log.xz 005127456.td-b3lyp_6-31g+(d).inp 005127456.td-b3lyp_6-31g+(d).log.xz

005127456.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127456.td-b3lyp_6-31+g(d).gjf (generated)

005127456.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127456.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127456.mol 005127456.PUBCHEM 005127456.mol (via Jmol)
005127457.b3lyp_6-31g(d).inp

005127457.b3lyp_6-31g(d).qchem.inp (generated)

005127457.b3lyp_6-31g(d).gjf (generated)

005127457.b3lyp_6-31g(d).firefly.inp (generated)

005127457.b3lyp_6-31g(d).smash.inp (generated)

005127457.b3lyp_6-31g(d).nwchem.inp (generated) 005127457.b3lyp_6-31g(d).log.xz 005127457.td-b3lyp_6-31g+(d).inp 005127457.td-b3lyp_6-31g+(d).log.xz

005127457.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127457.td-b3lyp_6-31+g(d).gjf (generated)

005127457.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127457.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127457.mol 005127457.PUBCHEM 005127457.mol (via Jmol)
005127525.b3lyp_6-31g(d).inp

005127525.b3lyp_6-31g(d).qchem.inp (generated)

005127525.b3lyp_6-31g(d).gjf (generated)

005127525.b3lyp_6-31g(d).firefly.inp (generated)

005127525.b3lyp_6-31g(d).smash.inp (generated)

005127525.b3lyp_6-31g(d).nwchem.inp (generated) 005127525.b3lyp_6-31g(d).log.xz 005127525.td-b3lyp_6-31g+(d).inp 005127525.td-b3lyp_6-31g+(d).log.xz

005127525.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127525.td-b3lyp_6-31+g(d).gjf (generated)

005127525.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127525.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127525.mol 005127525.PUBCHEM 005127525.mol (via Jmol)
005127553.b3lyp_6-31g(d).inp

005127553.b3lyp_6-31g(d).qchem.inp (generated)

005127553.b3lyp_6-31g(d).gjf (generated)

005127553.b3lyp_6-31g(d).firefly.inp (generated)

005127553.b3lyp_6-31g(d).smash.inp (generated)

005127553.b3lyp_6-31g(d).nwchem.inp (generated) 005127553.b3lyp_6-31g(d).log.xz 005127553.td-b3lyp_6-31g+(d).inp 005127553.td-b3lyp_6-31g+(d).log.xz

005127553.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127553.td-b3lyp_6-31+g(d).gjf (generated)

005127553.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127553.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127553.mol 005127553.PUBCHEM 005127553.mol (via Jmol)
005127556.b3lyp_6-31g(d).inp

005127556.b3lyp_6-31g(d).qchem.inp (generated)

005127556.b3lyp_6-31g(d).gjf (generated)

005127556.b3lyp_6-31g(d).firefly.inp (generated)

005127556.b3lyp_6-31g(d).smash.inp (generated)

005127556.b3lyp_6-31g(d).nwchem.inp (generated) 005127556.b3lyp_6-31g(d).log.xz 005127556.td-b3lyp_6-31g+(d).inp 005127556.td-b3lyp_6-31g+(d).log.xz

005127556.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127556.td-b3lyp_6-31+g(d).gjf (generated)

005127556.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127556.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127556.mol 005127556.PUBCHEM 005127556.mol (via Jmol)
005127598.b3lyp_6-31g(d).inp

005127598.b3lyp_6-31g(d).qchem.inp (generated)

005127598.b3lyp_6-31g(d).gjf (generated)

005127598.b3lyp_6-31g(d).firefly.inp (generated)

005127598.b3lyp_6-31g(d).smash.inp (generated)

005127598.b3lyp_6-31g(d).nwchem.inp (generated) 005127598.b3lyp_6-31g(d).log.xz 005127598.td-b3lyp_6-31g+(d).inp 005127598.td-b3lyp_6-31g+(d).log.xz

005127598.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127598.td-b3lyp_6-31+g(d).gjf (generated)

005127598.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127598.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127598.mol 005127598.PUBCHEM 005127598.mol (via Jmol)
005127599.b3lyp_6-31g(d).inp

005127599.b3lyp_6-31g(d).qchem.inp (generated)

005127599.b3lyp_6-31g(d).gjf (generated)

005127599.b3lyp_6-31g(d).firefly.inp (generated)

005127599.b3lyp_6-31g(d).smash.inp (generated)

005127599.b3lyp_6-31g(d).nwchem.inp (generated) 005127599.b3lyp_6-31g(d).log.xz 005127599.td-b3lyp_6-31g+(d).inp 005127599.td-b3lyp_6-31g+(d).log.xz

005127599.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127599.td-b3lyp_6-31+g(d).gjf (generated)

005127599.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127599.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127599.mol 005127599.PUBCHEM 005127599.mol (via Jmol)
005127670.b3lyp_6-31g(d).inp

005127670.b3lyp_6-31g(d).qchem.inp (generated)

005127670.b3lyp_6-31g(d).gjf (generated)

005127670.b3lyp_6-31g(d).firefly.inp (generated)

005127670.b3lyp_6-31g(d).smash.inp (generated)

005127670.b3lyp_6-31g(d).nwchem.inp (generated) 005127670.b3lyp_6-31g(d).log.xz 005127670.td-b3lyp_6-31g+(d).inp 005127670.td-b3lyp_6-31g+(d).log.xz

005127670.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127670.td-b3lyp_6-31+g(d).gjf (generated)

005127670.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127670.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127670.mol 005127670.PUBCHEM 005127670.mol (via Jmol)
005127684.b3lyp_6-31g(d).inp

005127684.b3lyp_6-31g(d).qchem.inp (generated)

005127684.b3lyp_6-31g(d).gjf (generated)

005127684.b3lyp_6-31g(d).firefly.inp (generated)

005127684.b3lyp_6-31g(d).smash.inp (generated)

005127684.b3lyp_6-31g(d).nwchem.inp (generated) 005127684.b3lyp_6-31g(d).log.xz 005127684.td-b3lyp_6-31g+(d).inp 005127684.td-b3lyp_6-31g+(d).log.xz

005127684.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127684.td-b3lyp_6-31+g(d).gjf (generated)

005127684.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127684.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127684.mol 005127684.PUBCHEM 005127684.mol (via Jmol)
005127715.b3lyp_6-31g(d).inp

005127715.b3lyp_6-31g(d).qchem.inp (generated)

005127715.b3lyp_6-31g(d).gjf (generated)

005127715.b3lyp_6-31g(d).firefly.inp (generated)

005127715.b3lyp_6-31g(d).smash.inp (generated)

005127715.b3lyp_6-31g(d).nwchem.inp (generated) 005127715.b3lyp_6-31g(d).log.xz 005127715.td-b3lyp_6-31g+(d).inp 005127715.td-b3lyp_6-31g+(d).log.xz

005127715.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127715.td-b3lyp_6-31+g(d).gjf (generated)

005127715.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127715.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127715.mol 005127715.PUBCHEM 005127715.mol (via Jmol)
005127753.b3lyp_6-31g(d).inp

005127753.b3lyp_6-31g(d).qchem.inp (generated)

005127753.b3lyp_6-31g(d).gjf (generated)

005127753.b3lyp_6-31g(d).firefly.inp (generated)

005127753.b3lyp_6-31g(d).smash.inp (generated)

005127753.b3lyp_6-31g(d).nwchem.inp (generated) 005127753.b3lyp_6-31g(d).log.xz 005127753.td-b3lyp_6-31g+(d).inp 005127753.td-b3lyp_6-31g+(d).log.xz

005127753.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127753.td-b3lyp_6-31+g(d).gjf (generated)

005127753.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127753.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127753.mol 005127753.PUBCHEM 005127753.mol (via Jmol)
005127807.b3lyp_6-31g(d).inp

005127807.b3lyp_6-31g(d).qchem.inp (generated)

005127807.b3lyp_6-31g(d).gjf (generated)

005127807.b3lyp_6-31g(d).firefly.inp (generated)

005127807.b3lyp_6-31g(d).smash.inp (generated)

005127807.b3lyp_6-31g(d).nwchem.inp (generated) 005127807.b3lyp_6-31g(d).log.xz 005127807.td-b3lyp_6-31g+(d).inp 005127807.td-b3lyp_6-31g+(d).log.xz

005127807.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127807.td-b3lyp_6-31+g(d).gjf (generated)

005127807.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127807.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127807.mol 005127807.PUBCHEM 005127807.mol (via Jmol)
005127809.b3lyp_6-31g(d).inp

005127809.b3lyp_6-31g(d).qchem.inp (generated)

005127809.b3lyp_6-31g(d).gjf (generated)

005127809.b3lyp_6-31g(d).firefly.inp (generated)

005127809.b3lyp_6-31g(d).smash.inp (generated)

005127809.b3lyp_6-31g(d).nwchem.inp (generated) 005127809.b3lyp_6-31g(d).log.xz 005127809.td-b3lyp_6-31g+(d).inp 005127809.td-b3lyp_6-31g+(d).log.xz

005127809.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127809.td-b3lyp_6-31+g(d).gjf (generated)

005127809.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127809.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127809.mol 005127809.PUBCHEM 005127809.mol (via Jmol)
005127861.b3lyp_6-31g(d).inp

005127861.b3lyp_6-31g(d).qchem.inp (generated)

005127861.b3lyp_6-31g(d).gjf (generated)

005127861.b3lyp_6-31g(d).firefly.inp (generated)

005127861.b3lyp_6-31g(d).smash.inp (generated)

005127861.b3lyp_6-31g(d).nwchem.inp (generated) 005127861.b3lyp_6-31g(d).log.xz 005127861.td-b3lyp_6-31g+(d).inp 005127861.td-b3lyp_6-31g+(d).log.xz

005127861.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127861.td-b3lyp_6-31+g(d).gjf (generated)

005127861.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127861.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127861.mol 005127861.PUBCHEM 005127861.mol (via Jmol)
005127915.b3lyp_6-31g(d).inp

005127915.b3lyp_6-31g(d).qchem.inp (generated)

005127915.b3lyp_6-31g(d).gjf (generated)

005127915.b3lyp_6-31g(d).firefly.inp (generated)

005127915.b3lyp_6-31g(d).smash.inp (generated)

005127915.b3lyp_6-31g(d).nwchem.inp (generated) 005127915.b3lyp_6-31g(d).log.xz 005127915.td-b3lyp_6-31g+(d).inp 005127915.td-b3lyp_6-31g+(d).log.xz

005127915.td-b3lyp_6-31+g(d).qchem.inp (generated)

005127915.td-b3lyp_6-31+g(d).gjf (generated)

005127915.td-b3lyp_6-31+g(d).firefly.inp (generated)

005127915.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005127915.mol 005127915.PUBCHEM 005127915.mol (via Jmol)
005127972.b3lyp_6-31g(d).inp

005127972.b3lyp_6-31g(d).qchem.inp (generated)

005127972.b3lyp_6-31g(d).gjf (generated)

005127972.b3lyp_6-31g(d).firefly.inp (generated)

005127972.b3lyp_6-31g(d).smash.inp (generated)

005127972.b3lyp_6-31g(d).nwchem.inp (generated) 005127972.b3lyp_6-31g(d).log.xz 005127972.mol 005127972.PUBCHEM 005127972.mol (via Jmol)
005127997.b3lyp_6-31g(d).inp

005127997.b3lyp_6-31g(d).qchem.inp (generated)

005127997.b3lyp_6-31g(d).gjf (generated)

005127997.b3lyp_6-31g(d).firefly.inp (generated)

005127997.b3lyp_6-31g(d).smash.inp (generated)

005127997.b3lyp_6-31g(d).nwchem.inp (generated) 005127997.b3lyp_6-31g(d).log.xz 005127997.mol 005127997.PUBCHEM 005127997.mol (via Jmol)
005128032.b3lyp_6-31g(d).inp

005128032.b3lyp_6-31g(d).qchem.inp (generated)

005128032.b3lyp_6-31g(d).gjf (generated)

005128032.b3lyp_6-31g(d).firefly.inp (generated)

005128032.b3lyp_6-31g(d).smash.inp (generated)

005128032.b3lyp_6-31g(d).nwchem.inp (generated) 005128032.b3lyp_6-31g(d).log.xz 005128032.td-b3lyp_6-31g+(d).inp 005128032.td-b3lyp_6-31g+(d).log.xz

005128032.td-b3lyp_6-31+g(d).qchem.inp (generated)

005128032.td-b3lyp_6-31+g(d).gjf (generated)

005128032.td-b3lyp_6-31+g(d).firefly.inp (generated)

005128032.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005128032.mol 005128032.PUBCHEM 005128032.mol (via Jmol)
005128034.b3lyp_6-31g(d).inp

005128034.b3lyp_6-31g(d).qchem.inp (generated)

005128034.b3lyp_6-31g(d).gjf (generated)

005128034.b3lyp_6-31g(d).firefly.inp (generated)

005128034.b3lyp_6-31g(d).smash.inp (generated)

005128034.b3lyp_6-31g(d).nwchem.inp (generated) 005128034.b3lyp_6-31g(d).log.xz 005128034.td-b3lyp_6-31g+(d).inp 005128034.td-b3lyp_6-31g+(d).log.xz

005128034.td-b3lyp_6-31+g(d).qchem.inp (generated)

005128034.td-b3lyp_6-31+g(d).gjf (generated)

005128034.td-b3lyp_6-31+g(d).firefly.inp (generated)

005128034.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005128034.mol 005128034.PUBCHEM 005128034.mol (via Jmol)
005128371.b3lyp_6-31g(d).inp

005128371.b3lyp_6-31g(d).qchem.inp (generated)

005128371.b3lyp_6-31g(d).gjf (generated)

005128371.b3lyp_6-31g(d).firefly.inp (generated)

005128371.b3lyp_6-31g(d).smash.inp (generated)

005128371.b3lyp_6-31g(d).nwchem.inp (generated) 005128371.b3lyp_6-31g(d).log.xz 005128371.td-b3lyp_6-31g+(d).inp 005128371.td-b3lyp_6-31g+(d).log.xz

005128371.td-b3lyp_6-31+g(d).qchem.inp (generated)

005128371.td-b3lyp_6-31+g(d).gjf (generated)

005128371.td-b3lyp_6-31+g(d).firefly.inp (generated)

005128371.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005128371.mol 005128371.PUBCHEM 005128371.mol (via Jmol)
005128428.b3lyp_6-31g(d).inp

005128428.b3lyp_6-31g(d).qchem.inp (generated)

005128428.b3lyp_6-31g(d).gjf (generated)

005128428.b3lyp_6-31g(d).firefly.inp (generated)

005128428.b3lyp_6-31g(d).smash.inp (generated)

005128428.b3lyp_6-31g(d).nwchem.inp (generated) 005128428.b3lyp_6-31g(d).log.xz 005128428.mol 005128428.PUBCHEM 005128428.mol (via Jmol)
005128447.b3lyp_6-31g(d).inp

005128447.b3lyp_6-31g(d).qchem.inp (generated)

005128447.b3lyp_6-31g(d).gjf (generated)

005128447.b3lyp_6-31g(d).firefly.inp (generated)

005128447.b3lyp_6-31g(d).smash.inp (generated)

005128447.b3lyp_6-31g(d).nwchem.inp (generated) 005128447.b3lyp_6-31g(d).log.xz 005128447.td-b3lyp_6-31g+(d).inp 005128447.td-b3lyp_6-31g+(d).log.xz

005128447.td-b3lyp_6-31+g(d).qchem.inp (generated)

005128447.td-b3lyp_6-31+g(d).gjf (generated)

005128447.td-b3lyp_6-31+g(d).firefly.inp (generated)

005128447.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005128447.mol 005128447.PUBCHEM 005128447.mol (via Jmol)
005128450.b3lyp_6-31g(d).inp

005128450.b3lyp_6-31g(d).qchem.inp (generated)

005128450.b3lyp_6-31g(d).gjf (generated)

005128450.b3lyp_6-31g(d).firefly.inp (generated)

005128450.b3lyp_6-31g(d).smash.inp (generated)

005128450.b3lyp_6-31g(d).nwchem.inp (generated) 005128450.b3lyp_6-31g(d).log.xz 005128450.td-b3lyp_6-31g+(d).inp 005128450.td-b3lyp_6-31g+(d).log.xz

005128450.td-b3lyp_6-31+g(d).qchem.inp (generated)

005128450.td-b3lyp_6-31+g(d).gjf (generated)

005128450.td-b3lyp_6-31+g(d).firefly.inp (generated)

005128450.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005128450.mol 005128450.PUBCHEM 005128450.mol (via Jmol)
005128463.b3lyp_6-31g(d).inp

005128463.b3lyp_6-31g(d).qchem.inp (generated)

005128463.b3lyp_6-31g(d).gjf (generated)

005128463.b3lyp_6-31g(d).firefly.inp (generated)

005128463.b3lyp_6-31g(d).smash.inp (generated)

005128463.b3lyp_6-31g(d).nwchem.inp (generated) 005128463.b3lyp_6-31g(d).log.xz 005128463.td-b3lyp_6-31g+(d).inp 005128463.td-b3lyp_6-31g+(d).log.xz

005128463.td-b3lyp_6-31+g(d).qchem.inp (generated)

005128463.td-b3lyp_6-31+g(d).gjf (generated)

005128463.td-b3lyp_6-31+g(d).firefly.inp (generated)

005128463.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005128463.mol 005128463.PUBCHEM 005128463.mol (via Jmol)
005128504.b3lyp_6-31g(d).inp

005128504.b3lyp_6-31g(d).qchem.inp (generated)

005128504.b3lyp_6-31g(d).gjf (generated)

005128504.b3lyp_6-31g(d).firefly.inp (generated)

005128504.b3lyp_6-31g(d).smash.inp (generated)

005128504.b3lyp_6-31g(d).nwchem.inp (generated) 005128504.b3lyp_6-31g(d).log.xz 005128504.td-b3lyp_6-31g+(d).inp 005128504.td-b3lyp_6-31g+(d).log.xz

005128504.td-b3lyp_6-31+g(d).qchem.inp (generated)

005128504.td-b3lyp_6-31+g(d).gjf (generated)

005128504.td-b3lyp_6-31+g(d).firefly.inp (generated)

005128504.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005128504.mol 005128504.PUBCHEM 005128504.mol (via Jmol)
005128577.b3lyp_6-31g(d).inp

005128577.b3lyp_6-31g(d).qchem.inp (generated)

005128577.b3lyp_6-31g(d).gjf (generated)

005128577.b3lyp_6-31g(d).firefly.inp (generated)

005128577.b3lyp_6-31g(d).smash.inp (generated)

005128577.b3lyp_6-31g(d).nwchem.inp (generated) 005128577.b3lyp_6-31g(d).log.xz 005128577.td-b3lyp_6-31g+(d).inp 005128577.td-b3lyp_6-31g+(d).log.xz

005128577.td-b3lyp_6-31+g(d).qchem.inp (generated)

005128577.td-b3lyp_6-31+g(d).gjf (generated)

005128577.td-b3lyp_6-31+g(d).firefly.inp (generated)

005128577.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005128577.mol 005128577.PUBCHEM 005128577.mol (via Jmol)
005128644.b3lyp_6-31g(d).inp

005128644.b3lyp_6-31g(d).qchem.inp (generated)

005128644.b3lyp_6-31g(d).gjf (generated)

005128644.b3lyp_6-31g(d).firefly.inp (generated)

005128644.b3lyp_6-31g(d).smash.inp (generated)

005128644.b3lyp_6-31g(d).nwchem.inp (generated) 005128644.b3lyp_6-31g(d).log.xz 005128644.td-b3lyp_6-31g+(d).inp 005128644.td-b3lyp_6-31g+(d).log.xz

005128644.td-b3lyp_6-31+g(d).qchem.inp (generated)

005128644.td-b3lyp_6-31+g(d).gjf (generated)

005128644.td-b3lyp_6-31+g(d).firefly.inp (generated)

005128644.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005128644.mol 005128644.PUBCHEM 005128644.mol (via Jmol)
005128704.b3lyp_6-31g(d).inp

005128704.b3lyp_6-31g(d).qchem.inp (generated)

005128704.b3lyp_6-31g(d).gjf (generated)

005128704.b3lyp_6-31g(d).firefly.inp (generated)

005128704.b3lyp_6-31g(d).smash.inp (generated)

005128704.b3lyp_6-31g(d).nwchem.inp (generated) 005128704.b3lyp_6-31g(d).log.xz 005128704.td-b3lyp_6-31g+(d).inp 005128704.td-b3lyp_6-31g+(d).log.xz

005128704.td-b3lyp_6-31+g(d).qchem.inp (generated)

005128704.td-b3lyp_6-31+g(d).gjf (generated)

005128704.td-b3lyp_6-31+g(d).firefly.inp (generated)

005128704.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005128704.mol 005128704.PUBCHEM 005128704.mol (via Jmol)
005128709.b3lyp_6-31g(d).inp

005128709.b3lyp_6-31g(d).qchem.inp (generated)

005128709.b3lyp_6-31g(d).gjf (generated)

005128709.b3lyp_6-31g(d).firefly.inp (generated)

005128709.b3lyp_6-31g(d).smash.inp (generated)

005128709.b3lyp_6-31g(d).nwchem.inp (generated) 005128709.b3lyp_6-31g(d).log.xz 005128709.td-b3lyp_6-31g+(d).inp 005128709.td-b3lyp_6-31g+(d).log.xz

005128709.td-b3lyp_6-31+g(d).qchem.inp (generated)

005128709.td-b3lyp_6-31+g(d).gjf (generated)

005128709.td-b3lyp_6-31+g(d).firefly.inp (generated)

005128709.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005128709.mol 005128709.PUBCHEM 005128709.mol (via Jmol)
005128713.b3lyp_6-31g(d).inp

005128713.b3lyp_6-31g(d).qchem.inp (generated)

005128713.b3lyp_6-31g(d).gjf (generated)

005128713.b3lyp_6-31g(d).firefly.inp (generated)

005128713.b3lyp_6-31g(d).smash.inp (generated)

005128713.b3lyp_6-31g(d).nwchem.inp (generated) 005128713.b3lyp_6-31g(d).log.xz 005128713.td-b3lyp_6-31g+(d).inp 005128713.td-b3lyp_6-31g+(d).log.xz

005128713.td-b3lyp_6-31+g(d).qchem.inp (generated)

005128713.td-b3lyp_6-31+g(d).gjf (generated)

005128713.td-b3lyp_6-31+g(d).firefly.inp (generated)

005128713.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005128713.mol 005128713.PUBCHEM 005128713.mol (via Jmol)
005128916.b3lyp_6-31g(d).inp

005128916.b3lyp_6-31g(d).qchem.inp (generated)

005128916.b3lyp_6-31g(d).gjf (generated)

005128916.b3lyp_6-31g(d).firefly.inp (generated)

005128916.b3lyp_6-31g(d).smash.inp (generated)

005128916.b3lyp_6-31g(d).nwchem.inp (generated) 005128916.b3lyp_6-31g(d).log.xz 005128916.td-b3lyp_6-31g+(d).inp 005128916.td-b3lyp_6-31g+(d).log.xz

005128916.td-b3lyp_6-31+g(d).qchem.inp (generated)

005128916.td-b3lyp_6-31+g(d).gjf (generated)

005128916.td-b3lyp_6-31+g(d).firefly.inp (generated)

005128916.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005128916.mol 005128916.PUBCHEM 005128916.mol (via Jmol)
005129139.b3lyp_6-31g(d).inp

005129139.b3lyp_6-31g(d).qchem.inp (generated)

005129139.b3lyp_6-31g(d).gjf (generated)

005129139.b3lyp_6-31g(d).firefly.inp (generated)

005129139.b3lyp_6-31g(d).smash.inp (generated)

005129139.b3lyp_6-31g(d).nwchem.inp (generated) 005129139.b3lyp_6-31g(d).log.xz 005129139.td-b3lyp_6-31g+(d).inp 005129139.td-b3lyp_6-31g+(d).log.xz

005129139.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129139.td-b3lyp_6-31+g(d).gjf (generated)

005129139.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129139.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129139.mol 005129139.PUBCHEM 005129139.mol (via Jmol)
005129159.b3lyp_6-31g(d).inp

005129159.b3lyp_6-31g(d).qchem.inp (generated)

005129159.b3lyp_6-31g(d).gjf (generated)

005129159.b3lyp_6-31g(d).firefly.inp (generated)

005129159.b3lyp_6-31g(d).smash.inp (generated)

005129159.b3lyp_6-31g(d).nwchem.inp (generated) 005129159.b3lyp_6-31g(d).log.xz 005129159.mol 005129159.PUBCHEM 005129159.mol (via Jmol)
005129183.b3lyp_6-31g(d).inp

005129183.b3lyp_6-31g(d).qchem.inp (generated)

005129183.b3lyp_6-31g(d).gjf (generated)

005129183.b3lyp_6-31g(d).firefly.inp (generated)

005129183.b3lyp_6-31g(d).smash.inp (generated)

005129183.b3lyp_6-31g(d).nwchem.inp (generated) 005129183.b3lyp_6-31g(d).log.xz 005129183.td-b3lyp_6-31g+(d).inp 005129183.td-b3lyp_6-31g+(d).log.xz

005129183.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129183.td-b3lyp_6-31+g(d).gjf (generated)

005129183.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129183.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129183.mol 005129183.PUBCHEM 005129183.mol (via Jmol)
005129184.b3lyp_6-31g(d).inp

005129184.b3lyp_6-31g(d).qchem.inp (generated)

005129184.b3lyp_6-31g(d).gjf (generated)

005129184.b3lyp_6-31g(d).firefly.inp (generated)

005129184.b3lyp_6-31g(d).smash.inp (generated)

005129184.b3lyp_6-31g(d).nwchem.inp (generated) 005129184.b3lyp_6-31g(d).log.xz 005129184.td-b3lyp_6-31g+(d).inp 005129184.td-b3lyp_6-31g+(d).log.xz

005129184.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129184.td-b3lyp_6-31+g(d).gjf (generated)

005129184.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129184.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129184.mol 005129184.PUBCHEM 005129184.mol (via Jmol)
005129187.b3lyp_6-31g(d).inp

005129187.b3lyp_6-31g(d).qchem.inp (generated)

005129187.b3lyp_6-31g(d).gjf (generated)

005129187.b3lyp_6-31g(d).firefly.inp (generated)

005129187.b3lyp_6-31g(d).smash.inp (generated)

005129187.b3lyp_6-31g(d).nwchem.inp (generated) 005129187.b3lyp_6-31g(d).log.xz 005129187.td-b3lyp_6-31g+(d).inp 005129187.td-b3lyp_6-31g+(d).log.xz

005129187.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129187.td-b3lyp_6-31+g(d).gjf (generated)

005129187.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129187.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129187.mol 005129187.PUBCHEM 005129187.mol (via Jmol)
005129204.b3lyp_6-31g(d).inp

005129204.b3lyp_6-31g(d).qchem.inp (generated)

005129204.b3lyp_6-31g(d).gjf (generated)

005129204.b3lyp_6-31g(d).firefly.inp (generated)

005129204.b3lyp_6-31g(d).smash.inp (generated)

005129204.b3lyp_6-31g(d).nwchem.inp (generated) 005129204.b3lyp_6-31g(d).log.xz 005129204.td-b3lyp_6-31g+(d).inp 005129204.td-b3lyp_6-31g+(d).log.xz

005129204.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129204.td-b3lyp_6-31+g(d).gjf (generated)

005129204.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129204.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129204.mol 005129204.PUBCHEM 005129204.mol (via Jmol)
005129261.b3lyp_6-31g(d).inp

005129261.b3lyp_6-31g(d).qchem.inp (generated)

005129261.b3lyp_6-31g(d).gjf (generated)

005129261.b3lyp_6-31g(d).firefly.inp (generated)

005129261.b3lyp_6-31g(d).smash.inp (generated)

005129261.b3lyp_6-31g(d).nwchem.inp (generated) 005129261.b3lyp_6-31g(d).log.xz 005129261.td-b3lyp_6-31g+(d).inp 005129261.td-b3lyp_6-31g+(d).log.xz

005129261.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129261.td-b3lyp_6-31+g(d).gjf (generated)

005129261.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129261.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129261.mol 005129261.PUBCHEM 005129261.mol (via Jmol)
005129280.b3lyp_6-31g(d).inp

005129280.b3lyp_6-31g(d).qchem.inp (generated)

005129280.b3lyp_6-31g(d).gjf (generated)

005129280.b3lyp_6-31g(d).firefly.inp (generated)

005129280.b3lyp_6-31g(d).smash.inp (generated)

005129280.b3lyp_6-31g(d).nwchem.inp (generated) 005129280.b3lyp_6-31g(d).log.xz 005129280.td-b3lyp_6-31g+(d).inp 005129280.td-b3lyp_6-31g+(d).log.xz

005129280.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129280.td-b3lyp_6-31+g(d).gjf (generated)

005129280.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129280.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129280.mol 005129280.PUBCHEM 005129280.mol (via Jmol)
005129301.b3lyp_6-31g(d).inp

005129301.b3lyp_6-31g(d).qchem.inp (generated)

005129301.b3lyp_6-31g(d).gjf (generated)

005129301.b3lyp_6-31g(d).firefly.inp (generated)

005129301.b3lyp_6-31g(d).smash.inp (generated)

005129301.b3lyp_6-31g(d).nwchem.inp (generated) 005129301.b3lyp_6-31g(d).log.xz 005129301.td-b3lyp_6-31g+(d).inp 005129301.td-b3lyp_6-31g+(d).log.xz

005129301.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129301.td-b3lyp_6-31+g(d).gjf (generated)

005129301.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129301.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129301.mol 005129301.PUBCHEM 005129301.mol (via Jmol)
005129304.b3lyp_6-31g(d).inp

005129304.b3lyp_6-31g(d).qchem.inp (generated)

005129304.b3lyp_6-31g(d).gjf (generated)

005129304.b3lyp_6-31g(d).firefly.inp (generated)

005129304.b3lyp_6-31g(d).smash.inp (generated)

005129304.b3lyp_6-31g(d).nwchem.inp (generated) 005129304.b3lyp_6-31g(d).log.xz 005129304.td-b3lyp_6-31g+(d).inp 005129304.td-b3lyp_6-31g+(d).log.xz

005129304.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129304.td-b3lyp_6-31+g(d).gjf (generated)

005129304.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129304.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129304.mol 005129304.PUBCHEM 005129304.mol (via Jmol)
005129305.b3lyp_6-31g(d).inp

005129305.b3lyp_6-31g(d).qchem.inp (generated)

005129305.b3lyp_6-31g(d).gjf (generated)

005129305.b3lyp_6-31g(d).firefly.inp (generated)

005129305.b3lyp_6-31g(d).smash.inp (generated)

005129305.b3lyp_6-31g(d).nwchem.inp (generated) 005129305.b3lyp_6-31g(d).log.xz 005129305.mol 005129305.PUBCHEM 005129305.mol (via Jmol)
005129344.b3lyp_6-31g(d).inp

005129344.b3lyp_6-31g(d).qchem.inp (generated)

005129344.b3lyp_6-31g(d).gjf (generated)

005129344.b3lyp_6-31g(d).firefly.inp (generated)

005129344.b3lyp_6-31g(d).smash.inp (generated)

005129344.b3lyp_6-31g(d).nwchem.inp (generated) 005129344.b3lyp_6-31g(d).log.xz 005129344.td-b3lyp_6-31g+(d).inp 005129344.td-b3lyp_6-31g+(d).log.xz

005129344.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129344.td-b3lyp_6-31+g(d).gjf (generated)

005129344.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129344.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129344.mol 005129344.PUBCHEM 005129344.mol (via Jmol)
005129406.b3lyp_6-31g(d).inp

005129406.b3lyp_6-31g(d).qchem.inp (generated)

005129406.b3lyp_6-31g(d).gjf (generated)

005129406.b3lyp_6-31g(d).firefly.inp (generated)

005129406.b3lyp_6-31g(d).smash.inp (generated)

005129406.b3lyp_6-31g(d).nwchem.inp (generated) 005129406.b3lyp_6-31g(d).log.xz 005129406.td-b3lyp_6-31g+(d).inp 005129406.td-b3lyp_6-31g+(d).log.xz

005129406.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129406.td-b3lyp_6-31+g(d).gjf (generated)

005129406.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129406.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129406.mol 005129406.PUBCHEM 005129406.mol (via Jmol)
005129435.b3lyp_6-31g(d).inp

005129435.b3lyp_6-31g(d).qchem.inp (generated)

005129435.b3lyp_6-31g(d).gjf (generated)

005129435.b3lyp_6-31g(d).firefly.inp (generated)

005129435.b3lyp_6-31g(d).smash.inp (generated)

005129435.b3lyp_6-31g(d).nwchem.inp (generated) 005129435.b3lyp_6-31g(d).log.xz 005129435.td-b3lyp_6-31g+(d).inp 005129435.td-b3lyp_6-31g+(d).log.xz

005129435.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129435.td-b3lyp_6-31+g(d).gjf (generated)

005129435.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129435.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129435.mol 005129435.PUBCHEM 005129435.mol (via Jmol)
005129459.b3lyp_6-31g(d).inp

005129459.b3lyp_6-31g(d).qchem.inp (generated)

005129459.b3lyp_6-31g(d).gjf (generated)

005129459.b3lyp_6-31g(d).firefly.inp (generated)

005129459.b3lyp_6-31g(d).smash.inp (generated)

005129459.b3lyp_6-31g(d).nwchem.inp (generated) 005129459.b3lyp_6-31g(d).log.xz 005129459.td-b3lyp_6-31g+(d).inp 005129459.td-b3lyp_6-31g+(d).log.xz

005129459.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129459.td-b3lyp_6-31+g(d).gjf (generated)

005129459.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129459.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129459.mol 005129459.PUBCHEM 005129459.mol (via Jmol)
005129460.b3lyp_6-31g(d).inp

005129460.b3lyp_6-31g(d).qchem.inp (generated)

005129460.b3lyp_6-31g(d).gjf (generated)

005129460.b3lyp_6-31g(d).firefly.inp (generated)

005129460.b3lyp_6-31g(d).smash.inp (generated)

005129460.b3lyp_6-31g(d).nwchem.inp (generated) 005129460.b3lyp_6-31g(d).log.xz 005129460.td-b3lyp_6-31g+(d).inp 005129460.td-b3lyp_6-31g+(d).log.xz

005129460.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129460.td-b3lyp_6-31+g(d).gjf (generated)

005129460.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129460.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129460.mol 005129460.PUBCHEM 005129460.mol (via Jmol)
005129472.b3lyp_6-31g(d).inp

005129472.b3lyp_6-31g(d).qchem.inp (generated)

005129472.b3lyp_6-31g(d).gjf (generated)

005129472.b3lyp_6-31g(d).firefly.inp (generated)

005129472.b3lyp_6-31g(d).smash.inp (generated)

005129472.b3lyp_6-31g(d).nwchem.inp (generated) 005129472.b3lyp_6-31g(d).log.xz 005129472.td-b3lyp_6-31g+(d).inp 005129472.td-b3lyp_6-31g+(d).log.xz

005129472.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129472.td-b3lyp_6-31+g(d).gjf (generated)

005129472.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129472.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129472.mol 005129472.PUBCHEM 005129472.mol (via Jmol)
005129500.b3lyp_6-31g(d).inp

005129500.b3lyp_6-31g(d).qchem.inp (generated)

005129500.b3lyp_6-31g(d).gjf (generated)

005129500.b3lyp_6-31g(d).firefly.inp (generated)

005129500.b3lyp_6-31g(d).smash.inp (generated)

005129500.b3lyp_6-31g(d).nwchem.inp (generated) 005129500.b3lyp_6-31g(d).log.xz 005129500.td-b3lyp_6-31g+(d).inp 005129500.td-b3lyp_6-31g+(d).log.xz

005129500.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129500.td-b3lyp_6-31+g(d).gjf (generated)

005129500.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129500.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129500.mol 005129500.PUBCHEM 005129500.mol (via Jmol)
005129501.b3lyp_6-31g(d).inp

005129501.b3lyp_6-31g(d).qchem.inp (generated)

005129501.b3lyp_6-31g(d).gjf (generated)

005129501.b3lyp_6-31g(d).firefly.inp (generated)

005129501.b3lyp_6-31g(d).smash.inp (generated)

005129501.b3lyp_6-31g(d).nwchem.inp (generated) 005129501.b3lyp_6-31g(d).log.xz 005129501.td-b3lyp_6-31g+(d).inp 005129501.td-b3lyp_6-31g+(d).log.xz

005129501.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129501.td-b3lyp_6-31+g(d).gjf (generated)

005129501.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129501.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129501.mol 005129501.PUBCHEM 005129501.mol (via Jmol)
005129542.b3lyp_6-31g(d).inp

005129542.b3lyp_6-31g(d).qchem.inp (generated)

005129542.b3lyp_6-31g(d).gjf (generated)

005129542.b3lyp_6-31g(d).firefly.inp (generated)

005129542.b3lyp_6-31g(d).smash.inp (generated)

005129542.b3lyp_6-31g(d).nwchem.inp (generated) 005129542.b3lyp_6-31g(d).log.xz 005129542.td-b3lyp_6-31g+(d).inp 005129542.td-b3lyp_6-31g+(d).log.xz

005129542.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129542.td-b3lyp_6-31+g(d).gjf (generated)

005129542.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129542.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129542.mol 005129542.PUBCHEM 005129542.mol (via Jmol)
005129620.b3lyp_6-31g(d).inp

005129620.b3lyp_6-31g(d).qchem.inp (generated)

005129620.b3lyp_6-31g(d).gjf (generated)

005129620.b3lyp_6-31g(d).firefly.inp (generated)

005129620.b3lyp_6-31g(d).smash.inp (generated)

005129620.b3lyp_6-31g(d).nwchem.inp (generated) 005129620.b3lyp_6-31g(d).log.xz 005129620.td-b3lyp_6-31g+(d).inp 005129620.td-b3lyp_6-31g+(d).log.xz

005129620.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129620.td-b3lyp_6-31+g(d).gjf (generated)

005129620.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129620.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129620.mol 005129620.PUBCHEM 005129620.mol (via Jmol)
005129634.b3lyp_6-31g(d).inp

005129634.b3lyp_6-31g(d).qchem.inp (generated)

005129634.b3lyp_6-31g(d).gjf (generated)

005129634.b3lyp_6-31g(d).firefly.inp (generated)

005129634.b3lyp_6-31g(d).smash.inp (generated)

005129634.b3lyp_6-31g(d).nwchem.inp (generated) 005129634.b3lyp_6-31g(d).log.xz 005129634.td-b3lyp_6-31g+(d).inp 005129634.td-b3lyp_6-31g+(d).log.xz

005129634.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129634.td-b3lyp_6-31+g(d).gjf (generated)

005129634.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129634.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129634.mol 005129634.PUBCHEM 005129634.mol (via Jmol)
005129731.b3lyp_6-31g(d).inp

005129731.b3lyp_6-31g(d).qchem.inp (generated)

005129731.b3lyp_6-31g(d).gjf (generated)

005129731.b3lyp_6-31g(d).firefly.inp (generated)

005129731.b3lyp_6-31g(d).smash.inp (generated)

005129731.b3lyp_6-31g(d).nwchem.inp (generated) 005129731.b3lyp_6-31g(d).log.xz 005129731.mol 005129731.PUBCHEM 005129731.mol (via Jmol)
005129738.b3lyp_6-31g(d).inp

005129738.b3lyp_6-31g(d).qchem.inp (generated)

005129738.b3lyp_6-31g(d).gjf (generated)

005129738.b3lyp_6-31g(d).firefly.inp (generated)

005129738.b3lyp_6-31g(d).smash.inp (generated)

005129738.b3lyp_6-31g(d).nwchem.inp (generated) 005129738.b3lyp_6-31g(d).log.xz 005129738.td-b3lyp_6-31g+(d).inp 005129738.td-b3lyp_6-31g+(d).log.xz

005129738.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129738.td-b3lyp_6-31+g(d).gjf (generated)

005129738.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129738.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129738.mol 005129738.PUBCHEM 005129738.mol (via Jmol)
005129741.b3lyp_6-31g(d).inp

005129741.b3lyp_6-31g(d).qchem.inp (generated)

005129741.b3lyp_6-31g(d).gjf (generated)

005129741.b3lyp_6-31g(d).firefly.inp (generated)

005129741.b3lyp_6-31g(d).smash.inp (generated)

005129741.b3lyp_6-31g(d).nwchem.inp (generated) 005129741.b3lyp_6-31g(d).log.xz 005129741.td-b3lyp_6-31g+(d).inp 005129741.td-b3lyp_6-31g+(d).log.xz

005129741.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129741.td-b3lyp_6-31+g(d).gjf (generated)

005129741.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129741.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129741.mol 005129741.PUBCHEM 005129741.mol (via Jmol)
005129745.b3lyp_6-31g(d).inp

005129745.b3lyp_6-31g(d).qchem.inp (generated)

005129745.b3lyp_6-31g(d).gjf (generated)

005129745.b3lyp_6-31g(d).firefly.inp (generated)

005129745.b3lyp_6-31g(d).smash.inp (generated)

005129745.b3lyp_6-31g(d).nwchem.inp (generated) 005129745.b3lyp_6-31g(d).log.xz 005129745.td-b3lyp_6-31g+(d).inp 005129745.td-b3lyp_6-31g+(d).log.xz

005129745.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129745.td-b3lyp_6-31+g(d).gjf (generated)

005129745.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129745.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129745.mol 005129745.PUBCHEM 005129745.mol (via Jmol)
005129768.b3lyp_6-31g(d).inp

005129768.b3lyp_6-31g(d).qchem.inp (generated)

005129768.b3lyp_6-31g(d).gjf (generated)

005129768.b3lyp_6-31g(d).firefly.inp (generated)

005129768.b3lyp_6-31g(d).smash.inp (generated)

005129768.b3lyp_6-31g(d).nwchem.inp (generated) 005129768.b3lyp_6-31g(d).log.xz 005129768.td-b3lyp_6-31g+(d).inp 005129768.td-b3lyp_6-31g+(d).log.xz

005129768.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129768.td-b3lyp_6-31+g(d).gjf (generated)

005129768.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129768.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129768.mol 005129768.PUBCHEM 005129768.mol (via Jmol)
005129826.b3lyp_6-31g(d).inp

005129826.b3lyp_6-31g(d).qchem.inp (generated)

005129826.b3lyp_6-31g(d).gjf (generated)

005129826.b3lyp_6-31g(d).firefly.inp (generated)

005129826.b3lyp_6-31g(d).smash.inp (generated)

005129826.b3lyp_6-31g(d).nwchem.inp (generated) 005129826.b3lyp_6-31g(d).log.xz 005129826.td-b3lyp_6-31g+(d).inp 005129826.td-b3lyp_6-31g+(d).log.xz

005129826.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129826.td-b3lyp_6-31+g(d).gjf (generated)

005129826.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129826.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129826.mol 005129826.PUBCHEM 005129826.mol (via Jmol)
005129869.b3lyp_6-31g(d).inp

005129869.b3lyp_6-31g(d).qchem.inp (generated)

005129869.b3lyp_6-31g(d).gjf (generated)

005129869.b3lyp_6-31g(d).firefly.inp (generated)

005129869.b3lyp_6-31g(d).smash.inp (generated)

005129869.b3lyp_6-31g(d).nwchem.inp (generated) 005129869.b3lyp_6-31g(d).log.xz 005129869.td-b3lyp_6-31g+(d).inp 005129869.td-b3lyp_6-31g+(d).log.xz

005129869.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129869.td-b3lyp_6-31+g(d).gjf (generated)

005129869.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129869.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129869.mol 005129869.PUBCHEM 005129869.mol (via Jmol)
005129871.b3lyp_6-31g(d).inp

005129871.b3lyp_6-31g(d).qchem.inp (generated)

005129871.b3lyp_6-31g(d).gjf (generated)

005129871.b3lyp_6-31g(d).firefly.inp (generated)

005129871.b3lyp_6-31g(d).smash.inp (generated)

005129871.b3lyp_6-31g(d).nwchem.inp (generated) 005129871.b3lyp_6-31g(d).log.xz 005129871.td-b3lyp_6-31g+(d).inp 005129871.td-b3lyp_6-31g+(d).log.xz

005129871.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129871.td-b3lyp_6-31+g(d).gjf (generated)

005129871.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129871.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129871.mol 005129871.PUBCHEM 005129871.mol (via Jmol)
005129899.b3lyp_6-31g(d).inp

005129899.b3lyp_6-31g(d).qchem.inp (generated)

005129899.b3lyp_6-31g(d).gjf (generated)

005129899.b3lyp_6-31g(d).firefly.inp (generated)

005129899.b3lyp_6-31g(d).smash.inp (generated)

005129899.b3lyp_6-31g(d).nwchem.inp (generated) 005129899.b3lyp_6-31g(d).log.xz 005129899.td-b3lyp_6-31g+(d).inp 005129899.td-b3lyp_6-31g+(d).log.xz

005129899.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129899.td-b3lyp_6-31+g(d).gjf (generated)

005129899.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129899.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129899.mol 005129899.PUBCHEM 005129899.mol (via Jmol)
005129917.b3lyp_6-31g(d).inp

005129917.b3lyp_6-31g(d).qchem.inp (generated)

005129917.b3lyp_6-31g(d).gjf (generated)

005129917.b3lyp_6-31g(d).firefly.inp (generated)

005129917.b3lyp_6-31g(d).smash.inp (generated)

005129917.b3lyp_6-31g(d).nwchem.inp (generated) 005129917.b3lyp_6-31g(d).log.xz 005129917.td-b3lyp_6-31g+(d).inp 005129917.td-b3lyp_6-31g+(d).log.xz

005129917.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129917.td-b3lyp_6-31+g(d).gjf (generated)

005129917.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129917.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129917.mol 005129917.PUBCHEM 005129917.mol (via Jmol)
005129918.b3lyp_6-31g(d).inp

005129918.b3lyp_6-31g(d).qchem.inp (generated)

005129918.b3lyp_6-31g(d).gjf (generated)

005129918.b3lyp_6-31g(d).firefly.inp (generated)

005129918.b3lyp_6-31g(d).smash.inp (generated)

005129918.b3lyp_6-31g(d).nwchem.inp (generated) 005129918.b3lyp_6-31g(d).log.xz 005129918.td-b3lyp_6-31g+(d).inp 005129918.td-b3lyp_6-31g+(d).log.xz

005129918.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129918.td-b3lyp_6-31+g(d).gjf (generated)

005129918.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129918.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129918.mol 005129918.PUBCHEM 005129918.mol (via Jmol)
005129950.b3lyp_6-31g(d).inp

005129950.b3lyp_6-31g(d).qchem.inp (generated)

005129950.b3lyp_6-31g(d).gjf (generated)

005129950.b3lyp_6-31g(d).firefly.inp (generated)

005129950.b3lyp_6-31g(d).smash.inp (generated)

005129950.b3lyp_6-31g(d).nwchem.inp (generated) 005129950.b3lyp_6-31g(d).log.xz 005129950.td-b3lyp_6-31g+(d).inp 005129950.td-b3lyp_6-31g+(d).log.xz

005129950.td-b3lyp_6-31+g(d).qchem.inp (generated)

005129950.td-b3lyp_6-31+g(d).gjf (generated)

005129950.td-b3lyp_6-31+g(d).firefly.inp (generated)

005129950.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005129950.mol 005129950.PUBCHEM 005129950.mol (via Jmol)
005130173.b3lyp_6-31g(d).inp

005130173.b3lyp_6-31g(d).qchem.inp (generated)

005130173.b3lyp_6-31g(d).gjf (generated)

005130173.b3lyp_6-31g(d).firefly.inp (generated)

005130173.b3lyp_6-31g(d).smash.inp (generated)

005130173.b3lyp_6-31g(d).nwchem.inp (generated) 005130173.b3lyp_6-31g(d).log.xz 005130173.td-b3lyp_6-31g+(d).inp 005130173.td-b3lyp_6-31g+(d).log.xz

005130173.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130173.td-b3lyp_6-31+g(d).gjf (generated)

005130173.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130173.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130173.mol 005130173.PUBCHEM 005130173.mol (via Jmol)
005130178.b3lyp_6-31g(d).inp

005130178.b3lyp_6-31g(d).qchem.inp (generated)

005130178.b3lyp_6-31g(d).gjf (generated)

005130178.b3lyp_6-31g(d).firefly.inp (generated)

005130178.b3lyp_6-31g(d).smash.inp (generated)

005130178.b3lyp_6-31g(d).nwchem.inp (generated) 005130178.b3lyp_6-31g(d).log.xz 005130178.td-b3lyp_6-31g+(d).inp 005130178.td-b3lyp_6-31g+(d).log.xz

005130178.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130178.td-b3lyp_6-31+g(d).gjf (generated)

005130178.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130178.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130178.mol 005130178.PUBCHEM 005130178.mol (via Jmol)
005130297.b3lyp_6-31g(d).inp

005130297.b3lyp_6-31g(d).qchem.inp (generated)

005130297.b3lyp_6-31g(d).gjf (generated)

005130297.b3lyp_6-31g(d).firefly.inp (generated)

005130297.b3lyp_6-31g(d).smash.inp (generated)

005130297.b3lyp_6-31g(d).nwchem.inp (generated) 005130297.b3lyp_6-31g(d).log.xz 005130297.td-b3lyp_6-31g+(d).inp 005130297.td-b3lyp_6-31g+(d).log.xz

005130297.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130297.td-b3lyp_6-31+g(d).gjf (generated)

005130297.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130297.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130297.mol 005130297.PUBCHEM 005130297.mol (via Jmol)
005130347.b3lyp_6-31g(d).inp

005130347.b3lyp_6-31g(d).qchem.inp (generated)

005130347.b3lyp_6-31g(d).gjf (generated)

005130347.b3lyp_6-31g(d).firefly.inp (generated)

005130347.b3lyp_6-31g(d).smash.inp (generated)

005130347.b3lyp_6-31g(d).nwchem.inp (generated) 005130347.b3lyp_6-31g(d).log.xz 005130347.td-b3lyp_6-31g+(d).inp 005130347.td-b3lyp_6-31g+(d).log.xz

005130347.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130347.td-b3lyp_6-31+g(d).gjf (generated)

005130347.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130347.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130347.mol 005130347.PUBCHEM 005130347.mol (via Jmol)
005130349.b3lyp_6-31g(d).inp

005130349.b3lyp_6-31g(d).qchem.inp (generated)

005130349.b3lyp_6-31g(d).gjf (generated)

005130349.b3lyp_6-31g(d).firefly.inp (generated)

005130349.b3lyp_6-31g(d).smash.inp (generated)

005130349.b3lyp_6-31g(d).nwchem.inp (generated) 005130349.b3lyp_6-31g(d).log.xz 005130349.td-b3lyp_6-31g+(d).inp 005130349.td-b3lyp_6-31g+(d).log.xz

005130349.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130349.td-b3lyp_6-31+g(d).gjf (generated)

005130349.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130349.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130349.mol 005130349.PUBCHEM 005130349.mol (via Jmol)
005130351.b3lyp_6-31g(d).inp

005130351.b3lyp_6-31g(d).qchem.inp (generated)

005130351.b3lyp_6-31g(d).gjf (generated)

005130351.b3lyp_6-31g(d).firefly.inp (generated)

005130351.b3lyp_6-31g(d).smash.inp (generated)

005130351.b3lyp_6-31g(d).nwchem.inp (generated) 005130351.b3lyp_6-31g(d).log.xz 005130351.td-b3lyp_6-31g+(d).inp 005130351.td-b3lyp_6-31g+(d).log.xz

005130351.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130351.td-b3lyp_6-31+g(d).gjf (generated)

005130351.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130351.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130351.mol 005130351.PUBCHEM 005130351.mol (via Jmol)
005130352.b3lyp_6-31g(d).inp

005130352.b3lyp_6-31g(d).qchem.inp (generated)

005130352.b3lyp_6-31g(d).gjf (generated)

005130352.b3lyp_6-31g(d).firefly.inp (generated)

005130352.b3lyp_6-31g(d).smash.inp (generated)

005130352.b3lyp_6-31g(d).nwchem.inp (generated) 005130352.b3lyp_6-31g(d).log.xz 005130352.td-b3lyp_6-31g+(d).inp 005130352.td-b3lyp_6-31g+(d).log.xz

005130352.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130352.td-b3lyp_6-31+g(d).gjf (generated)

005130352.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130352.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130352.mol 005130352.PUBCHEM 005130352.mol (via Jmol)
005130364.b3lyp_6-31g(d).inp

005130364.b3lyp_6-31g(d).qchem.inp (generated)

005130364.b3lyp_6-31g(d).gjf (generated)

005130364.b3lyp_6-31g(d).firefly.inp (generated)

005130364.b3lyp_6-31g(d).smash.inp (generated)

005130364.b3lyp_6-31g(d).nwchem.inp (generated) 005130364.b3lyp_6-31g(d).log.xz 005130364.td-b3lyp_6-31g+(d).inp 005130364.td-b3lyp_6-31g+(d).log.xz

005130364.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130364.td-b3lyp_6-31+g(d).gjf (generated)

005130364.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130364.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130364.mol 005130364.PUBCHEM 005130364.mol (via Jmol)
005130365.b3lyp_6-31g(d).inp

005130365.b3lyp_6-31g(d).qchem.inp (generated)

005130365.b3lyp_6-31g(d).gjf (generated)

005130365.b3lyp_6-31g(d).firefly.inp (generated)

005130365.b3lyp_6-31g(d).smash.inp (generated)

005130365.b3lyp_6-31g(d).nwchem.inp (generated) 005130365.b3lyp_6-31g(d).log.xz 005130365.td-b3lyp_6-31g+(d).inp 005130365.td-b3lyp_6-31g+(d).log.xz

005130365.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130365.td-b3lyp_6-31+g(d).gjf (generated)

005130365.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130365.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130365.mol 005130365.PUBCHEM 005130365.mol (via Jmol)
005130443.b3lyp_6-31g(d).inp

005130443.b3lyp_6-31g(d).qchem.inp (generated)

005130443.b3lyp_6-31g(d).gjf (generated)

005130443.b3lyp_6-31g(d).firefly.inp (generated)

005130443.b3lyp_6-31g(d).smash.inp (generated)

005130443.b3lyp_6-31g(d).nwchem.inp (generated) 005130443.b3lyp_6-31g(d).log.xz 005130443.td-b3lyp_6-31g+(d).inp 005130443.td-b3lyp_6-31g+(d).log.xz

005130443.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130443.td-b3lyp_6-31+g(d).gjf (generated)

005130443.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130443.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130443.mol 005130443.PUBCHEM 005130443.mol (via Jmol)
005130444.b3lyp_6-31g(d).inp

005130444.b3lyp_6-31g(d).qchem.inp (generated)

005130444.b3lyp_6-31g(d).gjf (generated)

005130444.b3lyp_6-31g(d).firefly.inp (generated)

005130444.b3lyp_6-31g(d).smash.inp (generated)

005130444.b3lyp_6-31g(d).nwchem.inp (generated) 005130444.b3lyp_6-31g(d).log.xz 005130444.td-b3lyp_6-31g+(d).inp 005130444.td-b3lyp_6-31g+(d).log.xz

005130444.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130444.td-b3lyp_6-31+g(d).gjf (generated)

005130444.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130444.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130444.mol 005130444.PUBCHEM 005130444.mol (via Jmol)
005130477.b3lyp_6-31g(d).inp

005130477.b3lyp_6-31g(d).qchem.inp (generated)

005130477.b3lyp_6-31g(d).gjf (generated)

005130477.b3lyp_6-31g(d).firefly.inp (generated)

005130477.b3lyp_6-31g(d).smash.inp (generated)

005130477.b3lyp_6-31g(d).nwchem.inp (generated) 005130477.b3lyp_6-31g(d).log.xz 005130477.td-b3lyp_6-31g+(d).inp 005130477.td-b3lyp_6-31g+(d).log.xz

005130477.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130477.td-b3lyp_6-31+g(d).gjf (generated)

005130477.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130477.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130477.mol 005130477.PUBCHEM 005130477.mol (via Jmol)
005130490.b3lyp_6-31g(d).inp

005130490.b3lyp_6-31g(d).qchem.inp (generated)

005130490.b3lyp_6-31g(d).gjf (generated)

005130490.b3lyp_6-31g(d).firefly.inp (generated)

005130490.b3lyp_6-31g(d).smash.inp (generated)

005130490.b3lyp_6-31g(d).nwchem.inp (generated) 005130490.b3lyp_6-31g(d).log.xz 005130490.td-b3lyp_6-31g+(d).inp 005130490.td-b3lyp_6-31g+(d).log.xz

005130490.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130490.td-b3lyp_6-31+g(d).gjf (generated)

005130490.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130490.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130490.mol 005130490.PUBCHEM 005130490.mol (via Jmol)
005130515.b3lyp_6-31g(d).inp

005130515.b3lyp_6-31g(d).qchem.inp (generated)

005130515.b3lyp_6-31g(d).gjf (generated)

005130515.b3lyp_6-31g(d).firefly.inp (generated)

005130515.b3lyp_6-31g(d).smash.inp (generated)

005130515.b3lyp_6-31g(d).nwchem.inp (generated) 005130515.b3lyp_6-31g(d).log.xz 005130515.td-b3lyp_6-31g+(d).inp 005130515.td-b3lyp_6-31g+(d).log.xz

005130515.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130515.td-b3lyp_6-31+g(d).gjf (generated)

005130515.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130515.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130515.mol 005130515.PUBCHEM 005130515.mol (via Jmol)
005130549.b3lyp_6-31g(d).inp

005130549.b3lyp_6-31g(d).qchem.inp (generated)

005130549.b3lyp_6-31g(d).gjf (generated)

005130549.b3lyp_6-31g(d).firefly.inp (generated)

005130549.b3lyp_6-31g(d).smash.inp (generated)

005130549.b3lyp_6-31g(d).nwchem.inp (generated) 005130549.b3lyp_6-31g(d).log.xz 005130549.td-b3lyp_6-31g+(d).inp 005130549.td-b3lyp_6-31g+(d).log.xz

005130549.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130549.td-b3lyp_6-31+g(d).gjf (generated)

005130549.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130549.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130549.mol 005130549.PUBCHEM 005130549.mol (via Jmol)
005130596.b3lyp_6-31g(d).inp

005130596.b3lyp_6-31g(d).qchem.inp (generated)

005130596.b3lyp_6-31g(d).gjf (generated)

005130596.b3lyp_6-31g(d).firefly.inp (generated)

005130596.b3lyp_6-31g(d).smash.inp (generated)

005130596.b3lyp_6-31g(d).nwchem.inp (generated) 005130596.b3lyp_6-31g(d).log.xz 005130596.td-b3lyp_6-31g+(d).inp 005130596.td-b3lyp_6-31g+(d).log.xz

005130596.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130596.td-b3lyp_6-31+g(d).gjf (generated)

005130596.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130596.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130596.mol 005130596.PUBCHEM 005130596.mol (via Jmol)
005130626.b3lyp_6-31g(d).inp

005130626.b3lyp_6-31g(d).qchem.inp (generated)

005130626.b3lyp_6-31g(d).gjf (generated)

005130626.b3lyp_6-31g(d).firefly.inp (generated)

005130626.b3lyp_6-31g(d).smash.inp (generated)

005130626.b3lyp_6-31g(d).nwchem.inp (generated) 005130626.b3lyp_6-31g(d).log.xz 005130626.td-b3lyp_6-31g+(d).inp 005130626.td-b3lyp_6-31g+(d).log.xz

005130626.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130626.td-b3lyp_6-31+g(d).gjf (generated)

005130626.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130626.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130626.mol 005130626.PUBCHEM 005130626.mol (via Jmol)
005130629.b3lyp_6-31g(d).inp

005130629.b3lyp_6-31g(d).qchem.inp (generated)

005130629.b3lyp_6-31g(d).gjf (generated)

005130629.b3lyp_6-31g(d).firefly.inp (generated)

005130629.b3lyp_6-31g(d).smash.inp (generated)

005130629.b3lyp_6-31g(d).nwchem.inp (generated) 005130629.b3lyp_6-31g(d).log.xz 005130629.td-b3lyp_6-31g+(d).inp 005130629.td-b3lyp_6-31g+(d).log.xz

005130629.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130629.td-b3lyp_6-31+g(d).gjf (generated)

005130629.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130629.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130629.mol 005130629.PUBCHEM 005130629.mol (via Jmol)
005130669.b3lyp_6-31g(d).inp

005130669.b3lyp_6-31g(d).qchem.inp (generated)

005130669.b3lyp_6-31g(d).gjf (generated)

005130669.b3lyp_6-31g(d).firefly.inp (generated)

005130669.b3lyp_6-31g(d).smash.inp (generated)

005130669.b3lyp_6-31g(d).nwchem.inp (generated) 005130669.b3lyp_6-31g(d).log.xz 005130669.td-b3lyp_6-31g+(d).inp 005130669.td-b3lyp_6-31g+(d).log.xz

005130669.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130669.td-b3lyp_6-31+g(d).gjf (generated)

005130669.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130669.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130669.mol 005130669.PUBCHEM 005130669.mol (via Jmol)
005130673.b3lyp_6-31g(d).inp

005130673.b3lyp_6-31g(d).qchem.inp (generated)

005130673.b3lyp_6-31g(d).gjf (generated)

005130673.b3lyp_6-31g(d).firefly.inp (generated)

005130673.b3lyp_6-31g(d).smash.inp (generated)

005130673.b3lyp_6-31g(d).nwchem.inp (generated) 005130673.b3lyp_6-31g(d).log.xz 005130673.td-b3lyp_6-31g+(d).inp 005130673.td-b3lyp_6-31g+(d).log.xz

005130673.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130673.td-b3lyp_6-31+g(d).gjf (generated)

005130673.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130673.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130673.mol 005130673.PUBCHEM 005130673.mol (via Jmol)
005130679.b3lyp_6-31g(d).inp

005130679.b3lyp_6-31g(d).qchem.inp (generated)

005130679.b3lyp_6-31g(d).gjf (generated)

005130679.b3lyp_6-31g(d).firefly.inp (generated)

005130679.b3lyp_6-31g(d).smash.inp (generated)

005130679.b3lyp_6-31g(d).nwchem.inp (generated) 005130679.b3lyp_6-31g(d).log.xz 005130679.td-b3lyp_6-31g+(d).inp 005130679.td-b3lyp_6-31g+(d).log.xz

005130679.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130679.td-b3lyp_6-31+g(d).gjf (generated)

005130679.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130679.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130679.mol 005130679.PUBCHEM 005130679.mol (via Jmol)
005130683.b3lyp_6-31g(d).inp

005130683.b3lyp_6-31g(d).qchem.inp (generated)

005130683.b3lyp_6-31g(d).gjf (generated)

005130683.b3lyp_6-31g(d).firefly.inp (generated)

005130683.b3lyp_6-31g(d).smash.inp (generated)

005130683.b3lyp_6-31g(d).nwchem.inp (generated) 005130683.b3lyp_6-31g(d).log.xz 005130683.td-b3lyp_6-31g+(d).inp 005130683.td-b3lyp_6-31g+(d).log.xz

005130683.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130683.td-b3lyp_6-31+g(d).gjf (generated)

005130683.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130683.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130683.mol 005130683.PUBCHEM 005130683.mol (via Jmol)
005130700.b3lyp_6-31g(d).inp

005130700.b3lyp_6-31g(d).qchem.inp (generated)

005130700.b3lyp_6-31g(d).gjf (generated)

005130700.b3lyp_6-31g(d).firefly.inp (generated)

005130700.b3lyp_6-31g(d).smash.inp (generated)

005130700.b3lyp_6-31g(d).nwchem.inp (generated) 005130700.b3lyp_6-31g(d).log.xz 005130700.td-b3lyp_6-31g+(d).inp 005130700.td-b3lyp_6-31g+(d).log.xz

005130700.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130700.td-b3lyp_6-31+g(d).gjf (generated)

005130700.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130700.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130700.mol 005130700.PUBCHEM 005130700.mol (via Jmol)
005130705.b3lyp_6-31g(d).inp

005130705.b3lyp_6-31g(d).qchem.inp (generated)

005130705.b3lyp_6-31g(d).gjf (generated)

005130705.b3lyp_6-31g(d).firefly.inp (generated)

005130705.b3lyp_6-31g(d).smash.inp (generated)

005130705.b3lyp_6-31g(d).nwchem.inp (generated) 005130705.b3lyp_6-31g(d).log.xz 005130705.td-b3lyp_6-31g+(d).inp 005130705.td-b3lyp_6-31g+(d).log.xz

005130705.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130705.td-b3lyp_6-31+g(d).gjf (generated)

005130705.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130705.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130705.mol 005130705.PUBCHEM 005130705.mol (via Jmol)
005130735.b3lyp_6-31g(d).inp

005130735.b3lyp_6-31g(d).qchem.inp (generated)

005130735.b3lyp_6-31g(d).gjf (generated)

005130735.b3lyp_6-31g(d).firefly.inp (generated)

005130735.b3lyp_6-31g(d).smash.inp (generated)

005130735.b3lyp_6-31g(d).nwchem.inp (generated) 005130735.b3lyp_6-31g(d).log.xz 005130735.td-b3lyp_6-31g+(d).inp 005130735.td-b3lyp_6-31g+(d).log.xz

005130735.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130735.td-b3lyp_6-31+g(d).gjf (generated)

005130735.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130735.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130735.mol 005130735.PUBCHEM 005130735.mol (via Jmol)
005130763.b3lyp_6-31g(d).inp

005130763.b3lyp_6-31g(d).qchem.inp (generated)

005130763.b3lyp_6-31g(d).gjf (generated)

005130763.b3lyp_6-31g(d).firefly.inp (generated)

005130763.b3lyp_6-31g(d).smash.inp (generated)

005130763.b3lyp_6-31g(d).nwchem.inp (generated) 005130763.b3lyp_6-31g(d).log.xz 005130763.td-b3lyp_6-31g+(d).inp 005130763.td-b3lyp_6-31g+(d).log.xz

005130763.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130763.td-b3lyp_6-31+g(d).gjf (generated)

005130763.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130763.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130763.mol 005130763.PUBCHEM 005130763.mol (via Jmol)
005130786.b3lyp_6-31g(d).inp

005130786.b3lyp_6-31g(d).qchem.inp (generated)

005130786.b3lyp_6-31g(d).gjf (generated)

005130786.b3lyp_6-31g(d).firefly.inp (generated)

005130786.b3lyp_6-31g(d).smash.inp (generated)

005130786.b3lyp_6-31g(d).nwchem.inp (generated) 005130786.b3lyp_6-31g(d).log.xz 005130786.td-b3lyp_6-31g+(d).inp 005130786.td-b3lyp_6-31g+(d).log.xz

005130786.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130786.td-b3lyp_6-31+g(d).gjf (generated)

005130786.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130786.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130786.mol 005130786.PUBCHEM 005130786.mol (via Jmol)
005130787.b3lyp_6-31g(d).inp

005130787.b3lyp_6-31g(d).qchem.inp (generated)

005130787.b3lyp_6-31g(d).gjf (generated)

005130787.b3lyp_6-31g(d).firefly.inp (generated)

005130787.b3lyp_6-31g(d).smash.inp (generated)

005130787.b3lyp_6-31g(d).nwchem.inp (generated) 005130787.b3lyp_6-31g(d).log.xz 005130787.td-b3lyp_6-31g+(d).inp 005130787.td-b3lyp_6-31g+(d).log.xz

005130787.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130787.td-b3lyp_6-31+g(d).gjf (generated)

005130787.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130787.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130787.mol 005130787.PUBCHEM 005130787.mol (via Jmol)
005130892.b3lyp_6-31g(d).inp

005130892.b3lyp_6-31g(d).qchem.inp (generated)

005130892.b3lyp_6-31g(d).gjf (generated)

005130892.b3lyp_6-31g(d).firefly.inp (generated)

005130892.b3lyp_6-31g(d).smash.inp (generated)

005130892.b3lyp_6-31g(d).nwchem.inp (generated) 005130892.b3lyp_6-31g(d).log.xz 005130892.td-b3lyp_6-31g+(d).inp 005130892.td-b3lyp_6-31g+(d).log.xz

005130892.td-b3lyp_6-31+g(d).qchem.inp (generated)

005130892.td-b3lyp_6-31+g(d).gjf (generated)

005130892.td-b3lyp_6-31+g(d).firefly.inp (generated)

005130892.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005130892.mol 005130892.PUBCHEM 005130892.mol (via Jmol)
005131046.b3lyp_6-31g(d).inp

005131046.b3lyp_6-31g(d).qchem.inp (generated)

005131046.b3lyp_6-31g(d).gjf (generated)

005131046.b3lyp_6-31g(d).firefly.inp (generated)

005131046.b3lyp_6-31g(d).smash.inp (generated)

005131046.b3lyp_6-31g(d).nwchem.inp (generated) 005131046.b3lyp_6-31g(d).log.xz 005131046.mol 005131046.PUBCHEM 005131046.mol (via Jmol)
005131049.b3lyp_6-31g(d).inp

005131049.b3lyp_6-31g(d).qchem.inp (generated)

005131049.b3lyp_6-31g(d).gjf (generated)

005131049.b3lyp_6-31g(d).firefly.inp (generated)

005131049.b3lyp_6-31g(d).smash.inp (generated)

005131049.b3lyp_6-31g(d).nwchem.inp (generated) 005131049.b3lyp_6-31g(d).log.xz 005131049.td-b3lyp_6-31g+(d).inp 005131049.td-b3lyp_6-31g+(d).log.xz

005131049.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131049.td-b3lyp_6-31+g(d).gjf (generated)

005131049.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131049.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131049.mol 005131049.PUBCHEM 005131049.mol (via Jmol)
005131075.b3lyp_6-31g(d).inp

005131075.b3lyp_6-31g(d).qchem.inp (generated)

005131075.b3lyp_6-31g(d).gjf (generated)

005131075.b3lyp_6-31g(d).firefly.inp (generated)

005131075.b3lyp_6-31g(d).smash.inp (generated)

005131075.b3lyp_6-31g(d).nwchem.inp (generated) 005131075.b3lyp_6-31g(d).log.xz 005131075.td-b3lyp_6-31g+(d).inp 005131075.td-b3lyp_6-31g+(d).log.xz

005131075.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131075.td-b3lyp_6-31+g(d).gjf (generated)

005131075.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131075.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131075.mol 005131075.PUBCHEM 005131075.mol (via Jmol)
005131076.b3lyp_6-31g(d).inp

005131076.b3lyp_6-31g(d).qchem.inp (generated)

005131076.b3lyp_6-31g(d).gjf (generated)

005131076.b3lyp_6-31g(d).firefly.inp (generated)

005131076.b3lyp_6-31g(d).smash.inp (generated)

005131076.b3lyp_6-31g(d).nwchem.inp (generated) 005131076.b3lyp_6-31g(d).log.xz 005131076.td-b3lyp_6-31g+(d).inp 005131076.td-b3lyp_6-31g+(d).log.xz

005131076.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131076.td-b3lyp_6-31+g(d).gjf (generated)

005131076.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131076.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131076.mol 005131076.PUBCHEM 005131076.mol (via Jmol)
005131156.b3lyp_6-31g(d).inp

005131156.b3lyp_6-31g(d).qchem.inp (generated)

005131156.b3lyp_6-31g(d).gjf (generated)

005131156.b3lyp_6-31g(d).firefly.inp (generated)

005131156.b3lyp_6-31g(d).smash.inp (generated)

005131156.b3lyp_6-31g(d).nwchem.inp (generated) 005131156.b3lyp_6-31g(d).log.xz 005131156.td-b3lyp_6-31g+(d).inp 005131156.td-b3lyp_6-31g+(d).log.xz

005131156.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131156.td-b3lyp_6-31+g(d).gjf (generated)

005131156.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131156.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131156.mol 005131156.PUBCHEM 005131156.mol (via Jmol)
005131195.b3lyp_6-31g(d).inp

005131195.b3lyp_6-31g(d).qchem.inp (generated)

005131195.b3lyp_6-31g(d).gjf (generated)

005131195.b3lyp_6-31g(d).firefly.inp (generated)

005131195.b3lyp_6-31g(d).smash.inp (generated)

005131195.b3lyp_6-31g(d).nwchem.inp (generated) 005131195.b3lyp_6-31g(d).log.xz 005131195.td-b3lyp_6-31g+(d).inp 005131195.td-b3lyp_6-31g+(d).log.xz

005131195.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131195.td-b3lyp_6-31+g(d).gjf (generated)

005131195.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131195.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131195.mol 005131195.PUBCHEM 005131195.mol (via Jmol)
005131202.b3lyp_6-31g(d).inp

005131202.b3lyp_6-31g(d).qchem.inp (generated)

005131202.b3lyp_6-31g(d).gjf (generated)

005131202.b3lyp_6-31g(d).firefly.inp (generated)

005131202.b3lyp_6-31g(d).smash.inp (generated)

005131202.b3lyp_6-31g(d).nwchem.inp (generated) 005131202.b3lyp_6-31g(d).log.xz 005131202.td-b3lyp_6-31g+(d).inp 005131202.td-b3lyp_6-31g+(d).log.xz

005131202.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131202.td-b3lyp_6-31+g(d).gjf (generated)

005131202.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131202.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131202.mol 005131202.PUBCHEM 005131202.mol (via Jmol)
005131214.b3lyp_6-31g(d).inp

005131214.b3lyp_6-31g(d).qchem.inp (generated)

005131214.b3lyp_6-31g(d).gjf (generated)

005131214.b3lyp_6-31g(d).firefly.inp (generated)

005131214.b3lyp_6-31g(d).smash.inp (generated)

005131214.b3lyp_6-31g(d).nwchem.inp (generated) 005131214.b3lyp_6-31g(d).log.xz 005131214.td-b3lyp_6-31g+(d).inp 005131214.td-b3lyp_6-31g+(d).log.xz

005131214.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131214.td-b3lyp_6-31+g(d).gjf (generated)

005131214.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131214.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131214.mol 005131214.PUBCHEM 005131214.mol (via Jmol)
005131216.b3lyp_6-31g(d).inp

005131216.b3lyp_6-31g(d).qchem.inp (generated)

005131216.b3lyp_6-31g(d).gjf (generated)

005131216.b3lyp_6-31g(d).firefly.inp (generated)

005131216.b3lyp_6-31g(d).smash.inp (generated)

005131216.b3lyp_6-31g(d).nwchem.inp (generated) 005131216.b3lyp_6-31g(d).log.xz 005131216.td-b3lyp_6-31g+(d).inp 005131216.td-b3lyp_6-31g+(d).log.xz

005131216.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131216.td-b3lyp_6-31+g(d).gjf (generated)

005131216.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131216.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131216.mol 005131216.PUBCHEM 005131216.mol (via Jmol)
005131270.b3lyp_6-31g(d).inp

005131270.b3lyp_6-31g(d).qchem.inp (generated)

005131270.b3lyp_6-31g(d).gjf (generated)

005131270.b3lyp_6-31g(d).firefly.inp (generated)

005131270.b3lyp_6-31g(d).smash.inp (generated)

005131270.b3lyp_6-31g(d).nwchem.inp (generated) 005131270.b3lyp_6-31g(d).log.xz 005131270.td-b3lyp_6-31g+(d).inp 005131270.td-b3lyp_6-31g+(d).log.xz

005131270.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131270.td-b3lyp_6-31+g(d).gjf (generated)

005131270.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131270.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131270.mol 005131270.PUBCHEM 005131270.mol (via Jmol)
005131271.b3lyp_6-31g(d).inp

005131271.b3lyp_6-31g(d).qchem.inp (generated)

005131271.b3lyp_6-31g(d).gjf (generated)

005131271.b3lyp_6-31g(d).firefly.inp (generated)

005131271.b3lyp_6-31g(d).smash.inp (generated)

005131271.b3lyp_6-31g(d).nwchem.inp (generated) 005131271.b3lyp_6-31g(d).log.xz 005131271.td-b3lyp_6-31g+(d).inp 005131271.td-b3lyp_6-31g+(d).log.xz

005131271.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131271.td-b3lyp_6-31+g(d).gjf (generated)

005131271.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131271.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131271.mol 005131271.PUBCHEM 005131271.mol (via Jmol)
005131291.b3lyp_6-31g(d).inp

005131291.b3lyp_6-31g(d).qchem.inp (generated)

005131291.b3lyp_6-31g(d).gjf (generated)

005131291.b3lyp_6-31g(d).firefly.inp (generated)

005131291.b3lyp_6-31g(d).smash.inp (generated)

005131291.b3lyp_6-31g(d).nwchem.inp (generated) 005131291.b3lyp_6-31g(d).log.xz 005131291.td-b3lyp_6-31g+(d).inp 005131291.td-b3lyp_6-31g+(d).log.xz

005131291.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131291.td-b3lyp_6-31+g(d).gjf (generated)

005131291.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131291.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131291.mol 005131291.PUBCHEM 005131291.mol (via Jmol)
005131331.b3lyp_6-31g(d).inp

005131331.b3lyp_6-31g(d).qchem.inp (generated)

005131331.b3lyp_6-31g(d).gjf (generated)

005131331.b3lyp_6-31g(d).firefly.inp (generated)

005131331.b3lyp_6-31g(d).smash.inp (generated)

005131331.b3lyp_6-31g(d).nwchem.inp (generated) 005131331.b3lyp_6-31g(d).log.xz 005131331.mol 005131331.PUBCHEM 005131331.mol (via Jmol)
005131340.b3lyp_6-31g(d).inp

005131340.b3lyp_6-31g(d).qchem.inp (generated)

005131340.b3lyp_6-31g(d).gjf (generated)

005131340.b3lyp_6-31g(d).firefly.inp (generated)

005131340.b3lyp_6-31g(d).smash.inp (generated)

005131340.b3lyp_6-31g(d).nwchem.inp (generated) 005131340.b3lyp_6-31g(d).log.xz 005131340.td-b3lyp_6-31g+(d).inp 005131340.td-b3lyp_6-31g+(d).log.xz

005131340.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131340.td-b3lyp_6-31+g(d).gjf (generated)

005131340.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131340.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131340.mol 005131340.PUBCHEM 005131340.mol (via Jmol)
005131372.b3lyp_6-31g(d).inp

005131372.b3lyp_6-31g(d).qchem.inp (generated)

005131372.b3lyp_6-31g(d).gjf (generated)

005131372.b3lyp_6-31g(d).firefly.inp (generated)

005131372.b3lyp_6-31g(d).smash.inp (generated)

005131372.b3lyp_6-31g(d).nwchem.inp (generated) 005131372.b3lyp_6-31g(d).log.xz 005131372.td-b3lyp_6-31g+(d).inp 005131372.td-b3lyp_6-31g+(d).log.xz

005131372.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131372.td-b3lyp_6-31+g(d).gjf (generated)

005131372.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131372.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131372.mol 005131372.PUBCHEM 005131372.mol (via Jmol)
005131374.b3lyp_6-31g(d).inp

005131374.b3lyp_6-31g(d).qchem.inp (generated)

005131374.b3lyp_6-31g(d).gjf (generated)

005131374.b3lyp_6-31g(d).firefly.inp (generated)

005131374.b3lyp_6-31g(d).smash.inp (generated)

005131374.b3lyp_6-31g(d).nwchem.inp (generated) 005131374.b3lyp_6-31g(d).log.xz 005131374.td-b3lyp_6-31g+(d).inp 005131374.td-b3lyp_6-31g+(d).log.xz

005131374.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131374.td-b3lyp_6-31+g(d).gjf (generated)

005131374.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131374.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131374.mol 005131374.PUBCHEM 005131374.mol (via Jmol)
005131427.b3lyp_6-31g(d).inp

005131427.b3lyp_6-31g(d).qchem.inp (generated)

005131427.b3lyp_6-31g(d).gjf (generated)

005131427.b3lyp_6-31g(d).firefly.inp (generated)

005131427.b3lyp_6-31g(d).smash.inp (generated)

005131427.b3lyp_6-31g(d).nwchem.inp (generated) 005131427.b3lyp_6-31g(d).log.xz 005131427.td-b3lyp_6-31g+(d).inp 005131427.td-b3lyp_6-31g+(d).log.xz

005131427.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131427.td-b3lyp_6-31+g(d).gjf (generated)

005131427.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131427.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131427.mol 005131427.PUBCHEM 005131427.mol (via Jmol)
005131428.b3lyp_6-31g(d).inp

005131428.b3lyp_6-31g(d).qchem.inp (generated)

005131428.b3lyp_6-31g(d).gjf (generated)

005131428.b3lyp_6-31g(d).firefly.inp (generated)

005131428.b3lyp_6-31g(d).smash.inp (generated)

005131428.b3lyp_6-31g(d).nwchem.inp (generated) 005131428.b3lyp_6-31g(d).log.xz 005131428.td-b3lyp_6-31g+(d).inp 005131428.td-b3lyp_6-31g+(d).log.xz

005131428.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131428.td-b3lyp_6-31+g(d).gjf (generated)

005131428.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131428.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131428.mol 005131428.PUBCHEM 005131428.mol (via Jmol)
005131545.b3lyp_6-31g(d).inp

005131545.b3lyp_6-31g(d).qchem.inp (generated)

005131545.b3lyp_6-31g(d).gjf (generated)

005131545.b3lyp_6-31g(d).firefly.inp (generated)

005131545.b3lyp_6-31g(d).smash.inp (generated)

005131545.b3lyp_6-31g(d).nwchem.inp (generated) 005131545.b3lyp_6-31g(d).log.xz 005131545.td-b3lyp_6-31g+(d).inp 005131545.td-b3lyp_6-31g+(d).log.xz

005131545.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131545.td-b3lyp_6-31+g(d).gjf (generated)

005131545.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131545.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131545.mol 005131545.PUBCHEM 005131545.mol (via Jmol)
005131546.b3lyp_6-31g(d).inp

005131546.b3lyp_6-31g(d).qchem.inp (generated)

005131546.b3lyp_6-31g(d).gjf (generated)

005131546.b3lyp_6-31g(d).firefly.inp (generated)

005131546.b3lyp_6-31g(d).smash.inp (generated)

005131546.b3lyp_6-31g(d).nwchem.inp (generated) 005131546.b3lyp_6-31g(d).log.xz 005131546.td-b3lyp_6-31g+(d).inp 005131546.td-b3lyp_6-31g+(d).log.xz

005131546.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131546.td-b3lyp_6-31+g(d).gjf (generated)

005131546.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131546.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131546.mol 005131546.PUBCHEM 005131546.mol (via Jmol)
005131635.b3lyp_6-31g(d).inp

005131635.b3lyp_6-31g(d).qchem.inp (generated)

005131635.b3lyp_6-31g(d).gjf (generated)

005131635.b3lyp_6-31g(d).firefly.inp (generated)

005131635.b3lyp_6-31g(d).smash.inp (generated)

005131635.b3lyp_6-31g(d).nwchem.inp (generated) 005131635.b3lyp_6-31g(d).log.xz 005131635.td-b3lyp_6-31g+(d).inp 005131635.td-b3lyp_6-31g+(d).log.xz

005131635.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131635.td-b3lyp_6-31+g(d).gjf (generated)

005131635.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131635.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131635.mol 005131635.PUBCHEM 005131635.mol (via Jmol)
005131681.b3lyp_6-31g(d).inp

005131681.b3lyp_6-31g(d).qchem.inp (generated)

005131681.b3lyp_6-31g(d).gjf (generated)

005131681.b3lyp_6-31g(d).firefly.inp (generated)

005131681.b3lyp_6-31g(d).smash.inp (generated)

005131681.b3lyp_6-31g(d).nwchem.inp (generated) 005131681.b3lyp_6-31g(d).log.xz 005131681.td-b3lyp_6-31g+(d).inp 005131681.td-b3lyp_6-31g+(d).log.xz

005131681.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131681.td-b3lyp_6-31+g(d).gjf (generated)

005131681.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131681.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131681.mol 005131681.PUBCHEM 005131681.mol (via Jmol)
005131682.b3lyp_6-31g(d).inp

005131682.b3lyp_6-31g(d).qchem.inp (generated)

005131682.b3lyp_6-31g(d).gjf (generated)

005131682.b3lyp_6-31g(d).firefly.inp (generated)

005131682.b3lyp_6-31g(d).smash.inp (generated)

005131682.b3lyp_6-31g(d).nwchem.inp (generated) 005131682.b3lyp_6-31g(d).log.xz 005131682.td-b3lyp_6-31g+(d).inp 005131682.td-b3lyp_6-31g+(d).log.xz

005131682.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131682.td-b3lyp_6-31+g(d).gjf (generated)

005131682.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131682.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131682.mol 005131682.PUBCHEM 005131682.mol (via Jmol)
005131713.b3lyp_6-31g(d).inp

005131713.b3lyp_6-31g(d).qchem.inp (generated)

005131713.b3lyp_6-31g(d).gjf (generated)

005131713.b3lyp_6-31g(d).firefly.inp (generated)

005131713.b3lyp_6-31g(d).smash.inp (generated)

005131713.b3lyp_6-31g(d).nwchem.inp (generated) 005131713.b3lyp_6-31g(d).log.xz 005131713.td-b3lyp_6-31g+(d).inp 005131713.td-b3lyp_6-31g+(d).log.xz

005131713.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131713.td-b3lyp_6-31+g(d).gjf (generated)

005131713.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131713.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131713.mol 005131713.PUBCHEM 005131713.mol (via Jmol)
005131769.b3lyp_6-31g(d).inp

005131769.b3lyp_6-31g(d).qchem.inp (generated)

005131769.b3lyp_6-31g(d).gjf (generated)

005131769.b3lyp_6-31g(d).firefly.inp (generated)

005131769.b3lyp_6-31g(d).smash.inp (generated)

005131769.b3lyp_6-31g(d).nwchem.inp (generated) 005131769.b3lyp_6-31g(d).log.xz 005131769.td-b3lyp_6-31g+(d).inp 005131769.td-b3lyp_6-31g+(d).log.xz

005131769.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131769.td-b3lyp_6-31+g(d).gjf (generated)

005131769.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131769.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131769.mol 005131769.PUBCHEM 005131769.mol (via Jmol)
005131778.b3lyp_6-31g(d).inp

005131778.b3lyp_6-31g(d).qchem.inp (generated)

005131778.b3lyp_6-31g(d).gjf (generated)

005131778.b3lyp_6-31g(d).firefly.inp (generated)

005131778.b3lyp_6-31g(d).smash.inp (generated)

005131778.b3lyp_6-31g(d).nwchem.inp (generated) 005131778.b3lyp_6-31g(d).log.xz 005131778.td-b3lyp_6-31g+(d).inp 005131778.td-b3lyp_6-31g+(d).log.xz

005131778.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131778.td-b3lyp_6-31+g(d).gjf (generated)

005131778.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131778.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131778.mol 005131778.PUBCHEM 005131778.mol (via Jmol)
005131779.b3lyp_6-31g(d).inp

005131779.b3lyp_6-31g(d).qchem.inp (generated)

005131779.b3lyp_6-31g(d).gjf (generated)

005131779.b3lyp_6-31g(d).firefly.inp (generated)

005131779.b3lyp_6-31g(d).smash.inp (generated)

005131779.b3lyp_6-31g(d).nwchem.inp (generated) 005131779.b3lyp_6-31g(d).log.xz 005131779.mol 005131779.PUBCHEM 005131779.mol (via Jmol)
005131780.b3lyp_6-31g(d).inp

005131780.b3lyp_6-31g(d).qchem.inp (generated)

005131780.b3lyp_6-31g(d).gjf (generated)

005131780.b3lyp_6-31g(d).firefly.inp (generated)

005131780.b3lyp_6-31g(d).smash.inp (generated)

005131780.b3lyp_6-31g(d).nwchem.inp (generated) 005131780.b3lyp_6-31g(d).log.xz 005131780.td-b3lyp_6-31g+(d).inp 005131780.td-b3lyp_6-31g+(d).log.xz

005131780.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131780.td-b3lyp_6-31+g(d).gjf (generated)

005131780.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131780.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131780.mol 005131780.PUBCHEM 005131780.mol (via Jmol)
005131783.b3lyp_6-31g(d).inp

005131783.b3lyp_6-31g(d).qchem.inp (generated)

005131783.b3lyp_6-31g(d).gjf (generated)

005131783.b3lyp_6-31g(d).firefly.inp (generated)

005131783.b3lyp_6-31g(d).smash.inp (generated)

005131783.b3lyp_6-31g(d).nwchem.inp (generated) 005131783.b3lyp_6-31g(d).log.xz 005131783.mol 005131783.PUBCHEM 005131783.mol (via Jmol)
005131962.b3lyp_6-31g(d).inp

005131962.b3lyp_6-31g(d).qchem.inp (generated)

005131962.b3lyp_6-31g(d).gjf (generated)

005131962.b3lyp_6-31g(d).firefly.inp (generated)

005131962.b3lyp_6-31g(d).smash.inp (generated)

005131962.b3lyp_6-31g(d).nwchem.inp (generated) 005131962.b3lyp_6-31g(d).log.xz 005131962.td-b3lyp_6-31g+(d).inp 005131962.td-b3lyp_6-31g+(d).log.xz

005131962.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131962.td-b3lyp_6-31+g(d).gjf (generated)

005131962.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131962.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131962.mol 005131962.PUBCHEM 005131962.mol (via Jmol)
005131963.b3lyp_6-31g(d).inp

005131963.b3lyp_6-31g(d).qchem.inp (generated)

005131963.b3lyp_6-31g(d).gjf (generated)

005131963.b3lyp_6-31g(d).firefly.inp (generated)

005131963.b3lyp_6-31g(d).smash.inp (generated)

005131963.b3lyp_6-31g(d).nwchem.inp (generated) 005131963.b3lyp_6-31g(d).log.xz 005131963.td-b3lyp_6-31g+(d).inp 005131963.td-b3lyp_6-31g+(d).log.xz

005131963.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131963.td-b3lyp_6-31+g(d).gjf (generated)

005131963.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131963.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131963.mol 005131963.PUBCHEM 005131963.mol (via Jmol)
005131964.b3lyp_6-31g(d).inp

005131964.b3lyp_6-31g(d).qchem.inp (generated)

005131964.b3lyp_6-31g(d).gjf (generated)

005131964.b3lyp_6-31g(d).firefly.inp (generated)

005131964.b3lyp_6-31g(d).smash.inp (generated)

005131964.b3lyp_6-31g(d).nwchem.inp (generated) 005131964.b3lyp_6-31g(d).log.xz 005131964.td-b3lyp_6-31g+(d).inp 005131964.td-b3lyp_6-31g+(d).log.xz

005131964.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131964.td-b3lyp_6-31+g(d).gjf (generated)

005131964.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131964.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131964.mol 005131964.PUBCHEM 005131964.mol (via Jmol)
005131965.b3lyp_6-31g(d).inp

005131965.b3lyp_6-31g(d).qchem.inp (generated)

005131965.b3lyp_6-31g(d).gjf (generated)

005131965.b3lyp_6-31g(d).firefly.inp (generated)

005131965.b3lyp_6-31g(d).smash.inp (generated)

005131965.b3lyp_6-31g(d).nwchem.inp (generated) 005131965.b3lyp_6-31g(d).log.xz 005131965.td-b3lyp_6-31g+(d).inp 005131965.td-b3lyp_6-31g+(d).log.xz

005131965.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131965.td-b3lyp_6-31+g(d).gjf (generated)

005131965.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131965.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131965.mol 005131965.PUBCHEM 005131965.mol (via Jmol)
005131966.b3lyp_6-31g(d).inp

005131966.b3lyp_6-31g(d).qchem.inp (generated)

005131966.b3lyp_6-31g(d).gjf (generated)

005131966.b3lyp_6-31g(d).firefly.inp (generated)

005131966.b3lyp_6-31g(d).smash.inp (generated)

005131966.b3lyp_6-31g(d).nwchem.inp (generated) 005131966.b3lyp_6-31g(d).log.xz 005131966.td-b3lyp_6-31g+(d).inp 005131966.td-b3lyp_6-31g+(d).log.xz

005131966.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131966.td-b3lyp_6-31+g(d).gjf (generated)

005131966.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131966.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131966.mol 005131966.PUBCHEM 005131966.mol (via Jmol)
005131967.b3lyp_6-31g(d).inp

005131967.b3lyp_6-31g(d).qchem.inp (generated)

005131967.b3lyp_6-31g(d).gjf (generated)

005131967.b3lyp_6-31g(d).firefly.inp (generated)

005131967.b3lyp_6-31g(d).smash.inp (generated)

005131967.b3lyp_6-31g(d).nwchem.inp (generated) 005131967.b3lyp_6-31g(d).log.xz 005131967.td-b3lyp_6-31g+(d).inp 005131967.td-b3lyp_6-31g+(d).log.xz

005131967.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131967.td-b3lyp_6-31+g(d).gjf (generated)

005131967.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131967.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131967.mol 005131967.PUBCHEM 005131967.mol (via Jmol)
005131991.b3lyp_6-31g(d).inp

005131991.b3lyp_6-31g(d).qchem.inp (generated)

005131991.b3lyp_6-31g(d).gjf (generated)

005131991.b3lyp_6-31g(d).firefly.inp (generated)

005131991.b3lyp_6-31g(d).smash.inp (generated)

005131991.b3lyp_6-31g(d).nwchem.inp (generated) 005131991.b3lyp_6-31g(d).log.xz 005131991.td-b3lyp_6-31g+(d).inp 005131991.td-b3lyp_6-31g+(d).log.xz

005131991.td-b3lyp_6-31+g(d).qchem.inp (generated)

005131991.td-b3lyp_6-31+g(d).gjf (generated)

005131991.td-b3lyp_6-31+g(d).firefly.inp (generated)

005131991.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005131991.mol 005131991.PUBCHEM 005131991.mol (via Jmol)
005132078.b3lyp_6-31g(d).inp

005132078.b3lyp_6-31g(d).qchem.inp (generated)

005132078.b3lyp_6-31g(d).gjf (generated)

005132078.b3lyp_6-31g(d).firefly.inp (generated)

005132078.b3lyp_6-31g(d).smash.inp (generated)

005132078.b3lyp_6-31g(d).nwchem.inp (generated) 005132078.b3lyp_6-31g(d).log.xz 005132078.td-b3lyp_6-31g+(d).inp 005132078.td-b3lyp_6-31g+(d).log.xz

005132078.td-b3lyp_6-31+g(d).qchem.inp (generated)

005132078.td-b3lyp_6-31+g(d).gjf (generated)

005132078.td-b3lyp_6-31+g(d).firefly.inp (generated)

005132078.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005132078.mol 005132078.PUBCHEM 005132078.mol (via Jmol)
005132136.b3lyp_6-31g(d).inp

005132136.b3lyp_6-31g(d).qchem.inp (generated)

005132136.b3lyp_6-31g(d).gjf (generated)

005132136.b3lyp_6-31g(d).firefly.inp (generated)

005132136.b3lyp_6-31g(d).smash.inp (generated)

005132136.b3lyp_6-31g(d).nwchem.inp (generated) 005132136.b3lyp_6-31g(d).log.xz 005132136.td-b3lyp_6-31g+(d).inp 005132136.td-b3lyp_6-31g+(d).log.xz

005132136.td-b3lyp_6-31+g(d).qchem.inp (generated)

005132136.td-b3lyp_6-31+g(d).gjf (generated)

005132136.td-b3lyp_6-31+g(d).firefly.inp (generated)

005132136.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005132136.mol 005132136.PUBCHEM 005132136.mol (via Jmol)
005132158.b3lyp_6-31g(d).inp

005132158.b3lyp_6-31g(d).qchem.inp (generated)

005132158.b3lyp_6-31g(d).gjf (generated)

005132158.b3lyp_6-31g(d).firefly.inp (generated)

005132158.b3lyp_6-31g(d).smash.inp (generated)

005132158.b3lyp_6-31g(d).nwchem.inp (generated) 005132158.b3lyp_6-31g(d).log.xz 005132158.td-b3lyp_6-31g+(d).inp 005132158.td-b3lyp_6-31g+(d).log.xz

005132158.td-b3lyp_6-31+g(d).qchem.inp (generated)

005132158.td-b3lyp_6-31+g(d).gjf (generated)

005132158.td-b3lyp_6-31+g(d).firefly.inp (generated)

005132158.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005132158.mol 005132158.PUBCHEM 005132158.mol (via Jmol)
005132354.b3lyp_6-31g(d).inp

005132354.b3lyp_6-31g(d).qchem.inp (generated)

005132354.b3lyp_6-31g(d).gjf (generated)

005132354.b3lyp_6-31g(d).firefly.inp (generated)

005132354.b3lyp_6-31g(d).smash.inp (generated)

005132354.b3lyp_6-31g(d).nwchem.inp (generated) 005132354.b3lyp_6-31g(d).log.xz 005132354.td-b3lyp_6-31g+(d).inp 005132354.td-b3lyp_6-31g+(d).log.xz

005132354.td-b3lyp_6-31+g(d).qchem.inp (generated)

005132354.td-b3lyp_6-31+g(d).gjf (generated)

005132354.td-b3lyp_6-31+g(d).firefly.inp (generated)

005132354.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005132354.mol 005132354.PUBCHEM 005132354.mol (via Jmol)
005132440.b3lyp_6-31g(d).inp

005132440.b3lyp_6-31g(d).qchem.inp (generated)

005132440.b3lyp_6-31g(d).gjf (generated)

005132440.b3lyp_6-31g(d).firefly.inp (generated)

005132440.b3lyp_6-31g(d).smash.inp (generated)

005132440.b3lyp_6-31g(d).nwchem.inp (generated) 005132440.b3lyp_6-31g(d).log.xz 005132440.mol 005132440.PUBCHEM 005132440.mol (via Jmol)
005132543.b3lyp_6-31g(d).inp

005132543.b3lyp_6-31g(d).qchem.inp (generated)

005132543.b3lyp_6-31g(d).gjf (generated)

005132543.b3lyp_6-31g(d).firefly.inp (generated)

005132543.b3lyp_6-31g(d).smash.inp (generated)

005132543.b3lyp_6-31g(d).nwchem.inp (generated) 005132543.b3lyp_6-31g(d).log.xz 005132543.td-b3lyp_6-31g+(d).inp 005132543.td-b3lyp_6-31g+(d).log.xz

005132543.td-b3lyp_6-31+g(d).qchem.inp (generated)

005132543.td-b3lyp_6-31+g(d).gjf (generated)

005132543.td-b3lyp_6-31+g(d).firefly.inp (generated)

005132543.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005132543.mol 005132543.PUBCHEM 005132543.mol (via Jmol)
005132571.b3lyp_6-31g(d).inp

005132571.b3lyp_6-31g(d).qchem.inp (generated)

005132571.b3lyp_6-31g(d).gjf (generated)

005132571.b3lyp_6-31g(d).firefly.inp (generated)

005132571.b3lyp_6-31g(d).smash.inp (generated)

005132571.b3lyp_6-31g(d).nwchem.inp (generated) 005132571.b3lyp_6-31g(d).log.xz 005132571.mol 005132571.PUBCHEM 005132571.mol (via Jmol)
005132634.b3lyp_6-31g(d).inp

005132634.b3lyp_6-31g(d).qchem.inp (generated)

005132634.b3lyp_6-31g(d).gjf (generated)

005132634.b3lyp_6-31g(d).firefly.inp (generated)

005132634.b3lyp_6-31g(d).smash.inp (generated)

005132634.b3lyp_6-31g(d).nwchem.inp (generated) 005132634.b3lyp_6-31g(d).log.xz 005132634.td-b3lyp_6-31g+(d).inp 005132634.td-b3lyp_6-31g+(d).log.xz

005132634.td-b3lyp_6-31+g(d).qchem.inp (generated)

005132634.td-b3lyp_6-31+g(d).gjf (generated)

005132634.td-b3lyp_6-31+g(d).firefly.inp (generated)

005132634.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005132634.mol 005132634.PUBCHEM 005132634.mol (via Jmol)
005132695.b3lyp_6-31g(d).inp

005132695.b3lyp_6-31g(d).qchem.inp (generated)

005132695.b3lyp_6-31g(d).gjf (generated)

005132695.b3lyp_6-31g(d).firefly.inp (generated)

005132695.b3lyp_6-31g(d).smash.inp (generated)

005132695.b3lyp_6-31g(d).nwchem.inp (generated) 005132695.b3lyp_6-31g(d).log.xz 005132695.td-b3lyp_6-31g+(d).inp 005132695.td-b3lyp_6-31g+(d).log.xz

005132695.td-b3lyp_6-31+g(d).qchem.inp (generated)

005132695.td-b3lyp_6-31+g(d).gjf (generated)

005132695.td-b3lyp_6-31+g(d).firefly.inp (generated)

005132695.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005132695.mol 005132695.PUBCHEM 005132695.mol (via Jmol)
005132792.b3lyp_6-31g(d).inp

005132792.b3lyp_6-31g(d).qchem.inp (generated)

005132792.b3lyp_6-31g(d).gjf (generated)

005132792.b3lyp_6-31g(d).firefly.inp (generated)

005132792.b3lyp_6-31g(d).smash.inp (generated)

005132792.b3lyp_6-31g(d).nwchem.inp (generated) 005132792.b3lyp_6-31g(d).log.xz 005132792.td-b3lyp_6-31g+(d).inp 005132792.td-b3lyp_6-31g+(d).log.xz

005132792.td-b3lyp_6-31+g(d).qchem.inp (generated)

005132792.td-b3lyp_6-31+g(d).gjf (generated)

005132792.td-b3lyp_6-31+g(d).firefly.inp (generated)

005132792.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005132792.mol 005132792.PUBCHEM 005132792.mol (via Jmol)
005132845.b3lyp_6-31g(d).inp

005132845.b3lyp_6-31g(d).qchem.inp (generated)

005132845.b3lyp_6-31g(d).gjf (generated)

005132845.b3lyp_6-31g(d).firefly.inp (generated)

005132845.b3lyp_6-31g(d).smash.inp (generated)

005132845.b3lyp_6-31g(d).nwchem.inp (generated) 005132845.b3lyp_6-31g(d).log.xz 005132845.td-b3lyp_6-31g+(d).inp 005132845.td-b3lyp_6-31g+(d).log.xz

005132845.td-b3lyp_6-31+g(d).qchem.inp (generated)

005132845.td-b3lyp_6-31+g(d).gjf (generated)

005132845.td-b3lyp_6-31+g(d).firefly.inp (generated)

005132845.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005132845.mol 005132845.PUBCHEM 005132845.mol (via Jmol)
005132848.b3lyp_6-31g(d).inp

005132848.b3lyp_6-31g(d).qchem.inp (generated)

005132848.b3lyp_6-31g(d).gjf (generated)

005132848.b3lyp_6-31g(d).firefly.inp (generated)

005132848.b3lyp_6-31g(d).smash.inp (generated)

005132848.b3lyp_6-31g(d).nwchem.inp (generated) 005132848.b3lyp_6-31g(d).log.xz 005132848.td-b3lyp_6-31g+(d).inp 005132848.td-b3lyp_6-31g+(d).log.xz

005132848.td-b3lyp_6-31+g(d).qchem.inp (generated)

005132848.td-b3lyp_6-31+g(d).gjf (generated)

005132848.td-b3lyp_6-31+g(d).firefly.inp (generated)

005132848.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005132848.mol 005132848.PUBCHEM 005132848.mol (via Jmol)
005132913.b3lyp_6-31g(d).inp

005132913.b3lyp_6-31g(d).qchem.inp (generated)

005132913.b3lyp_6-31g(d).gjf (generated)

005132913.b3lyp_6-31g(d).firefly.inp (generated)

005132913.b3lyp_6-31g(d).smash.inp (generated)

005132913.b3lyp_6-31g(d).nwchem.inp (generated) 005132913.b3lyp_6-31g(d).log.xz 005132913.td-b3lyp_6-31g+(d).inp 005132913.td-b3lyp_6-31g+(d).log.xz

005132913.td-b3lyp_6-31+g(d).qchem.inp (generated)

005132913.td-b3lyp_6-31+g(d).gjf (generated)

005132913.td-b3lyp_6-31+g(d).firefly.inp (generated)

005132913.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005132913.mol 005132913.PUBCHEM 005132913.mol (via Jmol)
005132915.b3lyp_6-31g(d).inp

005132915.b3lyp_6-31g(d).qchem.inp (generated)

005132915.b3lyp_6-31g(d).gjf (generated)

005132915.b3lyp_6-31g(d).firefly.inp (generated)

005132915.b3lyp_6-31g(d).smash.inp (generated)

005132915.b3lyp_6-31g(d).nwchem.inp (generated) 005132915.b3lyp_6-31g(d).log.xz 005132915.td-b3lyp_6-31g+(d).inp 005132915.td-b3lyp_6-31g+(d).log.xz

005132915.td-b3lyp_6-31+g(d).qchem.inp (generated)

005132915.td-b3lyp_6-31+g(d).gjf (generated)

005132915.td-b3lyp_6-31+g(d).firefly.inp (generated)

005132915.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005132915.mol 005132915.PUBCHEM 005132915.mol (via Jmol)
005132916.b3lyp_6-31g(d).inp

005132916.b3lyp_6-31g(d).qchem.inp (generated)

005132916.b3lyp_6-31g(d).gjf (generated)

005132916.b3lyp_6-31g(d).firefly.inp (generated)

005132916.b3lyp_6-31g(d).smash.inp (generated)

005132916.b3lyp_6-31g(d).nwchem.inp (generated) 005132916.b3lyp_6-31g(d).log.xz 005132916.td-b3lyp_6-31g+(d).inp 005132916.td-b3lyp_6-31g+(d).log.xz

005132916.td-b3lyp_6-31+g(d).qchem.inp (generated)

005132916.td-b3lyp_6-31+g(d).gjf (generated)

005132916.td-b3lyp_6-31+g(d).firefly.inp (generated)

005132916.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005132916.mol 005132916.PUBCHEM 005132916.mol (via Jmol)
005132949.b3lyp_6-31g(d).inp

005132949.b3lyp_6-31g(d).qchem.inp (generated)

005132949.b3lyp_6-31g(d).gjf (generated)

005132949.b3lyp_6-31g(d).firefly.inp (generated)

005132949.b3lyp_6-31g(d).smash.inp (generated)

005132949.b3lyp_6-31g(d).nwchem.inp (generated) 005132949.b3lyp_6-31g(d).log.xz 005132949.td-b3lyp_6-31g+(d).inp 005132949.td-b3lyp_6-31g+(d).log.xz

005132949.td-b3lyp_6-31+g(d).qchem.inp (generated)

005132949.td-b3lyp_6-31+g(d).gjf (generated)

005132949.td-b3lyp_6-31+g(d).firefly.inp (generated)

005132949.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005132949.mol 005132949.PUBCHEM 005132949.mol (via Jmol)
005132951.b3lyp_6-31g(d).inp

005132951.b3lyp_6-31g(d).qchem.inp (generated)

005132951.b3lyp_6-31g(d).gjf (generated)

005132951.b3lyp_6-31g(d).firefly.inp (generated)

005132951.b3lyp_6-31g(d).smash.inp (generated)

005132951.b3lyp_6-31g(d).nwchem.inp (generated) 005132951.b3lyp_6-31g(d).log.xz 005132951.td-b3lyp_6-31g+(d).inp 005132951.td-b3lyp_6-31g+(d).log.xz

005132951.td-b3lyp_6-31+g(d).qchem.inp (generated)

005132951.td-b3lyp_6-31+g(d).gjf (generated)

005132951.td-b3lyp_6-31+g(d).firefly.inp (generated)

005132951.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005132951.mol 005132951.PUBCHEM 005132951.mol (via Jmol)
005132982.b3lyp_6-31g(d).inp

005132982.b3lyp_6-31g(d).qchem.inp (generated)

005132982.b3lyp_6-31g(d).gjf (generated)

005132982.b3lyp_6-31g(d).firefly.inp (generated)

005132982.b3lyp_6-31g(d).smash.inp (generated)

005132982.b3lyp_6-31g(d).nwchem.inp (generated) 005132982.b3lyp_6-31g(d).log.xz 005132982.td-b3lyp_6-31g+(d).inp 005132982.td-b3lyp_6-31g+(d).log.xz

005132982.td-b3lyp_6-31+g(d).qchem.inp (generated)

005132982.td-b3lyp_6-31+g(d).gjf (generated)

005132982.td-b3lyp_6-31+g(d).firefly.inp (generated)

005132982.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005132982.mol 005132982.PUBCHEM 005132982.mol (via Jmol)
005132994.b3lyp_6-31g(d).inp

005132994.b3lyp_6-31g(d).qchem.inp (generated)

005132994.b3lyp_6-31g(d).gjf (generated)

005132994.b3lyp_6-31g(d).firefly.inp (generated)

005132994.b3lyp_6-31g(d).smash.inp (generated)

005132994.b3lyp_6-31g(d).nwchem.inp (generated) 005132994.b3lyp_6-31g(d).log.xz 005132994.td-b3lyp_6-31g+(d).inp 005132994.td-b3lyp_6-31g+(d).log.xz

005132994.td-b3lyp_6-31+g(d).qchem.inp (generated)

005132994.td-b3lyp_6-31+g(d).gjf (generated)

005132994.td-b3lyp_6-31+g(d).firefly.inp (generated)

005132994.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005132994.mol 005132994.PUBCHEM 005132994.mol (via Jmol)
005132996.b3lyp_6-31g(d).inp

005132996.b3lyp_6-31g(d).qchem.inp (generated)

005132996.b3lyp_6-31g(d).gjf (generated)

005132996.b3lyp_6-31g(d).firefly.inp (generated)

005132996.b3lyp_6-31g(d).smash.inp (generated)

005132996.b3lyp_6-31g(d).nwchem.inp (generated) 005132996.b3lyp_6-31g(d).log.xz 005132996.td-b3lyp_6-31g+(d).inp 005132996.td-b3lyp_6-31g+(d).log.xz

005132996.td-b3lyp_6-31+g(d).qchem.inp (generated)

005132996.td-b3lyp_6-31+g(d).gjf (generated)

005132996.td-b3lyp_6-31+g(d).firefly.inp (generated)

005132996.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005132996.mol 005132996.PUBCHEM 005132996.mol (via Jmol)
005133006.b3lyp_6-31g(d).inp

005133006.b3lyp_6-31g(d).qchem.inp (generated)

005133006.b3lyp_6-31g(d).gjf (generated)

005133006.b3lyp_6-31g(d).firefly.inp (generated)

005133006.b3lyp_6-31g(d).smash.inp (generated)

005133006.b3lyp_6-31g(d).nwchem.inp (generated) 005133006.b3lyp_6-31g(d).log.xz 005133006.td-b3lyp_6-31g+(d).inp 005133006.td-b3lyp_6-31g+(d).log.xz

005133006.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133006.td-b3lyp_6-31+g(d).gjf (generated)

005133006.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133006.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133006.mol 005133006.PUBCHEM 005133006.mol (via Jmol)
005133017.b3lyp_6-31g(d).inp

005133017.b3lyp_6-31g(d).qchem.inp (generated)

005133017.b3lyp_6-31g(d).gjf (generated)

005133017.b3lyp_6-31g(d).firefly.inp (generated)

005133017.b3lyp_6-31g(d).smash.inp (generated)

005133017.b3lyp_6-31g(d).nwchem.inp (generated) 005133017.b3lyp_6-31g(d).log.xz 005133017.td-b3lyp_6-31g+(d).inp 005133017.td-b3lyp_6-31g+(d).log.xz

005133017.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133017.td-b3lyp_6-31+g(d).gjf (generated)

005133017.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133017.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133017.mol 005133017.PUBCHEM 005133017.mol (via Jmol)
005133018.b3lyp_6-31g(d).inp

005133018.b3lyp_6-31g(d).qchem.inp (generated)

005133018.b3lyp_6-31g(d).gjf (generated)

005133018.b3lyp_6-31g(d).firefly.inp (generated)

005133018.b3lyp_6-31g(d).smash.inp (generated)

005133018.b3lyp_6-31g(d).nwchem.inp (generated) 005133018.b3lyp_6-31g(d).log.xz 005133018.td-b3lyp_6-31g+(d).inp 005133018.td-b3lyp_6-31g+(d).log.xz

005133018.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133018.td-b3lyp_6-31+g(d).gjf (generated)

005133018.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133018.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133018.mol 005133018.PUBCHEM 005133018.mol (via Jmol)
005133022.b3lyp_6-31g(d).inp

005133022.b3lyp_6-31g(d).qchem.inp (generated)

005133022.b3lyp_6-31g(d).gjf (generated)

005133022.b3lyp_6-31g(d).firefly.inp (generated)

005133022.b3lyp_6-31g(d).smash.inp (generated)

005133022.b3lyp_6-31g(d).nwchem.inp (generated) 005133022.b3lyp_6-31g(d).log.xz 005133022.td-b3lyp_6-31g+(d).inp 005133022.td-b3lyp_6-31g+(d).log.xz

005133022.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133022.td-b3lyp_6-31+g(d).gjf (generated)

005133022.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133022.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133022.mol 005133022.PUBCHEM 005133022.mol (via Jmol)
005133139.b3lyp_6-31g(d).inp

005133139.b3lyp_6-31g(d).qchem.inp (generated)

005133139.b3lyp_6-31g(d).gjf (generated)

005133139.b3lyp_6-31g(d).firefly.inp (generated)

005133139.b3lyp_6-31g(d).smash.inp (generated)

005133139.b3lyp_6-31g(d).nwchem.inp (generated) 005133139.b3lyp_6-31g(d).log.xz 005133139.td-b3lyp_6-31g+(d).inp 005133139.td-b3lyp_6-31g+(d).log.xz

005133139.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133139.td-b3lyp_6-31+g(d).gjf (generated)

005133139.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133139.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133139.mol 005133139.PUBCHEM 005133139.mol (via Jmol)
005133163.b3lyp_6-31g(d).inp

005133163.b3lyp_6-31g(d).qchem.inp (generated)

005133163.b3lyp_6-31g(d).gjf (generated)

005133163.b3lyp_6-31g(d).firefly.inp (generated)

005133163.b3lyp_6-31g(d).smash.inp (generated)

005133163.b3lyp_6-31g(d).nwchem.inp (generated) 005133163.b3lyp_6-31g(d).log.xz 005133163.td-b3lyp_6-31g+(d).inp 005133163.td-b3lyp_6-31g+(d).log.xz

005133163.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133163.td-b3lyp_6-31+g(d).gjf (generated)

005133163.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133163.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133163.mol 005133163.PUBCHEM 005133163.mol (via Jmol)
005133177.b3lyp_6-31g(d).inp

005133177.b3lyp_6-31g(d).qchem.inp (generated)

005133177.b3lyp_6-31g(d).gjf (generated)

005133177.b3lyp_6-31g(d).firefly.inp (generated)

005133177.b3lyp_6-31g(d).smash.inp (generated)

005133177.b3lyp_6-31g(d).nwchem.inp (generated) 005133177.b3lyp_6-31g(d).log.xz 005133177.mol 005133177.PUBCHEM 005133177.mol (via Jmol)
005133244.b3lyp_6-31g(d).inp

005133244.b3lyp_6-31g(d).qchem.inp (generated)

005133244.b3lyp_6-31g(d).gjf (generated)

005133244.b3lyp_6-31g(d).firefly.inp (generated)

005133244.b3lyp_6-31g(d).smash.inp (generated)

005133244.b3lyp_6-31g(d).nwchem.inp (generated) 005133244.b3lyp_6-31g(d).log.xz 005133244.td-b3lyp_6-31g+(d).inp 005133244.td-b3lyp_6-31g+(d).log.xz

005133244.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133244.td-b3lyp_6-31+g(d).gjf (generated)

005133244.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133244.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133244.mol 005133244.PUBCHEM 005133244.mol (via Jmol)
005133248.b3lyp_6-31g(d).inp

005133248.b3lyp_6-31g(d).qchem.inp (generated)

005133248.b3lyp_6-31g(d).gjf (generated)

005133248.b3lyp_6-31g(d).firefly.inp (generated)

005133248.b3lyp_6-31g(d).smash.inp (generated)

005133248.b3lyp_6-31g(d).nwchem.inp (generated) 005133248.b3lyp_6-31g(d).log.xz 005133248.mol 005133248.PUBCHEM 005133248.mol (via Jmol)
005133249.b3lyp_6-31g(d).inp

005133249.b3lyp_6-31g(d).qchem.inp (generated)

005133249.b3lyp_6-31g(d).gjf (generated)

005133249.b3lyp_6-31g(d).firefly.inp (generated)

005133249.b3lyp_6-31g(d).smash.inp (generated)

005133249.b3lyp_6-31g(d).nwchem.inp (generated) 005133249.b3lyp_6-31g(d).log.xz 005133249.td-b3lyp_6-31g+(d).inp 005133249.td-b3lyp_6-31g+(d).log.xz

005133249.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133249.td-b3lyp_6-31+g(d).gjf (generated)

005133249.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133249.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133249.mol 005133249.PUBCHEM 005133249.mol (via Jmol)
005133347.b3lyp_6-31g(d).inp

005133347.b3lyp_6-31g(d).qchem.inp (generated)

005133347.b3lyp_6-31g(d).gjf (generated)

005133347.b3lyp_6-31g(d).firefly.inp (generated)

005133347.b3lyp_6-31g(d).smash.inp (generated)

005133347.b3lyp_6-31g(d).nwchem.inp (generated) 005133347.b3lyp_6-31g(d).log.xz 005133347.td-b3lyp_6-31g+(d).inp 005133347.td-b3lyp_6-31g+(d).log.xz

005133347.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133347.td-b3lyp_6-31+g(d).gjf (generated)

005133347.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133347.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133347.mol 005133347.PUBCHEM 005133347.mol (via Jmol)
005133372.b3lyp_6-31g(d).inp

005133372.b3lyp_6-31g(d).qchem.inp (generated)

005133372.b3lyp_6-31g(d).gjf (generated)

005133372.b3lyp_6-31g(d).firefly.inp (generated)

005133372.b3lyp_6-31g(d).smash.inp (generated)

005133372.b3lyp_6-31g(d).nwchem.inp (generated) 005133372.b3lyp_6-31g(d).log.xz 005133372.mol 005133372.PUBCHEM 005133372.mol (via Jmol)
005133468.b3lyp_6-31g(d).inp

005133468.b3lyp_6-31g(d).qchem.inp (generated)

005133468.b3lyp_6-31g(d).gjf (generated)

005133468.b3lyp_6-31g(d).firefly.inp (generated)

005133468.b3lyp_6-31g(d).smash.inp (generated)

005133468.b3lyp_6-31g(d).nwchem.inp (generated) 005133468.b3lyp_6-31g(d).log.xz 005133468.td-b3lyp_6-31g+(d).inp 005133468.td-b3lyp_6-31g+(d).log.xz

005133468.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133468.td-b3lyp_6-31+g(d).gjf (generated)

005133468.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133468.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133468.mol 005133468.PUBCHEM 005133468.mol (via Jmol)
005133472.b3lyp_6-31g(d).inp

005133472.b3lyp_6-31g(d).qchem.inp (generated)

005133472.b3lyp_6-31g(d).gjf (generated)

005133472.b3lyp_6-31g(d).firefly.inp (generated)

005133472.b3lyp_6-31g(d).smash.inp (generated)

005133472.b3lyp_6-31g(d).nwchem.inp (generated) 005133472.b3lyp_6-31g(d).log.xz 005133472.td-b3lyp_6-31g+(d).inp 005133472.td-b3lyp_6-31g+(d).log.xz

005133472.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133472.td-b3lyp_6-31+g(d).gjf (generated)

005133472.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133472.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133472.mol 005133472.PUBCHEM 005133472.mol (via Jmol)
005133488.b3lyp_6-31g(d).inp

005133488.b3lyp_6-31g(d).qchem.inp (generated)

005133488.b3lyp_6-31g(d).gjf (generated)

005133488.b3lyp_6-31g(d).firefly.inp (generated)

005133488.b3lyp_6-31g(d).smash.inp (generated)

005133488.b3lyp_6-31g(d).nwchem.inp (generated) 005133488.b3lyp_6-31g(d).log.xz 005133488.td-b3lyp_6-31g+(d).inp 005133488.td-b3lyp_6-31g+(d).log.xz

005133488.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133488.td-b3lyp_6-31+g(d).gjf (generated)

005133488.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133488.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133488.mol 005133488.PUBCHEM 005133488.mol (via Jmol)
005133493.b3lyp_6-31g(d).inp

005133493.b3lyp_6-31g(d).qchem.inp (generated)

005133493.b3lyp_6-31g(d).gjf (generated)

005133493.b3lyp_6-31g(d).firefly.inp (generated)

005133493.b3lyp_6-31g(d).smash.inp (generated)

005133493.b3lyp_6-31g(d).nwchem.inp (generated) 005133493.b3lyp_6-31g(d).log.xz 005133493.td-b3lyp_6-31g+(d).inp 005133493.td-b3lyp_6-31g+(d).log.xz

005133493.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133493.td-b3lyp_6-31+g(d).gjf (generated)

005133493.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133493.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133493.mol 005133493.PUBCHEM 005133493.mol (via Jmol)
005133517.b3lyp_6-31g(d).inp

005133517.b3lyp_6-31g(d).qchem.inp (generated)

005133517.b3lyp_6-31g(d).gjf (generated)

005133517.b3lyp_6-31g(d).firefly.inp (generated)

005133517.b3lyp_6-31g(d).smash.inp (generated)

005133517.b3lyp_6-31g(d).nwchem.inp (generated) 005133517.b3lyp_6-31g(d).log.xz 005133517.td-b3lyp_6-31g+(d).inp 005133517.td-b3lyp_6-31g+(d).log.xz

005133517.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133517.td-b3lyp_6-31+g(d).gjf (generated)

005133517.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133517.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133517.mol 005133517.PUBCHEM 005133517.mol (via Jmol)
005133551.b3lyp_6-31g(d).inp

005133551.b3lyp_6-31g(d).qchem.inp (generated)

005133551.b3lyp_6-31g(d).gjf (generated)

005133551.b3lyp_6-31g(d).firefly.inp (generated)

005133551.b3lyp_6-31g(d).smash.inp (generated)

005133551.b3lyp_6-31g(d).nwchem.inp (generated) 005133551.b3lyp_6-31g(d).log.xz 005133551.td-b3lyp_6-31g+(d).inp 005133551.td-b3lyp_6-31g+(d).log.xz

005133551.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133551.td-b3lyp_6-31+g(d).gjf (generated)

005133551.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133551.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133551.mol 005133551.PUBCHEM 005133551.mol (via Jmol)
005133577.b3lyp_6-31g(d).inp

005133577.b3lyp_6-31g(d).qchem.inp (generated)

005133577.b3lyp_6-31g(d).gjf (generated)

005133577.b3lyp_6-31g(d).firefly.inp (generated)

005133577.b3lyp_6-31g(d).smash.inp (generated)

005133577.b3lyp_6-31g(d).nwchem.inp (generated) 005133577.b3lyp_6-31g(d).log.xz 005133577.td-b3lyp_6-31g+(d).inp 005133577.td-b3lyp_6-31g+(d).log.xz

005133577.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133577.td-b3lyp_6-31+g(d).gjf (generated)

005133577.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133577.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133577.mol 005133577.PUBCHEM 005133577.mol (via Jmol)
005133599.b3lyp_6-31g(d).inp

005133599.b3lyp_6-31g(d).qchem.inp (generated)

005133599.b3lyp_6-31g(d).gjf (generated)

005133599.b3lyp_6-31g(d).firefly.inp (generated)

005133599.b3lyp_6-31g(d).smash.inp (generated)

005133599.b3lyp_6-31g(d).nwchem.inp (generated) 005133599.b3lyp_6-31g(d).log.xz 005133599.td-b3lyp_6-31g+(d).inp 005133599.td-b3lyp_6-31g+(d).log.xz

005133599.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133599.td-b3lyp_6-31+g(d).gjf (generated)

005133599.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133599.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133599.mol 005133599.PUBCHEM 005133599.mol (via Jmol)
005133620.b3lyp_6-31g(d).inp

005133620.b3lyp_6-31g(d).qchem.inp (generated)

005133620.b3lyp_6-31g(d).gjf (generated)

005133620.b3lyp_6-31g(d).firefly.inp (generated)

005133620.b3lyp_6-31g(d).smash.inp (generated)

005133620.b3lyp_6-31g(d).nwchem.inp (generated) 005133620.b3lyp_6-31g(d).log.xz 005133620.td-b3lyp_6-31g+(d).inp 005133620.td-b3lyp_6-31g+(d).log.xz

005133620.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133620.td-b3lyp_6-31+g(d).gjf (generated)

005133620.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133620.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133620.mol 005133620.PUBCHEM 005133620.mol (via Jmol)
005133675.b3lyp_6-31g(d).inp

005133675.b3lyp_6-31g(d).qchem.inp (generated)

005133675.b3lyp_6-31g(d).gjf (generated)

005133675.b3lyp_6-31g(d).firefly.inp (generated)

005133675.b3lyp_6-31g(d).smash.inp (generated)

005133675.b3lyp_6-31g(d).nwchem.inp (generated) 005133675.b3lyp_6-31g(d).log.xz 005133675.mol 005133675.PUBCHEM 005133675.mol (via Jmol)
005133677.b3lyp_6-31g(d).inp

005133677.b3lyp_6-31g(d).qchem.inp (generated)

005133677.b3lyp_6-31g(d).gjf (generated)

005133677.b3lyp_6-31g(d).firefly.inp (generated)

005133677.b3lyp_6-31g(d).smash.inp (generated)

005133677.b3lyp_6-31g(d).nwchem.inp (generated) 005133677.b3lyp_6-31g(d).log.xz 005133677.td-b3lyp_6-31g+(d).inp 005133677.td-b3lyp_6-31g+(d).log.xz

005133677.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133677.td-b3lyp_6-31+g(d).gjf (generated)

005133677.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133677.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133677.mol 005133677.PUBCHEM 005133677.mol (via Jmol)
005133683.b3lyp_6-31g(d).inp

005133683.b3lyp_6-31g(d).qchem.inp (generated)

005133683.b3lyp_6-31g(d).gjf (generated)

005133683.b3lyp_6-31g(d).firefly.inp (generated)

005133683.b3lyp_6-31g(d).smash.inp (generated)

005133683.b3lyp_6-31g(d).nwchem.inp (generated) 005133683.b3lyp_6-31g(d).log.xz 005133683.td-b3lyp_6-31g+(d).inp 005133683.td-b3lyp_6-31g+(d).log.xz

005133683.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133683.td-b3lyp_6-31+g(d).gjf (generated)

005133683.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133683.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133683.mol 005133683.PUBCHEM 005133683.mol (via Jmol)
005133684.b3lyp_6-31g(d).inp

005133684.b3lyp_6-31g(d).qchem.inp (generated)

005133684.b3lyp_6-31g(d).gjf (generated)

005133684.b3lyp_6-31g(d).firefly.inp (generated)

005133684.b3lyp_6-31g(d).smash.inp (generated)

005133684.b3lyp_6-31g(d).nwchem.inp (generated) 005133684.b3lyp_6-31g(d).log.xz 005133684.td-b3lyp_6-31g+(d).inp 005133684.td-b3lyp_6-31g+(d).log.xz

005133684.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133684.td-b3lyp_6-31+g(d).gjf (generated)

005133684.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133684.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133684.mol 005133684.PUBCHEM 005133684.mol (via Jmol)
005133769.b3lyp_6-31g(d).inp

005133769.b3lyp_6-31g(d).qchem.inp (generated)

005133769.b3lyp_6-31g(d).gjf (generated)

005133769.b3lyp_6-31g(d).firefly.inp (generated)

005133769.b3lyp_6-31g(d).smash.inp (generated)

005133769.b3lyp_6-31g(d).nwchem.inp (generated) 005133769.b3lyp_6-31g(d).log.xz 005133769.mol 005133769.PUBCHEM 005133769.mol (via Jmol)
005133771.b3lyp_6-31g(d).inp

005133771.b3lyp_6-31g(d).qchem.inp (generated)

005133771.b3lyp_6-31g(d).gjf (generated)

005133771.b3lyp_6-31g(d).firefly.inp (generated)

005133771.b3lyp_6-31g(d).smash.inp (generated)

005133771.b3lyp_6-31g(d).nwchem.inp (generated) 005133771.b3lyp_6-31g(d).log.xz 005133771.td-b3lyp_6-31g+(d).inp 005133771.td-b3lyp_6-31g+(d).log.xz

005133771.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133771.td-b3lyp_6-31+g(d).gjf (generated)

005133771.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133771.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133771.mol 005133771.PUBCHEM 005133771.mol (via Jmol)
005133773.b3lyp_6-31g(d).inp

005133773.b3lyp_6-31g(d).qchem.inp (generated)

005133773.b3lyp_6-31g(d).gjf (generated)

005133773.b3lyp_6-31g(d).firefly.inp (generated)

005133773.b3lyp_6-31g(d).smash.inp (generated)

005133773.b3lyp_6-31g(d).nwchem.inp (generated) 005133773.b3lyp_6-31g(d).log.xz 005133773.td-b3lyp_6-31g+(d).inp 005133773.td-b3lyp_6-31g+(d).log.xz

005133773.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133773.td-b3lyp_6-31+g(d).gjf (generated)

005133773.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133773.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133773.mol 005133773.PUBCHEM 005133773.mol (via Jmol)
005133776.b3lyp_6-31g(d).inp

005133776.b3lyp_6-31g(d).qchem.inp (generated)

005133776.b3lyp_6-31g(d).gjf (generated)

005133776.b3lyp_6-31g(d).firefly.inp (generated)

005133776.b3lyp_6-31g(d).smash.inp (generated)

005133776.b3lyp_6-31g(d).nwchem.inp (generated) 005133776.b3lyp_6-31g(d).log.xz 005133776.td-b3lyp_6-31g+(d).inp 005133776.td-b3lyp_6-31g+(d).log.xz

005133776.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133776.td-b3lyp_6-31+g(d).gjf (generated)

005133776.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133776.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133776.mol 005133776.PUBCHEM 005133776.mol (via Jmol)
005133944.b3lyp_6-31g(d).inp

005133944.b3lyp_6-31g(d).qchem.inp (generated)

005133944.b3lyp_6-31g(d).gjf (generated)

005133944.b3lyp_6-31g(d).firefly.inp (generated)

005133944.b3lyp_6-31g(d).smash.inp (generated)

005133944.b3lyp_6-31g(d).nwchem.inp (generated) 005133944.b3lyp_6-31g(d).log.xz 005133944.td-b3lyp_6-31g+(d).inp 005133944.td-b3lyp_6-31g+(d).log.xz

005133944.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133944.td-b3lyp_6-31+g(d).gjf (generated)

005133944.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133944.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133944.mol 005133944.PUBCHEM 005133944.mol (via Jmol)
005133953.b3lyp_6-31g(d).inp

005133953.b3lyp_6-31g(d).qchem.inp (generated)

005133953.b3lyp_6-31g(d).gjf (generated)

005133953.b3lyp_6-31g(d).firefly.inp (generated)

005133953.b3lyp_6-31g(d).smash.inp (generated)

005133953.b3lyp_6-31g(d).nwchem.inp (generated) 005133953.b3lyp_6-31g(d).log.xz 005133953.td-b3lyp_6-31g+(d).inp 005133953.td-b3lyp_6-31g+(d).log.xz

005133953.td-b3lyp_6-31+g(d).qchem.inp (generated)

005133953.td-b3lyp_6-31+g(d).gjf (generated)

005133953.td-b3lyp_6-31+g(d).firefly.inp (generated)

005133953.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005133953.mol 005133953.PUBCHEM 005133953.mol (via Jmol)
005133992.b3lyp_6-31g(d).inp

005133992.b3lyp_6-31g(d).qchem.inp (generated)

005133992.b3lyp_6-31g(d).gjf (generated)

005133992.b3lyp_6-31g(d).firefly.inp (generated)

005133992.b3lyp_6-31g(d).smash.inp (generated)

005133992.b3lyp_6-31g(d).nwchem.inp (generated) 005133992.b3lyp_6-31g(d).log.xz 005133992.mol 005133992.PUBCHEM 005133992.mol (via Jmol)
005134098.b3lyp_6-31g(d).inp

005134098.b3lyp_6-31g(d).qchem.inp (generated)

005134098.b3lyp_6-31g(d).gjf (generated)

005134098.b3lyp_6-31g(d).firefly.inp (generated)

005134098.b3lyp_6-31g(d).smash.inp (generated)

005134098.b3lyp_6-31g(d).nwchem.inp (generated) 005134098.b3lyp_6-31g(d).log.xz 005134098.td-b3lyp_6-31g+(d).inp 005134098.td-b3lyp_6-31g+(d).log.xz

005134098.td-b3lyp_6-31+g(d).qchem.inp (generated)

005134098.td-b3lyp_6-31+g(d).gjf (generated)

005134098.td-b3lyp_6-31+g(d).firefly.inp (generated)

005134098.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005134098.mol 005134098.PUBCHEM 005134098.mol (via Jmol)
005134223.b3lyp_6-31g(d).inp

005134223.b3lyp_6-31g(d).qchem.inp (generated)

005134223.b3lyp_6-31g(d).gjf (generated)

005134223.b3lyp_6-31g(d).firefly.inp (generated)

005134223.b3lyp_6-31g(d).smash.inp (generated)

005134223.b3lyp_6-31g(d).nwchem.inp (generated) 005134223.b3lyp_6-31g(d).log.xz 005134223.td-b3lyp_6-31g+(d).inp 005134223.td-b3lyp_6-31g+(d).log.xz

005134223.td-b3lyp_6-31+g(d).qchem.inp (generated)

005134223.td-b3lyp_6-31+g(d).gjf (generated)

005134223.td-b3lyp_6-31+g(d).firefly.inp (generated)

005134223.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005134223.mol 005134223.PUBCHEM 005134223.mol (via Jmol)
005134237.b3lyp_6-31g(d).inp

005134237.b3lyp_6-31g(d).qchem.inp (generated)

005134237.b3lyp_6-31g(d).gjf (generated)

005134237.b3lyp_6-31g(d).firefly.inp (generated)

005134237.b3lyp_6-31g(d).smash.inp (generated)

005134237.b3lyp_6-31g(d).nwchem.inp (generated) 005134237.b3lyp_6-31g(d).log.xz 005134237.td-b3lyp_6-31g+(d).inp 005134237.td-b3lyp_6-31g+(d).log.xz

005134237.td-b3lyp_6-31+g(d).qchem.inp (generated)

005134237.td-b3lyp_6-31+g(d).gjf (generated)

005134237.td-b3lyp_6-31+g(d).firefly.inp (generated)

005134237.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005134237.mol 005134237.PUBCHEM 005134237.mol (via Jmol)
005134238.b3lyp_6-31g(d).inp

005134238.b3lyp_6-31g(d).qchem.inp (generated)

005134238.b3lyp_6-31g(d).gjf (generated)

005134238.b3lyp_6-31g(d).firefly.inp (generated)

005134238.b3lyp_6-31g(d).smash.inp (generated)

005134238.b3lyp_6-31g(d).nwchem.inp (generated) 005134238.b3lyp_6-31g(d).log.xz 005134238.td-b3lyp_6-31g+(d).inp 005134238.td-b3lyp_6-31g+(d).log.xz

005134238.td-b3lyp_6-31+g(d).qchem.inp (generated)

005134238.td-b3lyp_6-31+g(d).gjf (generated)

005134238.td-b3lyp_6-31+g(d).firefly.inp (generated)

005134238.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005134238.mol 005134238.PUBCHEM 005134238.mol (via Jmol)
005134239.b3lyp_6-31g(d).inp

005134239.b3lyp_6-31g(d).qchem.inp (generated)

005134239.b3lyp_6-31g(d).gjf (generated)

005134239.b3lyp_6-31g(d).firefly.inp (generated)

005134239.b3lyp_6-31g(d).smash.inp (generated)

005134239.b3lyp_6-31g(d).nwchem.inp (generated) 005134239.b3lyp_6-31g(d).log.xz 005134239.mol 005134239.PUBCHEM 005134239.mol (via Jmol)
005134289.b3lyp_6-31g(d).inp

005134289.b3lyp_6-31g(d).qchem.inp (generated)

005134289.b3lyp_6-31g(d).gjf (generated)

005134289.b3lyp_6-31g(d).firefly.inp (generated)

005134289.b3lyp_6-31g(d).smash.inp (generated)

005134289.b3lyp_6-31g(d).nwchem.inp (generated) 005134289.b3lyp_6-31g(d).log.xz 005134289.mol 005134289.PUBCHEM 005134289.mol (via Jmol)
005134315.b3lyp_6-31g(d).inp

005134315.b3lyp_6-31g(d).qchem.inp (generated)

005134315.b3lyp_6-31g(d).gjf (generated)

005134315.b3lyp_6-31g(d).firefly.inp (generated)

005134315.b3lyp_6-31g(d).smash.inp (generated)

005134315.b3lyp_6-31g(d).nwchem.inp (generated) 005134315.b3lyp_6-31g(d).log.xz 005134315.td-b3lyp_6-31g+(d).inp 005134315.td-b3lyp_6-31g+(d).log.xz

005134315.td-b3lyp_6-31+g(d).qchem.inp (generated)

005134315.td-b3lyp_6-31+g(d).gjf (generated)

005134315.td-b3lyp_6-31+g(d).firefly.inp (generated)

005134315.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005134315.mol 005134315.PUBCHEM 005134315.mol (via Jmol)
005134316.b3lyp_6-31g(d).inp

005134316.b3lyp_6-31g(d).qchem.inp (generated)

005134316.b3lyp_6-31g(d).gjf (generated)

005134316.b3lyp_6-31g(d).firefly.inp (generated)

005134316.b3lyp_6-31g(d).smash.inp (generated)

005134316.b3lyp_6-31g(d).nwchem.inp (generated) 005134316.b3lyp_6-31g(d).log.xz 005134316.td-b3lyp_6-31g+(d).inp 005134316.td-b3lyp_6-31g+(d).log.xz

005134316.td-b3lyp_6-31+g(d).qchem.inp (generated)

005134316.td-b3lyp_6-31+g(d).gjf (generated)

005134316.td-b3lyp_6-31+g(d).firefly.inp (generated)

005134316.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005134316.mol 005134316.PUBCHEM 005134316.mol (via Jmol)
005134354.b3lyp_6-31g(d).inp

005134354.b3lyp_6-31g(d).qchem.inp (generated)

005134354.b3lyp_6-31g(d).gjf (generated)

005134354.b3lyp_6-31g(d).firefly.inp (generated)

005134354.b3lyp_6-31g(d).smash.inp (generated)

005134354.b3lyp_6-31g(d).nwchem.inp (generated) 005134354.b3lyp_6-31g(d).log.xz 005134354.td-b3lyp_6-31g+(d).inp 005134354.td-b3lyp_6-31g+(d).log.xz

005134354.td-b3lyp_6-31+g(d).qchem.inp (generated)

005134354.td-b3lyp_6-31+g(d).gjf (generated)

005134354.td-b3lyp_6-31+g(d).firefly.inp (generated)

005134354.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005134354.mol 005134354.PUBCHEM 005134354.mol (via Jmol)
005134355.b3lyp_6-31g(d).inp

005134355.b3lyp_6-31g(d).qchem.inp (generated)

005134355.b3lyp_6-31g(d).gjf (generated)

005134355.b3lyp_6-31g(d).firefly.inp (generated)

005134355.b3lyp_6-31g(d).smash.inp (generated)

005134355.b3lyp_6-31g(d).nwchem.inp (generated) 005134355.b3lyp_6-31g(d).log.xz 005134355.td-b3lyp_6-31g+(d).inp 005134355.td-b3lyp_6-31g+(d).log.xz

005134355.td-b3lyp_6-31+g(d).qchem.inp (generated)

005134355.td-b3lyp_6-31+g(d).gjf (generated)

005134355.td-b3lyp_6-31+g(d).firefly.inp (generated)

005134355.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005134355.mol 005134355.PUBCHEM 005134355.mol (via Jmol)
005134404.b3lyp_6-31g(d).inp

005134404.b3lyp_6-31g(d).qchem.inp (generated)

005134404.b3lyp_6-31g(d).gjf (generated)

005134404.b3lyp_6-31g(d).firefly.inp (generated)

005134404.b3lyp_6-31g(d).smash.inp (generated)

005134404.b3lyp_6-31g(d).nwchem.inp (generated) 005134404.b3lyp_6-31g(d).log.xz 005134404.td-b3lyp_6-31g+(d).inp 005134404.td-b3lyp_6-31g+(d).log.xz

005134404.td-b3lyp_6-31+g(d).qchem.inp (generated)

005134404.td-b3lyp_6-31+g(d).gjf (generated)

005134404.td-b3lyp_6-31+g(d).firefly.inp (generated)

005134404.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005134404.mol 005134404.PUBCHEM 005134404.mol (via Jmol)
005134496.b3lyp_6-31g(d).inp

005134496.b3lyp_6-31g(d).qchem.inp (generated)

005134496.b3lyp_6-31g(d).gjf (generated)

005134496.b3lyp_6-31g(d).firefly.inp (generated)

005134496.b3lyp_6-31g(d).smash.inp (generated)

005134496.b3lyp_6-31g(d).nwchem.inp (generated) 005134496.b3lyp_6-31g(d).log.xz 005134496.mol 005134496.PUBCHEM 005134496.mol (via Jmol)
005134557.b3lyp_6-31g(d).inp

005134557.b3lyp_6-31g(d).qchem.inp (generated)

005134557.b3lyp_6-31g(d).gjf (generated)

005134557.b3lyp_6-31g(d).firefly.inp (generated)

005134557.b3lyp_6-31g(d).smash.inp (generated)

005134557.b3lyp_6-31g(d).nwchem.inp (generated) 005134557.b3lyp_6-31g(d).log.xz 005134557.mol 005134557.PUBCHEM 005134557.mol (via Jmol)
005134602.b3lyp_6-31g(d).inp

005134602.b3lyp_6-31g(d).qchem.inp (generated)

005134602.b3lyp_6-31g(d).gjf (generated)

005134602.b3lyp_6-31g(d).firefly.inp (generated)

005134602.b3lyp_6-31g(d).smash.inp (generated)

005134602.b3lyp_6-31g(d).nwchem.inp (generated) 005134602.b3lyp_6-31g(d).log.xz 005134602.td-b3lyp_6-31g+(d).inp 005134602.td-b3lyp_6-31g+(d).log.xz

005134602.td-b3lyp_6-31+g(d).qchem.inp (generated)

005134602.td-b3lyp_6-31+g(d).gjf (generated)

005134602.td-b3lyp_6-31+g(d).firefly.inp (generated)

005134602.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005134602.mol 005134602.PUBCHEM 005134602.mol (via Jmol)
005134626.b3lyp_6-31g(d).inp

005134626.b3lyp_6-31g(d).qchem.inp (generated)

005134626.b3lyp_6-31g(d).gjf (generated)

005134626.b3lyp_6-31g(d).firefly.inp (generated)

005134626.b3lyp_6-31g(d).smash.inp (generated)

005134626.b3lyp_6-31g(d).nwchem.inp (generated) 005134626.b3lyp_6-31g(d).log.xz 005134626.td-b3lyp_6-31g+(d).inp 005134626.td-b3lyp_6-31g+(d).log.xz

005134626.td-b3lyp_6-31+g(d).qchem.inp (generated)

005134626.td-b3lyp_6-31+g(d).gjf (generated)

005134626.td-b3lyp_6-31+g(d).firefly.inp (generated)

005134626.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005134626.mol 005134626.PUBCHEM 005134626.mol (via Jmol)
005134631.b3lyp_6-31g(d).inp

005134631.b3lyp_6-31g(d).qchem.inp (generated)

005134631.b3lyp_6-31g(d).gjf (generated)

005134631.b3lyp_6-31g(d).firefly.inp (generated)

005134631.b3lyp_6-31g(d).smash.inp (generated)

005134631.b3lyp_6-31g(d).nwchem.inp (generated) 005134631.b3lyp_6-31g(d).log.xz 005134631.td-b3lyp_6-31g+(d).inp 005134631.td-b3lyp_6-31g+(d).log.xz

005134631.td-b3lyp_6-31+g(d).qchem.inp (generated)

005134631.td-b3lyp_6-31+g(d).gjf (generated)

005134631.td-b3lyp_6-31+g(d).firefly.inp (generated)

005134631.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005134631.mol 005134631.PUBCHEM 005134631.mol (via Jmol)
005134656.b3lyp_6-31g(d).inp

005134656.b3lyp_6-31g(d).qchem.inp (generated)

005134656.b3lyp_6-31g(d).gjf (generated)

005134656.b3lyp_6-31g(d).firefly.inp (generated)

005134656.b3lyp_6-31g(d).smash.inp (generated)

005134656.b3lyp_6-31g(d).nwchem.inp (generated) 005134656.b3lyp_6-31g(d).log.xz 005134656.td-b3lyp_6-31g+(d).inp 005134656.td-b3lyp_6-31g+(d).log.xz

005134656.td-b3lyp_6-31+g(d).qchem.inp (generated)

005134656.td-b3lyp_6-31+g(d).gjf (generated)

005134656.td-b3lyp_6-31+g(d).firefly.inp (generated)

005134656.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005134656.mol 005134656.PUBCHEM 005134656.mol (via Jmol)
005134666.b3lyp_6-31g(d).inp

005134666.b3lyp_6-31g(d).qchem.inp (generated)

005134666.b3lyp_6-31g(d).gjf (generated)

005134666.b3lyp_6-31g(d).firefly.inp (generated)

005134666.b3lyp_6-31g(d).smash.inp (generated)

005134666.b3lyp_6-31g(d).nwchem.inp (generated) 005134666.b3lyp_6-31g(d).log.xz 005134666.td-b3lyp_6-31g+(d).inp 005134666.td-b3lyp_6-31g+(d).log.xz

005134666.td-b3lyp_6-31+g(d).qchem.inp (generated)

005134666.td-b3lyp_6-31+g(d).gjf (generated)

005134666.td-b3lyp_6-31+g(d).firefly.inp (generated)

005134666.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005134666.mol 005134666.PUBCHEM 005134666.mol (via Jmol)
005134667.b3lyp_6-31g(d).inp

005134667.b3lyp_6-31g(d).qchem.inp (generated)

005134667.b3lyp_6-31g(d).gjf (generated)

005134667.b3lyp_6-31g(d).firefly.inp (generated)

005134667.b3lyp_6-31g(d).smash.inp (generated)

005134667.b3lyp_6-31g(d).nwchem.inp (generated) 005134667.b3lyp_6-31g(d).log.xz 005134667.td-b3lyp_6-31g+(d).inp 005134667.td-b3lyp_6-31g+(d).log.xz

005134667.td-b3lyp_6-31+g(d).qchem.inp (generated)

005134667.td-b3lyp_6-31+g(d).gjf (generated)

005134667.td-b3lyp_6-31+g(d).firefly.inp (generated)

005134667.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005134667.mol 005134667.PUBCHEM 005134667.mol (via Jmol)
005134668.b3lyp_6-31g(d).inp

005134668.b3lyp_6-31g(d).qchem.inp (generated)

005134668.b3lyp_6-31g(d).gjf (generated)

005134668.b3lyp_6-31g(d).firefly.inp (generated)

005134668.b3lyp_6-31g(d).smash.inp (generated)

005134668.b3lyp_6-31g(d).nwchem.inp (generated) 005134668.b3lyp_6-31g(d).log.xz 005134668.td-b3lyp_6-31g+(d).inp 005134668.td-b3lyp_6-31g+(d).log.xz

005134668.td-b3lyp_6-31+g(d).qchem.inp (generated)

005134668.td-b3lyp_6-31+g(d).gjf (generated)

005134668.td-b3lyp_6-31+g(d).firefly.inp (generated)

005134668.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005134668.mol 005134668.PUBCHEM 005134668.mol (via Jmol)
005134683.b3lyp_6-31g(d).inp

005134683.b3lyp_6-31g(d).qchem.inp (generated)

005134683.b3lyp_6-31g(d).gjf (generated)

005134683.b3lyp_6-31g(d).firefly.inp (generated)

005134683.b3lyp_6-31g(d).smash.inp (generated)

005134683.b3lyp_6-31g(d).nwchem.inp (generated) 005134683.b3lyp_6-31g(d).log.xz 005134683.mol 005134683.PUBCHEM 005134683.mol (via Jmol)
005134734.b3lyp_6-31g(d).inp

005134734.b3lyp_6-31g(d).qchem.inp (generated)

005134734.b3lyp_6-31g(d).gjf (generated)

005134734.b3lyp_6-31g(d).firefly.inp (generated)

005134734.b3lyp_6-31g(d).smash.inp (generated)

005134734.b3lyp_6-31g(d).nwchem.inp (generated) 005134734.b3lyp_6-31g(d).log.xz 005134734.td-b3lyp_6-31g+(d).inp 005134734.td-b3lyp_6-31g+(d).log.xz

005134734.td-b3lyp_6-31+g(d).qchem.inp (generated)

005134734.td-b3lyp_6-31+g(d).gjf (generated)

005134734.td-b3lyp_6-31+g(d).firefly.inp (generated)

005134734.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005134734.mol 005134734.PUBCHEM 005134734.mol (via Jmol)
005134808.b3lyp_6-31g(d).inp

005134808.b3lyp_6-31g(d).qchem.inp (generated)

005134808.b3lyp_6-31g(d).gjf (generated)

005134808.b3lyp_6-31g(d).firefly.inp (generated)

005134808.b3lyp_6-31g(d).smash.inp (generated)

005134808.b3lyp_6-31g(d).nwchem.inp (generated) 005134808.b3lyp_6-31g(d).log.xz 005134808.mol 005134808.PUBCHEM 005134808.mol (via Jmol)
005134861.b3lyp_6-31g(d).inp

005134861.b3lyp_6-31g(d).qchem.inp (generated)

005134861.b3lyp_6-31g(d).gjf (generated)

005134861.b3lyp_6-31g(d).firefly.inp (generated)

005134861.b3lyp_6-31g(d).smash.inp (generated)

005134861.b3lyp_6-31g(d).nwchem.inp (generated) 005134861.b3lyp_6-31g(d).log.xz 005134861.td-b3lyp_6-31g+(d).inp 005134861.td-b3lyp_6-31g+(d).log.xz

005134861.td-b3lyp_6-31+g(d).qchem.inp (generated)

005134861.td-b3lyp_6-31+g(d).gjf (generated)

005134861.td-b3lyp_6-31+g(d).firefly.inp (generated)

005134861.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005134861.mol 005134861.PUBCHEM 005134861.mol (via Jmol)
005134862.b3lyp_6-31g(d).inp

005134862.b3lyp_6-31g(d).qchem.inp (generated)

005134862.b3lyp_6-31g(d).gjf (generated)

005134862.b3lyp_6-31g(d).firefly.inp (generated)

005134862.b3lyp_6-31g(d).smash.inp (generated)

005134862.b3lyp_6-31g(d).nwchem.inp (generated) 005134862.b3lyp_6-31g(d).log.xz 005134862.td-b3lyp_6-31g+(d).inp 005134862.td-b3lyp_6-31g+(d).log.xz

005134862.td-b3lyp_6-31+g(d).qchem.inp (generated)

005134862.td-b3lyp_6-31+g(d).gjf (generated)

005134862.td-b3lyp_6-31+g(d).firefly.inp (generated)

005134862.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005134862.mol 005134862.PUBCHEM 005134862.mol (via Jmol)
005134917.b3lyp_6-31g(d).inp

005134917.b3lyp_6-31g(d).qchem.inp (generated)

005134917.b3lyp_6-31g(d).gjf (generated)

005134917.b3lyp_6-31g(d).firefly.inp (generated)

005134917.b3lyp_6-31g(d).smash.inp (generated)

005134917.b3lyp_6-31g(d).nwchem.inp (generated) 005134917.b3lyp_6-31g(d).log.xz 005134917.mol 005134917.PUBCHEM 005134917.mol (via Jmol)
005134924.b3lyp_6-31g(d).inp

005134924.b3lyp_6-31g(d).qchem.inp (generated)

005134924.b3lyp_6-31g(d).gjf (generated)

005134924.b3lyp_6-31g(d).firefly.inp (generated)

005134924.b3lyp_6-31g(d).smash.inp (generated)

005134924.b3lyp_6-31g(d).nwchem.inp (generated) 005134924.b3lyp_6-31g(d).log.xz 005134924.td-b3lyp_6-31g+(d).inp 005134924.td-b3lyp_6-31g+(d).log.xz

005134924.td-b3lyp_6-31+g(d).qchem.inp (generated)

005134924.td-b3lyp_6-31+g(d).gjf (generated)

005134924.td-b3lyp_6-31+g(d).firefly.inp (generated)

005134924.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005134924.mol 005134924.PUBCHEM 005134924.mol (via Jmol)
005135021.b3lyp_6-31g(d).inp

005135021.b3lyp_6-31g(d).qchem.inp (generated)

005135021.b3lyp_6-31g(d).gjf (generated)

005135021.b3lyp_6-31g(d).firefly.inp (generated)

005135021.b3lyp_6-31g(d).smash.inp (generated)

005135021.b3lyp_6-31g(d).nwchem.inp (generated) 005135021.b3lyp_6-31g(d).log.xz 005135021.td-b3lyp_6-31g+(d).inp 005135021.td-b3lyp_6-31g+(d).log.xz

005135021.td-b3lyp_6-31+g(d).qchem.inp (generated)

005135021.td-b3lyp_6-31+g(d).gjf (generated)

005135021.td-b3lyp_6-31+g(d).firefly.inp (generated)

005135021.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005135021.mol 005135021.PUBCHEM 005135021.mol (via Jmol)
005135023.b3lyp_6-31g(d).inp

005135023.b3lyp_6-31g(d).qchem.inp (generated)

005135023.b3lyp_6-31g(d).gjf (generated)

005135023.b3lyp_6-31g(d).firefly.inp (generated)

005135023.b3lyp_6-31g(d).smash.inp (generated)

005135023.b3lyp_6-31g(d).nwchem.inp (generated) 005135023.b3lyp_6-31g(d).log.xz 005135023.td-b3lyp_6-31g+(d).inp 005135023.td-b3lyp_6-31g+(d).log.xz

005135023.td-b3lyp_6-31+g(d).qchem.inp (generated)

005135023.td-b3lyp_6-31+g(d).gjf (generated)

005135023.td-b3lyp_6-31+g(d).firefly.inp (generated)

005135023.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005135023.mol 005135023.PUBCHEM 005135023.mol (via Jmol)
005135042.b3lyp_6-31g(d).inp

005135042.b3lyp_6-31g(d).qchem.inp (generated)

005135042.b3lyp_6-31g(d).gjf (generated)

005135042.b3lyp_6-31g(d).firefly.inp (generated)

005135042.b3lyp_6-31g(d).smash.inp (generated)

005135042.b3lyp_6-31g(d).nwchem.inp (generated) 005135042.b3lyp_6-31g(d).log.xz 005135042.td-b3lyp_6-31g+(d).inp 005135042.td-b3lyp_6-31g+(d).log.xz

005135042.td-b3lyp_6-31+g(d).qchem.inp (generated)

005135042.td-b3lyp_6-31+g(d).gjf (generated)

005135042.td-b3lyp_6-31+g(d).firefly.inp (generated)

005135042.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005135042.mol 005135042.PUBCHEM 005135042.mol (via Jmol)
005135059.b3lyp_6-31g(d).inp

005135059.b3lyp_6-31g(d).qchem.inp (generated)

005135059.b3lyp_6-31g(d).gjf (generated)

005135059.b3lyp_6-31g(d).firefly.inp (generated)

005135059.b3lyp_6-31g(d).smash.inp (generated)

005135059.b3lyp_6-31g(d).nwchem.inp (generated) 005135059.b3lyp_6-31g(d).log.xz 005135059.td-b3lyp_6-31g+(d).inp 005135059.td-b3lyp_6-31g+(d).log.xz

005135059.td-b3lyp_6-31+g(d).qchem.inp (generated)

005135059.td-b3lyp_6-31+g(d).gjf (generated)

005135059.td-b3lyp_6-31+g(d).firefly.inp (generated)

005135059.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005135059.mol 005135059.PUBCHEM 005135059.mol (via Jmol)
005135104.b3lyp_6-31g(d).inp

005135104.b3lyp_6-31g(d).qchem.inp (generated)

005135104.b3lyp_6-31g(d).gjf (generated)

005135104.b3lyp_6-31g(d).firefly.inp (generated)

005135104.b3lyp_6-31g(d).smash.inp (generated)

005135104.b3lyp_6-31g(d).nwchem.inp (generated) 005135104.b3lyp_6-31g(d).log.xz 005135104.mol 005135104.PUBCHEM 005135104.mol (via Jmol)
005135116.b3lyp_6-31g(d).inp

005135116.b3lyp_6-31g(d).qchem.inp (generated)

005135116.b3lyp_6-31g(d).gjf (generated)

005135116.b3lyp_6-31g(d).firefly.inp (generated)

005135116.b3lyp_6-31g(d).smash.inp (generated)

005135116.b3lyp_6-31g(d).nwchem.inp (generated) 005135116.b3lyp_6-31g(d).log.xz 005135116.td-b3lyp_6-31g+(d).inp 005135116.td-b3lyp_6-31g+(d).log.xz

005135116.td-b3lyp_6-31+g(d).qchem.inp (generated)

005135116.td-b3lyp_6-31+g(d).gjf (generated)

005135116.td-b3lyp_6-31+g(d).firefly.inp (generated)

005135116.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005135116.mol 005135116.PUBCHEM 005135116.mol (via Jmol)
005135148.b3lyp_6-31g(d).inp

005135148.b3lyp_6-31g(d).qchem.inp (generated)

005135148.b3lyp_6-31g(d).gjf (generated)

005135148.b3lyp_6-31g(d).firefly.inp (generated)

005135148.b3lyp_6-31g(d).smash.inp (generated)

005135148.b3lyp_6-31g(d).nwchem.inp (generated) 005135148.b3lyp_6-31g(d).log.xz 005135148.td-b3lyp_6-31g+(d).inp 005135148.td-b3lyp_6-31g+(d).log.xz

005135148.td-b3lyp_6-31+g(d).qchem.inp (generated)

005135148.td-b3lyp_6-31+g(d).gjf (generated)

005135148.td-b3lyp_6-31+g(d).firefly.inp (generated)

005135148.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005135148.mol 005135148.PUBCHEM 005135148.mol (via Jmol)
005135178.b3lyp_6-31g(d).inp

005135178.b3lyp_6-31g(d).qchem.inp (generated)

005135178.b3lyp_6-31g(d).gjf (generated)

005135178.b3lyp_6-31g(d).firefly.inp (generated)

005135178.b3lyp_6-31g(d).smash.inp (generated)

005135178.b3lyp_6-31g(d).nwchem.inp (generated) 005135178.b3lyp_6-31g(d).log.xz 005135178.td-b3lyp_6-31g+(d).inp 005135178.td-b3lyp_6-31g+(d).log.xz

005135178.td-b3lyp_6-31+g(d).qchem.inp (generated)

005135178.td-b3lyp_6-31+g(d).gjf (generated)

005135178.td-b3lyp_6-31+g(d).firefly.inp (generated)

005135178.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005135178.mol 005135178.PUBCHEM 005135178.mol (via Jmol)
005135180.b3lyp_6-31g(d).inp

005135180.b3lyp_6-31g(d).qchem.inp (generated)

005135180.b3lyp_6-31g(d).gjf (generated)

005135180.b3lyp_6-31g(d).firefly.inp (generated)

005135180.b3lyp_6-31g(d).smash.inp (generated)

005135180.b3lyp_6-31g(d).nwchem.inp (generated) 005135180.b3lyp_6-31g(d).log.xz 005135180.td-b3lyp_6-31g+(d).inp 005135180.td-b3lyp_6-31g+(d).log.xz

005135180.td-b3lyp_6-31+g(d).qchem.inp (generated)

005135180.td-b3lyp_6-31+g(d).gjf (generated)

005135180.td-b3lyp_6-31+g(d).firefly.inp (generated)

005135180.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005135180.mol 005135180.PUBCHEM 005135180.mol (via Jmol)
005135191.b3lyp_6-31g(d).inp

005135191.b3lyp_6-31g(d).qchem.inp (generated)

005135191.b3lyp_6-31g(d).gjf (generated)

005135191.b3lyp_6-31g(d).firefly.inp (generated)

005135191.b3lyp_6-31g(d).smash.inp (generated)

005135191.b3lyp_6-31g(d).nwchem.inp (generated) 005135191.b3lyp_6-31g(d).log.xz 005135191.td-b3lyp_6-31g+(d).inp 005135191.td-b3lyp_6-31g+(d).log.xz

005135191.td-b3lyp_6-31+g(d).qchem.inp (generated)

005135191.td-b3lyp_6-31+g(d).gjf (generated)

005135191.td-b3lyp_6-31+g(d).firefly.inp (generated)

005135191.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005135191.mol 005135191.PUBCHEM 005135191.mol (via Jmol)
005135227.b3lyp_6-31g(d).inp

005135227.b3lyp_6-31g(d).qchem.inp (generated)

005135227.b3lyp_6-31g(d).gjf (generated)

005135227.b3lyp_6-31g(d).firefly.inp (generated)

005135227.b3lyp_6-31g(d).smash.inp (generated)

005135227.b3lyp_6-31g(d).nwchem.inp (generated) 005135227.b3lyp_6-31g(d).log.xz 005135227.td-b3lyp_6-31g+(d).inp 005135227.td-b3lyp_6-31g+(d).log.xz

005135227.td-b3lyp_6-31+g(d).qchem.inp (generated)

005135227.td-b3lyp_6-31+g(d).gjf (generated)

005135227.td-b3lyp_6-31+g(d).firefly.inp (generated)

005135227.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005135227.mol 005135227.PUBCHEM 005135227.mol (via Jmol)
005135288.b3lyp_6-31g(d).inp

005135288.b3lyp_6-31g(d).qchem.inp (generated)

005135288.b3lyp_6-31g(d).gjf (generated)

005135288.b3lyp_6-31g(d).firefly.inp (generated)

005135288.b3lyp_6-31g(d).smash.inp (generated)

005135288.b3lyp_6-31g(d).nwchem.inp (generated) 005135288.b3lyp_6-31g(d).log.xz 005135288.td-b3lyp_6-31g+(d).inp 005135288.td-b3lyp_6-31g+(d).log.xz

005135288.td-b3lyp_6-31+g(d).qchem.inp (generated)

005135288.td-b3lyp_6-31+g(d).gjf (generated)

005135288.td-b3lyp_6-31+g(d).firefly.inp (generated)

005135288.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005135288.mol 005135288.PUBCHEM 005135288.mol (via Jmol)
005135304.b3lyp_6-31g(d).inp

005135304.b3lyp_6-31g(d).qchem.inp (generated)

005135304.b3lyp_6-31g(d).gjf (generated)

005135304.b3lyp_6-31g(d).firefly.inp (generated)

005135304.b3lyp_6-31g(d).smash.inp (generated)

005135304.b3lyp_6-31g(d).nwchem.inp (generated) 005135304.b3lyp_6-31g(d).log.xz 005135304.td-b3lyp_6-31g+(d).inp 005135304.td-b3lyp_6-31g+(d).log.xz

005135304.td-b3lyp_6-31+g(d).qchem.inp (generated)

005135304.td-b3lyp_6-31+g(d).gjf (generated)

005135304.td-b3lyp_6-31+g(d).firefly.inp (generated)

005135304.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005135304.mol 005135304.PUBCHEM 005135304.mol (via Jmol)
005135442.b3lyp_6-31g(d).inp

005135442.b3lyp_6-31g(d).qchem.inp (generated)

005135442.b3lyp_6-31g(d).gjf (generated)

005135442.b3lyp_6-31g(d).firefly.inp (generated)

005135442.b3lyp_6-31g(d).smash.inp (generated)

005135442.b3lyp_6-31g(d).nwchem.inp (generated) 005135442.b3lyp_6-31g(d).log.xz 005135442.mol 005135442.PUBCHEM 005135442.mol (via Jmol)
005135560.b3lyp_6-31g(d).inp

005135560.b3lyp_6-31g(d).qchem.inp (generated)

005135560.b3lyp_6-31g(d).gjf (generated)

005135560.b3lyp_6-31g(d).firefly.inp (generated)

005135560.b3lyp_6-31g(d).smash.inp (generated)

005135560.b3lyp_6-31g(d).nwchem.inp (generated) 005135560.b3lyp_6-31g(d).log.xz 005135560.td-b3lyp_6-31g+(d).inp 005135560.td-b3lyp_6-31g+(d).log.xz

005135560.td-b3lyp_6-31+g(d).qchem.inp (generated)

005135560.td-b3lyp_6-31+g(d).gjf (generated)

005135560.td-b3lyp_6-31+g(d).firefly.inp (generated)

005135560.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005135560.mol 005135560.PUBCHEM 005135560.mol (via Jmol)
005135648.b3lyp_6-31g(d).inp

005135648.b3lyp_6-31g(d).qchem.inp (generated)

005135648.b3lyp_6-31g(d).gjf (generated)

005135648.b3lyp_6-31g(d).firefly.inp (generated)

005135648.b3lyp_6-31g(d).smash.inp (generated)

005135648.b3lyp_6-31g(d).nwchem.inp (generated) 005135648.b3lyp_6-31g(d).log.xz 005135648.td-b3lyp_6-31g+(d).inp 005135648.td-b3lyp_6-31g+(d).log.xz

005135648.td-b3lyp_6-31+g(d).qchem.inp (generated)

005135648.td-b3lyp_6-31+g(d).gjf (generated)

005135648.td-b3lyp_6-31+g(d).firefly.inp (generated)

005135648.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005135648.mol 005135648.PUBCHEM 005135648.mol (via Jmol)
005135684.b3lyp_6-31g(d).inp

005135684.b3lyp_6-31g(d).qchem.inp (generated)

005135684.b3lyp_6-31g(d).gjf (generated)

005135684.b3lyp_6-31g(d).firefly.inp (generated)

005135684.b3lyp_6-31g(d).smash.inp (generated)

005135684.b3lyp_6-31g(d).nwchem.inp (generated) 005135684.b3lyp_6-31g(d).log.xz 005135684.td-b3lyp_6-31g+(d).inp 005135684.td-b3lyp_6-31g+(d).log.xz

005135684.td-b3lyp_6-31+g(d).qchem.inp (generated)

005135684.td-b3lyp_6-31+g(d).gjf (generated)

005135684.td-b3lyp_6-31+g(d).firefly.inp (generated)

005135684.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005135684.mol 005135684.PUBCHEM 005135684.mol (via Jmol)
005135767.b3lyp_6-31g(d).inp

005135767.b3lyp_6-31g(d).qchem.inp (generated)

005135767.b3lyp_6-31g(d).gjf (generated)

005135767.b3lyp_6-31g(d).firefly.inp (generated)

005135767.b3lyp_6-31g(d).smash.inp (generated)

005135767.b3lyp_6-31g(d).nwchem.inp (generated) 005135767.b3lyp_6-31g(d).log.xz 005135767.td-b3lyp_6-31g+(d).inp 005135767.td-b3lyp_6-31g+(d).log.xz

005135767.td-b3lyp_6-31+g(d).qchem.inp (generated)

005135767.td-b3lyp_6-31+g(d).gjf (generated)

005135767.td-b3lyp_6-31+g(d).firefly.inp (generated)

005135767.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005135767.mol 005135767.PUBCHEM 005135767.mol (via Jmol)
005135768.b3lyp_6-31g(d).inp

005135768.b3lyp_6-31g(d).qchem.inp (generated)

005135768.b3lyp_6-31g(d).gjf (generated)

005135768.b3lyp_6-31g(d).firefly.inp (generated)

005135768.b3lyp_6-31g(d).smash.inp (generated)

005135768.b3lyp_6-31g(d).nwchem.inp (generated) 005135768.b3lyp_6-31g(d).log.xz 005135768.mol 005135768.PUBCHEM 005135768.mol (via Jmol)
005135784.b3lyp_6-31g(d).inp

005135784.b3lyp_6-31g(d).qchem.inp (generated)

005135784.b3lyp_6-31g(d).gjf (generated)

005135784.b3lyp_6-31g(d).firefly.inp (generated)

005135784.b3lyp_6-31g(d).smash.inp (generated)

005135784.b3lyp_6-31g(d).nwchem.inp (generated) 005135784.b3lyp_6-31g(d).log.xz 005135784.td-b3lyp_6-31g+(d).inp 005135784.td-b3lyp_6-31g+(d).log.xz

005135784.td-b3lyp_6-31+g(d).qchem.inp (generated)

005135784.td-b3lyp_6-31+g(d).gjf (generated)

005135784.td-b3lyp_6-31+g(d).firefly.inp (generated)

005135784.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005135784.mol 005135784.PUBCHEM 005135784.mol (via Jmol)
005135850.b3lyp_6-31g(d).inp

005135850.b3lyp_6-31g(d).qchem.inp (generated)

005135850.b3lyp_6-31g(d).gjf (generated)

005135850.b3lyp_6-31g(d).firefly.inp (generated)

005135850.b3lyp_6-31g(d).smash.inp (generated)

005135850.b3lyp_6-31g(d).nwchem.inp (generated) 005135850.b3lyp_6-31g(d).log.xz 005135850.td-b3lyp_6-31g+(d).inp 005135850.td-b3lyp_6-31g+(d).log.xz

005135850.td-b3lyp_6-31+g(d).qchem.inp (generated)

005135850.td-b3lyp_6-31+g(d).gjf (generated)

005135850.td-b3lyp_6-31+g(d).firefly.inp (generated)

005135850.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005135850.mol 005135850.PUBCHEM 005135850.mol (via Jmol)
005135915.b3lyp_6-31g(d).inp

005135915.b3lyp_6-31g(d).qchem.inp (generated)

005135915.b3lyp_6-31g(d).gjf (generated)

005135915.b3lyp_6-31g(d).firefly.inp (generated)

005135915.b3lyp_6-31g(d).smash.inp (generated)

005135915.b3lyp_6-31g(d).nwchem.inp (generated) 005135915.b3lyp_6-31g(d).log.xz 005135915.td-b3lyp_6-31g+(d).inp 005135915.td-b3lyp_6-31g+(d).log.xz

005135915.td-b3lyp_6-31+g(d).qchem.inp (generated)

005135915.td-b3lyp_6-31+g(d).gjf (generated)

005135915.td-b3lyp_6-31+g(d).firefly.inp (generated)

005135915.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005135915.mol 005135915.PUBCHEM 005135915.mol (via Jmol)
005135916.b3lyp_6-31g(d).inp

005135916.b3lyp_6-31g(d).qchem.inp (generated)

005135916.b3lyp_6-31g(d).gjf (generated)

005135916.b3lyp_6-31g(d).firefly.inp (generated)

005135916.b3lyp_6-31g(d).smash.inp (generated)

005135916.b3lyp_6-31g(d).nwchem.inp (generated) 005135916.b3lyp_6-31g(d).log.xz 005135916.td-b3lyp_6-31g+(d).inp 005135916.td-b3lyp_6-31g+(d).log.xz

005135916.td-b3lyp_6-31+g(d).qchem.inp (generated)

005135916.td-b3lyp_6-31+g(d).gjf (generated)

005135916.td-b3lyp_6-31+g(d).firefly.inp (generated)

005135916.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005135916.mol 005135916.PUBCHEM 005135916.mol (via Jmol)
005135946.b3lyp_6-31g(d).inp

005135946.b3lyp_6-31g(d).qchem.inp (generated)

005135946.b3lyp_6-31g(d).gjf (generated)

005135946.b3lyp_6-31g(d).firefly.inp (generated)

005135946.b3lyp_6-31g(d).smash.inp (generated)

005135946.b3lyp_6-31g(d).nwchem.inp (generated) 005135946.b3lyp_6-31g(d).log.xz 005135946.td-b3lyp_6-31g+(d).inp 005135946.td-b3lyp_6-31g+(d).log.xz

005135946.td-b3lyp_6-31+g(d).qchem.inp (generated)

005135946.td-b3lyp_6-31+g(d).gjf (generated)

005135946.td-b3lyp_6-31+g(d).firefly.inp (generated)

005135946.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005135946.mol 005135946.PUBCHEM 005135946.mol (via Jmol)
005135997.b3lyp_6-31g(d).inp

005135997.b3lyp_6-31g(d).qchem.inp (generated)

005135997.b3lyp_6-31g(d).gjf (generated)

005135997.b3lyp_6-31g(d).firefly.inp (generated)

005135997.b3lyp_6-31g(d).smash.inp (generated)

005135997.b3lyp_6-31g(d).nwchem.inp (generated) 005135997.b3lyp_6-31g(d).log.xz 005135997.td-b3lyp_6-31g+(d).inp 005135997.td-b3lyp_6-31g+(d).log.xz

005135997.td-b3lyp_6-31+g(d).qchem.inp (generated)

005135997.td-b3lyp_6-31+g(d).gjf (generated)

005135997.td-b3lyp_6-31+g(d).firefly.inp (generated)

005135997.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005135997.mol 005135997.PUBCHEM 005135997.mol (via Jmol)
005136001.b3lyp_6-31g(d).inp

005136001.b3lyp_6-31g(d).qchem.inp (generated)

005136001.b3lyp_6-31g(d).gjf (generated)

005136001.b3lyp_6-31g(d).firefly.inp (generated)

005136001.b3lyp_6-31g(d).smash.inp (generated)

005136001.b3lyp_6-31g(d).nwchem.inp (generated) 005136001.b3lyp_6-31g(d).log.xz 005136001.td-b3lyp_6-31g+(d).inp 005136001.td-b3lyp_6-31g+(d).log.xz

005136001.td-b3lyp_6-31+g(d).qchem.inp (generated)

005136001.td-b3lyp_6-31+g(d).gjf (generated)

005136001.td-b3lyp_6-31+g(d).firefly.inp (generated)

005136001.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005136001.mol 005136001.PUBCHEM 005136001.mol (via Jmol)
005136003.b3lyp_6-31g(d).inp

005136003.b3lyp_6-31g(d).qchem.inp (generated)

005136003.b3lyp_6-31g(d).gjf (generated)

005136003.b3lyp_6-31g(d).firefly.inp (generated)

005136003.b3lyp_6-31g(d).smash.inp (generated)

005136003.b3lyp_6-31g(d).nwchem.inp (generated) 005136003.b3lyp_6-31g(d).log.xz 005136003.td-b3lyp_6-31g+(d).inp 005136003.td-b3lyp_6-31g+(d).log.xz

005136003.td-b3lyp_6-31+g(d).qchem.inp (generated)

005136003.td-b3lyp_6-31+g(d).gjf (generated)

005136003.td-b3lyp_6-31+g(d).firefly.inp (generated)

005136003.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005136003.mol 005136003.PUBCHEM 005136003.mol (via Jmol)
005136078.b3lyp_6-31g(d).inp

005136078.b3lyp_6-31g(d).qchem.inp (generated)

005136078.b3lyp_6-31g(d).gjf (generated)

005136078.b3lyp_6-31g(d).firefly.inp (generated)

005136078.b3lyp_6-31g(d).smash.inp (generated)

005136078.b3lyp_6-31g(d).nwchem.inp (generated) 005136078.b3lyp_6-31g(d).log.xz 005136078.td-b3lyp_6-31g+(d).inp 005136078.td-b3lyp_6-31g+(d).log.xz

005136078.td-b3lyp_6-31+g(d).qchem.inp (generated)

005136078.td-b3lyp_6-31+g(d).gjf (generated)

005136078.td-b3lyp_6-31+g(d).firefly.inp (generated)

005136078.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005136078.mol 005136078.PUBCHEM 005136078.mol (via Jmol)
005136079.b3lyp_6-31g(d).inp

005136079.b3lyp_6-31g(d).qchem.inp (generated)

005136079.b3lyp_6-31g(d).gjf (generated)

005136079.b3lyp_6-31g(d).firefly.inp (generated)

005136079.b3lyp_6-31g(d).smash.inp (generated)

005136079.b3lyp_6-31g(d).nwchem.inp (generated) 005136079.b3lyp_6-31g(d).log.xz 005136079.td-b3lyp_6-31g+(d).inp 005136079.td-b3lyp_6-31g+(d).log.xz

005136079.td-b3lyp_6-31+g(d).qchem.inp (generated)

005136079.td-b3lyp_6-31+g(d).gjf (generated)

005136079.td-b3lyp_6-31+g(d).firefly.inp (generated)

005136079.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005136079.mol 005136079.PUBCHEM 005136079.mol (via Jmol)
005136129.b3lyp_6-31g(d).inp

005136129.b3lyp_6-31g(d).qchem.inp (generated)

005136129.b3lyp_6-31g(d).gjf (generated)

005136129.b3lyp_6-31g(d).firefly.inp (generated)

005136129.b3lyp_6-31g(d).smash.inp (generated)

005136129.b3lyp_6-31g(d).nwchem.inp (generated) 005136129.b3lyp_6-31g(d).log.xz 005136129.mol 005136129.PUBCHEM 005136129.mol (via Jmol)
005136131.b3lyp_6-31g(d).inp

005136131.b3lyp_6-31g(d).qchem.inp (generated)

005136131.b3lyp_6-31g(d).gjf (generated)

005136131.b3lyp_6-31g(d).firefly.inp (generated)

005136131.b3lyp_6-31g(d).smash.inp (generated)

005136131.b3lyp_6-31g(d).nwchem.inp (generated) 005136131.b3lyp_6-31g(d).log.xz 005136131.td-b3lyp_6-31g+(d).inp 005136131.td-b3lyp_6-31g+(d).log.xz

005136131.td-b3lyp_6-31+g(d).qchem.inp (generated)

005136131.td-b3lyp_6-31+g(d).gjf (generated)

005136131.td-b3lyp_6-31+g(d).firefly.inp (generated)

005136131.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005136131.mol 005136131.PUBCHEM 005136131.mol (via Jmol)
005136143.b3lyp_6-31g(d).inp

005136143.b3lyp_6-31g(d).qchem.inp (generated)

005136143.b3lyp_6-31g(d).gjf (generated)

005136143.b3lyp_6-31g(d).firefly.inp (generated)

005136143.b3lyp_6-31g(d).smash.inp (generated)

005136143.b3lyp_6-31g(d).nwchem.inp (generated) 005136143.b3lyp_6-31g(d).log.xz 005136143.td-b3lyp_6-31g+(d).inp 005136143.td-b3lyp_6-31g+(d).log.xz

005136143.td-b3lyp_6-31+g(d).qchem.inp (generated)

005136143.td-b3lyp_6-31+g(d).gjf (generated)

005136143.td-b3lyp_6-31+g(d).firefly.inp (generated)

005136143.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005136143.mol 005136143.PUBCHEM 005136143.mol (via Jmol)
005136192.b3lyp_6-31g(d).inp

005136192.b3lyp_6-31g(d).qchem.inp (generated)

005136192.b3lyp_6-31g(d).gjf (generated)

005136192.b3lyp_6-31g(d).firefly.inp (generated)

005136192.b3lyp_6-31g(d).smash.inp (generated)

005136192.b3lyp_6-31g(d).nwchem.inp (generated) 005136192.b3lyp_6-31g(d).log.xz 005136192.td-b3lyp_6-31g+(d).inp 005136192.td-b3lyp_6-31g+(d).log.xz

005136192.td-b3lyp_6-31+g(d).qchem.inp (generated)

005136192.td-b3lyp_6-31+g(d).gjf (generated)

005136192.td-b3lyp_6-31+g(d).firefly.inp (generated)

005136192.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005136192.mol 005136192.PUBCHEM 005136192.mol (via Jmol)
005136201.b3lyp_6-31g(d).inp

005136201.b3lyp_6-31g(d).qchem.inp (generated)

005136201.b3lyp_6-31g(d).gjf (generated)

005136201.b3lyp_6-31g(d).firefly.inp (generated)

005136201.b3lyp_6-31g(d).smash.inp (generated)

005136201.b3lyp_6-31g(d).nwchem.inp (generated) 005136201.b3lyp_6-31g(d).log.xz 005136201.mol 005136201.PUBCHEM 005136201.mol (via Jmol)
005136238.b3lyp_6-31g(d).inp

005136238.b3lyp_6-31g(d).qchem.inp (generated)

005136238.b3lyp_6-31g(d).gjf (generated)

005136238.b3lyp_6-31g(d).firefly.inp (generated)

005136238.b3lyp_6-31g(d).smash.inp (generated)

005136238.b3lyp_6-31g(d).nwchem.inp (generated) 005136238.b3lyp_6-31g(d).log.xz 005136238.td-b3lyp_6-31g+(d).inp 005136238.td-b3lyp_6-31g+(d).log.xz

005136238.td-b3lyp_6-31+g(d).qchem.inp (generated)

005136238.td-b3lyp_6-31+g(d).gjf (generated)

005136238.td-b3lyp_6-31+g(d).firefly.inp (generated)

005136238.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005136238.mol 005136238.PUBCHEM 005136238.mol (via Jmol)
005136240.b3lyp_6-31g(d).inp

005136240.b3lyp_6-31g(d).qchem.inp (generated)

005136240.b3lyp_6-31g(d).gjf (generated)

005136240.b3lyp_6-31g(d).firefly.inp (generated)

005136240.b3lyp_6-31g(d).smash.inp (generated)

005136240.b3lyp_6-31g(d).nwchem.inp (generated) 005136240.b3lyp_6-31g(d).log.xz 005136240.td-b3lyp_6-31g+(d).inp 005136240.td-b3lyp_6-31g+(d).log.xz

005136240.td-b3lyp_6-31+g(d).qchem.inp (generated)

005136240.td-b3lyp_6-31+g(d).gjf (generated)

005136240.td-b3lyp_6-31+g(d).firefly.inp (generated)

005136240.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005136240.mol 005136240.PUBCHEM 005136240.mol (via Jmol)
005136241.b3lyp_6-31g(d).inp

005136241.b3lyp_6-31g(d).qchem.inp (generated)

005136241.b3lyp_6-31g(d).gjf (generated)

005136241.b3lyp_6-31g(d).firefly.inp (generated)

005136241.b3lyp_6-31g(d).smash.inp (generated)

005136241.b3lyp_6-31g(d).nwchem.inp (generated) 005136241.b3lyp_6-31g(d).log.xz 005136241.td-b3lyp_6-31g+(d).inp 005136241.td-b3lyp_6-31g+(d).log.xz

005136241.td-b3lyp_6-31+g(d).qchem.inp (generated)

005136241.td-b3lyp_6-31+g(d).gjf (generated)

005136241.td-b3lyp_6-31+g(d).firefly.inp (generated)

005136241.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005136241.mol 005136241.PUBCHEM 005136241.mol (via Jmol)
005136245.b3lyp_6-31g(d).inp

005136245.b3lyp_6-31g(d).qchem.inp (generated)

005136245.b3lyp_6-31g(d).gjf (generated)

005136245.b3lyp_6-31g(d).firefly.inp (generated)

005136245.b3lyp_6-31g(d).smash.inp (generated)

005136245.b3lyp_6-31g(d).nwchem.inp (generated) 005136245.b3lyp_6-31g(d).log.xz 005136245.td-b3lyp_6-31g+(d).inp 005136245.td-b3lyp_6-31g+(d).log.xz

005136245.td-b3lyp_6-31+g(d).qchem.inp (generated)

005136245.td-b3lyp_6-31+g(d).gjf (generated)

005136245.td-b3lyp_6-31+g(d).firefly.inp (generated)

005136245.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005136245.mol 005136245.PUBCHEM 005136245.mol (via Jmol)
005136256.b3lyp_6-31g(d).inp

005136256.b3lyp_6-31g(d).qchem.inp (generated)

005136256.b3lyp_6-31g(d).gjf (generated)

005136256.b3lyp_6-31g(d).firefly.inp (generated)

005136256.b3lyp_6-31g(d).smash.inp (generated)

005136256.b3lyp_6-31g(d).nwchem.inp (generated) 005136256.b3lyp_6-31g(d).log.xz 005136256.td-b3lyp_6-31g+(d).inp 005136256.td-b3lyp_6-31g+(d).log.xz

005136256.td-b3lyp_6-31+g(d).qchem.inp (generated)

005136256.td-b3lyp_6-31+g(d).gjf (generated)

005136256.td-b3lyp_6-31+g(d).firefly.inp (generated)

005136256.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005136256.mol 005136256.PUBCHEM 005136256.mol (via Jmol)
005136270.b3lyp_6-31g(d).inp

005136270.b3lyp_6-31g(d).qchem.inp (generated)

005136270.b3lyp_6-31g(d).gjf (generated)

005136270.b3lyp_6-31g(d).firefly.inp (generated)

005136270.b3lyp_6-31g(d).smash.inp (generated)

005136270.b3lyp_6-31g(d).nwchem.inp (generated) 005136270.b3lyp_6-31g(d).log.xz 005136270.mol 005136270.PUBCHEM 005136270.mol (via Jmol)
005136313.b3lyp_6-31g(d).inp

005136313.b3lyp_6-31g(d).qchem.inp (generated)

005136313.b3lyp_6-31g(d).gjf (generated)

005136313.b3lyp_6-31g(d).firefly.inp (generated)

005136313.b3lyp_6-31g(d).smash.inp (generated)

005136313.b3lyp_6-31g(d).nwchem.inp (generated) 005136313.b3lyp_6-31g(d).log.xz 005136313.td-b3lyp_6-31g+(d).inp 005136313.td-b3lyp_6-31g+(d).log.xz

005136313.td-b3lyp_6-31+g(d).qchem.inp (generated)

005136313.td-b3lyp_6-31+g(d).gjf (generated)

005136313.td-b3lyp_6-31+g(d).firefly.inp (generated)

005136313.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005136313.mol 005136313.PUBCHEM 005136313.mol (via Jmol)
005136335.b3lyp_6-31g(d).inp

005136335.b3lyp_6-31g(d).qchem.inp (generated)

005136335.b3lyp_6-31g(d).gjf (generated)

005136335.b3lyp_6-31g(d).firefly.inp (generated)

005136335.b3lyp_6-31g(d).smash.inp (generated)

005136335.b3lyp_6-31g(d).nwchem.inp (generated) 005136335.b3lyp_6-31g(d).log.xz 005136335.td-b3lyp_6-31g+(d).inp 005136335.td-b3lyp_6-31g+(d).log.xz

005136335.td-b3lyp_6-31+g(d).qchem.inp (generated)

005136335.td-b3lyp_6-31+g(d).gjf (generated)

005136335.td-b3lyp_6-31+g(d).firefly.inp (generated)

005136335.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005136335.mol 005136335.PUBCHEM 005136335.mol (via Jmol)
005136400.b3lyp_6-31g(d).inp

005136400.b3lyp_6-31g(d).qchem.inp (generated)

005136400.b3lyp_6-31g(d).gjf (generated)

005136400.b3lyp_6-31g(d).firefly.inp (generated)

005136400.b3lyp_6-31g(d).smash.inp (generated)

005136400.b3lyp_6-31g(d).nwchem.inp (generated) 005136400.b3lyp_6-31g(d).log.xz 005136400.td-b3lyp_6-31g+(d).inp 005136400.td-b3lyp_6-31g+(d).log.xz

005136400.td-b3lyp_6-31+g(d).qchem.inp (generated)

005136400.td-b3lyp_6-31+g(d).gjf (generated)

005136400.td-b3lyp_6-31+g(d).firefly.inp (generated)

005136400.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005136400.mol 005136400.PUBCHEM 005136400.mol (via Jmol)
005136412.b3lyp_6-31g(d).inp

005136412.b3lyp_6-31g(d).qchem.inp (generated)

005136412.b3lyp_6-31g(d).gjf (generated)

005136412.b3lyp_6-31g(d).firefly.inp (generated)

005136412.b3lyp_6-31g(d).smash.inp (generated)

005136412.b3lyp_6-31g(d).nwchem.inp (generated) 005136412.b3lyp_6-31g(d).log.xz 005136412.td-b3lyp_6-31g+(d).inp 005136412.td-b3lyp_6-31g+(d).log.xz

005136412.td-b3lyp_6-31+g(d).qchem.inp (generated)

005136412.td-b3lyp_6-31+g(d).gjf (generated)

005136412.td-b3lyp_6-31+g(d).firefly.inp (generated)

005136412.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005136412.mol 005136412.PUBCHEM 005136412.mol (via Jmol)
005136479.b3lyp_6-31g(d).inp

005136479.b3lyp_6-31g(d).qchem.inp (generated)

005136479.b3lyp_6-31g(d).gjf (generated)

005136479.b3lyp_6-31g(d).firefly.inp (generated)

005136479.b3lyp_6-31g(d).smash.inp (generated)

005136479.b3lyp_6-31g(d).nwchem.inp (generated) 005136479.b3lyp_6-31g(d).log.xz 005136479.mol 005136479.PUBCHEM 005136479.mol (via Jmol)
005136581.b3lyp_6-31g(d).inp

005136581.b3lyp_6-31g(d).qchem.inp (generated)

005136581.b3lyp_6-31g(d).gjf (generated)

005136581.b3lyp_6-31g(d).firefly.inp (generated)

005136581.b3lyp_6-31g(d).smash.inp (generated)

005136581.b3lyp_6-31g(d).nwchem.inp (generated) 005136581.b3lyp_6-31g(d).log.xz 005136581.td-b3lyp_6-31g+(d).inp 005136581.td-b3lyp_6-31g+(d).log.xz

005136581.td-b3lyp_6-31+g(d).qchem.inp (generated)

005136581.td-b3lyp_6-31+g(d).gjf (generated)

005136581.td-b3lyp_6-31+g(d).firefly.inp (generated)

005136581.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005136581.mol 005136581.PUBCHEM 005136581.mol (via Jmol)
005136589.b3lyp_6-31g(d).inp

005136589.b3lyp_6-31g(d).qchem.inp (generated)

005136589.b3lyp_6-31g(d).gjf (generated)

005136589.b3lyp_6-31g(d).firefly.inp (generated)

005136589.b3lyp_6-31g(d).smash.inp (generated)

005136589.b3lyp_6-31g(d).nwchem.inp (generated) 005136589.b3lyp_6-31g(d).log.xz 005136589.td-b3lyp_6-31g+(d).inp 005136589.td-b3lyp_6-31g+(d).log.xz

005136589.td-b3lyp_6-31+g(d).qchem.inp (generated)

005136589.td-b3lyp_6-31+g(d).gjf (generated)

005136589.td-b3lyp_6-31+g(d).firefly.inp (generated)

005136589.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005136589.mol 005136589.PUBCHEM 005136589.mol (via Jmol)
005136721.b3lyp_6-31g(d).inp

005136721.b3lyp_6-31g(d).qchem.inp (generated)

005136721.b3lyp_6-31g(d).gjf (generated)

005136721.b3lyp_6-31g(d).firefly.inp (generated)

005136721.b3lyp_6-31g(d).smash.inp (generated)

005136721.b3lyp_6-31g(d).nwchem.inp (generated) 005136721.b3lyp_6-31g(d).log.xz 005136721.td-b3lyp_6-31g+(d).inp 005136721.td-b3lyp_6-31g+(d).log.xz

005136721.td-b3lyp_6-31+g(d).qchem.inp (generated)

005136721.td-b3lyp_6-31+g(d).gjf (generated)

005136721.td-b3lyp_6-31+g(d).firefly.inp (generated)

005136721.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005136721.mol 005136721.PUBCHEM 005136721.mol (via Jmol)
005136745.b3lyp_6-31g(d).inp

005136745.b3lyp_6-31g(d).qchem.inp (generated)

005136745.b3lyp_6-31g(d).gjf (generated)

005136745.b3lyp_6-31g(d).firefly.inp (generated)

005136745.b3lyp_6-31g(d).smash.inp (generated)

005136745.b3lyp_6-31g(d).nwchem.inp (generated) 005136745.b3lyp_6-31g(d).log.xz 005136745.td-b3lyp_6-31g+(d).inp 005136745.td-b3lyp_6-31g+(d).log.xz

005136745.td-b3lyp_6-31+g(d).qchem.inp (generated)

005136745.td-b3lyp_6-31+g(d).gjf (generated)

005136745.td-b3lyp_6-31+g(d).firefly.inp (generated)

005136745.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005136745.mol 005136745.PUBCHEM 005136745.mol (via Jmol)
005136832.b3lyp_6-31g(d).inp

005136832.b3lyp_6-31g(d).qchem.inp (generated)

005136832.b3lyp_6-31g(d).gjf (generated)

005136832.b3lyp_6-31g(d).firefly.inp (generated)

005136832.b3lyp_6-31g(d).smash.inp (generated)

005136832.b3lyp_6-31g(d).nwchem.inp (generated) 005136832.b3lyp_6-31g(d).log.xz 005136832.td-b3lyp_6-31g+(d).inp 005136832.td-b3lyp_6-31g+(d).log.xz

005136832.td-b3lyp_6-31+g(d).qchem.inp (generated)

005136832.td-b3lyp_6-31+g(d).gjf (generated)

005136832.td-b3lyp_6-31+g(d).firefly.inp (generated)

005136832.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005136832.mol 005136832.PUBCHEM 005136832.mol (via Jmol)
005136836.b3lyp_6-31g(d).inp

005136836.b3lyp_6-31g(d).qchem.inp (generated)

005136836.b3lyp_6-31g(d).gjf (generated)

005136836.b3lyp_6-31g(d).firefly.inp (generated)

005136836.b3lyp_6-31g(d).smash.inp (generated)

005136836.b3lyp_6-31g(d).nwchem.inp (generated) 005136836.b3lyp_6-31g(d).log.xz 005136836.mol 005136836.PUBCHEM 005136836.mol (via Jmol)
005136867.b3lyp_6-31g(d).inp

005136867.b3lyp_6-31g(d).qchem.inp (generated)

005136867.b3lyp_6-31g(d).gjf (generated)

005136867.b3lyp_6-31g(d).firefly.inp (generated)

005136867.b3lyp_6-31g(d).smash.inp (generated)

005136867.b3lyp_6-31g(d).nwchem.inp (generated) 005136867.b3lyp_6-31g(d).log.xz 005136867.td-b3lyp_6-31g+(d).inp 005136867.td-b3lyp_6-31g+(d).log.xz

005136867.td-b3lyp_6-31+g(d).qchem.inp (generated)

005136867.td-b3lyp_6-31+g(d).gjf (generated)

005136867.td-b3lyp_6-31+g(d).firefly.inp (generated)

005136867.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005136867.mol 005136867.PUBCHEM 005136867.mol (via Jmol)
005136936.b3lyp_6-31g(d).inp

005136936.b3lyp_6-31g(d).qchem.inp (generated)

005136936.b3lyp_6-31g(d).gjf (generated)

005136936.b3lyp_6-31g(d).firefly.inp (generated)

005136936.b3lyp_6-31g(d).smash.inp (generated)

005136936.b3lyp_6-31g(d).nwchem.inp (generated) 005136936.b3lyp_6-31g(d).log.xz 005136936.td-b3lyp_6-31g+(d).inp 005136936.td-b3lyp_6-31g+(d).log.xz

005136936.td-b3lyp_6-31+g(d).qchem.inp (generated)

005136936.td-b3lyp_6-31+g(d).gjf (generated)

005136936.td-b3lyp_6-31+g(d).firefly.inp (generated)

005136936.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005136936.mol 005136936.PUBCHEM 005136936.mol (via Jmol)
005137033.b3lyp_6-31g(d).inp

005137033.b3lyp_6-31g(d).qchem.inp (generated)

005137033.b3lyp_6-31g(d).gjf (generated)

005137033.b3lyp_6-31g(d).firefly.inp (generated)

005137033.b3lyp_6-31g(d).smash.inp (generated)

005137033.b3lyp_6-31g(d).nwchem.inp (generated) 005137033.b3lyp_6-31g(d).log.xz 005137033.mol 005137033.PUBCHEM 005137033.mol (via Jmol)
005137135.b3lyp_6-31g(d).inp

005137135.b3lyp_6-31g(d).qchem.inp (generated)

005137135.b3lyp_6-31g(d).gjf (generated)

005137135.b3lyp_6-31g(d).firefly.inp (generated)

005137135.b3lyp_6-31g(d).smash.inp (generated)

005137135.b3lyp_6-31g(d).nwchem.inp (generated) 005137135.b3lyp_6-31g(d).log.xz 005137135.td-b3lyp_6-31g+(d).inp 005137135.td-b3lyp_6-31g+(d).log.xz

005137135.td-b3lyp_6-31+g(d).qchem.inp (generated)

005137135.td-b3lyp_6-31+g(d).gjf (generated)

005137135.td-b3lyp_6-31+g(d).firefly.inp (generated)

005137135.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005137135.mol 005137135.PUBCHEM 005137135.mol (via Jmol)
005137221.b3lyp_6-31g(d).inp

005137221.b3lyp_6-31g(d).qchem.inp (generated)

005137221.b3lyp_6-31g(d).gjf (generated)

005137221.b3lyp_6-31g(d).firefly.inp (generated)

005137221.b3lyp_6-31g(d).smash.inp (generated)

005137221.b3lyp_6-31g(d).nwchem.inp (generated) 005137221.b3lyp_6-31g(d).log.xz 005137221.td-b3lyp_6-31g+(d).inp 005137221.td-b3lyp_6-31g+(d).log.xz

005137221.td-b3lyp_6-31+g(d).qchem.inp (generated)

005137221.td-b3lyp_6-31+g(d).gjf (generated)

005137221.td-b3lyp_6-31+g(d).firefly.inp (generated)

005137221.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005137221.mol 005137221.PUBCHEM 005137221.mol (via Jmol)
005137241.b3lyp_6-31g(d).inp

005137241.b3lyp_6-31g(d).qchem.inp (generated)

005137241.b3lyp_6-31g(d).gjf (generated)

005137241.b3lyp_6-31g(d).firefly.inp (generated)

005137241.b3lyp_6-31g(d).smash.inp (generated)

005137241.b3lyp_6-31g(d).nwchem.inp (generated) 005137241.b3lyp_6-31g(d).log.xz 005137241.td-b3lyp_6-31g+(d).inp 005137241.td-b3lyp_6-31g+(d).log.xz

005137241.td-b3lyp_6-31+g(d).qchem.inp (generated)

005137241.td-b3lyp_6-31+g(d).gjf (generated)

005137241.td-b3lyp_6-31+g(d).firefly.inp (generated)

005137241.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005137241.mol 005137241.PUBCHEM 005137241.mol (via Jmol)
005137243.b3lyp_6-31g(d).inp

005137243.b3lyp_6-31g(d).qchem.inp (generated)

005137243.b3lyp_6-31g(d).gjf (generated)

005137243.b3lyp_6-31g(d).firefly.inp (generated)

005137243.b3lyp_6-31g(d).smash.inp (generated)

005137243.b3lyp_6-31g(d).nwchem.inp (generated) 005137243.b3lyp_6-31g(d).log.xz 005137243.mol 005137243.PUBCHEM 005137243.mol (via Jmol)
005137321.b3lyp_6-31g(d).inp

005137321.b3lyp_6-31g(d).qchem.inp (generated)

005137321.b3lyp_6-31g(d).gjf (generated)

005137321.b3lyp_6-31g(d).firefly.inp (generated)

005137321.b3lyp_6-31g(d).smash.inp (generated)

005137321.b3lyp_6-31g(d).nwchem.inp (generated) 005137321.b3lyp_6-31g(d).log.xz 005137321.td-b3lyp_6-31g+(d).inp 005137321.td-b3lyp_6-31g+(d).log.xz

005137321.td-b3lyp_6-31+g(d).qchem.inp (generated)

005137321.td-b3lyp_6-31+g(d).gjf (generated)

005137321.td-b3lyp_6-31+g(d).firefly.inp (generated)

005137321.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005137321.mol 005137321.PUBCHEM 005137321.mol (via Jmol)
005137349.b3lyp_6-31g(d).inp

005137349.b3lyp_6-31g(d).qchem.inp (generated)

005137349.b3lyp_6-31g(d).gjf (generated)

005137349.b3lyp_6-31g(d).firefly.inp (generated)

005137349.b3lyp_6-31g(d).smash.inp (generated)

005137349.b3lyp_6-31g(d).nwchem.inp (generated) 005137349.b3lyp_6-31g(d).log.xz 005137349.mol 005137349.PUBCHEM 005137349.mol (via Jmol)
005137365.b3lyp_6-31g(d).inp

005137365.b3lyp_6-31g(d).qchem.inp (generated)

005137365.b3lyp_6-31g(d).gjf (generated)

005137365.b3lyp_6-31g(d).firefly.inp (generated)

005137365.b3lyp_6-31g(d).smash.inp (generated)

005137365.b3lyp_6-31g(d).nwchem.inp (generated) 005137365.b3lyp_6-31g(d).log.xz 005137365.mol 005137365.PUBCHEM 005137365.mol (via Jmol)
005137380.b3lyp_6-31g(d).inp

005137380.b3lyp_6-31g(d).qchem.inp (generated)

005137380.b3lyp_6-31g(d).gjf (generated)

005137380.b3lyp_6-31g(d).firefly.inp (generated)

005137380.b3lyp_6-31g(d).smash.inp (generated)

005137380.b3lyp_6-31g(d).nwchem.inp (generated) 005137380.b3lyp_6-31g(d).log.xz 005137380.td-b3lyp_6-31g+(d).inp 005137380.td-b3lyp_6-31g+(d).log.xz

005137380.td-b3lyp_6-31+g(d).qchem.inp (generated)

005137380.td-b3lyp_6-31+g(d).gjf (generated)

005137380.td-b3lyp_6-31+g(d).firefly.inp (generated)

005137380.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005137380.mol 005137380.PUBCHEM 005137380.mol (via Jmol)
005137465.b3lyp_6-31g(d).inp

005137465.b3lyp_6-31g(d).qchem.inp (generated)

005137465.b3lyp_6-31g(d).gjf (generated)

005137465.b3lyp_6-31g(d).firefly.inp (generated)

005137465.b3lyp_6-31g(d).smash.inp (generated)

005137465.b3lyp_6-31g(d).nwchem.inp (generated) 005137465.b3lyp_6-31g(d).log.xz 005137465.td-b3lyp_6-31g+(d).inp 005137465.td-b3lyp_6-31g+(d).log.xz

005137465.td-b3lyp_6-31+g(d).qchem.inp (generated)

005137465.td-b3lyp_6-31+g(d).gjf (generated)

005137465.td-b3lyp_6-31+g(d).firefly.inp (generated)

005137465.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005137465.mol 005137465.PUBCHEM 005137465.mol (via Jmol)
005137664.b3lyp_6-31g(d).inp

005137664.b3lyp_6-31g(d).qchem.inp (generated)

005137664.b3lyp_6-31g(d).gjf (generated)

005137664.b3lyp_6-31g(d).firefly.inp (generated)

005137664.b3lyp_6-31g(d).smash.inp (generated)

005137664.b3lyp_6-31g(d).nwchem.inp (generated) 005137664.b3lyp_6-31g(d).log.xz 005137664.td-b3lyp_6-31g+(d).inp 005137664.td-b3lyp_6-31g+(d).log.xz

005137664.td-b3lyp_6-31+g(d).qchem.inp (generated)

005137664.td-b3lyp_6-31+g(d).gjf (generated)

005137664.td-b3lyp_6-31+g(d).firefly.inp (generated)

005137664.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005137664.mol 005137664.PUBCHEM 005137664.mol (via Jmol)
005137729.b3lyp_6-31g(d).inp

005137729.b3lyp_6-31g(d).qchem.inp (generated)

005137729.b3lyp_6-31g(d).gjf (generated)

005137729.b3lyp_6-31g(d).firefly.inp (generated)

005137729.b3lyp_6-31g(d).smash.inp (generated)

005137729.b3lyp_6-31g(d).nwchem.inp (generated) 005137729.b3lyp_6-31g(d).log.xz 005137729.mol 005137729.PUBCHEM 005137729.mol (via Jmol)
005137816.b3lyp_6-31g(d).inp

005137816.b3lyp_6-31g(d).qchem.inp (generated)

005137816.b3lyp_6-31g(d).gjf (generated)

005137816.b3lyp_6-31g(d).firefly.inp (generated)

005137816.b3lyp_6-31g(d).smash.inp (generated)

005137816.b3lyp_6-31g(d).nwchem.inp (generated) 005137816.b3lyp_6-31g(d).log.xz 005137816.td-b3lyp_6-31g+(d).inp 005137816.td-b3lyp_6-31g+(d).log.xz

005137816.td-b3lyp_6-31+g(d).qchem.inp (generated)

005137816.td-b3lyp_6-31+g(d).gjf (generated)

005137816.td-b3lyp_6-31+g(d).firefly.inp (generated)

005137816.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005137816.mol 005137816.PUBCHEM 005137816.mol (via Jmol)
005137933.b3lyp_6-31g(d).inp

005137933.b3lyp_6-31g(d).qchem.inp (generated)

005137933.b3lyp_6-31g(d).gjf (generated)

005137933.b3lyp_6-31g(d).firefly.inp (generated)

005137933.b3lyp_6-31g(d).smash.inp (generated)

005137933.b3lyp_6-31g(d).nwchem.inp (generated) 005137933.b3lyp_6-31g(d).log.xz 005137933.td-b3lyp_6-31g+(d).inp 005137933.td-b3lyp_6-31g+(d).log.xz

005137933.td-b3lyp_6-31+g(d).qchem.inp (generated)

005137933.td-b3lyp_6-31+g(d).gjf (generated)

005137933.td-b3lyp_6-31+g(d).firefly.inp (generated)

005137933.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005137933.mol 005137933.PUBCHEM 005137933.mol (via Jmol)
005138102.b3lyp_6-31g(d).inp

005138102.b3lyp_6-31g(d).qchem.inp (generated)

005138102.b3lyp_6-31g(d).gjf (generated)

005138102.b3lyp_6-31g(d).firefly.inp (generated)

005138102.b3lyp_6-31g(d).smash.inp (generated)

005138102.b3lyp_6-31g(d).nwchem.inp (generated) 005138102.b3lyp_6-31g(d).log.xz 005138102.mol 005138102.PUBCHEM 005138102.mol (via Jmol)
005138125.b3lyp_6-31g(d).inp

005138125.b3lyp_6-31g(d).qchem.inp (generated)

005138125.b3lyp_6-31g(d).gjf (generated)

005138125.b3lyp_6-31g(d).firefly.inp (generated)

005138125.b3lyp_6-31g(d).smash.inp (generated)

005138125.b3lyp_6-31g(d).nwchem.inp (generated) 005138125.b3lyp_6-31g(d).log.xz 005138125.td-b3lyp_6-31g+(d).inp 005138125.td-b3lyp_6-31g+(d).log.xz

005138125.td-b3lyp_6-31+g(d).qchem.inp (generated)

005138125.td-b3lyp_6-31+g(d).gjf (generated)

005138125.td-b3lyp_6-31+g(d).firefly.inp (generated)

005138125.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005138125.mol 005138125.PUBCHEM 005138125.mol (via Jmol)
005138140.b3lyp_6-31g(d).inp

005138140.b3lyp_6-31g(d).qchem.inp (generated)

005138140.b3lyp_6-31g(d).gjf (generated)

005138140.b3lyp_6-31g(d).firefly.inp (generated)

005138140.b3lyp_6-31g(d).smash.inp (generated)

005138140.b3lyp_6-31g(d).nwchem.inp (generated) 005138140.b3lyp_6-31g(d).log.xz 005138140.td-b3lyp_6-31g+(d).inp 005138140.td-b3lyp_6-31g+(d).log.xz

005138140.td-b3lyp_6-31+g(d).qchem.inp (generated)

005138140.td-b3lyp_6-31+g(d).gjf (generated)

005138140.td-b3lyp_6-31+g(d).firefly.inp (generated)

005138140.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005138140.mol 005138140.PUBCHEM 005138140.mol (via Jmol)
005138167.b3lyp_6-31g(d).inp

005138167.b3lyp_6-31g(d).qchem.inp (generated)

005138167.b3lyp_6-31g(d).gjf (generated)

005138167.b3lyp_6-31g(d).firefly.inp (generated)

005138167.b3lyp_6-31g(d).smash.inp (generated)

005138167.b3lyp_6-31g(d).nwchem.inp (generated) 005138167.b3lyp_6-31g(d).log.xz 005138167.mol 005138167.PUBCHEM 005138167.mol (via Jmol)
005138169.b3lyp_6-31g(d).inp

005138169.b3lyp_6-31g(d).qchem.inp (generated)

005138169.b3lyp_6-31g(d).gjf (generated)

005138169.b3lyp_6-31g(d).firefly.inp (generated)

005138169.b3lyp_6-31g(d).smash.inp (generated)

005138169.b3lyp_6-31g(d).nwchem.inp (generated) 005138169.b3lyp_6-31g(d).log.xz 005138169.td-b3lyp_6-31g+(d).inp 005138169.td-b3lyp_6-31g+(d).log.xz

005138169.td-b3lyp_6-31+g(d).qchem.inp (generated)

005138169.td-b3lyp_6-31+g(d).gjf (generated)

005138169.td-b3lyp_6-31+g(d).firefly.inp (generated)

005138169.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005138169.mol 005138169.PUBCHEM 005138169.mol (via Jmol)
005138248.b3lyp_6-31g(d).inp

005138248.b3lyp_6-31g(d).qchem.inp (generated)

005138248.b3lyp_6-31g(d).gjf (generated)

005138248.b3lyp_6-31g(d).firefly.inp (generated)

005138248.b3lyp_6-31g(d).smash.inp (generated)

005138248.b3lyp_6-31g(d).nwchem.inp (generated) 005138248.b3lyp_6-31g(d).log.xz 005138248.td-b3lyp_6-31g+(d).inp 005138248.td-b3lyp_6-31g+(d).log.xz

005138248.td-b3lyp_6-31+g(d).qchem.inp (generated)

005138248.td-b3lyp_6-31+g(d).gjf (generated)

005138248.td-b3lyp_6-31+g(d).firefly.inp (generated)

005138248.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005138248.mol 005138248.PUBCHEM 005138248.mol (via Jmol)
005138283.b3lyp_6-31g(d).inp

005138283.b3lyp_6-31g(d).qchem.inp (generated)

005138283.b3lyp_6-31g(d).gjf (generated)

005138283.b3lyp_6-31g(d).firefly.inp (generated)

005138283.b3lyp_6-31g(d).smash.inp (generated)

005138283.b3lyp_6-31g(d).nwchem.inp (generated) 005138283.b3lyp_6-31g(d).log.xz 005138283.td-b3lyp_6-31g+(d).inp 005138283.td-b3lyp_6-31g+(d).log.xz

005138283.td-b3lyp_6-31+g(d).qchem.inp (generated)

005138283.td-b3lyp_6-31+g(d).gjf (generated)

005138283.td-b3lyp_6-31+g(d).firefly.inp (generated)

005138283.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005138283.mol 005138283.PUBCHEM 005138283.mol (via Jmol)
005138286.b3lyp_6-31g(d).inp

005138286.b3lyp_6-31g(d).qchem.inp (generated)

005138286.b3lyp_6-31g(d).gjf (generated)

005138286.b3lyp_6-31g(d).firefly.inp (generated)

005138286.b3lyp_6-31g(d).smash.inp (generated)

005138286.b3lyp_6-31g(d).nwchem.inp (generated) 005138286.b3lyp_6-31g(d).log.xz 005138286.td-b3lyp_6-31g+(d).inp 005138286.td-b3lyp_6-31g+(d).log.xz

005138286.td-b3lyp_6-31+g(d).qchem.inp (generated)

005138286.td-b3lyp_6-31+g(d).gjf (generated)

005138286.td-b3lyp_6-31+g(d).firefly.inp (generated)

005138286.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005138286.mol 005138286.PUBCHEM 005138286.mol (via Jmol)
005138290.b3lyp_6-31g(d).inp

005138290.b3lyp_6-31g(d).qchem.inp (generated)

005138290.b3lyp_6-31g(d).gjf (generated)

005138290.b3lyp_6-31g(d).firefly.inp (generated)

005138290.b3lyp_6-31g(d).smash.inp (generated)

005138290.b3lyp_6-31g(d).nwchem.inp (generated) 005138290.b3lyp_6-31g(d).log.xz 005138290.mol 005138290.PUBCHEM 005138290.mol (via Jmol)
005138501.b3lyp_6-31g(d).inp

005138501.b3lyp_6-31g(d).qchem.inp (generated)

005138501.b3lyp_6-31g(d).gjf (generated)

005138501.b3lyp_6-31g(d).firefly.inp (generated)

005138501.b3lyp_6-31g(d).smash.inp (generated)

005138501.b3lyp_6-31g(d).nwchem.inp (generated) 005138501.b3lyp_6-31g(d).log.xz 005138501.td-b3lyp_6-31g+(d).inp 005138501.td-b3lyp_6-31g+(d).log.xz

005138501.td-b3lyp_6-31+g(d).qchem.inp (generated)

005138501.td-b3lyp_6-31+g(d).gjf (generated)

005138501.td-b3lyp_6-31+g(d).firefly.inp (generated)

005138501.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005138501.mol 005138501.PUBCHEM 005138501.mol (via Jmol)
005138776.b3lyp_6-31g(d).inp

005138776.b3lyp_6-31g(d).qchem.inp (generated)

005138776.b3lyp_6-31g(d).gjf (generated)

005138776.b3lyp_6-31g(d).firefly.inp (generated)

005138776.b3lyp_6-31g(d).smash.inp (generated)

005138776.b3lyp_6-31g(d).nwchem.inp (generated) 005138776.b3lyp_6-31g(d).log.xz 005138776.td-b3lyp_6-31g+(d).inp 005138776.td-b3lyp_6-31g+(d).log.xz

005138776.td-b3lyp_6-31+g(d).qchem.inp (generated)

005138776.td-b3lyp_6-31+g(d).gjf (generated)

005138776.td-b3lyp_6-31+g(d).firefly.inp (generated)

005138776.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005138776.mol 005138776.PUBCHEM 005138776.mol (via Jmol)
005138783.b3lyp_6-31g(d).inp

005138783.b3lyp_6-31g(d).qchem.inp (generated)

005138783.b3lyp_6-31g(d).gjf (generated)

005138783.b3lyp_6-31g(d).firefly.inp (generated)

005138783.b3lyp_6-31g(d).smash.inp (generated)

005138783.b3lyp_6-31g(d).nwchem.inp (generated) 005138783.b3lyp_6-31g(d).log.xz 005138783.td-b3lyp_6-31g+(d).inp 005138783.td-b3lyp_6-31g+(d).log.xz

005138783.td-b3lyp_6-31+g(d).qchem.inp (generated)

005138783.td-b3lyp_6-31+g(d).gjf (generated)

005138783.td-b3lyp_6-31+g(d).firefly.inp (generated)

005138783.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005138783.mol 005138783.PUBCHEM 005138783.mol (via Jmol)
005138791.b3lyp_6-31g(d).inp

005138791.b3lyp_6-31g(d).qchem.inp (generated)

005138791.b3lyp_6-31g(d).gjf (generated)

005138791.b3lyp_6-31g(d).firefly.inp (generated)

005138791.b3lyp_6-31g(d).smash.inp (generated)

005138791.b3lyp_6-31g(d).nwchem.inp (generated) 005138791.b3lyp_6-31g(d).log.xz 005138791.td-b3lyp_6-31g+(d).inp 005138791.td-b3lyp_6-31g+(d).log.xz

005138791.td-b3lyp_6-31+g(d).qchem.inp (generated)

005138791.td-b3lyp_6-31+g(d).gjf (generated)

005138791.td-b3lyp_6-31+g(d).firefly.inp (generated)

005138791.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005138791.mol 005138791.PUBCHEM 005138791.mol (via Jmol)
005138807.b3lyp_6-31g(d).inp

005138807.b3lyp_6-31g(d).qchem.inp (generated)

005138807.b3lyp_6-31g(d).gjf (generated)

005138807.b3lyp_6-31g(d).firefly.inp (generated)

005138807.b3lyp_6-31g(d).smash.inp (generated)

005138807.b3lyp_6-31g(d).nwchem.inp (generated) 005138807.b3lyp_6-31g(d).log.xz 005138807.td-b3lyp_6-31g+(d).inp 005138807.td-b3lyp_6-31g+(d).log.xz

005138807.td-b3lyp_6-31+g(d).qchem.inp (generated)

005138807.td-b3lyp_6-31+g(d).gjf (generated)

005138807.td-b3lyp_6-31+g(d).firefly.inp (generated)

005138807.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005138807.mol 005138807.PUBCHEM 005138807.mol (via Jmol)
005138813.b3lyp_6-31g(d).inp

005138813.b3lyp_6-31g(d).qchem.inp (generated)

005138813.b3lyp_6-31g(d).gjf (generated)

005138813.b3lyp_6-31g(d).firefly.inp (generated)

005138813.b3lyp_6-31g(d).smash.inp (generated)

005138813.b3lyp_6-31g(d).nwchem.inp (generated) 005138813.b3lyp_6-31g(d).log.xz 005138813.td-b3lyp_6-31g+(d).inp 005138813.td-b3lyp_6-31g+(d).log.xz

005138813.td-b3lyp_6-31+g(d).qchem.inp (generated)

005138813.td-b3lyp_6-31+g(d).gjf (generated)

005138813.td-b3lyp_6-31+g(d).firefly.inp (generated)

005138813.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005138813.mol 005138813.PUBCHEM 005138813.mol (via Jmol)
005138852.b3lyp_6-31g(d).inp

005138852.b3lyp_6-31g(d).qchem.inp (generated)

005138852.b3lyp_6-31g(d).gjf (generated)

005138852.b3lyp_6-31g(d).firefly.inp (generated)

005138852.b3lyp_6-31g(d).smash.inp (generated)

005138852.b3lyp_6-31g(d).nwchem.inp (generated) 005138852.b3lyp_6-31g(d).log.xz 005138852.td-b3lyp_6-31g+(d).inp 005138852.td-b3lyp_6-31g+(d).log.xz

005138852.td-b3lyp_6-31+g(d).qchem.inp (generated)

005138852.td-b3lyp_6-31+g(d).gjf (generated)

005138852.td-b3lyp_6-31+g(d).firefly.inp (generated)

005138852.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005138852.mol 005138852.PUBCHEM 005138852.mol (via Jmol)
005138875.b3lyp_6-31g(d).inp

005138875.b3lyp_6-31g(d).qchem.inp (generated)

005138875.b3lyp_6-31g(d).gjf (generated)

005138875.b3lyp_6-31g(d).firefly.inp (generated)

005138875.b3lyp_6-31g(d).smash.inp (generated)

005138875.b3lyp_6-31g(d).nwchem.inp (generated) 005138875.b3lyp_6-31g(d).log.xz 005138875.td-b3lyp_6-31g+(d).inp 005138875.td-b3lyp_6-31g+(d).log.xz

005138875.td-b3lyp_6-31+g(d).qchem.inp (generated)

005138875.td-b3lyp_6-31+g(d).gjf (generated)

005138875.td-b3lyp_6-31+g(d).firefly.inp (generated)

005138875.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005138875.mol 005138875.PUBCHEM 005138875.mol (via Jmol)
005138905.b3lyp_6-31g(d).inp

005138905.b3lyp_6-31g(d).qchem.inp (generated)

005138905.b3lyp_6-31g(d).gjf (generated)

005138905.b3lyp_6-31g(d).firefly.inp (generated)

005138905.b3lyp_6-31g(d).smash.inp (generated)

005138905.b3lyp_6-31g(d).nwchem.inp (generated) 005138905.b3lyp_6-31g(d).log.xz 005138905.td-b3lyp_6-31g+(d).inp 005138905.td-b3lyp_6-31g+(d).log.xz

005138905.td-b3lyp_6-31+g(d).qchem.inp (generated)

005138905.td-b3lyp_6-31+g(d).gjf (generated)

005138905.td-b3lyp_6-31+g(d).firefly.inp (generated)

005138905.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005138905.mol 005138905.PUBCHEM 005138905.mol (via Jmol)
005139177.b3lyp_6-31g(d).inp

005139177.b3lyp_6-31g(d).qchem.inp (generated)

005139177.b3lyp_6-31g(d).gjf (generated)

005139177.b3lyp_6-31g(d).firefly.inp (generated)

005139177.b3lyp_6-31g(d).smash.inp (generated)

005139177.b3lyp_6-31g(d).nwchem.inp (generated) 005139177.b3lyp_6-31g(d).log.xz 005139177.mol 005139177.PUBCHEM 005139177.mol (via Jmol)
005139381.b3lyp_6-31g(d).inp

005139381.b3lyp_6-31g(d).qchem.inp (generated)

005139381.b3lyp_6-31g(d).gjf (generated)

005139381.b3lyp_6-31g(d).firefly.inp (generated)

005139381.b3lyp_6-31g(d).smash.inp (generated)

005139381.b3lyp_6-31g(d).nwchem.inp (generated) 005139381.b3lyp_6-31g(d).log.xz 005139381.td-b3lyp_6-31g+(d).inp 005139381.td-b3lyp_6-31g+(d).log.xz

005139381.td-b3lyp_6-31+g(d).qchem.inp (generated)

005139381.td-b3lyp_6-31+g(d).gjf (generated)

005139381.td-b3lyp_6-31+g(d).firefly.inp (generated)

005139381.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005139381.mol 005139381.PUBCHEM 005139381.mol (via Jmol)
005139534.b3lyp_6-31g(d).inp

005139534.b3lyp_6-31g(d).qchem.inp (generated)

005139534.b3lyp_6-31g(d).gjf (generated)

005139534.b3lyp_6-31g(d).firefly.inp (generated)

005139534.b3lyp_6-31g(d).smash.inp (generated)

005139534.b3lyp_6-31g(d).nwchem.inp (generated) 005139534.b3lyp_6-31g(d).log.xz 005139534.td-b3lyp_6-31g+(d).inp 005139534.td-b3lyp_6-31g+(d).log.xz

005139534.td-b3lyp_6-31+g(d).qchem.inp (generated)

005139534.td-b3lyp_6-31+g(d).gjf (generated)

005139534.td-b3lyp_6-31+g(d).firefly.inp (generated)

005139534.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005139534.mol 005139534.PUBCHEM 005139534.mol (via Jmol)
005139538.b3lyp_6-31g(d).inp

005139538.b3lyp_6-31g(d).qchem.inp (generated)

005139538.b3lyp_6-31g(d).gjf (generated)

005139538.b3lyp_6-31g(d).firefly.inp (generated)

005139538.b3lyp_6-31g(d).smash.inp (generated)

005139538.b3lyp_6-31g(d).nwchem.inp (generated) 005139538.b3lyp_6-31g(d).log.xz 005139538.td-b3lyp_6-31g+(d).inp 005139538.td-b3lyp_6-31g+(d).log.xz

005139538.td-b3lyp_6-31+g(d).qchem.inp (generated)

005139538.td-b3lyp_6-31+g(d).gjf (generated)

005139538.td-b3lyp_6-31+g(d).firefly.inp (generated)

005139538.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005139538.mol 005139538.PUBCHEM 005139538.mol (via Jmol)
005139555.b3lyp_6-31g(d).inp

005139555.b3lyp_6-31g(d).qchem.inp (generated)

005139555.b3lyp_6-31g(d).gjf (generated)

005139555.b3lyp_6-31g(d).firefly.inp (generated)

005139555.b3lyp_6-31g(d).smash.inp (generated)

005139555.b3lyp_6-31g(d).nwchem.inp (generated) 005139555.b3lyp_6-31g(d).log.xz 005139555.td-b3lyp_6-31g+(d).inp 005139555.td-b3lyp_6-31g+(d).log.xz

005139555.td-b3lyp_6-31+g(d).qchem.inp (generated)

005139555.td-b3lyp_6-31+g(d).gjf (generated)

005139555.td-b3lyp_6-31+g(d).firefly.inp (generated)

005139555.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005139555.mol 005139555.PUBCHEM 005139555.mol (via Jmol)
005139624.b3lyp_6-31g(d).inp

005139624.b3lyp_6-31g(d).qchem.inp (generated)

005139624.b3lyp_6-31g(d).gjf (generated)

005139624.b3lyp_6-31g(d).firefly.inp (generated)

005139624.b3lyp_6-31g(d).smash.inp (generated)

005139624.b3lyp_6-31g(d).nwchem.inp (generated) 005139624.b3lyp_6-31g(d).log.xz 005139624.mol 005139624.PUBCHEM 005139624.mol (via Jmol)
005139792.b3lyp_6-31g(d).inp

005139792.b3lyp_6-31g(d).qchem.inp (generated)

005139792.b3lyp_6-31g(d).gjf (generated)

005139792.b3lyp_6-31g(d).firefly.inp (generated)

005139792.b3lyp_6-31g(d).smash.inp (generated)

005139792.b3lyp_6-31g(d).nwchem.inp (generated) 005139792.b3lyp_6-31g(d).log.xz 005139792.td-b3lyp_6-31g+(d).inp 005139792.td-b3lyp_6-31g+(d).log.xz

005139792.td-b3lyp_6-31+g(d).qchem.inp (generated)

005139792.td-b3lyp_6-31+g(d).gjf (generated)

005139792.td-b3lyp_6-31+g(d).firefly.inp (generated)

005139792.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005139792.mol 005139792.PUBCHEM 005139792.mol (via Jmol)
005139794.b3lyp_6-31g(d).inp

005139794.b3lyp_6-31g(d).qchem.inp (generated)

005139794.b3lyp_6-31g(d).gjf (generated)

005139794.b3lyp_6-31g(d).firefly.inp (generated)

005139794.b3lyp_6-31g(d).smash.inp (generated)

005139794.b3lyp_6-31g(d).nwchem.inp (generated) 005139794.b3lyp_6-31g(d).log.xz 005139794.td-b3lyp_6-31g+(d).inp 005139794.td-b3lyp_6-31g+(d).log.xz

005139794.td-b3lyp_6-31+g(d).qchem.inp (generated)

005139794.td-b3lyp_6-31+g(d).gjf (generated)

005139794.td-b3lyp_6-31+g(d).firefly.inp (generated)

005139794.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005139794.mol 005139794.PUBCHEM 005139794.mol (via Jmol)
005139825.b3lyp_6-31g(d).inp

005139825.b3lyp_6-31g(d).qchem.inp (generated)

005139825.b3lyp_6-31g(d).gjf (generated)

005139825.b3lyp_6-31g(d).firefly.inp (generated)

005139825.b3lyp_6-31g(d).smash.inp (generated)

005139825.b3lyp_6-31g(d).nwchem.inp (generated) 005139825.b3lyp_6-31g(d).log.xz 005139825.td-b3lyp_6-31g+(d).inp 005139825.td-b3lyp_6-31g+(d).log.xz

005139825.td-b3lyp_6-31+g(d).qchem.inp (generated)

005139825.td-b3lyp_6-31+g(d).gjf (generated)

005139825.td-b3lyp_6-31+g(d).firefly.inp (generated)

005139825.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005139825.mol 005139825.PUBCHEM 005139825.mol (via Jmol)
005139870.b3lyp_6-31g(d).inp

005139870.b3lyp_6-31g(d).qchem.inp (generated)

005139870.b3lyp_6-31g(d).gjf (generated)

005139870.b3lyp_6-31g(d).firefly.inp (generated)

005139870.b3lyp_6-31g(d).smash.inp (generated)

005139870.b3lyp_6-31g(d).nwchem.inp (generated) 005139870.b3lyp_6-31g(d).log.xz 005139870.td-b3lyp_6-31g+(d).inp 005139870.td-b3lyp_6-31g+(d).log.xz

005139870.td-b3lyp_6-31+g(d).qchem.inp (generated)

005139870.td-b3lyp_6-31+g(d).gjf (generated)

005139870.td-b3lyp_6-31+g(d).firefly.inp (generated)

005139870.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005139870.mol 005139870.PUBCHEM 005139870.mol (via Jmol)
005139879.b3lyp_6-31g(d).inp

005139879.b3lyp_6-31g(d).qchem.inp (generated)

005139879.b3lyp_6-31g(d).gjf (generated)

005139879.b3lyp_6-31g(d).firefly.inp (generated)

005139879.b3lyp_6-31g(d).smash.inp (generated)

005139879.b3lyp_6-31g(d).nwchem.inp (generated) 005139879.b3lyp_6-31g(d).log.xz 005139879.td-b3lyp_6-31g+(d).inp 005139879.td-b3lyp_6-31g+(d).log.xz

005139879.td-b3lyp_6-31+g(d).qchem.inp (generated)

005139879.td-b3lyp_6-31+g(d).gjf (generated)

005139879.td-b3lyp_6-31+g(d).firefly.inp (generated)

005139879.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005139879.mol 005139879.PUBCHEM 005139879.mol (via Jmol)
005139889.b3lyp_6-31g(d).inp

005139889.b3lyp_6-31g(d).qchem.inp (generated)

005139889.b3lyp_6-31g(d).gjf (generated)

005139889.b3lyp_6-31g(d).firefly.inp (generated)

005139889.b3lyp_6-31g(d).smash.inp (generated)

005139889.b3lyp_6-31g(d).nwchem.inp (generated) 005139889.b3lyp_6-31g(d).log.xz 005139889.td-b3lyp_6-31g+(d).inp 005139889.td-b3lyp_6-31g+(d).log.xz

005139889.td-b3lyp_6-31+g(d).qchem.inp (generated)

005139889.td-b3lyp_6-31+g(d).gjf (generated)

005139889.td-b3lyp_6-31+g(d).firefly.inp (generated)

005139889.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005139889.mol 005139889.PUBCHEM 005139889.mol (via Jmol)
005139911.b3lyp_6-31g(d).inp

005139911.b3lyp_6-31g(d).qchem.inp (generated)

005139911.b3lyp_6-31g(d).gjf (generated)

005139911.b3lyp_6-31g(d).firefly.inp (generated)

005139911.b3lyp_6-31g(d).smash.inp (generated)

005139911.b3lyp_6-31g(d).nwchem.inp (generated) 005139911.b3lyp_6-31g(d).log.xz 005139911.td-b3lyp_6-31g+(d).inp 005139911.td-b3lyp_6-31g+(d).log.xz

005139911.td-b3lyp_6-31+g(d).qchem.inp (generated)

005139911.td-b3lyp_6-31+g(d).gjf (generated)

005139911.td-b3lyp_6-31+g(d).firefly.inp (generated)

005139911.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005139911.mol 005139911.PUBCHEM 005139911.mol (via Jmol)
005139938.b3lyp_6-31g(d).inp

005139938.b3lyp_6-31g(d).qchem.inp (generated)

005139938.b3lyp_6-31g(d).gjf (generated)

005139938.b3lyp_6-31g(d).firefly.inp (generated)

005139938.b3lyp_6-31g(d).smash.inp (generated)

005139938.b3lyp_6-31g(d).nwchem.inp (generated) 005139938.b3lyp_6-31g(d).log.xz 005139938.td-b3lyp_6-31g+(d).inp 005139938.td-b3lyp_6-31g+(d).log.xz

005139938.td-b3lyp_6-31+g(d).qchem.inp (generated)

005139938.td-b3lyp_6-31+g(d).gjf (generated)

005139938.td-b3lyp_6-31+g(d).firefly.inp (generated)

005139938.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005139938.mol 005139938.PUBCHEM 005139938.mol (via Jmol)
005139980.b3lyp_6-31g(d).inp

005139980.b3lyp_6-31g(d).qchem.inp (generated)

005139980.b3lyp_6-31g(d).gjf (generated)

005139980.b3lyp_6-31g(d).firefly.inp (generated)

005139980.b3lyp_6-31g(d).smash.inp (generated)

005139980.b3lyp_6-31g(d).nwchem.inp (generated) 005139980.b3lyp_6-31g(d).log.xz 005139980.td-b3lyp_6-31g+(d).inp 005139980.td-b3lyp_6-31g+(d).log.xz

005139980.td-b3lyp_6-31+g(d).qchem.inp (generated)

005139980.td-b3lyp_6-31+g(d).gjf (generated)

005139980.td-b3lyp_6-31+g(d).firefly.inp (generated)

005139980.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005139980.mol 005139980.PUBCHEM 005139980.mol (via Jmol)
005140003.b3lyp_6-31g(d).inp

005140003.b3lyp_6-31g(d).qchem.inp (generated)

005140003.b3lyp_6-31g(d).gjf (generated)

005140003.b3lyp_6-31g(d).firefly.inp (generated)

005140003.b3lyp_6-31g(d).smash.inp (generated)

005140003.b3lyp_6-31g(d).nwchem.inp (generated) 005140003.b3lyp_6-31g(d).log.xz 005140003.td-b3lyp_6-31g+(d).inp 005140003.td-b3lyp_6-31g+(d).log.xz

005140003.td-b3lyp_6-31+g(d).qchem.inp (generated)

005140003.td-b3lyp_6-31+g(d).gjf (generated)

005140003.td-b3lyp_6-31+g(d).firefly.inp (generated)

005140003.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005140003.mol 005140003.PUBCHEM 005140003.mol (via Jmol)
005140084.b3lyp_6-31g(d).inp

005140084.b3lyp_6-31g(d).qchem.inp (generated)

005140084.b3lyp_6-31g(d).gjf (generated)

005140084.b3lyp_6-31g(d).firefly.inp (generated)

005140084.b3lyp_6-31g(d).smash.inp (generated)

005140084.b3lyp_6-31g(d).nwchem.inp (generated) 005140084.b3lyp_6-31g(d).log.xz 005140084.td-b3lyp_6-31g+(d).inp 005140084.td-b3lyp_6-31g+(d).log.xz

005140084.td-b3lyp_6-31+g(d).qchem.inp (generated)

005140084.td-b3lyp_6-31+g(d).gjf (generated)

005140084.td-b3lyp_6-31+g(d).firefly.inp (generated)

005140084.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005140084.mol 005140084.PUBCHEM 005140084.mol (via Jmol)
005140351.b3lyp_6-31g(d).inp

005140351.b3lyp_6-31g(d).qchem.inp (generated)

005140351.b3lyp_6-31g(d).gjf (generated)

005140351.b3lyp_6-31g(d).firefly.inp (generated)

005140351.b3lyp_6-31g(d).smash.inp (generated)

005140351.b3lyp_6-31g(d).nwchem.inp (generated) 005140351.b3lyp_6-31g(d).log.xz 005140351.td-b3lyp_6-31g+(d).inp 005140351.td-b3lyp_6-31g+(d).log.xz

005140351.td-b3lyp_6-31+g(d).qchem.inp (generated)

005140351.td-b3lyp_6-31+g(d).gjf (generated)

005140351.td-b3lyp_6-31+g(d).firefly.inp (generated)

005140351.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005140351.mol 005140351.PUBCHEM 005140351.mol (via Jmol)
005140426.b3lyp_6-31g(d).inp

005140426.b3lyp_6-31g(d).qchem.inp (generated)

005140426.b3lyp_6-31g(d).gjf (generated)

005140426.b3lyp_6-31g(d).firefly.inp (generated)

005140426.b3lyp_6-31g(d).smash.inp (generated)

005140426.b3lyp_6-31g(d).nwchem.inp (generated) 005140426.b3lyp_6-31g(d).log.xz 005140426.td-b3lyp_6-31g+(d).inp 005140426.td-b3lyp_6-31g+(d).log.xz

005140426.td-b3lyp_6-31+g(d).qchem.inp (generated)

005140426.td-b3lyp_6-31+g(d).gjf (generated)

005140426.td-b3lyp_6-31+g(d).firefly.inp (generated)

005140426.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005140426.mol 005140426.PUBCHEM 005140426.mol (via Jmol)
005140436.b3lyp_6-31g(d).inp

005140436.b3lyp_6-31g(d).qchem.inp (generated)

005140436.b3lyp_6-31g(d).gjf (generated)

005140436.b3lyp_6-31g(d).firefly.inp (generated)

005140436.b3lyp_6-31g(d).smash.inp (generated)

005140436.b3lyp_6-31g(d).nwchem.inp (generated) 005140436.b3lyp_6-31g(d).log.xz 005140436.td-b3lyp_6-31g+(d).inp 005140436.td-b3lyp_6-31g+(d).log.xz

005140436.td-b3lyp_6-31+g(d).qchem.inp (generated)

005140436.td-b3lyp_6-31+g(d).gjf (generated)

005140436.td-b3lyp_6-31+g(d).firefly.inp (generated)

005140436.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005140436.mol 005140436.PUBCHEM 005140436.mol (via Jmol)
005140455.b3lyp_6-31g(d).inp

005140455.b3lyp_6-31g(d).qchem.inp (generated)

005140455.b3lyp_6-31g(d).gjf (generated)

005140455.b3lyp_6-31g(d).firefly.inp (generated)

005140455.b3lyp_6-31g(d).smash.inp (generated)

005140455.b3lyp_6-31g(d).nwchem.inp (generated) 005140455.b3lyp_6-31g(d).log.xz 005140455.td-b3lyp_6-31g+(d).inp 005140455.td-b3lyp_6-31g+(d).log.xz

005140455.td-b3lyp_6-31+g(d).qchem.inp (generated)

005140455.td-b3lyp_6-31+g(d).gjf (generated)

005140455.td-b3lyp_6-31+g(d).firefly.inp (generated)

005140455.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005140455.mol 005140455.PUBCHEM 005140455.mol (via Jmol)
005140464.b3lyp_6-31g(d).inp

005140464.b3lyp_6-31g(d).qchem.inp (generated)

005140464.b3lyp_6-31g(d).gjf (generated)

005140464.b3lyp_6-31g(d).firefly.inp (generated)

005140464.b3lyp_6-31g(d).smash.inp (generated)

005140464.b3lyp_6-31g(d).nwchem.inp (generated) 005140464.b3lyp_6-31g(d).log.xz 005140464.td-b3lyp_6-31g+(d).inp 005140464.td-b3lyp_6-31g+(d).log.xz

005140464.td-b3lyp_6-31+g(d).qchem.inp (generated)

005140464.td-b3lyp_6-31+g(d).gjf (generated)

005140464.td-b3lyp_6-31+g(d).firefly.inp (generated)

005140464.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005140464.mol 005140464.PUBCHEM 005140464.mol (via Jmol)
005140517.b3lyp_6-31g(d).inp

005140517.b3lyp_6-31g(d).qchem.inp (generated)

005140517.b3lyp_6-31g(d).gjf (generated)

005140517.b3lyp_6-31g(d).firefly.inp (generated)

005140517.b3lyp_6-31g(d).smash.inp (generated)

005140517.b3lyp_6-31g(d).nwchem.inp (generated) 005140517.b3lyp_6-31g(d).log.xz 005140517.td-b3lyp_6-31g+(d).inp 005140517.td-b3lyp_6-31g+(d).log.xz

005140517.td-b3lyp_6-31+g(d).qchem.inp (generated)

005140517.td-b3lyp_6-31+g(d).gjf (generated)

005140517.td-b3lyp_6-31+g(d).firefly.inp (generated)

005140517.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005140517.mol 005140517.PUBCHEM 005140517.mol (via Jmol)
005140531.b3lyp_6-31g(d).inp

005140531.b3lyp_6-31g(d).qchem.inp (generated)

005140531.b3lyp_6-31g(d).gjf (generated)

005140531.b3lyp_6-31g(d).firefly.inp (generated)

005140531.b3lyp_6-31g(d).smash.inp (generated)

005140531.b3lyp_6-31g(d).nwchem.inp (generated) 005140531.b3lyp_6-31g(d).log.xz 005140531.td-b3lyp_6-31g+(d).inp 005140531.td-b3lyp_6-31g+(d).log.xz

005140531.td-b3lyp_6-31+g(d).qchem.inp (generated)

005140531.td-b3lyp_6-31+g(d).gjf (generated)

005140531.td-b3lyp_6-31+g(d).firefly.inp (generated)

005140531.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005140531.mol 005140531.PUBCHEM 005140531.mol (via Jmol)
005140538.b3lyp_6-31g(d).inp

005140538.b3lyp_6-31g(d).qchem.inp (generated)

005140538.b3lyp_6-31g(d).gjf (generated)

005140538.b3lyp_6-31g(d).firefly.inp (generated)

005140538.b3lyp_6-31g(d).smash.inp (generated)

005140538.b3lyp_6-31g(d).nwchem.inp (generated) 005140538.b3lyp_6-31g(d).log.xz 005140538.td-b3lyp_6-31g+(d).inp 005140538.td-b3lyp_6-31g+(d).log.xz

005140538.td-b3lyp_6-31+g(d).qchem.inp (generated)

005140538.td-b3lyp_6-31+g(d).gjf (generated)

005140538.td-b3lyp_6-31+g(d).firefly.inp (generated)

005140538.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005140538.mol 005140538.PUBCHEM 005140538.mol (via Jmol)
005140539.b3lyp_6-31g(d).inp

005140539.b3lyp_6-31g(d).qchem.inp (generated)

005140539.b3lyp_6-31g(d).gjf (generated)

005140539.b3lyp_6-31g(d).firefly.inp (generated)

005140539.b3lyp_6-31g(d).smash.inp (generated)

005140539.b3lyp_6-31g(d).nwchem.inp (generated) 005140539.b3lyp_6-31g(d).log.xz 005140539.mol 005140539.PUBCHEM 005140539.mol (via Jmol)
005140574.b3lyp_6-31g(d).inp

005140574.b3lyp_6-31g(d).qchem.inp (generated)

005140574.b3lyp_6-31g(d).gjf (generated)

005140574.b3lyp_6-31g(d).firefly.inp (generated)

005140574.b3lyp_6-31g(d).smash.inp (generated)

005140574.b3lyp_6-31g(d).nwchem.inp (generated) 005140574.b3lyp_6-31g(d).log.xz 005140574.td-b3lyp_6-31g+(d).inp 005140574.td-b3lyp_6-31g+(d).log.xz

005140574.td-b3lyp_6-31+g(d).qchem.inp (generated)

005140574.td-b3lyp_6-31+g(d).gjf (generated)

005140574.td-b3lyp_6-31+g(d).firefly.inp (generated)

005140574.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005140574.mol 005140574.PUBCHEM 005140574.mol (via Jmol)
005140631.b3lyp_6-31g(d).inp

005140631.b3lyp_6-31g(d).qchem.inp (generated)

005140631.b3lyp_6-31g(d).gjf (generated)

005140631.b3lyp_6-31g(d).firefly.inp (generated)

005140631.b3lyp_6-31g(d).smash.inp (generated)

005140631.b3lyp_6-31g(d).nwchem.inp (generated) 005140631.b3lyp_6-31g(d).log.xz 005140631.mol 005140631.PUBCHEM 005140631.mol (via Jmol)
005140633.b3lyp_6-31g(d).inp

005140633.b3lyp_6-31g(d).qchem.inp (generated)

005140633.b3lyp_6-31g(d).gjf (generated)

005140633.b3lyp_6-31g(d).firefly.inp (generated)

005140633.b3lyp_6-31g(d).smash.inp (generated)

005140633.b3lyp_6-31g(d).nwchem.inp (generated) 005140633.b3lyp_6-31g(d).log.xz 005140633.td-b3lyp_6-31g+(d).inp 005140633.td-b3lyp_6-31g+(d).log.xz

005140633.td-b3lyp_6-31+g(d).qchem.inp (generated)

005140633.td-b3lyp_6-31+g(d).gjf (generated)

005140633.td-b3lyp_6-31+g(d).firefly.inp (generated)

005140633.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005140633.mol 005140633.PUBCHEM 005140633.mol (via Jmol)
005140634.b3lyp_6-31g(d).inp

005140634.b3lyp_6-31g(d).qchem.inp (generated)

005140634.b3lyp_6-31g(d).gjf (generated)

005140634.b3lyp_6-31g(d).firefly.inp (generated)

005140634.b3lyp_6-31g(d).smash.inp (generated)

005140634.b3lyp_6-31g(d).nwchem.inp (generated) 005140634.b3lyp_6-31g(d).log.xz 005140634.td-b3lyp_6-31g+(d).inp 005140634.td-b3lyp_6-31g+(d).log.xz

005140634.td-b3lyp_6-31+g(d).qchem.inp (generated)

005140634.td-b3lyp_6-31+g(d).gjf (generated)

005140634.td-b3lyp_6-31+g(d).firefly.inp (generated)

005140634.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005140634.mol 005140634.PUBCHEM 005140634.mol (via Jmol)
005140636.b3lyp_6-31g(d).inp

005140636.b3lyp_6-31g(d).qchem.inp (generated)

005140636.b3lyp_6-31g(d).gjf (generated)

005140636.b3lyp_6-31g(d).firefly.inp (generated)

005140636.b3lyp_6-31g(d).smash.inp (generated)

005140636.b3lyp_6-31g(d).nwchem.inp (generated) 005140636.b3lyp_6-31g(d).log.xz 005140636.mol 005140636.PUBCHEM 005140636.mol (via Jmol)
005140695.b3lyp_6-31g(d).inp

005140695.b3lyp_6-31g(d).qchem.inp (generated)

005140695.b3lyp_6-31g(d).gjf (generated)

005140695.b3lyp_6-31g(d).firefly.inp (generated)

005140695.b3lyp_6-31g(d).smash.inp (generated)

005140695.b3lyp_6-31g(d).nwchem.inp (generated) 005140695.b3lyp_6-31g(d).log.xz 005140695.td-b3lyp_6-31g+(d).inp 005140695.td-b3lyp_6-31g+(d).log.xz

005140695.td-b3lyp_6-31+g(d).qchem.inp (generated)

005140695.td-b3lyp_6-31+g(d).gjf (generated)

005140695.td-b3lyp_6-31+g(d).firefly.inp (generated)

005140695.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005140695.mol 005140695.PUBCHEM 005140695.mol (via Jmol)
005140696.b3lyp_6-31g(d).inp

005140696.b3lyp_6-31g(d).qchem.inp (generated)

005140696.b3lyp_6-31g(d).gjf (generated)

005140696.b3lyp_6-31g(d).firefly.inp (generated)

005140696.b3lyp_6-31g(d).smash.inp (generated)

005140696.b3lyp_6-31g(d).nwchem.inp (generated) 005140696.b3lyp_6-31g(d).log.xz 005140696.td-b3lyp_6-31g+(d).inp 005140696.td-b3lyp_6-31g+(d).log.xz

005140696.td-b3lyp_6-31+g(d).qchem.inp (generated)

005140696.td-b3lyp_6-31+g(d).gjf (generated)

005140696.td-b3lyp_6-31+g(d).firefly.inp (generated)

005140696.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005140696.mol 005140696.PUBCHEM 005140696.mol (via Jmol)
005140698.b3lyp_6-31g(d).inp

005140698.b3lyp_6-31g(d).qchem.inp (generated)

005140698.b3lyp_6-31g(d).gjf (generated)

005140698.b3lyp_6-31g(d).firefly.inp (generated)

005140698.b3lyp_6-31g(d).smash.inp (generated)

005140698.b3lyp_6-31g(d).nwchem.inp (generated) 005140698.b3lyp_6-31g(d).log.xz 005140698.td-b3lyp_6-31g+(d).inp 005140698.td-b3lyp_6-31g+(d).log.xz

005140698.td-b3lyp_6-31+g(d).qchem.inp (generated)

005140698.td-b3lyp_6-31+g(d).gjf (generated)

005140698.td-b3lyp_6-31+g(d).firefly.inp (generated)

005140698.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005140698.mol 005140698.PUBCHEM 005140698.mol (via Jmol)
005140851.b3lyp_6-31g(d).inp

005140851.b3lyp_6-31g(d).qchem.inp (generated)

005140851.b3lyp_6-31g(d).gjf (generated)

005140851.b3lyp_6-31g(d).firefly.inp (generated)

005140851.b3lyp_6-31g(d).smash.inp (generated)

005140851.b3lyp_6-31g(d).nwchem.inp (generated) 005140851.b3lyp_6-31g(d).log.xz 005140851.td-b3lyp_6-31g+(d).inp 005140851.td-b3lyp_6-31g+(d).log.xz

005140851.td-b3lyp_6-31+g(d).qchem.inp (generated)

005140851.td-b3lyp_6-31+g(d).gjf (generated)

005140851.td-b3lyp_6-31+g(d).firefly.inp (generated)

005140851.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005140851.mol 005140851.PUBCHEM 005140851.mol (via Jmol)
005140854.b3lyp_6-31g(d).inp

005140854.b3lyp_6-31g(d).qchem.inp (generated)

005140854.b3lyp_6-31g(d).gjf (generated)

005140854.b3lyp_6-31g(d).firefly.inp (generated)

005140854.b3lyp_6-31g(d).smash.inp (generated)

005140854.b3lyp_6-31g(d).nwchem.inp (generated) 005140854.b3lyp_6-31g(d).log.xz 005140854.td-b3lyp_6-31g+(d).inp 005140854.td-b3lyp_6-31g+(d).log.xz

005140854.td-b3lyp_6-31+g(d).qchem.inp (generated)

005140854.td-b3lyp_6-31+g(d).gjf (generated)

005140854.td-b3lyp_6-31+g(d).firefly.inp (generated)

005140854.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005140854.mol 005140854.PUBCHEM 005140854.mol (via Jmol)
005140861.b3lyp_6-31g(d).inp

005140861.b3lyp_6-31g(d).qchem.inp (generated)

005140861.b3lyp_6-31g(d).gjf (generated)

005140861.b3lyp_6-31g(d).firefly.inp (generated)

005140861.b3lyp_6-31g(d).smash.inp (generated)

005140861.b3lyp_6-31g(d).nwchem.inp (generated) 005140861.b3lyp_6-31g(d).log.xz 005140861.td-b3lyp_6-31g+(d).inp 005140861.td-b3lyp_6-31g+(d).log.xz

005140861.td-b3lyp_6-31+g(d).qchem.inp (generated)

005140861.td-b3lyp_6-31+g(d).gjf (generated)

005140861.td-b3lyp_6-31+g(d).firefly.inp (generated)

005140861.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005140861.mol 005140861.PUBCHEM 005140861.mol (via Jmol)
005140880.b3lyp_6-31g(d).inp

005140880.b3lyp_6-31g(d).qchem.inp (generated)

005140880.b3lyp_6-31g(d).gjf (generated)

005140880.b3lyp_6-31g(d).firefly.inp (generated)

005140880.b3lyp_6-31g(d).smash.inp (generated)

005140880.b3lyp_6-31g(d).nwchem.inp (generated) 005140880.b3lyp_6-31g(d).log.xz 005140880.td-b3lyp_6-31g+(d).inp 005140880.td-b3lyp_6-31g+(d).log.xz

005140880.td-b3lyp_6-31+g(d).qchem.inp (generated)

005140880.td-b3lyp_6-31+g(d).gjf (generated)

005140880.td-b3lyp_6-31+g(d).firefly.inp (generated)

005140880.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005140880.mol 005140880.PUBCHEM 005140880.mol (via Jmol)
005140915.b3lyp_6-31g(d).inp

005140915.b3lyp_6-31g(d).qchem.inp (generated)

005140915.b3lyp_6-31g(d).gjf (generated)

005140915.b3lyp_6-31g(d).firefly.inp (generated)

005140915.b3lyp_6-31g(d).smash.inp (generated)

005140915.b3lyp_6-31g(d).nwchem.inp (generated) 005140915.b3lyp_6-31g(d).log.xz 005140915.td-b3lyp_6-31g+(d).inp 005140915.td-b3lyp_6-31g+(d).log.xz

005140915.td-b3lyp_6-31+g(d).qchem.inp (generated)

005140915.td-b3lyp_6-31+g(d).gjf (generated)

005140915.td-b3lyp_6-31+g(d).firefly.inp (generated)

005140915.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005140915.mol 005140915.PUBCHEM 005140915.mol (via Jmol)
005140921.b3lyp_6-31g(d).inp

005140921.b3lyp_6-31g(d).qchem.inp (generated)

005140921.b3lyp_6-31g(d).gjf (generated)

005140921.b3lyp_6-31g(d).firefly.inp (generated)

005140921.b3lyp_6-31g(d).smash.inp (generated)

005140921.b3lyp_6-31g(d).nwchem.inp (generated) 005140921.b3lyp_6-31g(d).log.xz 005140921.mol 005140921.PUBCHEM 005140921.mol (via Jmol)
005140975.b3lyp_6-31g(d).inp

005140975.b3lyp_6-31g(d).qchem.inp (generated)

005140975.b3lyp_6-31g(d).gjf (generated)

005140975.b3lyp_6-31g(d).firefly.inp (generated)

005140975.b3lyp_6-31g(d).smash.inp (generated)

005140975.b3lyp_6-31g(d).nwchem.inp (generated) 005140975.b3lyp_6-31g(d).log.xz 005140975.td-b3lyp_6-31g+(d).inp 005140975.td-b3lyp_6-31g+(d).log.xz

005140975.td-b3lyp_6-31+g(d).qchem.inp (generated)

005140975.td-b3lyp_6-31+g(d).gjf (generated)

005140975.td-b3lyp_6-31+g(d).firefly.inp (generated)

005140975.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005140975.mol 005140975.PUBCHEM 005140975.mol (via Jmol)
005141035.b3lyp_6-31g(d).inp

005141035.b3lyp_6-31g(d).qchem.inp (generated)

005141035.b3lyp_6-31g(d).gjf (generated)

005141035.b3lyp_6-31g(d).firefly.inp (generated)

005141035.b3lyp_6-31g(d).smash.inp (generated)

005141035.b3lyp_6-31g(d).nwchem.inp (generated) 005141035.b3lyp_6-31g(d).log.xz 005141035.td-b3lyp_6-31g+(d).inp 005141035.td-b3lyp_6-31g+(d).log.xz

005141035.td-b3lyp_6-31+g(d).qchem.inp (generated)

005141035.td-b3lyp_6-31+g(d).gjf (generated)

005141035.td-b3lyp_6-31+g(d).firefly.inp (generated)

005141035.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005141035.mol 005141035.PUBCHEM 005141035.mol (via Jmol)
005141097.b3lyp_6-31g(d).inp

005141097.b3lyp_6-31g(d).qchem.inp (generated)

005141097.b3lyp_6-31g(d).gjf (generated)

005141097.b3lyp_6-31g(d).firefly.inp (generated)

005141097.b3lyp_6-31g(d).smash.inp (generated)

005141097.b3lyp_6-31g(d).nwchem.inp (generated) 005141097.b3lyp_6-31g(d).log.xz 005141097.td-b3lyp_6-31g+(d).inp 005141097.td-b3lyp_6-31g+(d).log.xz

005141097.td-b3lyp_6-31+g(d).qchem.inp (generated)

005141097.td-b3lyp_6-31+g(d).gjf (generated)

005141097.td-b3lyp_6-31+g(d).firefly.inp (generated)

005141097.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005141097.mol 005141097.PUBCHEM 005141097.mol (via Jmol)
005141119.b3lyp_6-31g(d).inp

005141119.b3lyp_6-31g(d).qchem.inp (generated)

005141119.b3lyp_6-31g(d).gjf (generated)

005141119.b3lyp_6-31g(d).firefly.inp (generated)

005141119.b3lyp_6-31g(d).smash.inp (generated)

005141119.b3lyp_6-31g(d).nwchem.inp (generated) 005141119.b3lyp_6-31g(d).log.xz 005141119.mol 005141119.PUBCHEM 005141119.mol (via Jmol)
005141124.b3lyp_6-31g(d).inp

005141124.b3lyp_6-31g(d).qchem.inp (generated)

005141124.b3lyp_6-31g(d).gjf (generated)

005141124.b3lyp_6-31g(d).firefly.inp (generated)

005141124.b3lyp_6-31g(d).smash.inp (generated)

005141124.b3lyp_6-31g(d).nwchem.inp (generated) 005141124.b3lyp_6-31g(d).log.xz 005141124.td-b3lyp_6-31g+(d).inp 005141124.td-b3lyp_6-31g+(d).log.xz

005141124.td-b3lyp_6-31+g(d).qchem.inp (generated)

005141124.td-b3lyp_6-31+g(d).gjf (generated)

005141124.td-b3lyp_6-31+g(d).firefly.inp (generated)

005141124.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005141124.mol 005141124.PUBCHEM 005141124.mol (via Jmol)
005141167.b3lyp_6-31g(d).inp

005141167.b3lyp_6-31g(d).qchem.inp (generated)

005141167.b3lyp_6-31g(d).gjf (generated)

005141167.b3lyp_6-31g(d).firefly.inp (generated)

005141167.b3lyp_6-31g(d).smash.inp (generated)

005141167.b3lyp_6-31g(d).nwchem.inp (generated) 005141167.b3lyp_6-31g(d).log.xz 005141167.td-b3lyp_6-31g+(d).inp 005141167.td-b3lyp_6-31g+(d).log.xz

005141167.td-b3lyp_6-31+g(d).qchem.inp (generated)

005141167.td-b3lyp_6-31+g(d).gjf (generated)

005141167.td-b3lyp_6-31+g(d).firefly.inp (generated)

005141167.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005141167.mol 005141167.PUBCHEM 005141167.mol (via Jmol)
005141169.b3lyp_6-31g(d).inp

005141169.b3lyp_6-31g(d).qchem.inp (generated)

005141169.b3lyp_6-31g(d).gjf (generated)

005141169.b3lyp_6-31g(d).firefly.inp (generated)

005141169.b3lyp_6-31g(d).smash.inp (generated)

005141169.b3lyp_6-31g(d).nwchem.inp (generated) 005141169.b3lyp_6-31g(d).log.xz 005141169.td-b3lyp_6-31g+(d).inp 005141169.td-b3lyp_6-31g+(d).log.xz

005141169.td-b3lyp_6-31+g(d).qchem.inp (generated)

005141169.td-b3lyp_6-31+g(d).gjf (generated)

005141169.td-b3lyp_6-31+g(d).firefly.inp (generated)

005141169.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005141169.mol 005141169.PUBCHEM 005141169.mol (via Jmol)
005141174.b3lyp_6-31g(d).inp

005141174.b3lyp_6-31g(d).qchem.inp (generated)

005141174.b3lyp_6-31g(d).gjf (generated)

005141174.b3lyp_6-31g(d).firefly.inp (generated)

005141174.b3lyp_6-31g(d).smash.inp (generated)

005141174.b3lyp_6-31g(d).nwchem.inp (generated) 005141174.b3lyp_6-31g(d).log.xz 005141174.mol 005141174.PUBCHEM 005141174.mol (via Jmol)
005141177.b3lyp_6-31g(d).inp

005141177.b3lyp_6-31g(d).qchem.inp (generated)

005141177.b3lyp_6-31g(d).gjf (generated)

005141177.b3lyp_6-31g(d).firefly.inp (generated)

005141177.b3lyp_6-31g(d).smash.inp (generated)

005141177.b3lyp_6-31g(d).nwchem.inp (generated) 005141177.b3lyp_6-31g(d).log.xz 005141177.mol 005141177.PUBCHEM 005141177.mol (via Jmol)
005141180.b3lyp_6-31g(d).inp

005141180.b3lyp_6-31g(d).qchem.inp (generated)

005141180.b3lyp_6-31g(d).gjf (generated)

005141180.b3lyp_6-31g(d).firefly.inp (generated)

005141180.b3lyp_6-31g(d).smash.inp (generated)

005141180.b3lyp_6-31g(d).nwchem.inp (generated) 005141180.b3lyp_6-31g(d).log.xz 005141180.td-b3lyp_6-31g+(d).inp 005141180.td-b3lyp_6-31g+(d).log.xz

005141180.td-b3lyp_6-31+g(d).qchem.inp (generated)

005141180.td-b3lyp_6-31+g(d).gjf (generated)

005141180.td-b3lyp_6-31+g(d).firefly.inp (generated)

005141180.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005141180.mol 005141180.PUBCHEM 005141180.mol (via Jmol)
005141242.b3lyp_6-31g(d).inp

005141242.b3lyp_6-31g(d).qchem.inp (generated)

005141242.b3lyp_6-31g(d).gjf (generated)

005141242.b3lyp_6-31g(d).firefly.inp (generated)

005141242.b3lyp_6-31g(d).smash.inp (generated)

005141242.b3lyp_6-31g(d).nwchem.inp (generated) 005141242.b3lyp_6-31g(d).log.xz 005141242.td-b3lyp_6-31g+(d).inp 005141242.td-b3lyp_6-31g+(d).log.xz

005141242.td-b3lyp_6-31+g(d).qchem.inp (generated)

005141242.td-b3lyp_6-31+g(d).gjf (generated)

005141242.td-b3lyp_6-31+g(d).firefly.inp (generated)

005141242.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005141242.mol 005141242.PUBCHEM 005141242.mol (via Jmol)
005141287.b3lyp_6-31g(d).inp

005141287.b3lyp_6-31g(d).qchem.inp (generated)

005141287.b3lyp_6-31g(d).gjf (generated)

005141287.b3lyp_6-31g(d).firefly.inp (generated)

005141287.b3lyp_6-31g(d).smash.inp (generated)

005141287.b3lyp_6-31g(d).nwchem.inp (generated) 005141287.b3lyp_6-31g(d).log.xz 005141287.td-b3lyp_6-31g+(d).inp 005141287.td-b3lyp_6-31g+(d).log.xz

005141287.td-b3lyp_6-31+g(d).qchem.inp (generated)

005141287.td-b3lyp_6-31+g(d).gjf (generated)

005141287.td-b3lyp_6-31+g(d).firefly.inp (generated)

005141287.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005141287.mol 005141287.PUBCHEM 005141287.mol (via Jmol)
005141323.b3lyp_6-31g(d).inp

005141323.b3lyp_6-31g(d).qchem.inp (generated)

005141323.b3lyp_6-31g(d).gjf (generated)

005141323.b3lyp_6-31g(d).firefly.inp (generated)

005141323.b3lyp_6-31g(d).smash.inp (generated)

005141323.b3lyp_6-31g(d).nwchem.inp (generated) 005141323.b3lyp_6-31g(d).log.xz 005141323.td-b3lyp_6-31g+(d).inp 005141323.td-b3lyp_6-31g+(d).log.xz

005141323.td-b3lyp_6-31+g(d).qchem.inp (generated)

005141323.td-b3lyp_6-31+g(d).gjf (generated)

005141323.td-b3lyp_6-31+g(d).firefly.inp (generated)

005141323.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005141323.mol 005141323.PUBCHEM 005141323.mol (via Jmol)
005141363.b3lyp_6-31g(d).inp

005141363.b3lyp_6-31g(d).qchem.inp (generated)

005141363.b3lyp_6-31g(d).gjf (generated)

005141363.b3lyp_6-31g(d).firefly.inp (generated)

005141363.b3lyp_6-31g(d).smash.inp (generated)

005141363.b3lyp_6-31g(d).nwchem.inp (generated) 005141363.b3lyp_6-31g(d).log.xz 005141363.td-b3lyp_6-31g+(d).inp 005141363.td-b3lyp_6-31g+(d).log.xz

005141363.td-b3lyp_6-31+g(d).qchem.inp (generated)

005141363.td-b3lyp_6-31+g(d).gjf (generated)

005141363.td-b3lyp_6-31+g(d).firefly.inp (generated)

005141363.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005141363.mol 005141363.PUBCHEM 005141363.mol (via Jmol)
005141364.b3lyp_6-31g(d).inp

005141364.b3lyp_6-31g(d).qchem.inp (generated)

005141364.b3lyp_6-31g(d).gjf (generated)

005141364.b3lyp_6-31g(d).firefly.inp (generated)

005141364.b3lyp_6-31g(d).smash.inp (generated)

005141364.b3lyp_6-31g(d).nwchem.inp (generated) 005141364.b3lyp_6-31g(d).log.xz 005141364.td-b3lyp_6-31g+(d).inp 005141364.td-b3lyp_6-31g+(d).log.xz

005141364.td-b3lyp_6-31+g(d).qchem.inp (generated)

005141364.td-b3lyp_6-31+g(d).gjf (generated)

005141364.td-b3lyp_6-31+g(d).firefly.inp (generated)

005141364.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005141364.mol 005141364.PUBCHEM 005141364.mol (via Jmol)
005141395.b3lyp_6-31g(d).inp

005141395.b3lyp_6-31g(d).qchem.inp (generated)

005141395.b3lyp_6-31g(d).gjf (generated)

005141395.b3lyp_6-31g(d).firefly.inp (generated)

005141395.b3lyp_6-31g(d).smash.inp (generated)

005141395.b3lyp_6-31g(d).nwchem.inp (generated) 005141395.b3lyp_6-31g(d).log.xz 005141395.td-b3lyp_6-31g+(d).inp 005141395.td-b3lyp_6-31g+(d).log.xz

005141395.td-b3lyp_6-31+g(d).qchem.inp (generated)

005141395.td-b3lyp_6-31+g(d).gjf (generated)

005141395.td-b3lyp_6-31+g(d).firefly.inp (generated)

005141395.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005141395.mol 005141395.PUBCHEM 005141395.mol (via Jmol)
005141423.b3lyp_6-31g(d).inp

005141423.b3lyp_6-31g(d).qchem.inp (generated)

005141423.b3lyp_6-31g(d).gjf (generated)

005141423.b3lyp_6-31g(d).firefly.inp (generated)

005141423.b3lyp_6-31g(d).smash.inp (generated)

005141423.b3lyp_6-31g(d).nwchem.inp (generated) 005141423.b3lyp_6-31g(d).log.xz 005141423.td-b3lyp_6-31g+(d).inp 005141423.td-b3lyp_6-31g+(d).log.xz

005141423.td-b3lyp_6-31+g(d).qchem.inp (generated)

005141423.td-b3lyp_6-31+g(d).gjf (generated)

005141423.td-b3lyp_6-31+g(d).firefly.inp (generated)

005141423.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005141423.mol 005141423.PUBCHEM 005141423.mol (via Jmol)
005141598.b3lyp_6-31g(d).inp

005141598.b3lyp_6-31g(d).qchem.inp (generated)

005141598.b3lyp_6-31g(d).gjf (generated)

005141598.b3lyp_6-31g(d).firefly.inp (generated)

005141598.b3lyp_6-31g(d).smash.inp (generated)

005141598.b3lyp_6-31g(d).nwchem.inp (generated) 005141598.b3lyp_6-31g(d).log.xz 005141598.td-b3lyp_6-31g+(d).inp 005141598.td-b3lyp_6-31g+(d).log.xz

005141598.td-b3lyp_6-31+g(d).qchem.inp (generated)

005141598.td-b3lyp_6-31+g(d).gjf (generated)

005141598.td-b3lyp_6-31+g(d).firefly.inp (generated)

005141598.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005141598.mol 005141598.PUBCHEM 005141598.mol (via Jmol)
005141659.b3lyp_6-31g(d).inp

005141659.b3lyp_6-31g(d).qchem.inp (generated)

005141659.b3lyp_6-31g(d).gjf (generated)

005141659.b3lyp_6-31g(d).firefly.inp (generated)

005141659.b3lyp_6-31g(d).smash.inp (generated)

005141659.b3lyp_6-31g(d).nwchem.inp (generated) 005141659.b3lyp_6-31g(d).log.xz 005141659.td-b3lyp_6-31g+(d).inp 005141659.td-b3lyp_6-31g+(d).log.xz

005141659.td-b3lyp_6-31+g(d).qchem.inp (generated)

005141659.td-b3lyp_6-31+g(d).gjf (generated)

005141659.td-b3lyp_6-31+g(d).firefly.inp (generated)

005141659.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005141659.mol 005141659.PUBCHEM 005141659.mol (via Jmol)
005141660.b3lyp_6-31g(d).inp

005141660.b3lyp_6-31g(d).qchem.inp (generated)

005141660.b3lyp_6-31g(d).gjf (generated)

005141660.b3lyp_6-31g(d).firefly.inp (generated)

005141660.b3lyp_6-31g(d).smash.inp (generated)

005141660.b3lyp_6-31g(d).nwchem.inp (generated) 005141660.b3lyp_6-31g(d).log.xz 005141660.td-b3lyp_6-31g+(d).inp 005141660.td-b3lyp_6-31g+(d).log.xz

005141660.td-b3lyp_6-31+g(d).qchem.inp (generated)

005141660.td-b3lyp_6-31+g(d).gjf (generated)

005141660.td-b3lyp_6-31+g(d).firefly.inp (generated)

005141660.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005141660.mol 005141660.PUBCHEM 005141660.mol (via Jmol)
005141789.b3lyp_6-31g(d).inp

005141789.b3lyp_6-31g(d).qchem.inp (generated)

005141789.b3lyp_6-31g(d).gjf (generated)

005141789.b3lyp_6-31g(d).firefly.inp (generated)

005141789.b3lyp_6-31g(d).smash.inp (generated)

005141789.b3lyp_6-31g(d).nwchem.inp (generated) 005141789.b3lyp_6-31g(d).log.xz 005141789.td-b3lyp_6-31g+(d).inp 005141789.td-b3lyp_6-31g+(d).log.xz

005141789.td-b3lyp_6-31+g(d).qchem.inp (generated)

005141789.td-b3lyp_6-31+g(d).gjf (generated)

005141789.td-b3lyp_6-31+g(d).firefly.inp (generated)

005141789.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005141789.mol 005141789.PUBCHEM 005141789.mol (via Jmol)
005141820.b3lyp_6-31g(d).inp

005141820.b3lyp_6-31g(d).qchem.inp (generated)

005141820.b3lyp_6-31g(d).gjf (generated)

005141820.b3lyp_6-31g(d).firefly.inp (generated)

005141820.b3lyp_6-31g(d).smash.inp (generated)

005141820.b3lyp_6-31g(d).nwchem.inp (generated) 005141820.b3lyp_6-31g(d).log.xz 005141820.td-b3lyp_6-31g+(d).inp 005141820.td-b3lyp_6-31g+(d).log.xz

005141820.td-b3lyp_6-31+g(d).qchem.inp (generated)

005141820.td-b3lyp_6-31+g(d).gjf (generated)

005141820.td-b3lyp_6-31+g(d).firefly.inp (generated)

005141820.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005141820.mol 005141820.PUBCHEM 005141820.mol (via Jmol)
005141846.b3lyp_6-31g(d).inp

005141846.b3lyp_6-31g(d).qchem.inp (generated)

005141846.b3lyp_6-31g(d).gjf (generated)

005141846.b3lyp_6-31g(d).firefly.inp (generated)

005141846.b3lyp_6-31g(d).smash.inp (generated)

005141846.b3lyp_6-31g(d).nwchem.inp (generated) 005141846.b3lyp_6-31g(d).log.xz 005141846.td-b3lyp_6-31g+(d).inp 005141846.td-b3lyp_6-31g+(d).log.xz

005141846.td-b3lyp_6-31+g(d).qchem.inp (generated)

005141846.td-b3lyp_6-31+g(d).gjf (generated)

005141846.td-b3lyp_6-31+g(d).firefly.inp (generated)

005141846.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005141846.mol 005141846.PUBCHEM 005141846.mol (via Jmol)
005141956.b3lyp_6-31g(d).inp

005141956.b3lyp_6-31g(d).qchem.inp (generated)

005141956.b3lyp_6-31g(d).gjf (generated)

005141956.b3lyp_6-31g(d).firefly.inp (generated)

005141956.b3lyp_6-31g(d).smash.inp (generated)

005141956.b3lyp_6-31g(d).nwchem.inp (generated) 005141956.b3lyp_6-31g(d).log.xz 005141956.td-b3lyp_6-31g+(d).inp 005141956.td-b3lyp_6-31g+(d).log.xz

005141956.td-b3lyp_6-31+g(d).qchem.inp (generated)

005141956.td-b3lyp_6-31+g(d).gjf (generated)

005141956.td-b3lyp_6-31+g(d).firefly.inp (generated)

005141956.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005141956.mol 005141956.PUBCHEM 005141956.mol (via Jmol)
005142022.b3lyp_6-31g(d).inp

005142022.b3lyp_6-31g(d).qchem.inp (generated)

005142022.b3lyp_6-31g(d).gjf (generated)

005142022.b3lyp_6-31g(d).firefly.inp (generated)

005142022.b3lyp_6-31g(d).smash.inp (generated)

005142022.b3lyp_6-31g(d).nwchem.inp (generated) 005142022.b3lyp_6-31g(d).log.xz 005142022.td-b3lyp_6-31g+(d).inp 005142022.td-b3lyp_6-31g+(d).log.xz

005142022.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142022.td-b3lyp_6-31+g(d).gjf (generated)

005142022.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142022.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142022.mol 005142022.PUBCHEM 005142022.mol (via Jmol)
005142024.b3lyp_6-31g(d).inp

005142024.b3lyp_6-31g(d).qchem.inp (generated)

005142024.b3lyp_6-31g(d).gjf (generated)

005142024.b3lyp_6-31g(d).firefly.inp (generated)

005142024.b3lyp_6-31g(d).smash.inp (generated)

005142024.b3lyp_6-31g(d).nwchem.inp (generated) 005142024.b3lyp_6-31g(d).log.xz 005142024.mol 005142024.PUBCHEM 005142024.mol (via Jmol)
005142038.b3lyp_6-31g(d).inp

005142038.b3lyp_6-31g(d).qchem.inp (generated)

005142038.b3lyp_6-31g(d).gjf (generated)

005142038.b3lyp_6-31g(d).firefly.inp (generated)

005142038.b3lyp_6-31g(d).smash.inp (generated)

005142038.b3lyp_6-31g(d).nwchem.inp (generated) 005142038.b3lyp_6-31g(d).log.xz 005142038.td-b3lyp_6-31g+(d).inp 005142038.td-b3lyp_6-31g+(d).log.xz

005142038.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142038.td-b3lyp_6-31+g(d).gjf (generated)

005142038.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142038.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142038.mol 005142038.PUBCHEM 005142038.mol (via Jmol)
005142041.b3lyp_6-31g(d).inp

005142041.b3lyp_6-31g(d).qchem.inp (generated)

005142041.b3lyp_6-31g(d).gjf (generated)

005142041.b3lyp_6-31g(d).firefly.inp (generated)

005142041.b3lyp_6-31g(d).smash.inp (generated)

005142041.b3lyp_6-31g(d).nwchem.inp (generated) 005142041.b3lyp_6-31g(d).log.xz 005142041.td-b3lyp_6-31g+(d).inp 005142041.td-b3lyp_6-31g+(d).log.xz

005142041.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142041.td-b3lyp_6-31+g(d).gjf (generated)

005142041.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142041.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142041.mol 005142041.PUBCHEM 005142041.mol (via Jmol)
005142044.b3lyp_6-31g(d).inp

005142044.b3lyp_6-31g(d).qchem.inp (generated)

005142044.b3lyp_6-31g(d).gjf (generated)

005142044.b3lyp_6-31g(d).firefly.inp (generated)

005142044.b3lyp_6-31g(d).smash.inp (generated)

005142044.b3lyp_6-31g(d).nwchem.inp (generated) 005142044.b3lyp_6-31g(d).log.xz 005142044.td-b3lyp_6-31g+(d).inp 005142044.td-b3lyp_6-31g+(d).log.xz

005142044.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142044.td-b3lyp_6-31+g(d).gjf (generated)

005142044.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142044.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142044.mol 005142044.PUBCHEM 005142044.mol (via Jmol)
005142091.b3lyp_6-31g(d).inp

005142091.b3lyp_6-31g(d).qchem.inp (generated)

005142091.b3lyp_6-31g(d).gjf (generated)

005142091.b3lyp_6-31g(d).firefly.inp (generated)

005142091.b3lyp_6-31g(d).smash.inp (generated)

005142091.b3lyp_6-31g(d).nwchem.inp (generated) 005142091.b3lyp_6-31g(d).log.xz 005142091.td-b3lyp_6-31g+(d).inp 005142091.td-b3lyp_6-31g+(d).log.xz

005142091.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142091.td-b3lyp_6-31+g(d).gjf (generated)

005142091.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142091.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142091.mol 005142091.PUBCHEM 005142091.mol (via Jmol)
005142102.b3lyp_6-31g(d).inp

005142102.b3lyp_6-31g(d).qchem.inp (generated)

005142102.b3lyp_6-31g(d).gjf (generated)

005142102.b3lyp_6-31g(d).firefly.inp (generated)

005142102.b3lyp_6-31g(d).smash.inp (generated)

005142102.b3lyp_6-31g(d).nwchem.inp (generated) 005142102.b3lyp_6-31g(d).log.xz 005142102.td-b3lyp_6-31g+(d).inp 005142102.td-b3lyp_6-31g+(d).log.xz

005142102.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142102.td-b3lyp_6-31+g(d).gjf (generated)

005142102.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142102.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142102.mol 005142102.PUBCHEM 005142102.mol (via Jmol)
005142111.b3lyp_6-31g(d).inp

005142111.b3lyp_6-31g(d).qchem.inp (generated)

005142111.b3lyp_6-31g(d).gjf (generated)

005142111.b3lyp_6-31g(d).firefly.inp (generated)

005142111.b3lyp_6-31g(d).smash.inp (generated)

005142111.b3lyp_6-31g(d).nwchem.inp (generated) 005142111.b3lyp_6-31g(d).log.xz 005142111.td-b3lyp_6-31g+(d).inp 005142111.td-b3lyp_6-31g+(d).log.xz

005142111.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142111.td-b3lyp_6-31+g(d).gjf (generated)

005142111.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142111.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142111.mol 005142111.PUBCHEM 005142111.mol (via Jmol)
005142155.b3lyp_6-31g(d).inp

005142155.b3lyp_6-31g(d).qchem.inp (generated)

005142155.b3lyp_6-31g(d).gjf (generated)

005142155.b3lyp_6-31g(d).firefly.inp (generated)

005142155.b3lyp_6-31g(d).smash.inp (generated)

005142155.b3lyp_6-31g(d).nwchem.inp (generated) 005142155.b3lyp_6-31g(d).log.xz 005142155.td-b3lyp_6-31g+(d).inp 005142155.td-b3lyp_6-31g+(d).log.xz

005142155.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142155.td-b3lyp_6-31+g(d).gjf (generated)

005142155.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142155.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142155.mol 005142155.PUBCHEM 005142155.mol (via Jmol)
005142183.b3lyp_6-31g(d).inp

005142183.b3lyp_6-31g(d).qchem.inp (generated)

005142183.b3lyp_6-31g(d).gjf (generated)

005142183.b3lyp_6-31g(d).firefly.inp (generated)

005142183.b3lyp_6-31g(d).smash.inp (generated)

005142183.b3lyp_6-31g(d).nwchem.inp (generated) 005142183.b3lyp_6-31g(d).log.xz 005142183.mol 005142183.PUBCHEM 005142183.mol (via Jmol)
005142223.b3lyp_6-31g(d).inp

005142223.b3lyp_6-31g(d).qchem.inp (generated)

005142223.b3lyp_6-31g(d).gjf (generated)

005142223.b3lyp_6-31g(d).firefly.inp (generated)

005142223.b3lyp_6-31g(d).smash.inp (generated)

005142223.b3lyp_6-31g(d).nwchem.inp (generated) 005142223.b3lyp_6-31g(d).log.xz 005142223.td-b3lyp_6-31g+(d).inp 005142223.td-b3lyp_6-31g+(d).log.xz

005142223.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142223.td-b3lyp_6-31+g(d).gjf (generated)

005142223.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142223.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142223.mol 005142223.PUBCHEM 005142223.mol (via Jmol)
005142253.b3lyp_6-31g(d).inp

005142253.b3lyp_6-31g(d).qchem.inp (generated)

005142253.b3lyp_6-31g(d).gjf (generated)

005142253.b3lyp_6-31g(d).firefly.inp (generated)

005142253.b3lyp_6-31g(d).smash.inp (generated)

005142253.b3lyp_6-31g(d).nwchem.inp (generated) 005142253.b3lyp_6-31g(d).log.xz 005142253.mol 005142253.PUBCHEM 005142253.mol (via Jmol)
005142281.b3lyp_6-31g(d).inp

005142281.b3lyp_6-31g(d).qchem.inp (generated)

005142281.b3lyp_6-31g(d).gjf (generated)

005142281.b3lyp_6-31g(d).firefly.inp (generated)

005142281.b3lyp_6-31g(d).smash.inp (generated)

005142281.b3lyp_6-31g(d).nwchem.inp (generated) 005142281.b3lyp_6-31g(d).log.xz 005142281.td-b3lyp_6-31g+(d).inp 005142281.td-b3lyp_6-31g+(d).log.xz

005142281.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142281.td-b3lyp_6-31+g(d).gjf (generated)

005142281.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142281.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142281.mol 005142281.PUBCHEM 005142281.mol (via Jmol)
005142303.b3lyp_6-31g(d).inp

005142303.b3lyp_6-31g(d).qchem.inp (generated)

005142303.b3lyp_6-31g(d).gjf (generated)

005142303.b3lyp_6-31g(d).firefly.inp (generated)

005142303.b3lyp_6-31g(d).smash.inp (generated)

005142303.b3lyp_6-31g(d).nwchem.inp (generated) 005142303.b3lyp_6-31g(d).log.xz 005142303.td-b3lyp_6-31g+(d).inp 005142303.td-b3lyp_6-31g+(d).log.xz

005142303.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142303.td-b3lyp_6-31+g(d).gjf (generated)

005142303.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142303.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142303.mol 005142303.PUBCHEM 005142303.mol (via Jmol)
005142307.b3lyp_6-31g(d).inp

005142307.b3lyp_6-31g(d).qchem.inp (generated)

005142307.b3lyp_6-31g(d).gjf (generated)

005142307.b3lyp_6-31g(d).firefly.inp (generated)

005142307.b3lyp_6-31g(d).smash.inp (generated)

005142307.b3lyp_6-31g(d).nwchem.inp (generated) 005142307.b3lyp_6-31g(d).log.xz 005142307.td-b3lyp_6-31g+(d).inp 005142307.td-b3lyp_6-31g+(d).log.xz

005142307.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142307.td-b3lyp_6-31+g(d).gjf (generated)

005142307.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142307.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142307.mol 005142307.PUBCHEM 005142307.mol (via Jmol)
005142382.b3lyp_6-31g(d).inp

005142382.b3lyp_6-31g(d).qchem.inp (generated)

005142382.b3lyp_6-31g(d).gjf (generated)

005142382.b3lyp_6-31g(d).firefly.inp (generated)

005142382.b3lyp_6-31g(d).smash.inp (generated)

005142382.b3lyp_6-31g(d).nwchem.inp (generated) 005142382.b3lyp_6-31g(d).log.xz 005142382.mol 005142382.PUBCHEM 005142382.mol (via Jmol)
005142393.b3lyp_6-31g(d).inp

005142393.b3lyp_6-31g(d).qchem.inp (generated)

005142393.b3lyp_6-31g(d).gjf (generated)

005142393.b3lyp_6-31g(d).firefly.inp (generated)

005142393.b3lyp_6-31g(d).smash.inp (generated)

005142393.b3lyp_6-31g(d).nwchem.inp (generated) 005142393.b3lyp_6-31g(d).log.xz 005142393.mol 005142393.PUBCHEM 005142393.mol (via Jmol)
005142457.b3lyp_6-31g(d).inp

005142457.b3lyp_6-31g(d).qchem.inp (generated)

005142457.b3lyp_6-31g(d).gjf (generated)

005142457.b3lyp_6-31g(d).firefly.inp (generated)

005142457.b3lyp_6-31g(d).smash.inp (generated)

005142457.b3lyp_6-31g(d).nwchem.inp (generated) 005142457.b3lyp_6-31g(d).log.xz 005142457.td-b3lyp_6-31g+(d).inp 005142457.td-b3lyp_6-31g+(d).log.xz

005142457.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142457.td-b3lyp_6-31+g(d).gjf (generated)

005142457.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142457.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142457.mol 005142457.PUBCHEM 005142457.mol (via Jmol)
005142458.b3lyp_6-31g(d).inp

005142458.b3lyp_6-31g(d).qchem.inp (generated)

005142458.b3lyp_6-31g(d).gjf (generated)

005142458.b3lyp_6-31g(d).firefly.inp (generated)

005142458.b3lyp_6-31g(d).smash.inp (generated)

005142458.b3lyp_6-31g(d).nwchem.inp (generated) 005142458.b3lyp_6-31g(d).log.xz 005142458.td-b3lyp_6-31g+(d).inp 005142458.td-b3lyp_6-31g+(d).log.xz

005142458.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142458.td-b3lyp_6-31+g(d).gjf (generated)

005142458.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142458.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142458.mol 005142458.PUBCHEM 005142458.mol (via Jmol)
005142460.b3lyp_6-31g(d).inp

005142460.b3lyp_6-31g(d).qchem.inp (generated)

005142460.b3lyp_6-31g(d).gjf (generated)

005142460.b3lyp_6-31g(d).firefly.inp (generated)

005142460.b3lyp_6-31g(d).smash.inp (generated)

005142460.b3lyp_6-31g(d).nwchem.inp (generated) 005142460.b3lyp_6-31g(d).log.xz 005142460.td-b3lyp_6-31g+(d).inp 005142460.td-b3lyp_6-31g+(d).log.xz

005142460.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142460.td-b3lyp_6-31+g(d).gjf (generated)

005142460.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142460.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142460.mol 005142460.PUBCHEM 005142460.mol (via Jmol)
005142464.b3lyp_6-31g(d).inp

005142464.b3lyp_6-31g(d).qchem.inp (generated)

005142464.b3lyp_6-31g(d).gjf (generated)

005142464.b3lyp_6-31g(d).firefly.inp (generated)

005142464.b3lyp_6-31g(d).smash.inp (generated)

005142464.b3lyp_6-31g(d).nwchem.inp (generated) 005142464.b3lyp_6-31g(d).log.xz 005142464.td-b3lyp_6-31g+(d).inp 005142464.td-b3lyp_6-31g+(d).log.xz

005142464.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142464.td-b3lyp_6-31+g(d).gjf (generated)

005142464.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142464.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142464.mol 005142464.PUBCHEM 005142464.mol (via Jmol)
005142480.b3lyp_6-31g(d).inp

005142480.b3lyp_6-31g(d).qchem.inp (generated)

005142480.b3lyp_6-31g(d).gjf (generated)

005142480.b3lyp_6-31g(d).firefly.inp (generated)

005142480.b3lyp_6-31g(d).smash.inp (generated)

005142480.b3lyp_6-31g(d).nwchem.inp (generated) 005142480.b3lyp_6-31g(d).log.xz 005142480.td-b3lyp_6-31g+(d).inp 005142480.td-b3lyp_6-31g+(d).log.xz

005142480.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142480.td-b3lyp_6-31+g(d).gjf (generated)

005142480.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142480.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142480.mol 005142480.PUBCHEM 005142480.mol (via Jmol)
005142487.b3lyp_6-31g(d).inp

005142487.b3lyp_6-31g(d).qchem.inp (generated)

005142487.b3lyp_6-31g(d).gjf (generated)

005142487.b3lyp_6-31g(d).firefly.inp (generated)

005142487.b3lyp_6-31g(d).smash.inp (generated)

005142487.b3lyp_6-31g(d).nwchem.inp (generated) 005142487.b3lyp_6-31g(d).log.xz 005142487.td-b3lyp_6-31g+(d).inp 005142487.td-b3lyp_6-31g+(d).log.xz

005142487.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142487.td-b3lyp_6-31+g(d).gjf (generated)

005142487.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142487.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142487.mol 005142487.PUBCHEM 005142487.mol (via Jmol)
005142488.b3lyp_6-31g(d).inp

005142488.b3lyp_6-31g(d).qchem.inp (generated)

005142488.b3lyp_6-31g(d).gjf (generated)

005142488.b3lyp_6-31g(d).firefly.inp (generated)

005142488.b3lyp_6-31g(d).smash.inp (generated)

005142488.b3lyp_6-31g(d).nwchem.inp (generated) 005142488.b3lyp_6-31g(d).log.xz 005142488.td-b3lyp_6-31g+(d).inp 005142488.td-b3lyp_6-31g+(d).log.xz

005142488.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142488.td-b3lyp_6-31+g(d).gjf (generated)

005142488.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142488.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142488.mol 005142488.PUBCHEM 005142488.mol (via Jmol)
005142502.b3lyp_6-31g(d).inp

005142502.b3lyp_6-31g(d).qchem.inp (generated)

005142502.b3lyp_6-31g(d).gjf (generated)

005142502.b3lyp_6-31g(d).firefly.inp (generated)

005142502.b3lyp_6-31g(d).smash.inp (generated)

005142502.b3lyp_6-31g(d).nwchem.inp (generated) 005142502.b3lyp_6-31g(d).log.xz 005142502.td-b3lyp_6-31g+(d).inp 005142502.td-b3lyp_6-31g+(d).log.xz

005142502.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142502.td-b3lyp_6-31+g(d).gjf (generated)

005142502.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142502.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142502.mol 005142502.PUBCHEM 005142502.mol (via Jmol)
005142561.b3lyp_6-31g(d).inp

005142561.b3lyp_6-31g(d).qchem.inp (generated)

005142561.b3lyp_6-31g(d).gjf (generated)

005142561.b3lyp_6-31g(d).firefly.inp (generated)

005142561.b3lyp_6-31g(d).smash.inp (generated)

005142561.b3lyp_6-31g(d).nwchem.inp (generated) 005142561.b3lyp_6-31g(d).log.xz 005142561.td-b3lyp_6-31g+(d).inp 005142561.td-b3lyp_6-31g+(d).log.xz

005142561.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142561.td-b3lyp_6-31+g(d).gjf (generated)

005142561.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142561.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142561.mol 005142561.PUBCHEM 005142561.mol (via Jmol)
005142562.b3lyp_6-31g(d).inp

005142562.b3lyp_6-31g(d).qchem.inp (generated)

005142562.b3lyp_6-31g(d).gjf (generated)

005142562.b3lyp_6-31g(d).firefly.inp (generated)

005142562.b3lyp_6-31g(d).smash.inp (generated)

005142562.b3lyp_6-31g(d).nwchem.inp (generated) 005142562.b3lyp_6-31g(d).log.xz 005142562.mol 005142562.PUBCHEM 005142562.mol (via Jmol)
005142566.b3lyp_6-31g(d).inp

005142566.b3lyp_6-31g(d).qchem.inp (generated)

005142566.b3lyp_6-31g(d).gjf (generated)

005142566.b3lyp_6-31g(d).firefly.inp (generated)

005142566.b3lyp_6-31g(d).smash.inp (generated)

005142566.b3lyp_6-31g(d).nwchem.inp (generated) 005142566.b3lyp_6-31g(d).log.xz 005142566.td-b3lyp_6-31g+(d).inp 005142566.td-b3lyp_6-31g+(d).log.xz

005142566.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142566.td-b3lyp_6-31+g(d).gjf (generated)

005142566.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142566.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142566.mol 005142566.PUBCHEM 005142566.mol (via Jmol)
005142638.b3lyp_6-31g(d).inp

005142638.b3lyp_6-31g(d).qchem.inp (generated)

005142638.b3lyp_6-31g(d).gjf (generated)

005142638.b3lyp_6-31g(d).firefly.inp (generated)

005142638.b3lyp_6-31g(d).smash.inp (generated)

005142638.b3lyp_6-31g(d).nwchem.inp (generated) 005142638.b3lyp_6-31g(d).log.xz 005142638.td-b3lyp_6-31g+(d).inp 005142638.td-b3lyp_6-31g+(d).log.xz

005142638.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142638.td-b3lyp_6-31+g(d).gjf (generated)

005142638.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142638.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142638.mol 005142638.PUBCHEM 005142638.mol (via Jmol)
005142651.b3lyp_6-31g(d).inp

005142651.b3lyp_6-31g(d).qchem.inp (generated)

005142651.b3lyp_6-31g(d).gjf (generated)

005142651.b3lyp_6-31g(d).firefly.inp (generated)

005142651.b3lyp_6-31g(d).smash.inp (generated)

005142651.b3lyp_6-31g(d).nwchem.inp (generated) 005142651.b3lyp_6-31g(d).log.xz 005142651.td-b3lyp_6-31g+(d).inp 005142651.td-b3lyp_6-31g+(d).log.xz

005142651.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142651.td-b3lyp_6-31+g(d).gjf (generated)

005142651.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142651.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142651.mol 005142651.PUBCHEM 005142651.mol (via Jmol)
005142653.b3lyp_6-31g(d).inp

005142653.b3lyp_6-31g(d).qchem.inp (generated)

005142653.b3lyp_6-31g(d).gjf (generated)

005142653.b3lyp_6-31g(d).firefly.inp (generated)

005142653.b3lyp_6-31g(d).smash.inp (generated)

005142653.b3lyp_6-31g(d).nwchem.inp (generated) 005142653.b3lyp_6-31g(d).log.xz 005142653.td-b3lyp_6-31g+(d).inp 005142653.td-b3lyp_6-31g+(d).log.xz

005142653.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142653.td-b3lyp_6-31+g(d).gjf (generated)

005142653.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142653.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142653.mol 005142653.PUBCHEM 005142653.mol (via Jmol)
005142806.b3lyp_6-31g(d).inp

005142806.b3lyp_6-31g(d).qchem.inp (generated)

005142806.b3lyp_6-31g(d).gjf (generated)

005142806.b3lyp_6-31g(d).firefly.inp (generated)

005142806.b3lyp_6-31g(d).smash.inp (generated)

005142806.b3lyp_6-31g(d).nwchem.inp (generated) 005142806.b3lyp_6-31g(d).log.xz 005142806.mol 005142806.PUBCHEM 005142806.mol (via Jmol)
005142807.b3lyp_6-31g(d).inp

005142807.b3lyp_6-31g(d).qchem.inp (generated)

005142807.b3lyp_6-31g(d).gjf (generated)

005142807.b3lyp_6-31g(d).firefly.inp (generated)

005142807.b3lyp_6-31g(d).smash.inp (generated)

005142807.b3lyp_6-31g(d).nwchem.inp (generated) 005142807.b3lyp_6-31g(d).log.xz 005142807.td-b3lyp_6-31g+(d).inp 005142807.td-b3lyp_6-31g+(d).log.xz

005142807.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142807.td-b3lyp_6-31+g(d).gjf (generated)

005142807.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142807.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142807.mol 005142807.PUBCHEM 005142807.mol (via Jmol)
005142821.b3lyp_6-31g(d).inp

005142821.b3lyp_6-31g(d).qchem.inp (generated)

005142821.b3lyp_6-31g(d).gjf (generated)

005142821.b3lyp_6-31g(d).firefly.inp (generated)

005142821.b3lyp_6-31g(d).smash.inp (generated)

005142821.b3lyp_6-31g(d).nwchem.inp (generated) 005142821.b3lyp_6-31g(d).log.xz 005142821.td-b3lyp_6-31g+(d).inp 005142821.td-b3lyp_6-31g+(d).log.xz

005142821.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142821.td-b3lyp_6-31+g(d).gjf (generated)

005142821.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142821.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142821.mol 005142821.PUBCHEM 005142821.mol (via Jmol)
005142887.b3lyp_6-31g(d).inp

005142887.b3lyp_6-31g(d).qchem.inp (generated)

005142887.b3lyp_6-31g(d).gjf (generated)

005142887.b3lyp_6-31g(d).firefly.inp (generated)

005142887.b3lyp_6-31g(d).smash.inp (generated)

005142887.b3lyp_6-31g(d).nwchem.inp (generated) 005142887.b3lyp_6-31g(d).log.xz 005142887.td-b3lyp_6-31g+(d).inp 005142887.td-b3lyp_6-31g+(d).log.xz

005142887.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142887.td-b3lyp_6-31+g(d).gjf (generated)

005142887.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142887.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142887.mol 005142887.PUBCHEM 005142887.mol (via Jmol)
005142894.b3lyp_6-31g(d).inp

005142894.b3lyp_6-31g(d).qchem.inp (generated)

005142894.b3lyp_6-31g(d).gjf (generated)

005142894.b3lyp_6-31g(d).firefly.inp (generated)

005142894.b3lyp_6-31g(d).smash.inp (generated)

005142894.b3lyp_6-31g(d).nwchem.inp (generated) 005142894.b3lyp_6-31g(d).log.xz 005142894.td-b3lyp_6-31g+(d).inp 005142894.td-b3lyp_6-31g+(d).log.xz

005142894.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142894.td-b3lyp_6-31+g(d).gjf (generated)

005142894.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142894.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142894.mol 005142894.PUBCHEM 005142894.mol (via Jmol)
005142907.b3lyp_6-31g(d).inp

005142907.b3lyp_6-31g(d).qchem.inp (generated)

005142907.b3lyp_6-31g(d).gjf (generated)

005142907.b3lyp_6-31g(d).firefly.inp (generated)

005142907.b3lyp_6-31g(d).smash.inp (generated)

005142907.b3lyp_6-31g(d).nwchem.inp (generated) 005142907.b3lyp_6-31g(d).log.xz 005142907.td-b3lyp_6-31g+(d).inp 005142907.td-b3lyp_6-31g+(d).log.xz

005142907.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142907.td-b3lyp_6-31+g(d).gjf (generated)

005142907.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142907.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142907.mol 005142907.PUBCHEM 005142907.mol (via Jmol)
005142927.b3lyp_6-31g(d).inp

005142927.b3lyp_6-31g(d).qchem.inp (generated)

005142927.b3lyp_6-31g(d).gjf (generated)

005142927.b3lyp_6-31g(d).firefly.inp (generated)

005142927.b3lyp_6-31g(d).smash.inp (generated)

005142927.b3lyp_6-31g(d).nwchem.inp (generated) 005142927.b3lyp_6-31g(d).log.xz 005142927.td-b3lyp_6-31g+(d).inp 005142927.td-b3lyp_6-31g+(d).log.xz

005142927.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142927.td-b3lyp_6-31+g(d).gjf (generated)

005142927.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142927.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142927.mol 005142927.PUBCHEM 005142927.mol (via Jmol)
005142929.b3lyp_6-31g(d).inp

005142929.b3lyp_6-31g(d).qchem.inp (generated)

005142929.b3lyp_6-31g(d).gjf (generated)

005142929.b3lyp_6-31g(d).firefly.inp (generated)

005142929.b3lyp_6-31g(d).smash.inp (generated)

005142929.b3lyp_6-31g(d).nwchem.inp (generated) 005142929.b3lyp_6-31g(d).log.xz 005142929.td-b3lyp_6-31g+(d).inp 005142929.td-b3lyp_6-31g+(d).log.xz

005142929.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142929.td-b3lyp_6-31+g(d).gjf (generated)

005142929.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142929.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142929.mol 005142929.PUBCHEM 005142929.mol (via Jmol)
005142940.b3lyp_6-31g(d).inp

005142940.b3lyp_6-31g(d).qchem.inp (generated)

005142940.b3lyp_6-31g(d).gjf (generated)

005142940.b3lyp_6-31g(d).firefly.inp (generated)

005142940.b3lyp_6-31g(d).smash.inp (generated)

005142940.b3lyp_6-31g(d).nwchem.inp (generated) 005142940.b3lyp_6-31g(d).log.xz 005142940.td-b3lyp_6-31g+(d).inp 005142940.td-b3lyp_6-31g+(d).log.xz

005142940.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142940.td-b3lyp_6-31+g(d).gjf (generated)

005142940.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142940.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142940.mol 005142940.PUBCHEM 005142940.mol (via Jmol)
005142944.b3lyp_6-31g(d).inp

005142944.b3lyp_6-31g(d).qchem.inp (generated)

005142944.b3lyp_6-31g(d).gjf (generated)

005142944.b3lyp_6-31g(d).firefly.inp (generated)

005142944.b3lyp_6-31g(d).smash.inp (generated)

005142944.b3lyp_6-31g(d).nwchem.inp (generated) 005142944.b3lyp_6-31g(d).log.xz 005142944.mol 005142944.PUBCHEM 005142944.mol (via Jmol)
005142952.b3lyp_6-31g(d).inp

005142952.b3lyp_6-31g(d).qchem.inp (generated)

005142952.b3lyp_6-31g(d).gjf (generated)

005142952.b3lyp_6-31g(d).firefly.inp (generated)

005142952.b3lyp_6-31g(d).smash.inp (generated)

005142952.b3lyp_6-31g(d).nwchem.inp (generated) 005142952.b3lyp_6-31g(d).log.xz 005142952.mol 005142952.PUBCHEM 005142952.mol (via Jmol)
005142980.b3lyp_6-31g(d).inp

005142980.b3lyp_6-31g(d).qchem.inp (generated)

005142980.b3lyp_6-31g(d).gjf (generated)

005142980.b3lyp_6-31g(d).firefly.inp (generated)

005142980.b3lyp_6-31g(d).smash.inp (generated)

005142980.b3lyp_6-31g(d).nwchem.inp (generated) 005142980.b3lyp_6-31g(d).log.xz 005142980.td-b3lyp_6-31g+(d).inp 005142980.td-b3lyp_6-31g+(d).log.xz

005142980.td-b3lyp_6-31+g(d).qchem.inp (generated)

005142980.td-b3lyp_6-31+g(d).gjf (generated)

005142980.td-b3lyp_6-31+g(d).firefly.inp (generated)

005142980.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005142980.mol 005142980.PUBCHEM 005142980.mol (via Jmol)
005142986.b3lyp_6-31g(d).inp

005142986.b3lyp_6-31g(d).qchem.inp (generated)

005142986.b3lyp_6-31g(d).gjf (generated)

005142986.b3lyp_6-31g(d).firefly.inp (generated)

005142986.b3lyp_6-31g(d).smash.inp (generated)

005142986.b3lyp_6-31g(d).nwchem.inp (generated) 005142986.b3lyp_6-31g(d).log.xz 005142986.mol 005142986.PUBCHEM 005142986.mol (via Jmol)
005143164.b3lyp_6-31g(d).inp

005143164.b3lyp_6-31g(d).qchem.inp (generated)

005143164.b3lyp_6-31g(d).gjf (generated)

005143164.b3lyp_6-31g(d).firefly.inp (generated)

005143164.b3lyp_6-31g(d).smash.inp (generated)

005143164.b3lyp_6-31g(d).nwchem.inp (generated) 005143164.b3lyp_6-31g(d).log.xz 005143164.td-b3lyp_6-31g+(d).inp 005143164.td-b3lyp_6-31g+(d).log.xz

005143164.td-b3lyp_6-31+g(d).qchem.inp (generated)

005143164.td-b3lyp_6-31+g(d).gjf (generated)

005143164.td-b3lyp_6-31+g(d).firefly.inp (generated)

005143164.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005143164.mol 005143164.PUBCHEM 005143164.mol (via Jmol)
005143238.b3lyp_6-31g(d).inp

005143238.b3lyp_6-31g(d).qchem.inp (generated)

005143238.b3lyp_6-31g(d).gjf (generated)

005143238.b3lyp_6-31g(d).firefly.inp (generated)

005143238.b3lyp_6-31g(d).smash.inp (generated)

005143238.b3lyp_6-31g(d).nwchem.inp (generated) 005143238.b3lyp_6-31g(d).log.xz 005143238.td-b3lyp_6-31g+(d).inp 005143238.td-b3lyp_6-31g+(d).log.xz

005143238.td-b3lyp_6-31+g(d).qchem.inp (generated)

005143238.td-b3lyp_6-31+g(d).gjf (generated)

005143238.td-b3lyp_6-31+g(d).firefly.inp (generated)

005143238.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005143238.mol 005143238.PUBCHEM 005143238.mol (via Jmol)
005143335.b3lyp_6-31g(d).inp

005143335.b3lyp_6-31g(d).qchem.inp (generated)

005143335.b3lyp_6-31g(d).gjf (generated)

005143335.b3lyp_6-31g(d).firefly.inp (generated)

005143335.b3lyp_6-31g(d).smash.inp (generated)

005143335.b3lyp_6-31g(d).nwchem.inp (generated) 005143335.b3lyp_6-31g(d).log.xz 005143335.td-b3lyp_6-31g+(d).inp 005143335.td-b3lyp_6-31g+(d).log.xz

005143335.td-b3lyp_6-31+g(d).qchem.inp (generated)

005143335.td-b3lyp_6-31+g(d).gjf (generated)

005143335.td-b3lyp_6-31+g(d).firefly.inp (generated)

005143335.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005143335.mol 005143335.PUBCHEM 005143335.mol (via Jmol)
005143336.b3lyp_6-31g(d).inp

005143336.b3lyp_6-31g(d).qchem.inp (generated)

005143336.b3lyp_6-31g(d).gjf (generated)

005143336.b3lyp_6-31g(d).firefly.inp (generated)

005143336.b3lyp_6-31g(d).smash.inp (generated)

005143336.b3lyp_6-31g(d).nwchem.inp (generated) 005143336.b3lyp_6-31g(d).log.xz 005143336.td-b3lyp_6-31g+(d).inp 005143336.td-b3lyp_6-31g+(d).log.xz

005143336.td-b3lyp_6-31+g(d).qchem.inp (generated)

005143336.td-b3lyp_6-31+g(d).gjf (generated)

005143336.td-b3lyp_6-31+g(d).firefly.inp (generated)

005143336.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005143336.mol 005143336.PUBCHEM 005143336.mol (via Jmol)
005143352.b3lyp_6-31g(d).inp

005143352.b3lyp_6-31g(d).qchem.inp (generated)

005143352.b3lyp_6-31g(d).gjf (generated)

005143352.b3lyp_6-31g(d).firefly.inp (generated)

005143352.b3lyp_6-31g(d).smash.inp (generated)

005143352.b3lyp_6-31g(d).nwchem.inp (generated) 005143352.b3lyp_6-31g(d).log.xz 005143352.td-b3lyp_6-31g+(d).inp 005143352.td-b3lyp_6-31g+(d).log.xz

005143352.td-b3lyp_6-31+g(d).qchem.inp (generated)

005143352.td-b3lyp_6-31+g(d).gjf (generated)

005143352.td-b3lyp_6-31+g(d).firefly.inp (generated)

005143352.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005143352.mol 005143352.PUBCHEM 005143352.mol (via Jmol)
005143403.b3lyp_6-31g(d).inp

005143403.b3lyp_6-31g(d).qchem.inp (generated)

005143403.b3lyp_6-31g(d).gjf (generated)

005143403.b3lyp_6-31g(d).firefly.inp (generated)

005143403.b3lyp_6-31g(d).smash.inp (generated)

005143403.b3lyp_6-31g(d).nwchem.inp (generated) 005143403.b3lyp_6-31g(d).log.xz 005143403.td-b3lyp_6-31g+(d).inp 005143403.td-b3lyp_6-31g+(d).log.xz

005143403.td-b3lyp_6-31+g(d).qchem.inp (generated)

005143403.td-b3lyp_6-31+g(d).gjf (generated)

005143403.td-b3lyp_6-31+g(d).firefly.inp (generated)

005143403.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005143403.mol 005143403.PUBCHEM 005143403.mol (via Jmol)
005143411.b3lyp_6-31g(d).inp

005143411.b3lyp_6-31g(d).qchem.inp (generated)

005143411.b3lyp_6-31g(d).gjf (generated)

005143411.b3lyp_6-31g(d).firefly.inp (generated)

005143411.b3lyp_6-31g(d).smash.inp (generated)

005143411.b3lyp_6-31g(d).nwchem.inp (generated) 005143411.b3lyp_6-31g(d).log.xz 005143411.mol 005143411.PUBCHEM 005143411.mol (via Jmol)
005143549.b3lyp_6-31g(d).inp

005143549.b3lyp_6-31g(d).qchem.inp (generated)

005143549.b3lyp_6-31g(d).gjf (generated)

005143549.b3lyp_6-31g(d).firefly.inp (generated)

005143549.b3lyp_6-31g(d).smash.inp (generated)

005143549.b3lyp_6-31g(d).nwchem.inp (generated) 005143549.b3lyp_6-31g(d).log.xz 005143549.td-b3lyp_6-31g+(d).inp 005143549.td-b3lyp_6-31g+(d).log.xz

005143549.td-b3lyp_6-31+g(d).qchem.inp (generated)

005143549.td-b3lyp_6-31+g(d).gjf (generated)

005143549.td-b3lyp_6-31+g(d).firefly.inp (generated)

005143549.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005143549.mol 005143549.PUBCHEM 005143549.mol (via Jmol)
005143614.b3lyp_6-31g(d).inp

005143614.b3lyp_6-31g(d).qchem.inp (generated)

005143614.b3lyp_6-31g(d).gjf (generated)

005143614.b3lyp_6-31g(d).firefly.inp (generated)

005143614.b3lyp_6-31g(d).smash.inp (generated)

005143614.b3lyp_6-31g(d).nwchem.inp (generated) 005143614.b3lyp_6-31g(d).log.xz 005143614.td-b3lyp_6-31g+(d).inp 005143614.td-b3lyp_6-31g+(d).log.xz

005143614.td-b3lyp_6-31+g(d).qchem.inp (generated)

005143614.td-b3lyp_6-31+g(d).gjf (generated)

005143614.td-b3lyp_6-31+g(d).firefly.inp (generated)

005143614.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005143614.mol 005143614.PUBCHEM 005143614.mol (via Jmol)
005143631.b3lyp_6-31g(d).inp

005143631.b3lyp_6-31g(d).qchem.inp (generated)

005143631.b3lyp_6-31g(d).gjf (generated)

005143631.b3lyp_6-31g(d).firefly.inp (generated)

005143631.b3lyp_6-31g(d).smash.inp (generated)

005143631.b3lyp_6-31g(d).nwchem.inp (generated) 005143631.b3lyp_6-31g(d).log.xz 005143631.mol 005143631.PUBCHEM 005143631.mol (via Jmol)
005143632.b3lyp_6-31g(d).inp

005143632.b3lyp_6-31g(d).qchem.inp (generated)

005143632.b3lyp_6-31g(d).gjf (generated)

005143632.b3lyp_6-31g(d).firefly.inp (generated)

005143632.b3lyp_6-31g(d).smash.inp (generated)

005143632.b3lyp_6-31g(d).nwchem.inp (generated) 005143632.b3lyp_6-31g(d).log.xz 005143632.td-b3lyp_6-31g+(d).inp 005143632.td-b3lyp_6-31g+(d).log.xz

005143632.td-b3lyp_6-31+g(d).qchem.inp (generated)

005143632.td-b3lyp_6-31+g(d).gjf (generated)

005143632.td-b3lyp_6-31+g(d).firefly.inp (generated)

005143632.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005143632.mol 005143632.PUBCHEM 005143632.mol (via Jmol)
005143633.b3lyp_6-31g(d).inp

005143633.b3lyp_6-31g(d).qchem.inp (generated)

005143633.b3lyp_6-31g(d).gjf (generated)

005143633.b3lyp_6-31g(d).firefly.inp (generated)

005143633.b3lyp_6-31g(d).smash.inp (generated)

005143633.b3lyp_6-31g(d).nwchem.inp (generated) 005143633.b3lyp_6-31g(d).log.xz 005143633.td-b3lyp_6-31g+(d).inp 005143633.td-b3lyp_6-31g+(d).log.xz

005143633.td-b3lyp_6-31+g(d).qchem.inp (generated)

005143633.td-b3lyp_6-31+g(d).gjf (generated)

005143633.td-b3lyp_6-31+g(d).firefly.inp (generated)

005143633.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005143633.mol 005143633.PUBCHEM 005143633.mol (via Jmol)
005143634.b3lyp_6-31g(d).inp

005143634.b3lyp_6-31g(d).qchem.inp (generated)

005143634.b3lyp_6-31g(d).gjf (generated)

005143634.b3lyp_6-31g(d).firefly.inp (generated)

005143634.b3lyp_6-31g(d).smash.inp (generated)

005143634.b3lyp_6-31g(d).nwchem.inp (generated) 005143634.b3lyp_6-31g(d).log.xz 005143634.td-b3lyp_6-31g+(d).inp 005143634.td-b3lyp_6-31g+(d).log.xz

005143634.td-b3lyp_6-31+g(d).qchem.inp (generated)

005143634.td-b3lyp_6-31+g(d).gjf (generated)

005143634.td-b3lyp_6-31+g(d).firefly.inp (generated)

005143634.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005143634.mol 005143634.PUBCHEM 005143634.mol (via Jmol)
005143642.b3lyp_6-31g(d).inp

005143642.b3lyp_6-31g(d).qchem.inp (generated)

005143642.b3lyp_6-31g(d).gjf (generated)

005143642.b3lyp_6-31g(d).firefly.inp (generated)

005143642.b3lyp_6-31g(d).smash.inp (generated)

005143642.b3lyp_6-31g(d).nwchem.inp (generated) 005143642.b3lyp_6-31g(d).log.xz 005143642.td-b3lyp_6-31g+(d).inp 005143642.td-b3lyp_6-31g+(d).log.xz

005143642.td-b3lyp_6-31+g(d).qchem.inp (generated)

005143642.td-b3lyp_6-31+g(d).gjf (generated)

005143642.td-b3lyp_6-31+g(d).firefly.inp (generated)

005143642.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005143642.mol 005143642.PUBCHEM 005143642.mol (via Jmol)
005143680.b3lyp_6-31g(d).inp

005143680.b3lyp_6-31g(d).qchem.inp (generated)

005143680.b3lyp_6-31g(d).gjf (generated)

005143680.b3lyp_6-31g(d).firefly.inp (generated)

005143680.b3lyp_6-31g(d).smash.inp (generated)

005143680.b3lyp_6-31g(d).nwchem.inp (generated) 005143680.b3lyp_6-31g(d).log.xz 005143680.td-b3lyp_6-31g+(d).inp 005143680.td-b3lyp_6-31g+(d).log.xz

005143680.td-b3lyp_6-31+g(d).qchem.inp (generated)

005143680.td-b3lyp_6-31+g(d).gjf (generated)

005143680.td-b3lyp_6-31+g(d).firefly.inp (generated)

005143680.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005143680.mol 005143680.PUBCHEM 005143680.mol (via Jmol)
005143691.b3lyp_6-31g(d).inp

005143691.b3lyp_6-31g(d).qchem.inp (generated)

005143691.b3lyp_6-31g(d).gjf (generated)

005143691.b3lyp_6-31g(d).firefly.inp (generated)

005143691.b3lyp_6-31g(d).smash.inp (generated)

005143691.b3lyp_6-31g(d).nwchem.inp (generated) 005143691.b3lyp_6-31g(d).log.xz 005143691.td-b3lyp_6-31g+(d).inp 005143691.td-b3lyp_6-31g+(d).log.xz

005143691.td-b3lyp_6-31+g(d).qchem.inp (generated)

005143691.td-b3lyp_6-31+g(d).gjf (generated)

005143691.td-b3lyp_6-31+g(d).firefly.inp (generated)

005143691.td-b3lyp_6-31+g(d).nwchem.inp (generated) 005143691.mol 005143691.PUBCHEM 005143691.mol (via Jmol)
005143692.b3lyp_6-31g(d).inp