Index of

Last updated : Thu Mar 23 01:58:55 JST 2017
Total : 294 (245) in this page
006100037.b3lyp_6-31g(d).inp

006100037.b3lyp_6-31g(d).qchem.inp (generated)

006100037.b3lyp_6-31g(d).gjf (generated)

006100037.b3lyp_6-31g(d).firefly.inp (generated)

006100037.b3lyp_6-31g(d).smash.inp (generated)

006100037.b3lyp_6-31g(d).nwchem.inp (generated) 006100037.b3lyp_6-31g(d).log.xz 006100037.td-b3lyp_6-31g+(d).inp 006100037.td-b3lyp_6-31g+(d).log.xz

006100037.td-b3lyp_6-31+g(d).qchem.inp (generated)

006100037.td-b3lyp_6-31+g(d).gjf (generated)

006100037.td-b3lyp_6-31+g(d).firefly.inp (generated)

006100037.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006100037.mol 006100037.PUBCHEM 006100037.mol (via Jmol)
006100067.b3lyp_6-31g(d).inp

006100067.b3lyp_6-31g(d).qchem.inp (generated)

006100067.b3lyp_6-31g(d).gjf (generated)

006100067.b3lyp_6-31g(d).firefly.inp (generated)

006100067.b3lyp_6-31g(d).smash.inp (generated)

006100067.b3lyp_6-31g(d).nwchem.inp (generated) 006100067.b3lyp_6-31g(d).log.xz 006100067.td-b3lyp_6-31g+(d).inp 006100067.td-b3lyp_6-31g+(d).log.xz

006100067.td-b3lyp_6-31+g(d).qchem.inp (generated)

006100067.td-b3lyp_6-31+g(d).gjf (generated)

006100067.td-b3lyp_6-31+g(d).firefly.inp (generated)

006100067.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006100067.mol 006100067.PUBCHEM 006100067.mol (via Jmol)
006100322.b3lyp_6-31g(d).inp

006100322.b3lyp_6-31g(d).qchem.inp (generated)

006100322.b3lyp_6-31g(d).gjf (generated)

006100322.b3lyp_6-31g(d).firefly.inp (generated)

006100322.b3lyp_6-31g(d).smash.inp (generated)

006100322.b3lyp_6-31g(d).nwchem.inp (generated) 006100322.b3lyp_6-31g(d).log.xz 006100322.td-b3lyp_6-31g+(d).inp 006100322.td-b3lyp_6-31g+(d).log.xz

006100322.td-b3lyp_6-31+g(d).qchem.inp (generated)

006100322.td-b3lyp_6-31+g(d).gjf (generated)

006100322.td-b3lyp_6-31+g(d).firefly.inp (generated)

006100322.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006100322.mol 006100322.PUBCHEM 006100322.mol (via Jmol)
006100362.b3lyp_6-31g(d).inp

006100362.b3lyp_6-31g(d).qchem.inp (generated)

006100362.b3lyp_6-31g(d).gjf (generated)

006100362.b3lyp_6-31g(d).firefly.inp (generated)

006100362.b3lyp_6-31g(d).smash.inp (generated)

006100362.b3lyp_6-31g(d).nwchem.inp (generated) 006100362.b3lyp_6-31g(d).log.xz 006100362.td-b3lyp_6-31g+(d).inp 006100362.td-b3lyp_6-31g+(d).log.xz

006100362.td-b3lyp_6-31+g(d).qchem.inp (generated)

006100362.td-b3lyp_6-31+g(d).gjf (generated)

006100362.td-b3lyp_6-31+g(d).firefly.inp (generated)

006100362.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006100362.mol 006100362.PUBCHEM 006100362.mol (via Jmol)
006100577.b3lyp_6-31g(d).inp

006100577.b3lyp_6-31g(d).qchem.inp (generated)

006100577.b3lyp_6-31g(d).gjf (generated)

006100577.b3lyp_6-31g(d).firefly.inp (generated)

006100577.b3lyp_6-31g(d).smash.inp (generated)

006100577.b3lyp_6-31g(d).nwchem.inp (generated) 006100577.b3lyp_6-31g(d).log.xz 006100577.td-b3lyp_6-31g+(d).inp 006100577.td-b3lyp_6-31g+(d).log.xz

006100577.td-b3lyp_6-31+g(d).qchem.inp (generated)

006100577.td-b3lyp_6-31+g(d).gjf (generated)

006100577.td-b3lyp_6-31+g(d).firefly.inp (generated)

006100577.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006100577.mol 006100577.PUBCHEM 006100577.mol (via Jmol)
006100693.b3lyp_6-31g(d).inp

006100693.b3lyp_6-31g(d).qchem.inp (generated)

006100693.b3lyp_6-31g(d).gjf (generated)

006100693.b3lyp_6-31g(d).firefly.inp (generated)

006100693.b3lyp_6-31g(d).smash.inp (generated)

006100693.b3lyp_6-31g(d).nwchem.inp (generated) 006100693.b3lyp_6-31g(d).log.xz 006100693.td-b3lyp_6-31g+(d).inp 006100693.td-b3lyp_6-31g+(d).log.xz

006100693.td-b3lyp_6-31+g(d).qchem.inp (generated)

006100693.td-b3lyp_6-31+g(d).gjf (generated)

006100693.td-b3lyp_6-31+g(d).firefly.inp (generated)

006100693.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006100693.mol 006100693.PUBCHEM 006100693.mol (via Jmol)
006100695.b3lyp_6-31g(d).inp

006100695.b3lyp_6-31g(d).qchem.inp (generated)

006100695.b3lyp_6-31g(d).gjf (generated)

006100695.b3lyp_6-31g(d).firefly.inp (generated)

006100695.b3lyp_6-31g(d).smash.inp (generated)

006100695.b3lyp_6-31g(d).nwchem.inp (generated) 006100695.b3lyp_6-31g(d).log.xz 006100695.td-b3lyp_6-31g+(d).inp 006100695.td-b3lyp_6-31g+(d).log.xz

006100695.td-b3lyp_6-31+g(d).qchem.inp (generated)

006100695.td-b3lyp_6-31+g(d).gjf (generated)

006100695.td-b3lyp_6-31+g(d).firefly.inp (generated)

006100695.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006100695.mol 006100695.PUBCHEM 006100695.mol (via Jmol)
006100698.b3lyp_6-31g(d).inp

006100698.b3lyp_6-31g(d).qchem.inp (generated)

006100698.b3lyp_6-31g(d).gjf (generated)

006100698.b3lyp_6-31g(d).firefly.inp (generated)

006100698.b3lyp_6-31g(d).smash.inp (generated)

006100698.b3lyp_6-31g(d).nwchem.inp (generated) 006100698.b3lyp_6-31g(d).log.xz 006100698.td-b3lyp_6-31g+(d).inp 006100698.td-b3lyp_6-31g+(d).log.xz

006100698.td-b3lyp_6-31+g(d).qchem.inp (generated)

006100698.td-b3lyp_6-31+g(d).gjf (generated)

006100698.td-b3lyp_6-31+g(d).firefly.inp (generated)

006100698.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006100698.mol 006100698.PUBCHEM 006100698.mol (via Jmol)
006100702.b3lyp_6-31g(d).inp

006100702.b3lyp_6-31g(d).qchem.inp (generated)

006100702.b3lyp_6-31g(d).gjf (generated)

006100702.b3lyp_6-31g(d).firefly.inp (generated)

006100702.b3lyp_6-31g(d).smash.inp (generated)

006100702.b3lyp_6-31g(d).nwchem.inp (generated) 006100702.b3lyp_6-31g(d).log.xz 006100702.td-b3lyp_6-31g+(d).inp 006100702.td-b3lyp_6-31g+(d).log.xz

006100702.td-b3lyp_6-31+g(d).qchem.inp (generated)

006100702.td-b3lyp_6-31+g(d).gjf (generated)

006100702.td-b3lyp_6-31+g(d).firefly.inp (generated)

006100702.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006100702.mol 006100702.PUBCHEM 006100702.mol (via Jmol)
006100704.b3lyp_6-31g(d).inp

006100704.b3lyp_6-31g(d).qchem.inp (generated)

006100704.b3lyp_6-31g(d).gjf (generated)

006100704.b3lyp_6-31g(d).firefly.inp (generated)

006100704.b3lyp_6-31g(d).smash.inp (generated)

006100704.b3lyp_6-31g(d).nwchem.inp (generated) 006100704.b3lyp_6-31g(d).log.xz 006100704.td-b3lyp_6-31g+(d).inp 006100704.td-b3lyp_6-31g+(d).log.xz

006100704.td-b3lyp_6-31+g(d).qchem.inp (generated)

006100704.td-b3lyp_6-31+g(d).gjf (generated)

006100704.td-b3lyp_6-31+g(d).firefly.inp (generated)

006100704.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006100704.mol 006100704.PUBCHEM 006100704.mol (via Jmol)
006100710.b3lyp_6-31g(d).inp

006100710.b3lyp_6-31g(d).qchem.inp (generated)

006100710.b3lyp_6-31g(d).gjf (generated)

006100710.b3lyp_6-31g(d).firefly.inp (generated)

006100710.b3lyp_6-31g(d).smash.inp (generated)

006100710.b3lyp_6-31g(d).nwchem.inp (generated) 006100710.b3lyp_6-31g(d).log.xz 006100710.td-b3lyp_6-31g+(d).inp 006100710.td-b3lyp_6-31g+(d).log.xz

006100710.td-b3lyp_6-31+g(d).qchem.inp (generated)

006100710.td-b3lyp_6-31+g(d).gjf (generated)

006100710.td-b3lyp_6-31+g(d).firefly.inp (generated)

006100710.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006100710.mol 006100710.PUBCHEM 006100710.mol (via Jmol)
006100745.b3lyp_6-31g(d).inp

006100745.b3lyp_6-31g(d).qchem.inp (generated)

006100745.b3lyp_6-31g(d).gjf (generated)

006100745.b3lyp_6-31g(d).firefly.inp (generated)

006100745.b3lyp_6-31g(d).smash.inp (generated)

006100745.b3lyp_6-31g(d).nwchem.inp (generated) 006100745.b3lyp_6-31g(d).log.xz 006100745.mol 006100745.PUBCHEM 006100745.mol (via Jmol)
006100845.b3lyp_6-31g(d).inp

006100845.b3lyp_6-31g(d).qchem.inp (generated)

006100845.b3lyp_6-31g(d).gjf (generated)

006100845.b3lyp_6-31g(d).firefly.inp (generated)

006100845.b3lyp_6-31g(d).smash.inp (generated)

006100845.b3lyp_6-31g(d).nwchem.inp (generated) 006100845.b3lyp_6-31g(d).log.xz 006100845.td-b3lyp_6-31g+(d).inp 006100845.td-b3lyp_6-31g+(d).log.xz

006100845.td-b3lyp_6-31+g(d).qchem.inp (generated)

006100845.td-b3lyp_6-31+g(d).gjf (generated)

006100845.td-b3lyp_6-31+g(d).firefly.inp (generated)

006100845.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006100845.mol 006100845.PUBCHEM 006100845.mol (via Jmol)
006100868.b3lyp_6-31g(d).inp

006100868.b3lyp_6-31g(d).qchem.inp (generated)

006100868.b3lyp_6-31g(d).gjf (generated)

006100868.b3lyp_6-31g(d).firefly.inp (generated)

006100868.b3lyp_6-31g(d).smash.inp (generated)

006100868.b3lyp_6-31g(d).nwchem.inp (generated) 006100868.b3lyp_6-31g(d).log.xz 006100868.mol 006100868.PUBCHEM 006100868.mol (via Jmol)
006100954.b3lyp_6-31g(d).inp

006100954.b3lyp_6-31g(d).qchem.inp (generated)

006100954.b3lyp_6-31g(d).gjf (generated)

006100954.b3lyp_6-31g(d).firefly.inp (generated)

006100954.b3lyp_6-31g(d).smash.inp (generated)

006100954.b3lyp_6-31g(d).nwchem.inp (generated) 006100954.b3lyp_6-31g(d).log.xz 006100954.td-b3lyp_6-31g+(d).inp 006100954.td-b3lyp_6-31g+(d).log.xz

006100954.td-b3lyp_6-31+g(d).qchem.inp (generated)

006100954.td-b3lyp_6-31+g(d).gjf (generated)

006100954.td-b3lyp_6-31+g(d).firefly.inp (generated)

006100954.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006100954.mol 006100954.PUBCHEM 006100954.mol (via Jmol)
006100977.b3lyp_6-31g(d).inp

006100977.b3lyp_6-31g(d).qchem.inp (generated)

006100977.b3lyp_6-31g(d).gjf (generated)

006100977.b3lyp_6-31g(d).firefly.inp (generated)

006100977.b3lyp_6-31g(d).smash.inp (generated)

006100977.b3lyp_6-31g(d).nwchem.inp (generated) 006100977.b3lyp_6-31g(d).log.xz 006100977.td-b3lyp_6-31g+(d).inp 006100977.td-b3lyp_6-31g+(d).log.xz

006100977.td-b3lyp_6-31+g(d).qchem.inp (generated)

006100977.td-b3lyp_6-31+g(d).gjf (generated)

006100977.td-b3lyp_6-31+g(d).firefly.inp (generated)

006100977.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006100977.mol 006100977.PUBCHEM 006100977.mol (via Jmol)
006101039.b3lyp_6-31g(d).inp

006101039.b3lyp_6-31g(d).qchem.inp (generated)

006101039.b3lyp_6-31g(d).gjf (generated)

006101039.b3lyp_6-31g(d).firefly.inp (generated)

006101039.b3lyp_6-31g(d).smash.inp (generated)

006101039.b3lyp_6-31g(d).nwchem.inp (generated) 006101039.b3lyp_6-31g(d).log.xz 006101039.td-b3lyp_6-31g+(d).inp 006101039.td-b3lyp_6-31g+(d).log.xz

006101039.td-b3lyp_6-31+g(d).qchem.inp (generated)

006101039.td-b3lyp_6-31+g(d).gjf (generated)

006101039.td-b3lyp_6-31+g(d).firefly.inp (generated)

006101039.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006101039.mol 006101039.PUBCHEM 006101039.mol (via Jmol)
006101059.b3lyp_6-31g(d).inp

006101059.b3lyp_6-31g(d).qchem.inp (generated)

006101059.b3lyp_6-31g(d).gjf (generated)

006101059.b3lyp_6-31g(d).firefly.inp (generated)

006101059.b3lyp_6-31g(d).smash.inp (generated)

006101059.b3lyp_6-31g(d).nwchem.inp (generated) 006101059.b3lyp_6-31g(d).log.xz 006101059.td-b3lyp_6-31g+(d).inp 006101059.td-b3lyp_6-31g+(d).log.xz

006101059.td-b3lyp_6-31+g(d).qchem.inp (generated)

006101059.td-b3lyp_6-31+g(d).gjf (generated)

006101059.td-b3lyp_6-31+g(d).firefly.inp (generated)

006101059.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006101059.mol 006101059.PUBCHEM 006101059.mol (via Jmol)
006101083.b3lyp_6-31g(d).inp

006101083.b3lyp_6-31g(d).qchem.inp (generated)

006101083.b3lyp_6-31g(d).gjf (generated)

006101083.b3lyp_6-31g(d).firefly.inp (generated)

006101083.b3lyp_6-31g(d).smash.inp (generated)

006101083.b3lyp_6-31g(d).nwchem.inp (generated) 006101083.b3lyp_6-31g(d).log.xz 006101083.td-b3lyp_6-31g+(d).inp 006101083.td-b3lyp_6-31g+(d).log.xz

006101083.td-b3lyp_6-31+g(d).qchem.inp (generated)

006101083.td-b3lyp_6-31+g(d).gjf (generated)

006101083.td-b3lyp_6-31+g(d).firefly.inp (generated)

006101083.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006101083.mol 006101083.PUBCHEM 006101083.mol (via Jmol)
006101139.b3lyp_6-31g(d).inp

006101139.b3lyp_6-31g(d).qchem.inp (generated)

006101139.b3lyp_6-31g(d).gjf (generated)

006101139.b3lyp_6-31g(d).firefly.inp (generated)

006101139.b3lyp_6-31g(d).smash.inp (generated)

006101139.b3lyp_6-31g(d).nwchem.inp (generated) 006101139.b3lyp_6-31g(d).log.xz 006101139.td-b3lyp_6-31g+(d).inp 006101139.td-b3lyp_6-31g+(d).log.xz

006101139.td-b3lyp_6-31+g(d).qchem.inp (generated)

006101139.td-b3lyp_6-31+g(d).gjf (generated)

006101139.td-b3lyp_6-31+g(d).firefly.inp (generated)

006101139.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006101139.mol 006101139.PUBCHEM 006101139.mol (via Jmol)
006101480.b3lyp_6-31g(d).inp

006101480.b3lyp_6-31g(d).qchem.inp (generated)

006101480.b3lyp_6-31g(d).gjf (generated)

006101480.b3lyp_6-31g(d).firefly.inp (generated)

006101480.b3lyp_6-31g(d).smash.inp (generated)

006101480.b3lyp_6-31g(d).nwchem.inp (generated) 006101480.b3lyp_6-31g(d).log.xz 006101480.mol 006101480.PUBCHEM 006101480.mol (via Jmol)
006101506.b3lyp_6-31g(d).inp

006101506.b3lyp_6-31g(d).qchem.inp (generated)

006101506.b3lyp_6-31g(d).gjf (generated)

006101506.b3lyp_6-31g(d).firefly.inp (generated)

006101506.b3lyp_6-31g(d).smash.inp (generated)

006101506.b3lyp_6-31g(d).nwchem.inp (generated) 006101506.b3lyp_6-31g(d).log.xz 006101506.td-b3lyp_6-31g+(d).inp 006101506.td-b3lyp_6-31g+(d).log.xz

006101506.td-b3lyp_6-31+g(d).qchem.inp (generated)

006101506.td-b3lyp_6-31+g(d).gjf (generated)

006101506.td-b3lyp_6-31+g(d).firefly.inp (generated)

006101506.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006101506.mol 006101506.PUBCHEM 006101506.mol (via Jmol)
006101537.b3lyp_6-31g(d).inp

006101537.b3lyp_6-31g(d).qchem.inp (generated)

006101537.b3lyp_6-31g(d).gjf (generated)

006101537.b3lyp_6-31g(d).firefly.inp (generated)

006101537.b3lyp_6-31g(d).smash.inp (generated)

006101537.b3lyp_6-31g(d).nwchem.inp (generated) 006101537.b3lyp_6-31g(d).log.xz 006101537.td-b3lyp_6-31g+(d).inp 006101537.td-b3lyp_6-31g+(d).log.xz

006101537.td-b3lyp_6-31+g(d).qchem.inp (generated)

006101537.td-b3lyp_6-31+g(d).gjf (generated)

006101537.td-b3lyp_6-31+g(d).firefly.inp (generated)

006101537.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006101537.mol 006101537.PUBCHEM 006101537.mol (via Jmol)
006101572.b3lyp_6-31g(d).inp

006101572.b3lyp_6-31g(d).qchem.inp (generated)

006101572.b3lyp_6-31g(d).gjf (generated)

006101572.b3lyp_6-31g(d).firefly.inp (generated)

006101572.b3lyp_6-31g(d).smash.inp (generated)

006101572.b3lyp_6-31g(d).nwchem.inp (generated) 006101572.b3lyp_6-31g(d).log.xz 006101572.td-b3lyp_6-31g+(d).inp 006101572.td-b3lyp_6-31g+(d).log.xz

006101572.td-b3lyp_6-31+g(d).qchem.inp (generated)

006101572.td-b3lyp_6-31+g(d).gjf (generated)

006101572.td-b3lyp_6-31+g(d).firefly.inp (generated)

006101572.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006101572.mol 006101572.PUBCHEM 006101572.mol (via Jmol)
006101588.b3lyp_6-31g(d).inp

006101588.b3lyp_6-31g(d).qchem.inp (generated)

006101588.b3lyp_6-31g(d).gjf (generated)

006101588.b3lyp_6-31g(d).firefly.inp (generated)

006101588.b3lyp_6-31g(d).smash.inp (generated)

006101588.b3lyp_6-31g(d).nwchem.inp (generated) 006101588.b3lyp_6-31g(d).log.xz 006101588.mol 006101588.PUBCHEM 006101588.mol (via Jmol)
006101658.b3lyp_6-31g(d).inp

006101658.b3lyp_6-31g(d).qchem.inp (generated)

006101658.b3lyp_6-31g(d).gjf (generated)

006101658.b3lyp_6-31g(d).firefly.inp (generated)

006101658.b3lyp_6-31g(d).smash.inp (generated)

006101658.b3lyp_6-31g(d).nwchem.inp (generated) 006101658.b3lyp_6-31g(d).log.xz 006101658.td-b3lyp_6-31g+(d).inp 006101658.td-b3lyp_6-31g+(d).log.xz

006101658.td-b3lyp_6-31+g(d).qchem.inp (generated)

006101658.td-b3lyp_6-31+g(d).gjf (generated)

006101658.td-b3lyp_6-31+g(d).firefly.inp (generated)

006101658.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006101658.mol 006101658.PUBCHEM 006101658.mol (via Jmol)
006101738.b3lyp_6-31g(d).inp

006101738.b3lyp_6-31g(d).qchem.inp (generated)

006101738.b3lyp_6-31g(d).gjf (generated)

006101738.b3lyp_6-31g(d).firefly.inp (generated)

006101738.b3lyp_6-31g(d).smash.inp (generated)

006101738.b3lyp_6-31g(d).nwchem.inp (generated) 006101738.b3lyp_6-31g(d).log.xz 006101738.td-b3lyp_6-31g+(d).inp 006101738.td-b3lyp_6-31g+(d).log.xz

006101738.td-b3lyp_6-31+g(d).qchem.inp (generated)

006101738.td-b3lyp_6-31+g(d).gjf (generated)

006101738.td-b3lyp_6-31+g(d).firefly.inp (generated)

006101738.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006101738.mol 006101738.PUBCHEM 006101738.mol (via Jmol)
006101744.b3lyp_6-31g(d).inp

006101744.b3lyp_6-31g(d).qchem.inp (generated)

006101744.b3lyp_6-31g(d).gjf (generated)

006101744.b3lyp_6-31g(d).firefly.inp (generated)

006101744.b3lyp_6-31g(d).smash.inp (generated)

006101744.b3lyp_6-31g(d).nwchem.inp (generated) 006101744.b3lyp_6-31g(d).log.xz 006101744.td-b3lyp_6-31g+(d).inp 006101744.td-b3lyp_6-31g+(d).log.xz

006101744.td-b3lyp_6-31+g(d).qchem.inp (generated)

006101744.td-b3lyp_6-31+g(d).gjf (generated)

006101744.td-b3lyp_6-31+g(d).firefly.inp (generated)

006101744.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006101744.mol 006101744.PUBCHEM 006101744.mol (via Jmol)
006101751.b3lyp_6-31g(d).inp

006101751.b3lyp_6-31g(d).qchem.inp (generated)

006101751.b3lyp_6-31g(d).gjf (generated)

006101751.b3lyp_6-31g(d).firefly.inp (generated)

006101751.b3lyp_6-31g(d).smash.inp (generated)

006101751.b3lyp_6-31g(d).nwchem.inp (generated) 006101751.b3lyp_6-31g(d).log.xz 006101751.td-b3lyp_6-31g+(d).inp 006101751.td-b3lyp_6-31g+(d).log.xz

006101751.td-b3lyp_6-31+g(d).qchem.inp (generated)

006101751.td-b3lyp_6-31+g(d).gjf (generated)

006101751.td-b3lyp_6-31+g(d).firefly.inp (generated)

006101751.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006101751.mol 006101751.PUBCHEM 006101751.mol (via Jmol)
006101843.b3lyp_6-31g(d).inp

006101843.b3lyp_6-31g(d).qchem.inp (generated)

006101843.b3lyp_6-31g(d).gjf (generated)

006101843.b3lyp_6-31g(d).firefly.inp (generated)

006101843.b3lyp_6-31g(d).smash.inp (generated)

006101843.b3lyp_6-31g(d).nwchem.inp (generated) 006101843.b3lyp_6-31g(d).log.xz 006101843.td-b3lyp_6-31g+(d).inp 006101843.td-b3lyp_6-31g+(d).log.xz

006101843.td-b3lyp_6-31+g(d).qchem.inp (generated)

006101843.td-b3lyp_6-31+g(d).gjf (generated)

006101843.td-b3lyp_6-31+g(d).firefly.inp (generated)

006101843.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006101843.mol 006101843.PUBCHEM 006101843.mol (via Jmol)
006101852.b3lyp_6-31g(d).inp

006101852.b3lyp_6-31g(d).qchem.inp (generated)

006101852.b3lyp_6-31g(d).gjf (generated)

006101852.b3lyp_6-31g(d).firefly.inp (generated)

006101852.b3lyp_6-31g(d).smash.inp (generated)

006101852.b3lyp_6-31g(d).nwchem.inp (generated) 006101852.b3lyp_6-31g(d).log.xz 006101852.td-b3lyp_6-31g+(d).inp 006101852.td-b3lyp_6-31g+(d).log.xz

006101852.td-b3lyp_6-31+g(d).qchem.inp (generated)

006101852.td-b3lyp_6-31+g(d).gjf (generated)

006101852.td-b3lyp_6-31+g(d).firefly.inp (generated)

006101852.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006101852.mol 006101852.PUBCHEM 006101852.mol (via Jmol)
006101933.b3lyp_6-31g(d).inp

006101933.b3lyp_6-31g(d).qchem.inp (generated)

006101933.b3lyp_6-31g(d).gjf (generated)

006101933.b3lyp_6-31g(d).firefly.inp (generated)

006101933.b3lyp_6-31g(d).smash.inp (generated)

006101933.b3lyp_6-31g(d).nwchem.inp (generated) 006101933.b3lyp_6-31g(d).log.xz 006101933.td-b3lyp_6-31g+(d).inp 006101933.td-b3lyp_6-31g+(d).log.xz

006101933.td-b3lyp_6-31+g(d).qchem.inp (generated)

006101933.td-b3lyp_6-31+g(d).gjf (generated)

006101933.td-b3lyp_6-31+g(d).firefly.inp (generated)

006101933.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006101933.mol 006101933.PUBCHEM 006101933.mol (via Jmol)
006101950.b3lyp_6-31g(d).inp

006101950.b3lyp_6-31g(d).qchem.inp (generated)

006101950.b3lyp_6-31g(d).gjf (generated)

006101950.b3lyp_6-31g(d).firefly.inp (generated)

006101950.b3lyp_6-31g(d).smash.inp (generated)

006101950.b3lyp_6-31g(d).nwchem.inp (generated) 006101950.b3lyp_6-31g(d).log.xz 006101950.td-b3lyp_6-31g+(d).inp 006101950.td-b3lyp_6-31g+(d).log.xz

006101950.td-b3lyp_6-31+g(d).qchem.inp (generated)

006101950.td-b3lyp_6-31+g(d).gjf (generated)

006101950.td-b3lyp_6-31+g(d).firefly.inp (generated)

006101950.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006101950.mol 006101950.PUBCHEM 006101950.mol (via Jmol)
006101956.b3lyp_6-31g(d).inp

006101956.b3lyp_6-31g(d).qchem.inp (generated)

006101956.b3lyp_6-31g(d).gjf (generated)

006101956.b3lyp_6-31g(d).firefly.inp (generated)

006101956.b3lyp_6-31g(d).smash.inp (generated)

006101956.b3lyp_6-31g(d).nwchem.inp (generated) 006101956.b3lyp_6-31g(d).log.xz 006101956.td-b3lyp_6-31g+(d).inp 006101956.td-b3lyp_6-31g+(d).log.xz

006101956.td-b3lyp_6-31+g(d).qchem.inp (generated)

006101956.td-b3lyp_6-31+g(d).gjf (generated)

006101956.td-b3lyp_6-31+g(d).firefly.inp (generated)

006101956.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006101956.mol 006101956.PUBCHEM 006101956.mol (via Jmol)
006101979.b3lyp_6-31g(d).inp

006101979.b3lyp_6-31g(d).qchem.inp (generated)

006101979.b3lyp_6-31g(d).gjf (generated)

006101979.b3lyp_6-31g(d).firefly.inp (generated)

006101979.b3lyp_6-31g(d).smash.inp (generated)

006101979.b3lyp_6-31g(d).nwchem.inp (generated) 006101979.b3lyp_6-31g(d).log.xz 006101979.mol 006101979.PUBCHEM 006101979.mol (via Jmol)
006102117.b3lyp_6-31g(d).inp

006102117.b3lyp_6-31g(d).qchem.inp (generated)

006102117.b3lyp_6-31g(d).gjf (generated)

006102117.b3lyp_6-31g(d).firefly.inp (generated)

006102117.b3lyp_6-31g(d).smash.inp (generated)

006102117.b3lyp_6-31g(d).nwchem.inp (generated) 006102117.b3lyp_6-31g(d).log.xz 006102117.td-b3lyp_6-31g+(d).inp 006102117.td-b3lyp_6-31g+(d).log.xz

006102117.td-b3lyp_6-31+g(d).qchem.inp (generated)

006102117.td-b3lyp_6-31+g(d).gjf (generated)

006102117.td-b3lyp_6-31+g(d).firefly.inp (generated)

006102117.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006102117.mol 006102117.PUBCHEM 006102117.mol (via Jmol)
006102374.b3lyp_6-31g(d).inp

006102374.b3lyp_6-31g(d).qchem.inp (generated)

006102374.b3lyp_6-31g(d).gjf (generated)

006102374.b3lyp_6-31g(d).firefly.inp (generated)

006102374.b3lyp_6-31g(d).smash.inp (generated)

006102374.b3lyp_6-31g(d).nwchem.inp (generated) 006102374.b3lyp_6-31g(d).log.xz 006102374.td-b3lyp_6-31g+(d).inp 006102374.td-b3lyp_6-31g+(d).log.xz

006102374.td-b3lyp_6-31+g(d).qchem.inp (generated)

006102374.td-b3lyp_6-31+g(d).gjf (generated)

006102374.td-b3lyp_6-31+g(d).firefly.inp (generated)

006102374.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006102374.mol 006102374.PUBCHEM 006102374.mol (via Jmol)
006102462.b3lyp_6-31g(d).inp

006102462.b3lyp_6-31g(d).qchem.inp (generated)

006102462.b3lyp_6-31g(d).gjf (generated)

006102462.b3lyp_6-31g(d).firefly.inp (generated)

006102462.b3lyp_6-31g(d).smash.inp (generated)

006102462.b3lyp_6-31g(d).nwchem.inp (generated) 006102462.b3lyp_6-31g(d).log.xz 006102462.td-b3lyp_6-31g+(d).inp 006102462.td-b3lyp_6-31g+(d).log.xz

006102462.td-b3lyp_6-31+g(d).qchem.inp (generated)

006102462.td-b3lyp_6-31+g(d).gjf (generated)

006102462.td-b3lyp_6-31+g(d).firefly.inp (generated)

006102462.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006102462.mol 006102462.PUBCHEM 006102462.mol (via Jmol)
006102473.b3lyp_6-31g(d).inp

006102473.b3lyp_6-31g(d).qchem.inp (generated)

006102473.b3lyp_6-31g(d).gjf (generated)

006102473.b3lyp_6-31g(d).firefly.inp (generated)

006102473.b3lyp_6-31g(d).smash.inp (generated)

006102473.b3lyp_6-31g(d).nwchem.inp (generated) 006102473.b3lyp_6-31g(d).log.xz 006102473.td-b3lyp_6-31g+(d).inp 006102473.td-b3lyp_6-31g+(d).log.xz

006102473.td-b3lyp_6-31+g(d).qchem.inp (generated)

006102473.td-b3lyp_6-31+g(d).gjf (generated)

006102473.td-b3lyp_6-31+g(d).firefly.inp (generated)

006102473.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006102473.mol 006102473.PUBCHEM 006102473.mol (via Jmol)
006102474.b3lyp_6-31g(d).inp

006102474.b3lyp_6-31g(d).qchem.inp (generated)

006102474.b3lyp_6-31g(d).gjf (generated)

006102474.b3lyp_6-31g(d).firefly.inp (generated)

006102474.b3lyp_6-31g(d).smash.inp (generated)

006102474.b3lyp_6-31g(d).nwchem.inp (generated) 006102474.b3lyp_6-31g(d).log.xz 006102474.td-b3lyp_6-31g+(d).inp 006102474.td-b3lyp_6-31g+(d).log.xz

006102474.td-b3lyp_6-31+g(d).qchem.inp (generated)

006102474.td-b3lyp_6-31+g(d).gjf (generated)

006102474.td-b3lyp_6-31+g(d).firefly.inp (generated)

006102474.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006102474.mol 006102474.PUBCHEM 006102474.mol (via Jmol)
006102732.b3lyp_6-31g(d).inp

006102732.b3lyp_6-31g(d).qchem.inp (generated)

006102732.b3lyp_6-31g(d).gjf (generated)

006102732.b3lyp_6-31g(d).firefly.inp (generated)

006102732.b3lyp_6-31g(d).smash.inp (generated)

006102732.b3lyp_6-31g(d).nwchem.inp (generated) 006102732.b3lyp_6-31g(d).log.xz 006102732.td-b3lyp_6-31g+(d).inp 006102732.td-b3lyp_6-31g+(d).log.xz

006102732.td-b3lyp_6-31+g(d).qchem.inp (generated)

006102732.td-b3lyp_6-31+g(d).gjf (generated)

006102732.td-b3lyp_6-31+g(d).firefly.inp (generated)

006102732.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006102732.mol 006102732.PUBCHEM 006102732.mol (via Jmol)
006102744.b3lyp_6-31g(d).inp

006102744.b3lyp_6-31g(d).qchem.inp (generated)

006102744.b3lyp_6-31g(d).gjf (generated)

006102744.b3lyp_6-31g(d).firefly.inp (generated)

006102744.b3lyp_6-31g(d).smash.inp (generated)

006102744.b3lyp_6-31g(d).nwchem.inp (generated) 006102744.b3lyp_6-31g(d).log.xz 006102744.td-b3lyp_6-31g+(d).inp 006102744.td-b3lyp_6-31g+(d).log.xz

006102744.td-b3lyp_6-31+g(d).qchem.inp (generated)

006102744.td-b3lyp_6-31+g(d).gjf (generated)

006102744.td-b3lyp_6-31+g(d).firefly.inp (generated)

006102744.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006102744.mol 006102744.PUBCHEM 006102744.mol (via Jmol)
006102760.b3lyp_6-31g(d).inp

006102760.b3lyp_6-31g(d).qchem.inp (generated)

006102760.b3lyp_6-31g(d).gjf (generated)

006102760.b3lyp_6-31g(d).firefly.inp (generated)

006102760.b3lyp_6-31g(d).smash.inp (generated)

006102760.b3lyp_6-31g(d).nwchem.inp (generated) 006102760.b3lyp_6-31g(d).log.xz 006102760.td-b3lyp_6-31g+(d).inp 006102760.td-b3lyp_6-31g+(d).log.xz

006102760.td-b3lyp_6-31+g(d).qchem.inp (generated)

006102760.td-b3lyp_6-31+g(d).gjf (generated)

006102760.td-b3lyp_6-31+g(d).firefly.inp (generated)

006102760.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006102760.mol 006102760.PUBCHEM 006102760.mol (via Jmol)
006102766.b3lyp_6-31g(d).inp

006102766.b3lyp_6-31g(d).qchem.inp (generated)

006102766.b3lyp_6-31g(d).gjf (generated)

006102766.b3lyp_6-31g(d).firefly.inp (generated)

006102766.b3lyp_6-31g(d).smash.inp (generated)

006102766.b3lyp_6-31g(d).nwchem.inp (generated) 006102766.b3lyp_6-31g(d).log.xz 006102766.td-b3lyp_6-31g+(d).inp 006102766.td-b3lyp_6-31g+(d).log.xz

006102766.td-b3lyp_6-31+g(d).qchem.inp (generated)

006102766.td-b3lyp_6-31+g(d).gjf (generated)

006102766.td-b3lyp_6-31+g(d).firefly.inp (generated)

006102766.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006102766.mol 006102766.PUBCHEM 006102766.mol (via Jmol)
006102768.b3lyp_6-31g(d).inp

006102768.b3lyp_6-31g(d).qchem.inp (generated)

006102768.b3lyp_6-31g(d).gjf (generated)

006102768.b3lyp_6-31g(d).firefly.inp (generated)

006102768.b3lyp_6-31g(d).smash.inp (generated)

006102768.b3lyp_6-31g(d).nwchem.inp (generated) 006102768.b3lyp_6-31g(d).log.xz 006102768.td-b3lyp_6-31g+(d).inp 006102768.td-b3lyp_6-31g+(d).log.xz

006102768.td-b3lyp_6-31+g(d).qchem.inp (generated)

006102768.td-b3lyp_6-31+g(d).gjf (generated)

006102768.td-b3lyp_6-31+g(d).firefly.inp (generated)

006102768.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006102768.mol 006102768.PUBCHEM 006102768.mol (via Jmol)
006102778.b3lyp_6-31g(d).inp

006102778.b3lyp_6-31g(d).qchem.inp (generated)

006102778.b3lyp_6-31g(d).gjf (generated)

006102778.b3lyp_6-31g(d).firefly.inp (generated)

006102778.b3lyp_6-31g(d).smash.inp (generated)

006102778.b3lyp_6-31g(d).nwchem.inp (generated) 006102778.b3lyp_6-31g(d).log.xz 006102778.td-b3lyp_6-31g+(d).inp 006102778.td-b3lyp_6-31g+(d).log.xz

006102778.td-b3lyp_6-31+g(d).qchem.inp (generated)

006102778.td-b3lyp_6-31+g(d).gjf (generated)

006102778.td-b3lyp_6-31+g(d).firefly.inp (generated)

006102778.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006102778.mol 006102778.PUBCHEM 006102778.mol (via Jmol)
006102780.b3lyp_6-31g(d).inp

006102780.b3lyp_6-31g(d).qchem.inp (generated)

006102780.b3lyp_6-31g(d).gjf (generated)

006102780.b3lyp_6-31g(d).firefly.inp (generated)

006102780.b3lyp_6-31g(d).smash.inp (generated)

006102780.b3lyp_6-31g(d).nwchem.inp (generated) 006102780.b3lyp_6-31g(d).log.xz 006102780.td-b3lyp_6-31g+(d).inp 006102780.td-b3lyp_6-31g+(d).log.xz

006102780.td-b3lyp_6-31+g(d).qchem.inp (generated)

006102780.td-b3lyp_6-31+g(d).gjf (generated)

006102780.td-b3lyp_6-31+g(d).firefly.inp (generated)

006102780.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006102780.mol 006102780.PUBCHEM 006102780.mol (via Jmol)
006102805.b3lyp_6-31g(d).inp

006102805.b3lyp_6-31g(d).qchem.inp (generated)

006102805.b3lyp_6-31g(d).gjf (generated)

006102805.b3lyp_6-31g(d).firefly.inp (generated)

006102805.b3lyp_6-31g(d).smash.inp (generated)

006102805.b3lyp_6-31g(d).nwchem.inp (generated) 006102805.b3lyp_6-31g(d).log.xz 006102805.td-b3lyp_6-31g+(d).inp 006102805.td-b3lyp_6-31g+(d).log.xz

006102805.td-b3lyp_6-31+g(d).qchem.inp (generated)

006102805.td-b3lyp_6-31+g(d).gjf (generated)

006102805.td-b3lyp_6-31+g(d).firefly.inp (generated)

006102805.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006102805.mol 006102805.PUBCHEM 006102805.mol (via Jmol)
006102862.b3lyp_6-31g(d).inp

006102862.b3lyp_6-31g(d).qchem.inp (generated)

006102862.b3lyp_6-31g(d).gjf (generated)

006102862.b3lyp_6-31g(d).firefly.inp (generated)

006102862.b3lyp_6-31g(d).smash.inp (generated)

006102862.b3lyp_6-31g(d).nwchem.inp (generated) 006102862.b3lyp_6-31g(d).log.xz 006102862.td-b3lyp_6-31g+(d).inp 006102862.td-b3lyp_6-31g+(d).log.xz

006102862.td-b3lyp_6-31+g(d).qchem.inp (generated)

006102862.td-b3lyp_6-31+g(d).gjf (generated)

006102862.td-b3lyp_6-31+g(d).firefly.inp (generated)

006102862.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006102862.mol 006102862.PUBCHEM 006102862.mol (via Jmol)
006102873.b3lyp_6-31g(d).inp

006102873.b3lyp_6-31g(d).qchem.inp (generated)

006102873.b3lyp_6-31g(d).gjf (generated)

006102873.b3lyp_6-31g(d).firefly.inp (generated)

006102873.b3lyp_6-31g(d).smash.inp (generated)

006102873.b3lyp_6-31g(d).nwchem.inp (generated) 006102873.b3lyp_6-31g(d).log.xz 006102873.td-b3lyp_6-31g+(d).inp 006102873.td-b3lyp_6-31g+(d).log.xz

006102873.td-b3lyp_6-31+g(d).qchem.inp (generated)

006102873.td-b3lyp_6-31+g(d).gjf (generated)

006102873.td-b3lyp_6-31+g(d).firefly.inp (generated)

006102873.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006102873.mol 006102873.PUBCHEM 006102873.mol (via Jmol)
006102935.b3lyp_6-31g(d).inp

006102935.b3lyp_6-31g(d).qchem.inp (generated)

006102935.b3lyp_6-31g(d).gjf (generated)

006102935.b3lyp_6-31g(d).firefly.inp (generated)

006102935.b3lyp_6-31g(d).smash.inp (generated)

006102935.b3lyp_6-31g(d).nwchem.inp (generated) 006102935.b3lyp_6-31g(d).log.xz 006102935.td-b3lyp_6-31g+(d).inp 006102935.td-b3lyp_6-31g+(d).log.xz

006102935.td-b3lyp_6-31+g(d).qchem.inp (generated)

006102935.td-b3lyp_6-31+g(d).gjf (generated)

006102935.td-b3lyp_6-31+g(d).firefly.inp (generated)

006102935.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006102935.mol 006102935.PUBCHEM 006102935.mol (via Jmol)
006103374.b3lyp_6-31g(d).inp

006103374.b3lyp_6-31g(d).qchem.inp (generated)

006103374.b3lyp_6-31g(d).gjf (generated)

006103374.b3lyp_6-31g(d).firefly.inp (generated)

006103374.b3lyp_6-31g(d).smash.inp (generated)

006103374.b3lyp_6-31g(d).nwchem.inp (generated) 006103374.b3lyp_6-31g(d).log.xz 006103374.td-b3lyp_6-31g+(d).inp 006103374.td-b3lyp_6-31g+(d).log.xz

006103374.td-b3lyp_6-31+g(d).qchem.inp (generated)

006103374.td-b3lyp_6-31+g(d).gjf (generated)

006103374.td-b3lyp_6-31+g(d).firefly.inp (generated)

006103374.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006103374.mol 006103374.PUBCHEM 006103374.mol (via Jmol)
006103398.b3lyp_6-31g(d).inp

006103398.b3lyp_6-31g(d).qchem.inp (generated)

006103398.b3lyp_6-31g(d).gjf (generated)

006103398.b3lyp_6-31g(d).firefly.inp (generated)

006103398.b3lyp_6-31g(d).smash.inp (generated)

006103398.b3lyp_6-31g(d).nwchem.inp (generated) 006103398.b3lyp_6-31g(d).log.xz 006103398.td-b3lyp_6-31g+(d).inp 006103398.td-b3lyp_6-31g+(d).log.xz

006103398.td-b3lyp_6-31+g(d).qchem.inp (generated)

006103398.td-b3lyp_6-31+g(d).gjf (generated)

006103398.td-b3lyp_6-31+g(d).firefly.inp (generated)

006103398.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006103398.mol 006103398.PUBCHEM 006103398.mol (via Jmol)
006103436.b3lyp_6-31g(d).inp

006103436.b3lyp_6-31g(d).qchem.inp (generated)

006103436.b3lyp_6-31g(d).gjf (generated)

006103436.b3lyp_6-31g(d).firefly.inp (generated)

006103436.b3lyp_6-31g(d).smash.inp (generated)

006103436.b3lyp_6-31g(d).nwchem.inp (generated) 006103436.b3lyp_6-31g(d).log.xz 006103436.td-b3lyp_6-31g+(d).inp 006103436.td-b3lyp_6-31g+(d).log.xz

006103436.td-b3lyp_6-31+g(d).qchem.inp (generated)

006103436.td-b3lyp_6-31+g(d).gjf (generated)

006103436.td-b3lyp_6-31+g(d).firefly.inp (generated)

006103436.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006103436.mol 006103436.PUBCHEM 006103436.mol (via Jmol)
006103447.b3lyp_6-31g(d).inp

006103447.b3lyp_6-31g(d).qchem.inp (generated)

006103447.b3lyp_6-31g(d).gjf (generated)

006103447.b3lyp_6-31g(d).firefly.inp (generated)

006103447.b3lyp_6-31g(d).smash.inp (generated)

006103447.b3lyp_6-31g(d).nwchem.inp (generated) 006103447.b3lyp_6-31g(d).log.xz 006103447.td-b3lyp_6-31g+(d).inp 006103447.td-b3lyp_6-31g+(d).log.xz

006103447.td-b3lyp_6-31+g(d).qchem.inp (generated)

006103447.td-b3lyp_6-31+g(d).gjf (generated)

006103447.td-b3lyp_6-31+g(d).firefly.inp (generated)

006103447.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006103447.mol 006103447.PUBCHEM 006103447.mol (via Jmol)
006103488.b3lyp_6-31g(d).inp

006103488.b3lyp_6-31g(d).qchem.inp (generated)

006103488.b3lyp_6-31g(d).gjf (generated)

006103488.b3lyp_6-31g(d).firefly.inp (generated)

006103488.b3lyp_6-31g(d).smash.inp (generated)

006103488.b3lyp_6-31g(d).nwchem.inp (generated) 006103488.b3lyp_6-31g(d).log.xz 006103488.mol 006103488.PUBCHEM 006103488.mol (via Jmol)
006103490.b3lyp_6-31g(d).inp

006103490.b3lyp_6-31g(d).qchem.inp (generated)

006103490.b3lyp_6-31g(d).gjf (generated)

006103490.b3lyp_6-31g(d).firefly.inp (generated)

006103490.b3lyp_6-31g(d).smash.inp (generated)

006103490.b3lyp_6-31g(d).nwchem.inp (generated) 006103490.b3lyp_6-31g(d).log.xz 006103490.td-b3lyp_6-31g+(d).inp 006103490.td-b3lyp_6-31g+(d).log.xz

006103490.td-b3lyp_6-31+g(d).qchem.inp (generated)

006103490.td-b3lyp_6-31+g(d).gjf (generated)

006103490.td-b3lyp_6-31+g(d).firefly.inp (generated)

006103490.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006103490.mol 006103490.PUBCHEM 006103490.mol (via Jmol)
006103523.b3lyp_6-31g(d).inp

006103523.b3lyp_6-31g(d).qchem.inp (generated)

006103523.b3lyp_6-31g(d).gjf (generated)

006103523.b3lyp_6-31g(d).firefly.inp (generated)

006103523.b3lyp_6-31g(d).smash.inp (generated)

006103523.b3lyp_6-31g(d).nwchem.inp (generated) 006103523.b3lyp_6-31g(d).log.xz 006103523.td-b3lyp_6-31g+(d).inp 006103523.td-b3lyp_6-31g+(d).log.xz

006103523.td-b3lyp_6-31+g(d).qchem.inp (generated)

006103523.td-b3lyp_6-31+g(d).gjf (generated)

006103523.td-b3lyp_6-31+g(d).firefly.inp (generated)

006103523.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006103523.mol 006103523.PUBCHEM 006103523.mol (via Jmol)
006103525.b3lyp_6-31g(d).inp

006103525.b3lyp_6-31g(d).qchem.inp (generated)

006103525.b3lyp_6-31g(d).gjf (generated)

006103525.b3lyp_6-31g(d).firefly.inp (generated)

006103525.b3lyp_6-31g(d).smash.inp (generated)

006103525.b3lyp_6-31g(d).nwchem.inp (generated) 006103525.b3lyp_6-31g(d).log.xz 006103525.td-b3lyp_6-31g+(d).inp 006103525.td-b3lyp_6-31g+(d).log.xz

006103525.td-b3lyp_6-31+g(d).qchem.inp (generated)

006103525.td-b3lyp_6-31+g(d).gjf (generated)

006103525.td-b3lyp_6-31+g(d).firefly.inp (generated)

006103525.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006103525.mol 006103525.PUBCHEM 006103525.mol (via Jmol)
006103714.b3lyp_6-31g(d).inp

006103714.b3lyp_6-31g(d).qchem.inp (generated)

006103714.b3lyp_6-31g(d).gjf (generated)

006103714.b3lyp_6-31g(d).firefly.inp (generated)

006103714.b3lyp_6-31g(d).smash.inp (generated)

006103714.b3lyp_6-31g(d).nwchem.inp (generated) 006103714.b3lyp_6-31g(d).log.xz 006103714.td-b3lyp_6-31g+(d).inp 006103714.td-b3lyp_6-31g+(d).log.xz

006103714.td-b3lyp_6-31+g(d).qchem.inp (generated)

006103714.td-b3lyp_6-31+g(d).gjf (generated)

006103714.td-b3lyp_6-31+g(d).firefly.inp (generated)

006103714.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006103714.mol 006103714.PUBCHEM 006103714.mol (via Jmol)
006103741.b3lyp_6-31g(d).inp

006103741.b3lyp_6-31g(d).qchem.inp (generated)

006103741.b3lyp_6-31g(d).gjf (generated)

006103741.b3lyp_6-31g(d).firefly.inp (generated)

006103741.b3lyp_6-31g(d).smash.inp (generated)

006103741.b3lyp_6-31g(d).nwchem.inp (generated) 006103741.b3lyp_6-31g(d).log.xz 006103741.td-b3lyp_6-31g+(d).inp 006103741.td-b3lyp_6-31g+(d).log.xz

006103741.td-b3lyp_6-31+g(d).qchem.inp (generated)

006103741.td-b3lyp_6-31+g(d).gjf (generated)

006103741.td-b3lyp_6-31+g(d).firefly.inp (generated)

006103741.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006103741.mol 006103741.PUBCHEM 006103741.mol (via Jmol)
006103853.b3lyp_6-31g(d).inp

006103853.b3lyp_6-31g(d).qchem.inp (generated)

006103853.b3lyp_6-31g(d).gjf (generated)

006103853.b3lyp_6-31g(d).firefly.inp (generated)

006103853.b3lyp_6-31g(d).smash.inp (generated)

006103853.b3lyp_6-31g(d).nwchem.inp (generated) 006103853.b3lyp_6-31g(d).log.xz 006103853.td-b3lyp_6-31g+(d).inp 006103853.td-b3lyp_6-31g+(d).log.xz

006103853.td-b3lyp_6-31+g(d).qchem.inp (generated)

006103853.td-b3lyp_6-31+g(d).gjf (generated)

006103853.td-b3lyp_6-31+g(d).firefly.inp (generated)

006103853.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006103853.mol 006103853.PUBCHEM 006103853.mol (via Jmol)
006103871.b3lyp_6-31g(d).inp

006103871.b3lyp_6-31g(d).qchem.inp (generated)

006103871.b3lyp_6-31g(d).gjf (generated)

006103871.b3lyp_6-31g(d).firefly.inp (generated)

006103871.b3lyp_6-31g(d).smash.inp (generated)

006103871.b3lyp_6-31g(d).nwchem.inp (generated) 006103871.b3lyp_6-31g(d).log.xz 006103871.mol 006103871.PUBCHEM 006103871.mol (via Jmol)
006103886.b3lyp_6-31g(d).inp

006103886.b3lyp_6-31g(d).qchem.inp (generated)

006103886.b3lyp_6-31g(d).gjf (generated)

006103886.b3lyp_6-31g(d).firefly.inp (generated)

006103886.b3lyp_6-31g(d).smash.inp (generated)

006103886.b3lyp_6-31g(d).nwchem.inp (generated) 006103886.b3lyp_6-31g(d).log.xz 006103886.mol 006103886.PUBCHEM 006103886.mol (via Jmol)
006103924.b3lyp_6-31g(d).inp

006103924.b3lyp_6-31g(d).qchem.inp (generated)

006103924.b3lyp_6-31g(d).gjf (generated)

006103924.b3lyp_6-31g(d).firefly.inp (generated)

006103924.b3lyp_6-31g(d).smash.inp (generated)

006103924.b3lyp_6-31g(d).nwchem.inp (generated) 006103924.b3lyp_6-31g(d).log.xz 006103924.td-b3lyp_6-31g+(d).inp 006103924.td-b3lyp_6-31g+(d).log.xz

006103924.td-b3lyp_6-31+g(d).qchem.inp (generated)

006103924.td-b3lyp_6-31+g(d).gjf (generated)

006103924.td-b3lyp_6-31+g(d).firefly.inp (generated)

006103924.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006103924.mol 006103924.PUBCHEM 006103924.mol (via Jmol)
006104260.b3lyp_6-31g(d).inp

006104260.b3lyp_6-31g(d).qchem.inp (generated)

006104260.b3lyp_6-31g(d).gjf (generated)

006104260.b3lyp_6-31g(d).firefly.inp (generated)

006104260.b3lyp_6-31g(d).smash.inp (generated)

006104260.b3lyp_6-31g(d).nwchem.inp (generated) 006104260.b3lyp_6-31g(d).log.xz 006104260.td-b3lyp_6-31g+(d).inp 006104260.td-b3lyp_6-31g+(d).log.xz

006104260.td-b3lyp_6-31+g(d).qchem.inp (generated)

006104260.td-b3lyp_6-31+g(d).gjf (generated)

006104260.td-b3lyp_6-31+g(d).firefly.inp (generated)

006104260.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006104260.mol 006104260.PUBCHEM 006104260.mol (via Jmol)
006104273.b3lyp_6-31g(d).inp

006104273.b3lyp_6-31g(d).qchem.inp (generated)

006104273.b3lyp_6-31g(d).gjf (generated)

006104273.b3lyp_6-31g(d).firefly.inp (generated)

006104273.b3lyp_6-31g(d).smash.inp (generated)

006104273.b3lyp_6-31g(d).nwchem.inp (generated) 006104273.b3lyp_6-31g(d).log.xz 006104273.mol 006104273.PUBCHEM 006104273.mol (via Jmol)
006104281.b3lyp_6-31g(d).inp

006104281.b3lyp_6-31g(d).qchem.inp (generated)

006104281.b3lyp_6-31g(d).gjf (generated)

006104281.b3lyp_6-31g(d).firefly.inp (generated)

006104281.b3lyp_6-31g(d).smash.inp (generated)

006104281.b3lyp_6-31g(d).nwchem.inp (generated) 006104281.b3lyp_6-31g(d).log.xz 006104281.td-b3lyp_6-31g+(d).inp 006104281.td-b3lyp_6-31g+(d).log.xz

006104281.td-b3lyp_6-31+g(d).qchem.inp (generated)

006104281.td-b3lyp_6-31+g(d).gjf (generated)

006104281.td-b3lyp_6-31+g(d).firefly.inp (generated)

006104281.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006104281.mol 006104281.PUBCHEM 006104281.mol (via Jmol)
006104290.b3lyp_6-31g(d).inp

006104290.b3lyp_6-31g(d).qchem.inp (generated)

006104290.b3lyp_6-31g(d).gjf (generated)

006104290.b3lyp_6-31g(d).firefly.inp (generated)

006104290.b3lyp_6-31g(d).smash.inp (generated)

006104290.b3lyp_6-31g(d).nwchem.inp (generated) 006104290.b3lyp_6-31g(d).log.xz 006104290.td-b3lyp_6-31g+(d).inp 006104290.td-b3lyp_6-31g+(d).log.xz

006104290.td-b3lyp_6-31+g(d).qchem.inp (generated)

006104290.td-b3lyp_6-31+g(d).gjf (generated)

006104290.td-b3lyp_6-31+g(d).firefly.inp (generated)

006104290.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006104290.mol 006104290.PUBCHEM 006104290.mol (via Jmol)
006104358.b3lyp_6-31g(d).inp

006104358.b3lyp_6-31g(d).qchem.inp (generated)

006104358.b3lyp_6-31g(d).gjf (generated)

006104358.b3lyp_6-31g(d).firefly.inp (generated)

006104358.b3lyp_6-31g(d).smash.inp (generated)

006104358.b3lyp_6-31g(d).nwchem.inp (generated) 006104358.b3lyp_6-31g(d).log.xz 006104358.td-b3lyp_6-31g+(d).inp 006104358.td-b3lyp_6-31g+(d).log.xz

006104358.td-b3lyp_6-31+g(d).qchem.inp (generated)

006104358.td-b3lyp_6-31+g(d).gjf (generated)

006104358.td-b3lyp_6-31+g(d).firefly.inp (generated)

006104358.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006104358.mol 006104358.PUBCHEM 006104358.mol (via Jmol)
006104389.b3lyp_6-31g(d).inp

006104389.b3lyp_6-31g(d).qchem.inp (generated)

006104389.b3lyp_6-31g(d).gjf (generated)

006104389.b3lyp_6-31g(d).firefly.inp (generated)

006104389.b3lyp_6-31g(d).smash.inp (generated)

006104389.b3lyp_6-31g(d).nwchem.inp (generated) 006104389.b3lyp_6-31g(d).log.xz 006104389.mol 006104389.PUBCHEM 006104389.mol (via Jmol)
006104421.b3lyp_6-31g(d).inp

006104421.b3lyp_6-31g(d).qchem.inp (generated)

006104421.b3lyp_6-31g(d).gjf (generated)

006104421.b3lyp_6-31g(d).firefly.inp (generated)

006104421.b3lyp_6-31g(d).smash.inp (generated)

006104421.b3lyp_6-31g(d).nwchem.inp (generated) 006104421.b3lyp_6-31g(d).log.xz 006104421.td-b3lyp_6-31g+(d).inp 006104421.td-b3lyp_6-31g+(d).log.xz

006104421.td-b3lyp_6-31+g(d).qchem.inp (generated)

006104421.td-b3lyp_6-31+g(d).gjf (generated)

006104421.td-b3lyp_6-31+g(d).firefly.inp (generated)

006104421.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006104421.mol 006104421.PUBCHEM 006104421.mol (via Jmol)
006104497.b3lyp_6-31g(d).inp

006104497.b3lyp_6-31g(d).qchem.inp (generated)

006104497.b3lyp_6-31g(d).gjf (generated)

006104497.b3lyp_6-31g(d).firefly.inp (generated)

006104497.b3lyp_6-31g(d).smash.inp (generated)

006104497.b3lyp_6-31g(d).nwchem.inp (generated) 006104497.b3lyp_6-31g(d).log.xz 006104497.td-b3lyp_6-31g+(d).inp 006104497.td-b3lyp_6-31g+(d).log.xz

006104497.td-b3lyp_6-31+g(d).qchem.inp (generated)

006104497.td-b3lyp_6-31+g(d).gjf (generated)

006104497.td-b3lyp_6-31+g(d).firefly.inp (generated)

006104497.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006104497.mol 006104497.PUBCHEM 006104497.mol (via Jmol)
006104513.b3lyp_6-31g(d).inp

006104513.b3lyp_6-31g(d).qchem.inp (generated)

006104513.b3lyp_6-31g(d).gjf (generated)

006104513.b3lyp_6-31g(d).firefly.inp (generated)

006104513.b3lyp_6-31g(d).smash.inp (generated)

006104513.b3lyp_6-31g(d).nwchem.inp (generated) 006104513.b3lyp_6-31g(d).log.xz 006104513.td-b3lyp_6-31g+(d).inp 006104513.td-b3lyp_6-31g+(d).log.xz

006104513.td-b3lyp_6-31+g(d).qchem.inp (generated)

006104513.td-b3lyp_6-31+g(d).gjf (generated)

006104513.td-b3lyp_6-31+g(d).firefly.inp (generated)

006104513.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006104513.mol 006104513.PUBCHEM 006104513.mol (via Jmol)
006104589.b3lyp_6-31g(d).inp

006104589.b3lyp_6-31g(d).qchem.inp (generated)

006104589.b3lyp_6-31g(d).gjf (generated)

006104589.b3lyp_6-31g(d).firefly.inp (generated)

006104589.b3lyp_6-31g(d).smash.inp (generated)

006104589.b3lyp_6-31g(d).nwchem.inp (generated) 006104589.b3lyp_6-31g(d).log.xz 006104589.mol 006104589.PUBCHEM 006104589.mol (via Jmol)
006104731.b3lyp_6-31g(d).inp

006104731.b3lyp_6-31g(d).qchem.inp (generated)

006104731.b3lyp_6-31g(d).gjf (generated)

006104731.b3lyp_6-31g(d).firefly.inp (generated)

006104731.b3lyp_6-31g(d).smash.inp (generated)

006104731.b3lyp_6-31g(d).nwchem.inp (generated) 006104731.b3lyp_6-31g(d).log.xz 006104731.td-b3lyp_6-31g+(d).inp 006104731.td-b3lyp_6-31g+(d).log.xz

006104731.td-b3lyp_6-31+g(d).qchem.inp (generated)

006104731.td-b3lyp_6-31+g(d).gjf (generated)

006104731.td-b3lyp_6-31+g(d).firefly.inp (generated)

006104731.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006104731.mol 006104731.PUBCHEM 006104731.mol (via Jmol)
006104815.b3lyp_6-31g(d).inp

006104815.b3lyp_6-31g(d).qchem.inp (generated)

006104815.b3lyp_6-31g(d).gjf (generated)

006104815.b3lyp_6-31g(d).firefly.inp (generated)

006104815.b3lyp_6-31g(d).smash.inp (generated)

006104815.b3lyp_6-31g(d).nwchem.inp (generated) 006104815.b3lyp_6-31g(d).log.xz 006104815.td-b3lyp_6-31g+(d).inp 006104815.td-b3lyp_6-31g+(d).log.xz

006104815.td-b3lyp_6-31+g(d).qchem.inp (generated)

006104815.td-b3lyp_6-31+g(d).gjf (generated)

006104815.td-b3lyp_6-31+g(d).firefly.inp (generated)

006104815.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006104815.mol 006104815.PUBCHEM 006104815.mol (via Jmol)
006104832.b3lyp_6-31g(d).inp

006104832.b3lyp_6-31g(d).qchem.inp (generated)

006104832.b3lyp_6-31g(d).gjf (generated)

006104832.b3lyp_6-31g(d).firefly.inp (generated)

006104832.b3lyp_6-31g(d).smash.inp (generated)

006104832.b3lyp_6-31g(d).nwchem.inp (generated) 006104832.b3lyp_6-31g(d).log.xz 006104832.td-b3lyp_6-31g+(d).inp 006104832.td-b3lyp_6-31g+(d).log.xz

006104832.td-b3lyp_6-31+g(d).qchem.inp (generated)

006104832.td-b3lyp_6-31+g(d).gjf (generated)

006104832.td-b3lyp_6-31+g(d).firefly.inp (generated)

006104832.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006104832.mol 006104832.PUBCHEM 006104832.mol (via Jmol)
006104897.b3lyp_6-31g(d).inp

006104897.b3lyp_6-31g(d).qchem.inp (generated)

006104897.b3lyp_6-31g(d).gjf (generated)

006104897.b3lyp_6-31g(d).firefly.inp (generated)

006104897.b3lyp_6-31g(d).smash.inp (generated)

006104897.b3lyp_6-31g(d).nwchem.inp (generated) 006104897.b3lyp_6-31g(d).log.xz 006104897.td-b3lyp_6-31g+(d).inp 006104897.td-b3lyp_6-31g+(d).log.xz

006104897.td-b3lyp_6-31+g(d).qchem.inp (generated)

006104897.td-b3lyp_6-31+g(d).gjf (generated)

006104897.td-b3lyp_6-31+g(d).firefly.inp (generated)

006104897.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006104897.mol 006104897.PUBCHEM 006104897.mol (via Jmol)
006104965.b3lyp_6-31g(d).inp

006104965.b3lyp_6-31g(d).qchem.inp (generated)

006104965.b3lyp_6-31g(d).gjf (generated)

006104965.b3lyp_6-31g(d).firefly.inp (generated)

006104965.b3lyp_6-31g(d).smash.inp (generated)

006104965.b3lyp_6-31g(d).nwchem.inp (generated) 006104965.b3lyp_6-31g(d).log.xz 006104965.td-b3lyp_6-31g+(d).inp 006104965.td-b3lyp_6-31g+(d).log.xz

006104965.td-b3lyp_6-31+g(d).qchem.inp (generated)

006104965.td-b3lyp_6-31+g(d).gjf (generated)

006104965.td-b3lyp_6-31+g(d).firefly.inp (generated)

006104965.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006104965.mol 006104965.PUBCHEM 006104965.mol (via Jmol)
006104981.b3lyp_6-31g(d).inp

006104981.b3lyp_6-31g(d).qchem.inp (generated)

006104981.b3lyp_6-31g(d).gjf (generated)

006104981.b3lyp_6-31g(d).firefly.inp (generated)

006104981.b3lyp_6-31g(d).smash.inp (generated)

006104981.b3lyp_6-31g(d).nwchem.inp (generated) 006104981.b3lyp_6-31g(d).log.xz 006104981.td-b3lyp_6-31g+(d).inp 006104981.td-b3lyp_6-31g+(d).log.xz

006104981.td-b3lyp_6-31+g(d).qchem.inp (generated)

006104981.td-b3lyp_6-31+g(d).gjf (generated)

006104981.td-b3lyp_6-31+g(d).firefly.inp (generated)

006104981.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006104981.mol 006104981.PUBCHEM 006104981.mol (via Jmol)
006105127.b3lyp_6-31g(d).inp

006105127.b3lyp_6-31g(d).qchem.inp (generated)

006105127.b3lyp_6-31g(d).gjf (generated)

006105127.b3lyp_6-31g(d).firefly.inp (generated)

006105127.b3lyp_6-31g(d).smash.inp (generated)

006105127.b3lyp_6-31g(d).nwchem.inp (generated) 006105127.b3lyp_6-31g(d).log.xz 006105127.td-b3lyp_6-31g+(d).inp 006105127.td-b3lyp_6-31g+(d).log.xz

006105127.td-b3lyp_6-31+g(d).qchem.inp (generated)

006105127.td-b3lyp_6-31+g(d).gjf (generated)

006105127.td-b3lyp_6-31+g(d).firefly.inp (generated)

006105127.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006105127.mol 006105127.PUBCHEM 006105127.mol (via Jmol)
006105182.b3lyp_6-31g(d).inp

006105182.b3lyp_6-31g(d).qchem.inp (generated)

006105182.b3lyp_6-31g(d).gjf (generated)

006105182.b3lyp_6-31g(d).firefly.inp (generated)

006105182.b3lyp_6-31g(d).smash.inp (generated)

006105182.b3lyp_6-31g(d).nwchem.inp (generated) 006105182.b3lyp_6-31g(d).log.xz 006105182.td-b3lyp_6-31g+(d).inp 006105182.td-b3lyp_6-31g+(d).log.xz

006105182.td-b3lyp_6-31+g(d).qchem.inp (generated)

006105182.td-b3lyp_6-31+g(d).gjf (generated)

006105182.td-b3lyp_6-31+g(d).firefly.inp (generated)

006105182.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006105182.mol 006105182.PUBCHEM 006105182.mol (via Jmol)
006105191.b3lyp_6-31g(d).inp

006105191.b3lyp_6-31g(d).qchem.inp (generated)

006105191.b3lyp_6-31g(d).gjf (generated)

006105191.b3lyp_6-31g(d).firefly.inp (generated)

006105191.b3lyp_6-31g(d).smash.inp (generated)

006105191.b3lyp_6-31g(d).nwchem.inp (generated) 006105191.b3lyp_6-31g(d).log.xz 006105191.td-b3lyp_6-31g+(d).inp 006105191.td-b3lyp_6-31g+(d).log.xz

006105191.td-b3lyp_6-31+g(d).qchem.inp (generated)

006105191.td-b3lyp_6-31+g(d).gjf (generated)

006105191.td-b3lyp_6-31+g(d).firefly.inp (generated)

006105191.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006105191.mol 006105191.PUBCHEM 006105191.mol (via Jmol)
006105231.b3lyp_6-31g(d).inp

006105231.b3lyp_6-31g(d).qchem.inp (generated)

006105231.b3lyp_6-31g(d).gjf (generated)

006105231.b3lyp_6-31g(d).firefly.inp (generated)

006105231.b3lyp_6-31g(d).smash.inp (generated)

006105231.b3lyp_6-31g(d).nwchem.inp (generated) 006105231.b3lyp_6-31g(d).log.xz 006105231.td-b3lyp_6-31g+(d).inp 006105231.td-b3lyp_6-31g+(d).log.xz

006105231.td-b3lyp_6-31+g(d).qchem.inp (generated)

006105231.td-b3lyp_6-31+g(d).gjf (generated)

006105231.td-b3lyp_6-31+g(d).firefly.inp (generated)

006105231.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006105231.mol 006105231.PUBCHEM 006105231.mol (via Jmol)
006105434.b3lyp_6-31g(d).inp

006105434.b3lyp_6-31g(d).qchem.inp (generated)

006105434.b3lyp_6-31g(d).gjf (generated)

006105434.b3lyp_6-31g(d).firefly.inp (generated)

006105434.b3lyp_6-31g(d).smash.inp (generated)

006105434.b3lyp_6-31g(d).nwchem.inp (generated) 006105434.b3lyp_6-31g(d).log.xz 006105434.td-b3lyp_6-31g+(d).inp 006105434.td-b3lyp_6-31g+(d).log.xz

006105434.td-b3lyp_6-31+g(d).qchem.inp (generated)

006105434.td-b3lyp_6-31+g(d).gjf (generated)

006105434.td-b3lyp_6-31+g(d).firefly.inp (generated)

006105434.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006105434.mol 006105434.PUBCHEM 006105434.mol (via Jmol)
006105437.b3lyp_6-31g(d).inp

006105437.b3lyp_6-31g(d).qchem.inp (generated)

006105437.b3lyp_6-31g(d).gjf (generated)

006105437.b3lyp_6-31g(d).firefly.inp (generated)

006105437.b3lyp_6-31g(d).smash.inp (generated)

006105437.b3lyp_6-31g(d).nwchem.inp (generated) 006105437.b3lyp_6-31g(d).log.xz 006105437.td-b3lyp_6-31g+(d).inp 006105437.td-b3lyp_6-31g+(d).log.xz

006105437.td-b3lyp_6-31+g(d).qchem.inp (generated)

006105437.td-b3lyp_6-31+g(d).gjf (generated)

006105437.td-b3lyp_6-31+g(d).firefly.inp (generated)

006105437.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006105437.mol 006105437.PUBCHEM 006105437.mol (via Jmol)
006105465.b3lyp_6-31g(d).inp

006105465.b3lyp_6-31g(d).qchem.inp (generated)

006105465.b3lyp_6-31g(d).gjf (generated)

006105465.b3lyp_6-31g(d).firefly.inp (generated)

006105465.b3lyp_6-31g(d).smash.inp (generated)

006105465.b3lyp_6-31g(d).nwchem.inp (generated) 006105465.b3lyp_6-31g(d).log.xz 006105465.td-b3lyp_6-31g+(d).inp 006105465.td-b3lyp_6-31g+(d).log.xz

006105465.td-b3lyp_6-31+g(d).qchem.inp (generated)

006105465.td-b3lyp_6-31+g(d).gjf (generated)

006105465.td-b3lyp_6-31+g(d).firefly.inp (generated)

006105465.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006105465.mol 006105465.PUBCHEM 006105465.mol (via Jmol)
006105477.b3lyp_6-31g(d).inp

006105477.b3lyp_6-31g(d).qchem.inp (generated)

006105477.b3lyp_6-31g(d).gjf (generated)

006105477.b3lyp_6-31g(d).firefly.inp (generated)

006105477.b3lyp_6-31g(d).smash.inp (generated)

006105477.b3lyp_6-31g(d).nwchem.inp (generated) 006105477.b3lyp_6-31g(d).log.xz 006105477.td-b3lyp_6-31g+(d).inp 006105477.td-b3lyp_6-31g+(d).log.xz

006105477.td-b3lyp_6-31+g(d).qchem.inp (generated)

006105477.td-b3lyp_6-31+g(d).gjf (generated)

006105477.td-b3lyp_6-31+g(d).firefly.inp (generated)

006105477.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006105477.mol 006105477.PUBCHEM 006105477.mol (via Jmol)
006105531.b3lyp_6-31g(d).inp

006105531.b3lyp_6-31g(d).qchem.inp (generated)

006105531.b3lyp_6-31g(d).gjf (generated)

006105531.b3lyp_6-31g(d).firefly.inp (generated)

006105531.b3lyp_6-31g(d).smash.inp (generated)

006105531.b3lyp_6-31g(d).nwchem.inp (generated) 006105531.b3lyp_6-31g(d).log.xz 006105531.td-b3lyp_6-31g+(d).inp 006105531.td-b3lyp_6-31g+(d).log.xz

006105531.td-b3lyp_6-31+g(d).qchem.inp (generated)

006105531.td-b3lyp_6-31+g(d).gjf (generated)

006105531.td-b3lyp_6-31+g(d).firefly.inp (generated)

006105531.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006105531.mol 006105531.PUBCHEM 006105531.mol (via Jmol)
006105564.b3lyp_6-31g(d).inp

006105564.b3lyp_6-31g(d).qchem.inp (generated)

006105564.b3lyp_6-31g(d).gjf (generated)

006105564.b3lyp_6-31g(d).firefly.inp (generated)

006105564.b3lyp_6-31g(d).smash.inp (generated)

006105564.b3lyp_6-31g(d).nwchem.inp (generated) 006105564.b3lyp_6-31g(d).log.xz 006105564.td-b3lyp_6-31g+(d).inp 006105564.td-b3lyp_6-31g+(d).log.xz

006105564.td-b3lyp_6-31+g(d).qchem.inp (generated)

006105564.td-b3lyp_6-31+g(d).gjf (generated)

006105564.td-b3lyp_6-31+g(d).firefly.inp (generated)

006105564.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006105564.mol 006105564.PUBCHEM 006105564.mol (via Jmol)
006105619.b3lyp_6-31g(d).inp

006105619.b3lyp_6-31g(d).qchem.inp (generated)

006105619.b3lyp_6-31g(d).gjf (generated)

006105619.b3lyp_6-31g(d).firefly.inp (generated)

006105619.b3lyp_6-31g(d).smash.inp (generated)

006105619.b3lyp_6-31g(d).nwchem.inp (generated) 006105619.b3lyp_6-31g(d).log.xz 006105619.mol 006105619.PUBCHEM 006105619.mol (via Jmol)
006105796.b3lyp_6-31g(d).inp

006105796.b3lyp_6-31g(d).qchem.inp (generated)

006105796.b3lyp_6-31g(d).gjf (generated)

006105796.b3lyp_6-31g(d).firefly.inp (generated)

006105796.b3lyp_6-31g(d).smash.inp (generated)

006105796.b3lyp_6-31g(d).nwchem.inp (generated) 006105796.b3lyp_6-31g(d).log.xz 006105796.td-b3lyp_6-31g+(d).inp 006105796.td-b3lyp_6-31g+(d).log.xz

006105796.td-b3lyp_6-31+g(d).qchem.inp (generated)

006105796.td-b3lyp_6-31+g(d).gjf (generated)

006105796.td-b3lyp_6-31+g(d).firefly.inp (generated)

006105796.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006105796.mol 006105796.PUBCHEM 006105796.mol (via Jmol)
006105797.b3lyp_6-31g(d).inp

006105797.b3lyp_6-31g(d).qchem.inp (generated)

006105797.b3lyp_6-31g(d).gjf (generated)

006105797.b3lyp_6-31g(d).firefly.inp (generated)

006105797.b3lyp_6-31g(d).smash.inp (generated)

006105797.b3lyp_6-31g(d).nwchem.inp (generated) 006105797.b3lyp_6-31g(d).log.xz 006105797.td-b3lyp_6-31g+(d).inp 006105797.td-b3lyp_6-31g+(d).log.xz

006105797.td-b3lyp_6-31+g(d).qchem.inp (generated)

006105797.td-b3lyp_6-31+g(d).gjf (generated)

006105797.td-b3lyp_6-31+g(d).firefly.inp (generated)

006105797.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006105797.mol 006105797.PUBCHEM 006105797.mol (via Jmol)
006105823.b3lyp_6-31g(d).inp

006105823.b3lyp_6-31g(d).qchem.inp (generated)

006105823.b3lyp_6-31g(d).gjf (generated)

006105823.b3lyp_6-31g(d).firefly.inp (generated)

006105823.b3lyp_6-31g(d).smash.inp (generated)

006105823.b3lyp_6-31g(d).nwchem.inp (generated) 006105823.b3lyp_6-31g(d).log.xz 006105823.td-b3lyp_6-31g+(d).inp 006105823.td-b3lyp_6-31g+(d).log.xz

006105823.td-b3lyp_6-31+g(d).qchem.inp (generated)

006105823.td-b3lyp_6-31+g(d).gjf (generated)

006105823.td-b3lyp_6-31+g(d).firefly.inp (generated)

006105823.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006105823.mol 006105823.PUBCHEM 006105823.mol (via Jmol)
006105844.b3lyp_6-31g(d).inp

006105844.b3lyp_6-31g(d).qchem.inp (generated)

006105844.b3lyp_6-31g(d).gjf (generated)

006105844.b3lyp_6-31g(d).firefly.inp (generated)

006105844.b3lyp_6-31g(d).smash.inp (generated)

006105844.b3lyp_6-31g(d).nwchem.inp (generated) 006105844.b3lyp_6-31g(d).log.xz 006105844.td-b3lyp_6-31g+(d).inp 006105844.td-b3lyp_6-31g+(d).log.xz

006105844.td-b3lyp_6-31+g(d).qchem.inp (generated)

006105844.td-b3lyp_6-31+g(d).gjf (generated)

006105844.td-b3lyp_6-31+g(d).firefly.inp (generated)

006105844.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006105844.mol 006105844.PUBCHEM 006105844.mol (via Jmol)
006105870.b3lyp_6-31g(d).inp

006105870.b3lyp_6-31g(d).qchem.inp (generated)

006105870.b3lyp_6-31g(d).gjf (generated)

006105870.b3lyp_6-31g(d).firefly.inp (generated)

006105870.b3lyp_6-31g(d).smash.inp (generated)

006105870.b3lyp_6-31g(d).nwchem.inp (generated) 006105870.b3lyp_6-31g(d).log.xz 006105870.td-b3lyp_6-31g+(d).inp 006105870.td-b3lyp_6-31g+(d).log.xz

006105870.td-b3lyp_6-31+g(d).qchem.inp (generated)

006105870.td-b3lyp_6-31+g(d).gjf (generated)

006105870.td-b3lyp_6-31+g(d).firefly.inp (generated)

006105870.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006105870.mol 006105870.PUBCHEM 006105870.mol (via Jmol)
006105887.b3lyp_6-31g(d).inp

006105887.b3lyp_6-31g(d).qchem.inp (generated)

006105887.b3lyp_6-31g(d).gjf (generated)

006105887.b3lyp_6-31g(d).firefly.inp (generated)

006105887.b3lyp_6-31g(d).smash.inp (generated)

006105887.b3lyp_6-31g(d).nwchem.inp (generated) 006105887.b3lyp_6-31g(d).log.xz 006105887.mol 006105887.PUBCHEM 006105887.mol (via Jmol)
006105899.b3lyp_6-31g(d).inp

006105899.b3lyp_6-31g(d).qchem.inp (generated)

006105899.b3lyp_6-31g(d).gjf (generated)

006105899.b3lyp_6-31g(d).firefly.inp (generated)

006105899.b3lyp_6-31g(d).smash.inp (generated)

006105899.b3lyp_6-31g(d).nwchem.inp (generated) 006105899.b3lyp_6-31g(d).log.xz 006105899.td-b3lyp_6-31g+(d).inp 006105899.td-b3lyp_6-31g+(d).log.xz

006105899.td-b3lyp_6-31+g(d).qchem.inp (generated)

006105899.td-b3lyp_6-31+g(d).gjf (generated)

006105899.td-b3lyp_6-31+g(d).firefly.inp (generated)

006105899.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006105899.mol 006105899.PUBCHEM 006105899.mol (via Jmol)
006105970.b3lyp_6-31g(d).inp

006105970.b3lyp_6-31g(d).qchem.inp (generated)

006105970.b3lyp_6-31g(d).gjf (generated)

006105970.b3lyp_6-31g(d).firefly.inp (generated)

006105970.b3lyp_6-31g(d).smash.inp (generated)

006105970.b3lyp_6-31g(d).nwchem.inp (generated) 006105970.b3lyp_6-31g(d).log.xz 006105970.td-b3lyp_6-31g+(d).inp 006105970.td-b3lyp_6-31g+(d).log.xz

006105970.td-b3lyp_6-31+g(d).qchem.inp (generated)

006105970.td-b3lyp_6-31+g(d).gjf (generated)

006105970.td-b3lyp_6-31+g(d).firefly.inp (generated)

006105970.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006105970.mol 006105970.PUBCHEM 006105970.mol (via Jmol)
006105987.b3lyp_6-31g(d).inp

006105987.b3lyp_6-31g(d).qchem.inp (generated)

006105987.b3lyp_6-31g(d).gjf (generated)

006105987.b3lyp_6-31g(d).firefly.inp (generated)

006105987.b3lyp_6-31g(d).smash.inp (generated)

006105987.b3lyp_6-31g(d).nwchem.inp (generated) 006105987.b3lyp_6-31g(d).log.xz 006105987.td-b3lyp_6-31g+(d).inp 006105987.td-b3lyp_6-31g+(d).log.xz

006105987.td-b3lyp_6-31+g(d).qchem.inp (generated)

006105987.td-b3lyp_6-31+g(d).gjf (generated)

006105987.td-b3lyp_6-31+g(d).firefly.inp (generated)

006105987.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006105987.mol 006105987.PUBCHEM 006105987.mol (via Jmol)
006106034.b3lyp_6-31g(d).inp

006106034.b3lyp_6-31g(d).qchem.inp (generated)

006106034.b3lyp_6-31g(d).gjf (generated)

006106034.b3lyp_6-31g(d).firefly.inp (generated)

006106034.b3lyp_6-31g(d).smash.inp (generated)

006106034.b3lyp_6-31g(d).nwchem.inp (generated) 006106034.b3lyp_6-31g(d).log.xz 006106034.td-b3lyp_6-31g+(d).inp 006106034.td-b3lyp_6-31g+(d).log.xz

006106034.td-b3lyp_6-31+g(d).qchem.inp (generated)

006106034.td-b3lyp_6-31+g(d).gjf (generated)

006106034.td-b3lyp_6-31+g(d).firefly.inp (generated)

006106034.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006106034.mol 006106034.PUBCHEM 006106034.mol (via Jmol)
006106146.b3lyp_6-31g(d).inp

006106146.b3lyp_6-31g(d).qchem.inp (generated)

006106146.b3lyp_6-31g(d).gjf (generated)

006106146.b3lyp_6-31g(d).firefly.inp (generated)

006106146.b3lyp_6-31g(d).smash.inp (generated)

006106146.b3lyp_6-31g(d).nwchem.inp (generated) 006106146.b3lyp_6-31g(d).log.xz 006106146.td-b3lyp_6-31g+(d).inp 006106146.td-b3lyp_6-31g+(d).log.xz

006106146.td-b3lyp_6-31+g(d).qchem.inp (generated)

006106146.td-b3lyp_6-31+g(d).gjf (generated)

006106146.td-b3lyp_6-31+g(d).firefly.inp (generated)

006106146.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006106146.mol 006106146.PUBCHEM 006106146.mol (via Jmol)
006106150.b3lyp_6-31g(d).inp

006106150.b3lyp_6-31g(d).qchem.inp (generated)

006106150.b3lyp_6-31g(d).gjf (generated)

006106150.b3lyp_6-31g(d).firefly.inp (generated)

006106150.b3lyp_6-31g(d).smash.inp (generated)

006106150.b3lyp_6-31g(d).nwchem.inp (generated) 006106150.b3lyp_6-31g(d).log.xz 006106150.td-b3lyp_6-31g+(d).inp 006106150.td-b3lyp_6-31g+(d).log.xz

006106150.td-b3lyp_6-31+g(d).qchem.inp (generated)

006106150.td-b3lyp_6-31+g(d).gjf (generated)

006106150.td-b3lyp_6-31+g(d).firefly.inp (generated)

006106150.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006106150.mol 006106150.PUBCHEM 006106150.mol (via Jmol)
006106219.b3lyp_6-31g(d).inp

006106219.b3lyp_6-31g(d).qchem.inp (generated)

006106219.b3lyp_6-31g(d).gjf (generated)

006106219.b3lyp_6-31g(d).firefly.inp (generated)

006106219.b3lyp_6-31g(d).smash.inp (generated)

006106219.b3lyp_6-31g(d).nwchem.inp (generated) 006106219.b3lyp_6-31g(d).log.xz 006106219.td-b3lyp_6-31g+(d).inp 006106219.td-b3lyp_6-31g+(d).log.xz

006106219.td-b3lyp_6-31+g(d).qchem.inp (generated)

006106219.td-b3lyp_6-31+g(d).gjf (generated)

006106219.td-b3lyp_6-31+g(d).firefly.inp (generated)

006106219.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006106219.mol 006106219.PUBCHEM 006106219.mol (via Jmol)
006106251.b3lyp_6-31g(d).inp

006106251.b3lyp_6-31g(d).qchem.inp (generated)

006106251.b3lyp_6-31g(d).gjf (generated)

006106251.b3lyp_6-31g(d).firefly.inp (generated)

006106251.b3lyp_6-31g(d).smash.inp (generated)

006106251.b3lyp_6-31g(d).nwchem.inp (generated) 006106251.b3lyp_6-31g(d).log.xz 006106251.td-b3lyp_6-31g+(d).inp 006106251.td-b3lyp_6-31g+(d).log.xz

006106251.td-b3lyp_6-31+g(d).qchem.inp (generated)

006106251.td-b3lyp_6-31+g(d).gjf (generated)

006106251.td-b3lyp_6-31+g(d).firefly.inp (generated)

006106251.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006106251.mol 006106251.PUBCHEM 006106251.mol (via Jmol)
006106302.b3lyp_6-31g(d).inp

006106302.b3lyp_6-31g(d).qchem.inp (generated)

006106302.b3lyp_6-31g(d).gjf (generated)

006106302.b3lyp_6-31g(d).firefly.inp (generated)

006106302.b3lyp_6-31g(d).smash.inp (generated)

006106302.b3lyp_6-31g(d).nwchem.inp (generated) 006106302.b3lyp_6-31g(d).log.xz 006106302.td-b3lyp_6-31g+(d).inp 006106302.td-b3lyp_6-31g+(d).log.xz

006106302.td-b3lyp_6-31+g(d).qchem.inp (generated)

006106302.td-b3lyp_6-31+g(d).gjf (generated)

006106302.td-b3lyp_6-31+g(d).firefly.inp (generated)

006106302.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006106302.mol 006106302.PUBCHEM 006106302.mol (via Jmol)
006106361.b3lyp_6-31g(d).inp

006106361.b3lyp_6-31g(d).qchem.inp (generated)

006106361.b3lyp_6-31g(d).gjf (generated)

006106361.b3lyp_6-31g(d).firefly.inp (generated)

006106361.b3lyp_6-31g(d).smash.inp (generated)

006106361.b3lyp_6-31g(d).nwchem.inp (generated) 006106361.b3lyp_6-31g(d).log.xz 006106361.td-b3lyp_6-31g+(d).inp 006106361.td-b3lyp_6-31g+(d).log.xz

006106361.td-b3lyp_6-31+g(d).qchem.inp (generated)

006106361.td-b3lyp_6-31+g(d).gjf (generated)

006106361.td-b3lyp_6-31+g(d).firefly.inp (generated)

006106361.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006106361.mol 006106361.PUBCHEM 006106361.mol (via Jmol)
006106552.b3lyp_6-31g(d).inp

006106552.b3lyp_6-31g(d).qchem.inp (generated)

006106552.b3lyp_6-31g(d).gjf (generated)

006106552.b3lyp_6-31g(d).firefly.inp (generated)

006106552.b3lyp_6-31g(d).smash.inp (generated)

006106552.b3lyp_6-31g(d).nwchem.inp (generated) 006106552.b3lyp_6-31g(d).log.xz 006106552.td-b3lyp_6-31g+(d).inp 006106552.td-b3lyp_6-31g+(d).log.xz

006106552.td-b3lyp_6-31+g(d).qchem.inp (generated)

006106552.td-b3lyp_6-31+g(d).gjf (generated)

006106552.td-b3lyp_6-31+g(d).firefly.inp (generated)

006106552.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006106552.mol 006106552.PUBCHEM 006106552.mol (via Jmol)
006106643.b3lyp_6-31g(d).inp

006106643.b3lyp_6-31g(d).qchem.inp (generated)

006106643.b3lyp_6-31g(d).gjf (generated)

006106643.b3lyp_6-31g(d).firefly.inp (generated)

006106643.b3lyp_6-31g(d).smash.inp (generated)

006106643.b3lyp_6-31g(d).nwchem.inp (generated) 006106643.b3lyp_6-31g(d).log.xz 006106643.td-b3lyp_6-31g+(d).inp 006106643.td-b3lyp_6-31g+(d).log.xz

006106643.td-b3lyp_6-31+g(d).qchem.inp (generated)

006106643.td-b3lyp_6-31+g(d).gjf (generated)

006106643.td-b3lyp_6-31+g(d).firefly.inp (generated)

006106643.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006106643.mol 006106643.PUBCHEM 006106643.mol (via Jmol)
006106653.b3lyp_6-31g(d).inp

006106653.b3lyp_6-31g(d).qchem.inp (generated)

006106653.b3lyp_6-31g(d).gjf (generated)

006106653.b3lyp_6-31g(d).firefly.inp (generated)

006106653.b3lyp_6-31g(d).smash.inp (generated)

006106653.b3lyp_6-31g(d).nwchem.inp (generated) 006106653.b3lyp_6-31g(d).log.xz 006106653.td-b3lyp_6-31g+(d).inp 006106653.td-b3lyp_6-31g+(d).log.xz

006106653.td-b3lyp_6-31+g(d).qchem.inp (generated)

006106653.td-b3lyp_6-31+g(d).gjf (generated)

006106653.td-b3lyp_6-31+g(d).firefly.inp (generated)

006106653.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006106653.mol 006106653.PUBCHEM 006106653.mol (via Jmol)
006106654.b3lyp_6-31g(d).inp

006106654.b3lyp_6-31g(d).qchem.inp (generated)

006106654.b3lyp_6-31g(d).gjf (generated)

006106654.b3lyp_6-31g(d).firefly.inp (generated)

006106654.b3lyp_6-31g(d).smash.inp (generated)

006106654.b3lyp_6-31g(d).nwchem.inp (generated) 006106654.b3lyp_6-31g(d).log.xz 006106654.td-b3lyp_6-31g+(d).inp 006106654.td-b3lyp_6-31g+(d).log.xz

006106654.td-b3lyp_6-31+g(d).qchem.inp (generated)

006106654.td-b3lyp_6-31+g(d).gjf (generated)

006106654.td-b3lyp_6-31+g(d).firefly.inp (generated)

006106654.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006106654.mol 006106654.PUBCHEM 006106654.mol (via Jmol)
006106721.b3lyp_6-31g(d).inp

006106721.b3lyp_6-31g(d).qchem.inp (generated)

006106721.b3lyp_6-31g(d).gjf (generated)

006106721.b3lyp_6-31g(d).firefly.inp (generated)

006106721.b3lyp_6-31g(d).smash.inp (generated)

006106721.b3lyp_6-31g(d).nwchem.inp (generated) 006106721.b3lyp_6-31g(d).log.xz 006106721.td-b3lyp_6-31g+(d).inp 006106721.td-b3lyp_6-31g+(d).log.xz

006106721.td-b3lyp_6-31+g(d).qchem.inp (generated)

006106721.td-b3lyp_6-31+g(d).gjf (generated)

006106721.td-b3lyp_6-31+g(d).firefly.inp (generated)

006106721.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006106721.mol 006106721.PUBCHEM 006106721.mol (via Jmol)
006106763.b3lyp_6-31g(d).inp

006106763.b3lyp_6-31g(d).qchem.inp (generated)

006106763.b3lyp_6-31g(d).gjf (generated)

006106763.b3lyp_6-31g(d).firefly.inp (generated)

006106763.b3lyp_6-31g(d).smash.inp (generated)

006106763.b3lyp_6-31g(d).nwchem.inp (generated) 006106763.b3lyp_6-31g(d).log.xz 006106763.mol 006106763.PUBCHEM 006106763.mol (via Jmol)
006106802.b3lyp_6-31g(d).inp

006106802.b3lyp_6-31g(d).qchem.inp (generated)

006106802.b3lyp_6-31g(d).gjf (generated)

006106802.b3lyp_6-31g(d).firefly.inp (generated)

006106802.b3lyp_6-31g(d).smash.inp (generated)

006106802.b3lyp_6-31g(d).nwchem.inp (generated) 006106802.b3lyp_6-31g(d).log.xz 006106802.td-b3lyp_6-31g+(d).inp 006106802.td-b3lyp_6-31g+(d).log.xz

006106802.td-b3lyp_6-31+g(d).qchem.inp (generated)

006106802.td-b3lyp_6-31+g(d).gjf (generated)

006106802.td-b3lyp_6-31+g(d).firefly.inp (generated)

006106802.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006106802.mol 006106802.PUBCHEM 006106802.mol (via Jmol)
006107176.b3lyp_6-31g(d).inp

006107176.b3lyp_6-31g(d).qchem.inp (generated)

006107176.b3lyp_6-31g(d).gjf (generated)

006107176.b3lyp_6-31g(d).firefly.inp (generated)

006107176.b3lyp_6-31g(d).smash.inp (generated)

006107176.b3lyp_6-31g(d).nwchem.inp (generated) 006107176.b3lyp_6-31g(d).log.xz 006107176.td-b3lyp_6-31g+(d).inp 006107176.td-b3lyp_6-31g+(d).log.xz

006107176.td-b3lyp_6-31+g(d).qchem.inp (generated)

006107176.td-b3lyp_6-31+g(d).gjf (generated)

006107176.td-b3lyp_6-31+g(d).firefly.inp (generated)

006107176.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006107176.mol 006107176.PUBCHEM 006107176.mol (via Jmol)
006107269.b3lyp_6-31g(d).inp

006107269.b3lyp_6-31g(d).qchem.inp (generated)

006107269.b3lyp_6-31g(d).gjf (generated)

006107269.b3lyp_6-31g(d).firefly.inp (generated)

006107269.b3lyp_6-31g(d).smash.inp (generated)

006107269.b3lyp_6-31g(d).nwchem.inp (generated) 006107269.b3lyp_6-31g(d).log.xz 006107269.td-b3lyp_6-31g+(d).inp 006107269.td-b3lyp_6-31g+(d).log.xz

006107269.td-b3lyp_6-31+g(d).qchem.inp (generated)

006107269.td-b3lyp_6-31+g(d).gjf (generated)

006107269.td-b3lyp_6-31+g(d).firefly.inp (generated)

006107269.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006107269.mol 006107269.PUBCHEM 006107269.mol (via Jmol)
006107316.b3lyp_6-31g(d).inp

006107316.b3lyp_6-31g(d).qchem.inp (generated)

006107316.b3lyp_6-31g(d).gjf (generated)

006107316.b3lyp_6-31g(d).firefly.inp (generated)

006107316.b3lyp_6-31g(d).smash.inp (generated)

006107316.b3lyp_6-31g(d).nwchem.inp (generated) 006107316.b3lyp_6-31g(d).log.xz 006107316.td-b3lyp_6-31g+(d).inp 006107316.td-b3lyp_6-31g+(d).log.xz

006107316.td-b3lyp_6-31+g(d).qchem.inp (generated)

006107316.td-b3lyp_6-31+g(d).gjf (generated)

006107316.td-b3lyp_6-31+g(d).firefly.inp (generated)

006107316.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006107316.mol 006107316.PUBCHEM 006107316.mol (via Jmol)
006107346.b3lyp_6-31g(d).inp

006107346.b3lyp_6-31g(d).qchem.inp (generated)

006107346.b3lyp_6-31g(d).gjf (generated)

006107346.b3lyp_6-31g(d).firefly.inp (generated)

006107346.b3lyp_6-31g(d).smash.inp (generated)

006107346.b3lyp_6-31g(d).nwchem.inp (generated) 006107346.b3lyp_6-31g(d).log.xz 006107346.td-b3lyp_6-31g+(d).inp 006107346.td-b3lyp_6-31g+(d).log.xz

006107346.td-b3lyp_6-31+g(d).qchem.inp (generated)

006107346.td-b3lyp_6-31+g(d).gjf (generated)

006107346.td-b3lyp_6-31+g(d).firefly.inp (generated)

006107346.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006107346.mol 006107346.PUBCHEM 006107346.mol (via Jmol)
006107349.b3lyp_6-31g(d).inp

006107349.b3lyp_6-31g(d).qchem.inp (generated)

006107349.b3lyp_6-31g(d).gjf (generated)

006107349.b3lyp_6-31g(d).firefly.inp (generated)

006107349.b3lyp_6-31g(d).smash.inp (generated)

006107349.b3lyp_6-31g(d).nwchem.inp (generated) 006107349.b3lyp_6-31g(d).log.xz 006107349.td-b3lyp_6-31g+(d).inp 006107349.td-b3lyp_6-31g+(d).log.xz

006107349.td-b3lyp_6-31+g(d).qchem.inp (generated)

006107349.td-b3lyp_6-31+g(d).gjf (generated)

006107349.td-b3lyp_6-31+g(d).firefly.inp (generated)

006107349.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006107349.mol 006107349.PUBCHEM 006107349.mol (via Jmol)
006107350.b3lyp_6-31g(d).inp

006107350.b3lyp_6-31g(d).qchem.inp (generated)

006107350.b3lyp_6-31g(d).gjf (generated)

006107350.b3lyp_6-31g(d).firefly.inp (generated)

006107350.b3lyp_6-31g(d).smash.inp (generated)

006107350.b3lyp_6-31g(d).nwchem.inp (generated) 006107350.b3lyp_6-31g(d).log.xz 006107350.td-b3lyp_6-31g+(d).inp 006107350.td-b3lyp_6-31g+(d).log.xz

006107350.td-b3lyp_6-31+g(d).qchem.inp (generated)

006107350.td-b3lyp_6-31+g(d).gjf (generated)

006107350.td-b3lyp_6-31+g(d).firefly.inp (generated)

006107350.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006107350.mol 006107350.PUBCHEM 006107350.mol (via Jmol)
006107372.b3lyp_6-31g(d).inp

006107372.b3lyp_6-31g(d).qchem.inp (generated)

006107372.b3lyp_6-31g(d).gjf (generated)

006107372.b3lyp_6-31g(d).firefly.inp (generated)

006107372.b3lyp_6-31g(d).smash.inp (generated)

006107372.b3lyp_6-31g(d).nwchem.inp (generated) 006107372.b3lyp_6-31g(d).log.xz 006107372.td-b3lyp_6-31g+(d).inp 006107372.td-b3lyp_6-31g+(d).log.xz

006107372.td-b3lyp_6-31+g(d).qchem.inp (generated)

006107372.td-b3lyp_6-31+g(d).gjf (generated)

006107372.td-b3lyp_6-31+g(d).firefly.inp (generated)

006107372.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006107372.mol 006107372.PUBCHEM 006107372.mol (via Jmol)
006107419.b3lyp_6-31g(d).inp

006107419.b3lyp_6-31g(d).qchem.inp (generated)

006107419.b3lyp_6-31g(d).gjf (generated)

006107419.b3lyp_6-31g(d).firefly.inp (generated)

006107419.b3lyp_6-31g(d).smash.inp (generated)

006107419.b3lyp_6-31g(d).nwchem.inp (generated) 006107419.b3lyp_6-31g(d).log.xz 006107419.td-b3lyp_6-31g+(d).inp 006107419.td-b3lyp_6-31g+(d).log.xz

006107419.td-b3lyp_6-31+g(d).qchem.inp (generated)

006107419.td-b3lyp_6-31+g(d).gjf (generated)

006107419.td-b3lyp_6-31+g(d).firefly.inp (generated)

006107419.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006107419.mol 006107419.PUBCHEM 006107419.mol (via Jmol)
006107427.b3lyp_6-31g(d).inp

006107427.b3lyp_6-31g(d).qchem.inp (generated)

006107427.b3lyp_6-31g(d).gjf (generated)

006107427.b3lyp_6-31g(d).firefly.inp (generated)

006107427.b3lyp_6-31g(d).smash.inp (generated)

006107427.b3lyp_6-31g(d).nwchem.inp (generated) 006107427.b3lyp_6-31g(d).log.xz 006107427.td-b3lyp_6-31g+(d).inp 006107427.td-b3lyp_6-31g+(d).log.xz

006107427.td-b3lyp_6-31+g(d).qchem.inp (generated)

006107427.td-b3lyp_6-31+g(d).gjf (generated)

006107427.td-b3lyp_6-31+g(d).firefly.inp (generated)

006107427.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006107427.mol 006107427.PUBCHEM 006107427.mol (via Jmol)
006107455.b3lyp_6-31g(d).inp

006107455.b3lyp_6-31g(d).qchem.inp (generated)

006107455.b3lyp_6-31g(d).gjf (generated)

006107455.b3lyp_6-31g(d).firefly.inp (generated)

006107455.b3lyp_6-31g(d).smash.inp (generated)

006107455.b3lyp_6-31g(d).nwchem.inp (generated) 006107455.b3lyp_6-31g(d).log.xz 006107455.td-b3lyp_6-31g+(d).inp 006107455.td-b3lyp_6-31g+(d).log.xz

006107455.td-b3lyp_6-31+g(d).qchem.inp (generated)

006107455.td-b3lyp_6-31+g(d).gjf (generated)

006107455.td-b3lyp_6-31+g(d).firefly.inp (generated)

006107455.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006107455.mol 006107455.PUBCHEM 006107455.mol (via Jmol)
006107464.b3lyp_6-31g(d).inp

006107464.b3lyp_6-31g(d).qchem.inp (generated)

006107464.b3lyp_6-31g(d).gjf (generated)

006107464.b3lyp_6-31g(d).firefly.inp (generated)

006107464.b3lyp_6-31g(d).smash.inp (generated)

006107464.b3lyp_6-31g(d).nwchem.inp (generated) 006107464.b3lyp_6-31g(d).log.xz 006107464.td-b3lyp_6-31g+(d).inp 006107464.td-b3lyp_6-31g+(d).log.xz

006107464.td-b3lyp_6-31+g(d).qchem.inp (generated)

006107464.td-b3lyp_6-31+g(d).gjf (generated)

006107464.td-b3lyp_6-31+g(d).firefly.inp (generated)

006107464.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006107464.mol 006107464.PUBCHEM 006107464.mol (via Jmol)
006107465.b3lyp_6-31g(d).inp

006107465.b3lyp_6-31g(d).qchem.inp (generated)

006107465.b3lyp_6-31g(d).gjf (generated)

006107465.b3lyp_6-31g(d).firefly.inp (generated)

006107465.b3lyp_6-31g(d).smash.inp (generated)

006107465.b3lyp_6-31g(d).nwchem.inp (generated) 006107465.b3lyp_6-31g(d).log.xz 006107465.mol 006107465.PUBCHEM 006107465.mol (via Jmol)
006107647.b3lyp_6-31g(d).inp

006107647.b3lyp_6-31g(d).qchem.inp (generated)

006107647.b3lyp_6-31g(d).gjf (generated)

006107647.b3lyp_6-31g(d).firefly.inp (generated)

006107647.b3lyp_6-31g(d).smash.inp (generated)

006107647.b3lyp_6-31g(d).nwchem.inp (generated) 006107647.b3lyp_6-31g(d).log.xz 006107647.td-b3lyp_6-31g+(d).inp 006107647.td-b3lyp_6-31g+(d).log.xz

006107647.td-b3lyp_6-31+g(d).qchem.inp (generated)

006107647.td-b3lyp_6-31+g(d).gjf (generated)

006107647.td-b3lyp_6-31+g(d).firefly.inp (generated)

006107647.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006107647.mol 006107647.PUBCHEM 006107647.mol (via Jmol)
006107704.b3lyp_6-31g(d).inp

006107704.b3lyp_6-31g(d).qchem.inp (generated)

006107704.b3lyp_6-31g(d).gjf (generated)

006107704.b3lyp_6-31g(d).firefly.inp (generated)

006107704.b3lyp_6-31g(d).smash.inp (generated)

006107704.b3lyp_6-31g(d).nwchem.inp (generated) 006107704.b3lyp_6-31g(d).log.xz 006107704.mol 006107704.PUBCHEM 006107704.mol (via Jmol)
006107708.b3lyp_6-31g(d).inp

006107708.b3lyp_6-31g(d).qchem.inp (generated)

006107708.b3lyp_6-31g(d).gjf (generated)

006107708.b3lyp_6-31g(d).firefly.inp (generated)

006107708.b3lyp_6-31g(d).smash.inp (generated)

006107708.b3lyp_6-31g(d).nwchem.inp (generated) 006107708.b3lyp_6-31g(d).log.xz 006107708.td-b3lyp_6-31g+(d).inp 006107708.td-b3lyp_6-31g+(d).log.xz

006107708.td-b3lyp_6-31+g(d).qchem.inp (generated)

006107708.td-b3lyp_6-31+g(d).gjf (generated)

006107708.td-b3lyp_6-31+g(d).firefly.inp (generated)

006107708.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006107708.mol 006107708.PUBCHEM 006107708.mol (via Jmol)
006107741.b3lyp_6-31g(d).inp

006107741.b3lyp_6-31g(d).qchem.inp (generated)

006107741.b3lyp_6-31g(d).gjf (generated)

006107741.b3lyp_6-31g(d).firefly.inp (generated)

006107741.b3lyp_6-31g(d).smash.inp (generated)

006107741.b3lyp_6-31g(d).nwchem.inp (generated) 006107741.b3lyp_6-31g(d).log.xz 006107741.td-b3lyp_6-31g+(d).inp 006107741.td-b3lyp_6-31g+(d).log.xz

006107741.td-b3lyp_6-31+g(d).qchem.inp (generated)

006107741.td-b3lyp_6-31+g(d).gjf (generated)

006107741.td-b3lyp_6-31+g(d).firefly.inp (generated)

006107741.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006107741.mol 006107741.PUBCHEM 006107741.mol (via Jmol)
006107804.b3lyp_6-31g(d).inp

006107804.b3lyp_6-31g(d).qchem.inp (generated)

006107804.b3lyp_6-31g(d).gjf (generated)

006107804.b3lyp_6-31g(d).firefly.inp (generated)

006107804.b3lyp_6-31g(d).smash.inp (generated)

006107804.b3lyp_6-31g(d).nwchem.inp (generated) 006107804.b3lyp_6-31g(d).log.xz 006107804.td-b3lyp_6-31g+(d).inp 006107804.td-b3lyp_6-31g+(d).log.xz

006107804.td-b3lyp_6-31+g(d).qchem.inp (generated)

006107804.td-b3lyp_6-31+g(d).gjf (generated)

006107804.td-b3lyp_6-31+g(d).firefly.inp (generated)

006107804.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006107804.mol 006107804.PUBCHEM 006107804.mol (via Jmol)
006107807.b3lyp_6-31g(d).inp

006107807.b3lyp_6-31g(d).qchem.inp (generated)

006107807.b3lyp_6-31g(d).gjf (generated)

006107807.b3lyp_6-31g(d).firefly.inp (generated)

006107807.b3lyp_6-31g(d).smash.inp (generated)

006107807.b3lyp_6-31g(d).nwchem.inp (generated) 006107807.b3lyp_6-31g(d).log.xz 006107807.mol 006107807.PUBCHEM 006107807.mol (via Jmol)
006107814.b3lyp_6-31g(d).inp

006107814.b3lyp_6-31g(d).qchem.inp (generated)

006107814.b3lyp_6-31g(d).gjf (generated)

006107814.b3lyp_6-31g(d).firefly.inp (generated)

006107814.b3lyp_6-31g(d).smash.inp (generated)

006107814.b3lyp_6-31g(d).nwchem.inp (generated) 006107814.b3lyp_6-31g(d).log.xz 006107814.td-b3lyp_6-31g+(d).inp 006107814.td-b3lyp_6-31g+(d).log.xz

006107814.td-b3lyp_6-31+g(d).qchem.inp (generated)

006107814.td-b3lyp_6-31+g(d).gjf (generated)

006107814.td-b3lyp_6-31+g(d).firefly.inp (generated)

006107814.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006107814.mol 006107814.PUBCHEM 006107814.mol (via Jmol)
006107838.b3lyp_6-31g(d).inp

006107838.b3lyp_6-31g(d).qchem.inp (generated)

006107838.b3lyp_6-31g(d).gjf (generated)

006107838.b3lyp_6-31g(d).firefly.inp (generated)

006107838.b3lyp_6-31g(d).smash.inp (generated)

006107838.b3lyp_6-31g(d).nwchem.inp (generated) 006107838.b3lyp_6-31g(d).log.xz 006107838.td-b3lyp_6-31g+(d).inp 006107838.td-b3lyp_6-31g+(d).log.xz

006107838.td-b3lyp_6-31+g(d).qchem.inp (generated)

006107838.td-b3lyp_6-31+g(d).gjf (generated)

006107838.td-b3lyp_6-31+g(d).firefly.inp (generated)

006107838.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006107838.mol 006107838.PUBCHEM 006107838.mol (via Jmol)
006108058.b3lyp_6-31g(d).inp

006108058.b3lyp_6-31g(d).qchem.inp (generated)

006108058.b3lyp_6-31g(d).gjf (generated)

006108058.b3lyp_6-31g(d).firefly.inp (generated)

006108058.b3lyp_6-31g(d).smash.inp (generated)

006108058.b3lyp_6-31g(d).nwchem.inp (generated) 006108058.b3lyp_6-31g(d).log.xz 006108058.td-b3lyp_6-31g+(d).inp 006108058.td-b3lyp_6-31g+(d).log.xz

006108058.td-b3lyp_6-31+g(d).qchem.inp (generated)

006108058.td-b3lyp_6-31+g(d).gjf (generated)

006108058.td-b3lyp_6-31+g(d).firefly.inp (generated)

006108058.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006108058.mol 006108058.PUBCHEM 006108058.mol (via Jmol)
006108177.b3lyp_6-31g(d).inp

006108177.b3lyp_6-31g(d).qchem.inp (generated)

006108177.b3lyp_6-31g(d).gjf (generated)

006108177.b3lyp_6-31g(d).firefly.inp (generated)

006108177.b3lyp_6-31g(d).smash.inp (generated)

006108177.b3lyp_6-31g(d).nwchem.inp (generated) 006108177.b3lyp_6-31g(d).log.xz 006108177.td-b3lyp_6-31g+(d).inp 006108177.td-b3lyp_6-31g+(d).log.xz

006108177.td-b3lyp_6-31+g(d).qchem.inp (generated)

006108177.td-b3lyp_6-31+g(d).gjf (generated)

006108177.td-b3lyp_6-31+g(d).firefly.inp (generated)

006108177.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006108177.mol 006108177.PUBCHEM 006108177.mol (via Jmol)
006108299.b3lyp_6-31g(d).inp

006108299.b3lyp_6-31g(d).qchem.inp (generated)

006108299.b3lyp_6-31g(d).gjf (generated)

006108299.b3lyp_6-31g(d).firefly.inp (generated)

006108299.b3lyp_6-31g(d).smash.inp (generated)

006108299.b3lyp_6-31g(d).nwchem.inp (generated) 006108299.b3lyp_6-31g(d).log.xz 006108299.mol 006108299.PUBCHEM 006108299.mol (via Jmol)
006108518.b3lyp_6-31g(d).inp

006108518.b3lyp_6-31g(d).qchem.inp (generated)

006108518.b3lyp_6-31g(d).gjf (generated)

006108518.b3lyp_6-31g(d).firefly.inp (generated)

006108518.b3lyp_6-31g(d).smash.inp (generated)

006108518.b3lyp_6-31g(d).nwchem.inp (generated) 006108518.b3lyp_6-31g(d).log.xz 006108518.td-b3lyp_6-31g+(d).inp 006108518.td-b3lyp_6-31g+(d).log.xz

006108518.td-b3lyp_6-31+g(d).qchem.inp (generated)

006108518.td-b3lyp_6-31+g(d).gjf (generated)

006108518.td-b3lyp_6-31+g(d).firefly.inp (generated)

006108518.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006108518.mol 006108518.PUBCHEM 006108518.mol (via Jmol)
006108531.b3lyp_6-31g(d).inp

006108531.b3lyp_6-31g(d).qchem.inp (generated)

006108531.b3lyp_6-31g(d).gjf (generated)

006108531.b3lyp_6-31g(d).firefly.inp (generated)

006108531.b3lyp_6-31g(d).smash.inp (generated)

006108531.b3lyp_6-31g(d).nwchem.inp (generated) 006108531.b3lyp_6-31g(d).log.xz 006108531.mol 006108531.PUBCHEM 006108531.mol (via Jmol)
006108569.b3lyp_6-31g(d).inp

006108569.b3lyp_6-31g(d).qchem.inp (generated)

006108569.b3lyp_6-31g(d).gjf (generated)

006108569.b3lyp_6-31g(d).firefly.inp (generated)

006108569.b3lyp_6-31g(d).smash.inp (generated)

006108569.b3lyp_6-31g(d).nwchem.inp (generated) 006108569.b3lyp_6-31g(d).log.xz 006108569.td-b3lyp_6-31g+(d).inp 006108569.td-b3lyp_6-31g+(d).log.xz

006108569.td-b3lyp_6-31+g(d).qchem.inp (generated)

006108569.td-b3lyp_6-31+g(d).gjf (generated)

006108569.td-b3lyp_6-31+g(d).firefly.inp (generated)

006108569.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006108569.mol 006108569.PUBCHEM 006108569.mol (via Jmol)
006108679.b3lyp_6-31g(d).inp

006108679.b3lyp_6-31g(d).qchem.inp (generated)

006108679.b3lyp_6-31g(d).gjf (generated)

006108679.b3lyp_6-31g(d).firefly.inp (generated)

006108679.b3lyp_6-31g(d).smash.inp (generated)

006108679.b3lyp_6-31g(d).nwchem.inp (generated) 006108679.b3lyp_6-31g(d).log.xz 006108679.td-b3lyp_6-31g+(d).inp 006108679.td-b3lyp_6-31g+(d).log.xz

006108679.td-b3lyp_6-31+g(d).qchem.inp (generated)

006108679.td-b3lyp_6-31+g(d).gjf (generated)

006108679.td-b3lyp_6-31+g(d).firefly.inp (generated)

006108679.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006108679.mol 006108679.PUBCHEM 006108679.mol (via Jmol)
006108721.b3lyp_6-31g(d).inp

006108721.b3lyp_6-31g(d).qchem.inp (generated)

006108721.b3lyp_6-31g(d).gjf (generated)

006108721.b3lyp_6-31g(d).firefly.inp (generated)

006108721.b3lyp_6-31g(d).smash.inp (generated)

006108721.b3lyp_6-31g(d).nwchem.inp (generated) 006108721.b3lyp_6-31g(d).log.xz 006108721.td-b3lyp_6-31g+(d).inp 006108721.td-b3lyp_6-31g+(d).log.xz

006108721.td-b3lyp_6-31+g(d).qchem.inp (generated)

006108721.td-b3lyp_6-31+g(d).gjf (generated)

006108721.td-b3lyp_6-31+g(d).firefly.inp (generated)

006108721.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006108721.mol 006108721.PUBCHEM 006108721.mol (via Jmol)
006108734.b3lyp_6-31g(d).inp

006108734.b3lyp_6-31g(d).qchem.inp (generated)

006108734.b3lyp_6-31g(d).gjf (generated)

006108734.b3lyp_6-31g(d).firefly.inp (generated)

006108734.b3lyp_6-31g(d).smash.inp (generated)

006108734.b3lyp_6-31g(d).nwchem.inp (generated) 006108734.b3lyp_6-31g(d).log.xz 006108734.td-b3lyp_6-31g+(d).inp 006108734.td-b3lyp_6-31g+(d).log.xz

006108734.td-b3lyp_6-31+g(d).qchem.inp (generated)

006108734.td-b3lyp_6-31+g(d).gjf (generated)

006108734.td-b3lyp_6-31+g(d).firefly.inp (generated)

006108734.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006108734.mol 006108734.PUBCHEM 006108734.mol (via Jmol)
006108761.b3lyp_6-31g(d).inp

006108761.b3lyp_6-31g(d).qchem.inp (generated)

006108761.b3lyp_6-31g(d).gjf (generated)

006108761.b3lyp_6-31g(d).firefly.inp (generated)

006108761.b3lyp_6-31g(d).smash.inp (generated)

006108761.b3lyp_6-31g(d).nwchem.inp (generated) 006108761.b3lyp_6-31g(d).log.xz 006108761.td-b3lyp_6-31g+(d).inp 006108761.td-b3lyp_6-31g+(d).log.xz

006108761.td-b3lyp_6-31+g(d).qchem.inp (generated)

006108761.td-b3lyp_6-31+g(d).gjf (generated)

006108761.td-b3lyp_6-31+g(d).firefly.inp (generated)

006108761.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006108761.mol 006108761.PUBCHEM 006108761.mol (via Jmol)
006108916.b3lyp_6-31g(d).inp

006108916.b3lyp_6-31g(d).qchem.inp (generated)

006108916.b3lyp_6-31g(d).gjf (generated)

006108916.b3lyp_6-31g(d).firefly.inp (generated)

006108916.b3lyp_6-31g(d).smash.inp (generated)

006108916.b3lyp_6-31g(d).nwchem.inp (generated) 006108916.b3lyp_6-31g(d).log.xz 006108916.mol 006108916.PUBCHEM 006108916.mol (via Jmol)
006108919.b3lyp_6-31g(d).inp

006108919.b3lyp_6-31g(d).qchem.inp (generated)

006108919.b3lyp_6-31g(d).gjf (generated)

006108919.b3lyp_6-31g(d).firefly.inp (generated)

006108919.b3lyp_6-31g(d).smash.inp (generated)

006108919.b3lyp_6-31g(d).nwchem.inp (generated) 006108919.b3lyp_6-31g(d).log.xz 006108919.td-b3lyp_6-31g+(d).inp 006108919.td-b3lyp_6-31g+(d).log.xz

006108919.td-b3lyp_6-31+g(d).qchem.inp (generated)

006108919.td-b3lyp_6-31+g(d).gjf (generated)

006108919.td-b3lyp_6-31+g(d).firefly.inp (generated)

006108919.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006108919.mol 006108919.PUBCHEM 006108919.mol (via Jmol)
006108920.b3lyp_6-31g(d).inp

006108920.b3lyp_6-31g(d).qchem.inp (generated)

006108920.b3lyp_6-31g(d).gjf (generated)

006108920.b3lyp_6-31g(d).firefly.inp (generated)

006108920.b3lyp_6-31g(d).smash.inp (generated)

006108920.b3lyp_6-31g(d).nwchem.inp (generated) 006108920.b3lyp_6-31g(d).log.xz 006108920.td-b3lyp_6-31g+(d).inp 006108920.td-b3lyp_6-31g+(d).log.xz

006108920.td-b3lyp_6-31+g(d).qchem.inp (generated)

006108920.td-b3lyp_6-31+g(d).gjf (generated)

006108920.td-b3lyp_6-31+g(d).firefly.inp (generated)

006108920.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006108920.mol 006108920.PUBCHEM 006108920.mol (via Jmol)
006109014.b3lyp_6-31g(d).inp

006109014.b3lyp_6-31g(d).qchem.inp (generated)

006109014.b3lyp_6-31g(d).gjf (generated)

006109014.b3lyp_6-31g(d).firefly.inp (generated)

006109014.b3lyp_6-31g(d).smash.inp (generated)

006109014.b3lyp_6-31g(d).nwchem.inp (generated) 006109014.b3lyp_6-31g(d).log.xz 006109014.td-b3lyp_6-31g+(d).inp 006109014.td-b3lyp_6-31g+(d).log.xz

006109014.td-b3lyp_6-31+g(d).qchem.inp (generated)

006109014.td-b3lyp_6-31+g(d).gjf (generated)

006109014.td-b3lyp_6-31+g(d).firefly.inp (generated)

006109014.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006109014.mol 006109014.PUBCHEM 006109014.mol (via Jmol)
006109338.b3lyp_6-31g(d).inp

006109338.b3lyp_6-31g(d).qchem.inp (generated)

006109338.b3lyp_6-31g(d).gjf (generated)

006109338.b3lyp_6-31g(d).firefly.inp (generated)

006109338.b3lyp_6-31g(d).smash.inp (generated)

006109338.b3lyp_6-31g(d).nwchem.inp (generated) 006109338.b3lyp_6-31g(d).log.xz 006109338.td-b3lyp_6-31g+(d).inp 006109338.td-b3lyp_6-31g+(d).log.xz

006109338.td-b3lyp_6-31+g(d).qchem.inp (generated)

006109338.td-b3lyp_6-31+g(d).gjf (generated)

006109338.td-b3lyp_6-31+g(d).firefly.inp (generated)

006109338.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006109338.mol 006109338.PUBCHEM 006109338.mol (via Jmol)
006109480.b3lyp_6-31g(d).inp

006109480.b3lyp_6-31g(d).qchem.inp (generated)

006109480.b3lyp_6-31g(d).gjf (generated)

006109480.b3lyp_6-31g(d).firefly.inp (generated)

006109480.b3lyp_6-31g(d).smash.inp (generated)

006109480.b3lyp_6-31g(d).nwchem.inp (generated) 006109480.b3lyp_6-31g(d).log.xz 006109480.td-b3lyp_6-31g+(d).inp 006109480.td-b3lyp_6-31g+(d).log.xz

006109480.td-b3lyp_6-31+g(d).qchem.inp (generated)

006109480.td-b3lyp_6-31+g(d).gjf (generated)

006109480.td-b3lyp_6-31+g(d).firefly.inp (generated)

006109480.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006109480.mol 006109480.PUBCHEM 006109480.mol (via Jmol)
006109552.b3lyp_6-31g(d).inp

006109552.b3lyp_6-31g(d).qchem.inp (generated)

006109552.b3lyp_6-31g(d).gjf (generated)

006109552.b3lyp_6-31g(d).firefly.inp (generated)

006109552.b3lyp_6-31g(d).smash.inp (generated)

006109552.b3lyp_6-31g(d).nwchem.inp (generated) 006109552.b3lyp_6-31g(d).log.xz 006109552.td-b3lyp_6-31g+(d).inp 006109552.td-b3lyp_6-31g+(d).log.xz

006109552.td-b3lyp_6-31+g(d).qchem.inp (generated)

006109552.td-b3lyp_6-31+g(d).gjf (generated)

006109552.td-b3lyp_6-31+g(d).firefly.inp (generated)

006109552.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006109552.mol 006109552.PUBCHEM 006109552.mol (via Jmol)
006109565.b3lyp_6-31g(d).inp

006109565.b3lyp_6-31g(d).qchem.inp (generated)

006109565.b3lyp_6-31g(d).gjf (generated)

006109565.b3lyp_6-31g(d).firefly.inp (generated)

006109565.b3lyp_6-31g(d).smash.inp (generated)

006109565.b3lyp_6-31g(d).nwchem.inp (generated) 006109565.b3lyp_6-31g(d).log.xz 006109565.td-b3lyp_6-31g+(d).inp 006109565.td-b3lyp_6-31g+(d).log.xz

006109565.td-b3lyp_6-31+g(d).qchem.inp (generated)

006109565.td-b3lyp_6-31+g(d).gjf (generated)

006109565.td-b3lyp_6-31+g(d).firefly.inp (generated)

006109565.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006109565.mol 006109565.PUBCHEM 006109565.mol (via Jmol)
006109583.b3lyp_6-31g(d).inp

006109583.b3lyp_6-31g(d).qchem.inp (generated)

006109583.b3lyp_6-31g(d).gjf (generated)

006109583.b3lyp_6-31g(d).firefly.inp (generated)

006109583.b3lyp_6-31g(d).smash.inp (generated)

006109583.b3lyp_6-31g(d).nwchem.inp (generated) 006109583.b3lyp_6-31g(d).log.xz 006109583.td-b3lyp_6-31g+(d).inp 006109583.td-b3lyp_6-31g+(d).log.xz

006109583.td-b3lyp_6-31+g(d).qchem.inp (generated)

006109583.td-b3lyp_6-31+g(d).gjf (generated)

006109583.td-b3lyp_6-31+g(d).firefly.inp (generated)

006109583.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006109583.mol 006109583.PUBCHEM 006109583.mol (via Jmol)
006109688.b3lyp_6-31g(d).inp

006109688.b3lyp_6-31g(d).qchem.inp (generated)

006109688.b3lyp_6-31g(d).gjf (generated)

006109688.b3lyp_6-31g(d).firefly.inp (generated)

006109688.b3lyp_6-31g(d).smash.inp (generated)

006109688.b3lyp_6-31g(d).nwchem.inp (generated) 006109688.b3lyp_6-31g(d).log.xz 006109688.mol 006109688.PUBCHEM 006109688.mol (via Jmol)
006109758.b3lyp_6-31g(d).inp

006109758.b3lyp_6-31g(d).qchem.inp (generated)

006109758.b3lyp_6-31g(d).gjf (generated)

006109758.b3lyp_6-31g(d).firefly.inp (generated)

006109758.b3lyp_6-31g(d).smash.inp (generated)

006109758.b3lyp_6-31g(d).nwchem.inp (generated) 006109758.b3lyp_6-31g(d).log.xz 006109758.td-b3lyp_6-31g+(d).inp 006109758.td-b3lyp_6-31g+(d).log.xz

006109758.td-b3lyp_6-31+g(d).qchem.inp (generated)

006109758.td-b3lyp_6-31+g(d).gjf (generated)

006109758.td-b3lyp_6-31+g(d).firefly.inp (generated)

006109758.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006109758.mol 006109758.PUBCHEM 006109758.mol (via Jmol)
006109844.b3lyp_6-31g(d).inp

006109844.b3lyp_6-31g(d).qchem.inp (generated)

006109844.b3lyp_6-31g(d).gjf (generated)

006109844.b3lyp_6-31g(d).firefly.inp (generated)

006109844.b3lyp_6-31g(d).smash.inp (generated)

006109844.b3lyp_6-31g(d).nwchem.inp (generated) 006109844.b3lyp_6-31g(d).log.xz 006109844.td-b3lyp_6-31g+(d).inp 006109844.td-b3lyp_6-31g+(d).log.xz

006109844.td-b3lyp_6-31+g(d).qchem.inp (generated)

006109844.td-b3lyp_6-31+g(d).gjf (generated)

006109844.td-b3lyp_6-31+g(d).firefly.inp (generated)

006109844.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006109844.mol 006109844.PUBCHEM 006109844.mol (via Jmol)
006110088.b3lyp_6-31g(d).inp

006110088.b3lyp_6-31g(d).qchem.inp (generated)

006110088.b3lyp_6-31g(d).gjf (generated)

006110088.b3lyp_6-31g(d).firefly.inp (generated)

006110088.b3lyp_6-31g(d).smash.inp (generated)

006110088.b3lyp_6-31g(d).nwchem.inp (generated) 006110088.b3lyp_6-31g(d).log.xz 006110088.td-b3lyp_6-31g+(d).inp 006110088.td-b3lyp_6-31g+(d).log.xz

006110088.td-b3lyp_6-31+g(d).qchem.inp (generated)

006110088.td-b3lyp_6-31+g(d).gjf (generated)

006110088.td-b3lyp_6-31+g(d).firefly.inp (generated)

006110088.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006110088.mol 006110088.PUBCHEM 006110088.mol (via Jmol)
006110155.b3lyp_6-31g(d).inp

006110155.b3lyp_6-31g(d).qchem.inp (generated)

006110155.b3lyp_6-31g(d).gjf (generated)

006110155.b3lyp_6-31g(d).firefly.inp (generated)

006110155.b3lyp_6-31g(d).smash.inp (generated)

006110155.b3lyp_6-31g(d).nwchem.inp (generated) 006110155.b3lyp_6-31g(d).log.xz 006110155.td-b3lyp_6-31g+(d).inp 006110155.td-b3lyp_6-31g+(d).log.xz

006110155.td-b3lyp_6-31+g(d).qchem.inp (generated)

006110155.td-b3lyp_6-31+g(d).gjf (generated)

006110155.td-b3lyp_6-31+g(d).firefly.inp (generated)

006110155.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006110155.mol 006110155.PUBCHEM 006110155.mol (via Jmol)
006110197.b3lyp_6-31g(d).inp

006110197.b3lyp_6-31g(d).qchem.inp (generated)

006110197.b3lyp_6-31g(d).gjf (generated)

006110197.b3lyp_6-31g(d).firefly.inp (generated)

006110197.b3lyp_6-31g(d).smash.inp (generated)

006110197.b3lyp_6-31g(d).nwchem.inp (generated) 006110197.b3lyp_6-31g(d).log.xz 006110197.td-b3lyp_6-31g+(d).inp 006110197.td-b3lyp_6-31g+(d).log.xz

006110197.td-b3lyp_6-31+g(d).qchem.inp (generated)

006110197.td-b3lyp_6-31+g(d).gjf (generated)

006110197.td-b3lyp_6-31+g(d).firefly.inp (generated)

006110197.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006110197.mol 006110197.PUBCHEM 006110197.mol (via Jmol)
006110204.b3lyp_6-31g(d).inp

006110204.b3lyp_6-31g(d).qchem.inp (generated)

006110204.b3lyp_6-31g(d).gjf (generated)

006110204.b3lyp_6-31g(d).firefly.inp (generated)

006110204.b3lyp_6-31g(d).smash.inp (generated)

006110204.b3lyp_6-31g(d).nwchem.inp (generated) 006110204.b3lyp_6-31g(d).log.xz 006110204.td-b3lyp_6-31g+(d).inp 006110204.td-b3lyp_6-31g+(d).log.xz

006110204.td-b3lyp_6-31+g(d).qchem.inp (generated)

006110204.td-b3lyp_6-31+g(d).gjf (generated)

006110204.td-b3lyp_6-31+g(d).firefly.inp (generated)

006110204.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006110204.mol 006110204.PUBCHEM 006110204.mol (via Jmol)
006110367.b3lyp_6-31g(d).inp

006110367.b3lyp_6-31g(d).qchem.inp (generated)

006110367.b3lyp_6-31g(d).gjf (generated)

006110367.b3lyp_6-31g(d).firefly.inp (generated)

006110367.b3lyp_6-31g(d).smash.inp (generated)

006110367.b3lyp_6-31g(d).nwchem.inp (generated) 006110367.b3lyp_6-31g(d).log.xz 006110367.td-b3lyp_6-31g+(d).inp 006110367.td-b3lyp_6-31g+(d).log.xz

006110367.td-b3lyp_6-31+g(d).qchem.inp (generated)

006110367.td-b3lyp_6-31+g(d).gjf (generated)

006110367.td-b3lyp_6-31+g(d).firefly.inp (generated)

006110367.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006110367.mol 006110367.PUBCHEM 006110367.mol (via Jmol)
006110370.b3lyp_6-31g(d).inp

006110370.b3lyp_6-31g(d).qchem.inp (generated)

006110370.b3lyp_6-31g(d).gjf (generated)

006110370.b3lyp_6-31g(d).firefly.inp (generated)

006110370.b3lyp_6-31g(d).smash.inp (generated)

006110370.b3lyp_6-31g(d).nwchem.inp (generated) 006110370.b3lyp_6-31g(d).log.xz 006110370.td-b3lyp_6-31g+(d).inp 006110370.td-b3lyp_6-31g+(d).log.xz

006110370.td-b3lyp_6-31+g(d).qchem.inp (generated)

006110370.td-b3lyp_6-31+g(d).gjf (generated)

006110370.td-b3lyp_6-31+g(d).firefly.inp (generated)

006110370.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006110370.mol 006110370.PUBCHEM 006110370.mol (via Jmol)
006110514.b3lyp_6-31g(d).inp

006110514.b3lyp_6-31g(d).qchem.inp (generated)

006110514.b3lyp_6-31g(d).gjf (generated)

006110514.b3lyp_6-31g(d).firefly.inp (generated)

006110514.b3lyp_6-31g(d).smash.inp (generated)

006110514.b3lyp_6-31g(d).nwchem.inp (generated) 006110514.b3lyp_6-31g(d).log.xz 006110514.td-b3lyp_6-31g+(d).inp 006110514.td-b3lyp_6-31g+(d).log.xz

006110514.td-b3lyp_6-31+g(d).qchem.inp (generated)

006110514.td-b3lyp_6-31+g(d).gjf (generated)

006110514.td-b3lyp_6-31+g(d).firefly.inp (generated)

006110514.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006110514.mol 006110514.PUBCHEM 006110514.mol (via Jmol)
006110611.b3lyp_6-31g(d).inp

006110611.b3lyp_6-31g(d).qchem.inp (generated)

006110611.b3lyp_6-31g(d).gjf (generated)

006110611.b3lyp_6-31g(d).firefly.inp (generated)

006110611.b3lyp_6-31g(d).smash.inp (generated)

006110611.b3lyp_6-31g(d).nwchem.inp (generated) 006110611.b3lyp_6-31g(d).log.xz 006110611.td-b3lyp_6-31g+(d).inp 006110611.td-b3lyp_6-31g+(d).log.xz

006110611.td-b3lyp_6-31+g(d).qchem.inp (generated)

006110611.td-b3lyp_6-31+g(d).gjf (generated)

006110611.td-b3lyp_6-31+g(d).firefly.inp (generated)

006110611.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006110611.mol 006110611.PUBCHEM 006110611.mol (via Jmol)
006110695.b3lyp_6-31g(d).inp

006110695.b3lyp_6-31g(d).qchem.inp (generated)

006110695.b3lyp_6-31g(d).gjf (generated)

006110695.b3lyp_6-31g(d).firefly.inp (generated)

006110695.b3lyp_6-31g(d).smash.inp (generated)

006110695.b3lyp_6-31g(d).nwchem.inp (generated) 006110695.b3lyp_6-31g(d).log.xz 006110695.td-b3lyp_6-31g+(d).inp 006110695.td-b3lyp_6-31g+(d).log.xz

006110695.td-b3lyp_6-31+g(d).qchem.inp (generated)

006110695.td-b3lyp_6-31+g(d).gjf (generated)

006110695.td-b3lyp_6-31+g(d).firefly.inp (generated)

006110695.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006110695.mol 006110695.PUBCHEM 006110695.mol (via Jmol)
006110728.b3lyp_6-31g(d).inp

006110728.b3lyp_6-31g(d).qchem.inp (generated)

006110728.b3lyp_6-31g(d).gjf (generated)

006110728.b3lyp_6-31g(d).firefly.inp (generated)

006110728.b3lyp_6-31g(d).smash.inp (generated)

006110728.b3lyp_6-31g(d).nwchem.inp (generated) 006110728.b3lyp_6-31g(d).log.xz 006110728.td-b3lyp_6-31g+(d).inp 006110728.td-b3lyp_6-31g+(d).log.xz

006110728.td-b3lyp_6-31+g(d).qchem.inp (generated)

006110728.td-b3lyp_6-31+g(d).gjf (generated)

006110728.td-b3lyp_6-31+g(d).firefly.inp (generated)

006110728.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006110728.mol 006110728.PUBCHEM 006110728.mol (via Jmol)
006110760.b3lyp_6-31g(d).inp

006110760.b3lyp_6-31g(d).qchem.inp (generated)

006110760.b3lyp_6-31g(d).gjf (generated)

006110760.b3lyp_6-31g(d).firefly.inp (generated)

006110760.b3lyp_6-31g(d).smash.inp (generated)

006110760.b3lyp_6-31g(d).nwchem.inp (generated) 006110760.b3lyp_6-31g(d).log.xz 006110760.td-b3lyp_6-31g+(d).inp 006110760.td-b3lyp_6-31g+(d).log.xz

006110760.td-b3lyp_6-31+g(d).qchem.inp (generated)

006110760.td-b3lyp_6-31+g(d).gjf (generated)

006110760.td-b3lyp_6-31+g(d).firefly.inp (generated)

006110760.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006110760.mol 006110760.PUBCHEM 006110760.mol (via Jmol)
006111016.b3lyp_6-31g(d).inp

006111016.b3lyp_6-31g(d).qchem.inp (generated)

006111016.b3lyp_6-31g(d).gjf (generated)

006111016.b3lyp_6-31g(d).firefly.inp (generated)

006111016.b3lyp_6-31g(d).smash.inp (generated)

006111016.b3lyp_6-31g(d).nwchem.inp (generated) 006111016.b3lyp_6-31g(d).log.xz 006111016.td-b3lyp_6-31g+(d).inp 006111016.td-b3lyp_6-31g+(d).log.xz

006111016.td-b3lyp_6-31+g(d).qchem.inp (generated)

006111016.td-b3lyp_6-31+g(d).gjf (generated)

006111016.td-b3lyp_6-31+g(d).firefly.inp (generated)

006111016.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006111016.mol 006111016.PUBCHEM 006111016.mol (via Jmol)
006111017.b3lyp_6-31g(d).inp

006111017.b3lyp_6-31g(d).qchem.inp (generated)

006111017.b3lyp_6-31g(d).gjf (generated)

006111017.b3lyp_6-31g(d).firefly.inp (generated)

006111017.b3lyp_6-31g(d).smash.inp (generated)

006111017.b3lyp_6-31g(d).nwchem.inp (generated) 006111017.b3lyp_6-31g(d).log.xz 006111017.td-b3lyp_6-31g+(d).inp 006111017.td-b3lyp_6-31g+(d).log.xz

006111017.td-b3lyp_6-31+g(d).qchem.inp (generated)

006111017.td-b3lyp_6-31+g(d).gjf (generated)

006111017.td-b3lyp_6-31+g(d).firefly.inp (generated)

006111017.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006111017.mol 006111017.PUBCHEM 006111017.mol (via Jmol)
006111064.b3lyp_6-31g(d).inp

006111064.b3lyp_6-31g(d).qchem.inp (generated)

006111064.b3lyp_6-31g(d).gjf (generated)

006111064.b3lyp_6-31g(d).firefly.inp (generated)

006111064.b3lyp_6-31g(d).smash.inp (generated)

006111064.b3lyp_6-31g(d).nwchem.inp (generated) 006111064.b3lyp_6-31g(d).log.xz 006111064.td-b3lyp_6-31g+(d).inp 006111064.td-b3lyp_6-31g+(d).log.xz

006111064.td-b3lyp_6-31+g(d).qchem.inp (generated)

006111064.td-b3lyp_6-31+g(d).gjf (generated)

006111064.td-b3lyp_6-31+g(d).firefly.inp (generated)

006111064.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006111064.mol 006111064.PUBCHEM 006111064.mol (via Jmol)
006111065.b3lyp_6-31g(d).inp

006111065.b3lyp_6-31g(d).qchem.inp (generated)

006111065.b3lyp_6-31g(d).gjf (generated)

006111065.b3lyp_6-31g(d).firefly.inp (generated)

006111065.b3lyp_6-31g(d).smash.inp (generated)

006111065.b3lyp_6-31g(d).nwchem.inp (generated) 006111065.b3lyp_6-31g(d).log.xz 006111065.mol 006111065.PUBCHEM 006111065.mol (via Jmol)
006111086.b3lyp_6-31g(d).inp

006111086.b3lyp_6-31g(d).qchem.inp (generated)

006111086.b3lyp_6-31g(d).gjf (generated)

006111086.b3lyp_6-31g(d).firefly.inp (generated)

006111086.b3lyp_6-31g(d).smash.inp (generated)

006111086.b3lyp_6-31g(d).nwchem.inp (generated) 006111086.b3lyp_6-31g(d).log.xz 006111086.td-b3lyp_6-31g+(d).inp 006111086.td-b3lyp_6-31g+(d).log.xz

006111086.td-b3lyp_6-31+g(d).qchem.inp (generated)

006111086.td-b3lyp_6-31+g(d).gjf (generated)

006111086.td-b3lyp_6-31+g(d).firefly.inp (generated)

006111086.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006111086.mol 006111086.PUBCHEM 006111086.mol (via Jmol)
006111095.b3lyp_6-31g(d).inp

006111095.b3lyp_6-31g(d).qchem.inp (generated)

006111095.b3lyp_6-31g(d).gjf (generated)

006111095.b3lyp_6-31g(d).firefly.inp (generated)

006111095.b3lyp_6-31g(d).smash.inp (generated)

006111095.b3lyp_6-31g(d).nwchem.inp (generated) 006111095.b3lyp_6-31g(d).log.xz 006111095.td-b3lyp_6-31g+(d).inp 006111095.td-b3lyp_6-31g+(d).log.xz

006111095.td-b3lyp_6-31+g(d).qchem.inp (generated)

006111095.td-b3lyp_6-31+g(d).gjf (generated)

006111095.td-b3lyp_6-31+g(d).firefly.inp (generated)

006111095.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006111095.mol 006111095.PUBCHEM 006111095.mol (via Jmol)
006111120.b3lyp_6-31g(d).inp

006111120.b3lyp_6-31g(d).qchem.inp (generated)

006111120.b3lyp_6-31g(d).gjf (generated)

006111120.b3lyp_6-31g(d).firefly.inp (generated)

006111120.b3lyp_6-31g(d).smash.inp (generated)

006111120.b3lyp_6-31g(d).nwchem.inp (generated) 006111120.b3lyp_6-31g(d).log.xz 006111120.mol 006111120.PUBCHEM 006111120.mol (via Jmol)
006111142.b3lyp_6-31g(d).inp

006111142.b3lyp_6-31g(d).qchem.inp (generated)

006111142.b3lyp_6-31g(d).gjf (generated)

006111142.b3lyp_6-31g(d).firefly.inp (generated)

006111142.b3lyp_6-31g(d).smash.inp (generated)

006111142.b3lyp_6-31g(d).nwchem.inp (generated) 006111142.b3lyp_6-31g(d).log.xz 006111142.mol 006111142.PUBCHEM 006111142.mol (via Jmol)
006111165.b3lyp_6-31g(d).inp

006111165.b3lyp_6-31g(d).qchem.inp (generated)

006111165.b3lyp_6-31g(d).gjf (generated)

006111165.b3lyp_6-31g(d).firefly.inp (generated)

006111165.b3lyp_6-31g(d).smash.inp (generated)

006111165.b3lyp_6-31g(d).nwchem.inp (generated) 006111165.b3lyp_6-31g(d).log.xz 006111165.td-b3lyp_6-31g+(d).inp 006111165.td-b3lyp_6-31g+(d).log.xz

006111165.td-b3lyp_6-31+g(d).qchem.inp (generated)

006111165.td-b3lyp_6-31+g(d).gjf (generated)

006111165.td-b3lyp_6-31+g(d).firefly.inp (generated)

006111165.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006111165.mol 006111165.PUBCHEM 006111165.mol (via Jmol)
006111533.b3lyp_6-31g(d).inp

006111533.b3lyp_6-31g(d).qchem.inp (generated)

006111533.b3lyp_6-31g(d).gjf (generated)

006111533.b3lyp_6-31g(d).firefly.inp (generated)

006111533.b3lyp_6-31g(d).smash.inp (generated)

006111533.b3lyp_6-31g(d).nwchem.inp (generated) 006111533.b3lyp_6-31g(d).log.xz 006111533.td-b3lyp_6-31g+(d).inp 006111533.td-b3lyp_6-31g+(d).log.xz

006111533.td-b3lyp_6-31+g(d).qchem.inp (generated)

006111533.td-b3lyp_6-31+g(d).gjf (generated)

006111533.td-b3lyp_6-31+g(d).firefly.inp (generated)

006111533.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006111533.mol 006111533.PUBCHEM 006111533.mol (via Jmol)
006111564.b3lyp_6-31g(d).inp

006111564.b3lyp_6-31g(d).qchem.inp (generated)

006111564.b3lyp_6-31g(d).gjf (generated)

006111564.b3lyp_6-31g(d).firefly.inp (generated)

006111564.b3lyp_6-31g(d).smash.inp (generated)

006111564.b3lyp_6-31g(d).nwchem.inp (generated) 006111564.b3lyp_6-31g(d).log.xz 006111564.td-b3lyp_6-31g+(d).inp 006111564.td-b3lyp_6-31g+(d).log.xz

006111564.td-b3lyp_6-31+g(d).qchem.inp (generated)

006111564.td-b3lyp_6-31+g(d).gjf (generated)

006111564.td-b3lyp_6-31+g(d).firefly.inp (generated)

006111564.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006111564.mol 006111564.PUBCHEM 006111564.mol (via Jmol)
006111587.b3lyp_6-31g(d).inp

006111587.b3lyp_6-31g(d).qchem.inp (generated)

006111587.b3lyp_6-31g(d).gjf (generated)

006111587.b3lyp_6-31g(d).firefly.inp (generated)

006111587.b3lyp_6-31g(d).smash.inp (generated)

006111587.b3lyp_6-31g(d).nwchem.inp (generated) 006111587.b3lyp_6-31g(d).log.xz 006111587.td-b3lyp_6-31g+(d).inp 006111587.td-b3lyp_6-31g+(d).log.xz

006111587.td-b3lyp_6-31+g(d).qchem.inp (generated)

006111587.td-b3lyp_6-31+g(d).gjf (generated)

006111587.td-b3lyp_6-31+g(d).firefly.inp (generated)

006111587.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006111587.mol 006111587.PUBCHEM 006111587.mol (via Jmol)
006111588.b3lyp_6-31g(d).inp

006111588.b3lyp_6-31g(d).qchem.inp (generated)

006111588.b3lyp_6-31g(d).gjf (generated)

006111588.b3lyp_6-31g(d).firefly.inp (generated)

006111588.b3lyp_6-31g(d).smash.inp (generated)

006111588.b3lyp_6-31g(d).nwchem.inp (generated) 006111588.b3lyp_6-31g(d).log.xz 006111588.td-b3lyp_6-31g+(d).inp 006111588.td-b3lyp_6-31g+(d).log.xz

006111588.td-b3lyp_6-31+g(d).qchem.inp (generated)

006111588.td-b3lyp_6-31+g(d).gjf (generated)

006111588.td-b3lyp_6-31+g(d).firefly.inp (generated)

006111588.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006111588.mol 006111588.PUBCHEM 006111588.mol (via Jmol)
006111601.b3lyp_6-31g(d).inp

006111601.b3lyp_6-31g(d).qchem.inp (generated)

006111601.b3lyp_6-31g(d).gjf (generated)

006111601.b3lyp_6-31g(d).firefly.inp (generated)

006111601.b3lyp_6-31g(d).smash.inp (generated)

006111601.b3lyp_6-31g(d).nwchem.inp (generated) 006111601.b3lyp_6-31g(d).log.xz 006111601.td-b3lyp_6-31g+(d).inp 006111601.td-b3lyp_6-31g+(d).log.xz

006111601.td-b3lyp_6-31+g(d).qchem.inp (generated)

006111601.td-b3lyp_6-31+g(d).gjf (generated)

006111601.td-b3lyp_6-31+g(d).firefly.inp (generated)

006111601.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006111601.mol 006111601.PUBCHEM 006111601.mol (via Jmol)
006111685.b3lyp_6-31g(d).inp

006111685.b3lyp_6-31g(d).qchem.inp (generated)

006111685.b3lyp_6-31g(d).gjf (generated)

006111685.b3lyp_6-31g(d).firefly.inp (generated)

006111685.b3lyp_6-31g(d).smash.inp (generated)

006111685.b3lyp_6-31g(d).nwchem.inp (generated) 006111685.b3lyp_6-31g(d).log.xz 006111685.mol 006111685.PUBCHEM 006111685.mol (via Jmol)
006111792.b3lyp_6-31g(d).inp

006111792.b3lyp_6-31g(d).qchem.inp (generated)

006111792.b3lyp_6-31g(d).gjf (generated)

006111792.b3lyp_6-31g(d).firefly.inp (generated)

006111792.b3lyp_6-31g(d).smash.inp (generated)

006111792.b3lyp_6-31g(d).nwchem.inp (generated) 006111792.b3lyp_6-31g(d).log.xz 006111792.td-b3lyp_6-31g+(d).inp 006111792.td-b3lyp_6-31g+(d).log.xz

006111792.td-b3lyp_6-31+g(d).qchem.inp (generated)

006111792.td-b3lyp_6-31+g(d).gjf (generated)

006111792.td-b3lyp_6-31+g(d).firefly.inp (generated)

006111792.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006111792.mol 006111792.PUBCHEM 006111792.mol (via Jmol)
006111793.b3lyp_6-31g(d).inp

006111793.b3lyp_6-31g(d).qchem.inp (generated)

006111793.b3lyp_6-31g(d).gjf (generated)

006111793.b3lyp_6-31g(d).firefly.inp (generated)

006111793.b3lyp_6-31g(d).smash.inp (generated)

006111793.b3lyp_6-31g(d).nwchem.inp (generated) 006111793.b3lyp_6-31g(d).log.xz 006111793.td-b3lyp_6-31g+(d).inp 006111793.td-b3lyp_6-31g+(d).log.xz

006111793.td-b3lyp_6-31+g(d).qchem.inp (generated)

006111793.td-b3lyp_6-31+g(d).gjf (generated)

006111793.td-b3lyp_6-31+g(d).firefly.inp (generated)

006111793.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006111793.mol 006111793.PUBCHEM 006111793.mol (via Jmol)
006111872.b3lyp_6-31g(d).inp

006111872.b3lyp_6-31g(d).qchem.inp (generated)

006111872.b3lyp_6-31g(d).gjf (generated)

006111872.b3lyp_6-31g(d).firefly.inp (generated)

006111872.b3lyp_6-31g(d).smash.inp (generated)

006111872.b3lyp_6-31g(d).nwchem.inp (generated) 006111872.b3lyp_6-31g(d).log.xz 006111872.td-b3lyp_6-31g+(d).inp 006111872.td-b3lyp_6-31g+(d).log.xz

006111872.td-b3lyp_6-31+g(d).qchem.inp (generated)

006111872.td-b3lyp_6-31+g(d).gjf (generated)

006111872.td-b3lyp_6-31+g(d).firefly.inp (generated)

006111872.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006111872.mol 006111872.PUBCHEM 006111872.mol (via Jmol)
006111937.b3lyp_6-31g(d).inp

006111937.b3lyp_6-31g(d).qchem.inp (generated)

006111937.b3lyp_6-31g(d).gjf (generated)

006111937.b3lyp_6-31g(d).firefly.inp (generated)

006111937.b3lyp_6-31g(d).smash.inp (generated)

006111937.b3lyp_6-31g(d).nwchem.inp (generated) 006111937.b3lyp_6-31g(d).log.xz 006111937.td-b3lyp_6-31g+(d).inp 006111937.td-b3lyp_6-31g+(d).log.xz

006111937.td-b3lyp_6-31+g(d).qchem.inp (generated)

006111937.td-b3lyp_6-31+g(d).gjf (generated)

006111937.td-b3lyp_6-31+g(d).firefly.inp (generated)

006111937.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006111937.mol 006111937.PUBCHEM 006111937.mol (via Jmol)
006112014.b3lyp_6-31g(d).inp

006112014.b3lyp_6-31g(d).qchem.inp (generated)

006112014.b3lyp_6-31g(d).gjf (generated)

006112014.b3lyp_6-31g(d).firefly.inp (generated)

006112014.b3lyp_6-31g(d).smash.inp (generated)

006112014.b3lyp_6-31g(d).nwchem.inp (generated) 006112014.b3lyp_6-31g(d).log.xz 006112014.td-b3lyp_6-31g+(d).inp 006112014.td-b3lyp_6-31g+(d).log.xz

006112014.td-b3lyp_6-31+g(d).qchem.inp (generated)

006112014.td-b3lyp_6-31+g(d).gjf (generated)

006112014.td-b3lyp_6-31+g(d).firefly.inp (generated)

006112014.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006112014.mol 006112014.PUBCHEM 006112014.mol (via Jmol)
006112037.b3lyp_6-31g(d).inp

006112037.b3lyp_6-31g(d).qchem.inp (generated)

006112037.b3lyp_6-31g(d).gjf (generated)

006112037.b3lyp_6-31g(d).firefly.inp (generated)

006112037.b3lyp_6-31g(d).smash.inp (generated)

006112037.b3lyp_6-31g(d).nwchem.inp (generated) 006112037.b3lyp_6-31g(d).log.xz 006112037.mol 006112037.PUBCHEM 006112037.mol (via Jmol)
006112093.b3lyp_6-31g(d).inp

006112093.b3lyp_6-31g(d).qchem.inp (generated)

006112093.b3lyp_6-31g(d).gjf (generated)

006112093.b3lyp_6-31g(d).firefly.inp (generated)

006112093.b3lyp_6-31g(d).smash.inp (generated)

006112093.b3lyp_6-31g(d).nwchem.inp (generated) 006112093.b3lyp_6-31g(d).log.xz 006112093.td-b3lyp_6-31g+(d).inp 006112093.td-b3lyp_6-31g+(d).log.xz

006112093.td-b3lyp_6-31+g(d).qchem.inp (generated)

006112093.td-b3lyp_6-31+g(d).gjf (generated)

006112093.td-b3lyp_6-31+g(d).firefly.inp (generated)

006112093.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006112093.mol 006112093.PUBCHEM 006112093.mol (via Jmol)
006112209.b3lyp_6-31g(d).inp

006112209.b3lyp_6-31g(d).qchem.inp (generated)

006112209.b3lyp_6-31g(d).gjf (generated)

006112209.b3lyp_6-31g(d).firefly.inp (generated)

006112209.b3lyp_6-31g(d).smash.inp (generated)

006112209.b3lyp_6-31g(d).nwchem.inp (generated) 006112209.b3lyp_6-31g(d).log.xz 006112209.td-b3lyp_6-31g+(d).inp 006112209.td-b3lyp_6-31g+(d).log.xz

006112209.td-b3lyp_6-31+g(d).qchem.inp (generated)

006112209.td-b3lyp_6-31+g(d).gjf (generated)

006112209.td-b3lyp_6-31+g(d).firefly.inp (generated)

006112209.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006112209.mol 006112209.PUBCHEM 006112209.mol (via Jmol)
006112211.b3lyp_6-31g(d).inp

006112211.b3lyp_6-31g(d).qchem.inp (generated)

006112211.b3lyp_6-31g(d).gjf (generated)

006112211.b3lyp_6-31g(d).firefly.inp (generated)

006112211.b3lyp_6-31g(d).smash.inp (generated)

006112211.b3lyp_6-31g(d).nwchem.inp (generated) 006112211.b3lyp_6-31g(d).log.xz 006112211.td-b3lyp_6-31g+(d).inp 006112211.td-b3lyp_6-31g+(d).log.xz

006112211.td-b3lyp_6-31+g(d).qchem.inp (generated)

006112211.td-b3lyp_6-31+g(d).gjf (generated)

006112211.td-b3lyp_6-31+g(d).firefly.inp (generated)

006112211.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006112211.mol 006112211.PUBCHEM 006112211.mol (via Jmol)
006112248.b3lyp_6-31g(d).inp

006112248.b3lyp_6-31g(d).qchem.inp (generated)

006112248.b3lyp_6-31g(d).gjf (generated)

006112248.b3lyp_6-31g(d).firefly.inp (generated)

006112248.b3lyp_6-31g(d).smash.inp (generated)

006112248.b3lyp_6-31g(d).nwchem.inp (generated) 006112248.b3lyp_6-31g(d).log.xz 006112248.mol 006112248.PUBCHEM 006112248.mol (via Jmol)
006112486.b3lyp_6-31g(d).inp

006112486.b3lyp_6-31g(d).qchem.inp (generated)

006112486.b3lyp_6-31g(d).gjf (generated)

006112486.b3lyp_6-31g(d).firefly.inp (generated)

006112486.b3lyp_6-31g(d).smash.inp (generated)

006112486.b3lyp_6-31g(d).nwchem.inp (generated) 006112486.b3lyp_6-31g(d).log.xz 006112486.td-b3lyp_6-31g+(d).inp 006112486.td-b3lyp_6-31g+(d).log.xz

006112486.td-b3lyp_6-31+g(d).qchem.inp (generated)

006112486.td-b3lyp_6-31+g(d).gjf (generated)

006112486.td-b3lyp_6-31+g(d).firefly.inp (generated)

006112486.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006112486.mol 006112486.PUBCHEM 006112486.mol (via Jmol)
006112525.b3lyp_6-31g(d).inp

006112525.b3lyp_6-31g(d).qchem.inp (generated)

006112525.b3lyp_6-31g(d).gjf (generated)

006112525.b3lyp_6-31g(d).firefly.inp (generated)

006112525.b3lyp_6-31g(d).smash.inp (generated)

006112525.b3lyp_6-31g(d).nwchem.inp (generated) 006112525.b3lyp_6-31g(d).log.xz 006112525.mol 006112525.PUBCHEM 006112525.mol (via Jmol)
006112554.b3lyp_6-31g(d).inp

006112554.b3lyp_6-31g(d).qchem.inp (generated)

006112554.b3lyp_6-31g(d).gjf (generated)

006112554.b3lyp_6-31g(d).firefly.inp (generated)

006112554.b3lyp_6-31g(d).smash.inp (generated)

006112554.b3lyp_6-31g(d).nwchem.inp (generated) 006112554.b3lyp_6-31g(d).log.xz 006112554.td-b3lyp_6-31g+(d).inp 006112554.td-b3lyp_6-31g+(d).log.xz

006112554.td-b3lyp_6-31+g(d).qchem.inp (generated)

006112554.td-b3lyp_6-31+g(d).gjf (generated)

006112554.td-b3lyp_6-31+g(d).firefly.inp (generated)

006112554.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006112554.mol 006112554.PUBCHEM 006112554.mol (via Jmol)
006112644.b3lyp_6-31g(d).inp

006112644.b3lyp_6-31g(d).qchem.inp (generated)

006112644.b3lyp_6-31g(d).gjf (generated)

006112644.b3lyp_6-31g(d).firefly.inp (generated)

006112644.b3lyp_6-31g(d).smash.inp (generated)

006112644.b3lyp_6-31g(d).nwchem.inp (generated) 006112644.b3lyp_6-31g(d).log.xz 006112644.mol 006112644.PUBCHEM 006112644.mol (via Jmol)
006112647.b3lyp_6-31g(d).inp

006112647.b3lyp_6-31g(d).qchem.inp (generated)

006112647.b3lyp_6-31g(d).gjf (generated)

006112647.b3lyp_6-31g(d).firefly.inp (generated)

006112647.b3lyp_6-31g(d).smash.inp (generated)

006112647.b3lyp_6-31g(d).nwchem.inp (generated) 006112647.b3lyp_6-31g(d).log.xz 006112647.td-b3lyp_6-31g+(d).inp 006112647.td-b3lyp_6-31g+(d).log.xz

006112647.td-b3lyp_6-31+g(d).qchem.inp (generated)

006112647.td-b3lyp_6-31+g(d).gjf (generated)

006112647.td-b3lyp_6-31+g(d).firefly.inp (generated)

006112647.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006112647.mol 006112647.PUBCHEM 006112647.mol (via Jmol)
006112668.b3lyp_6-31g(d).inp

006112668.b3lyp_6-31g(d).qchem.inp (generated)

006112668.b3lyp_6-31g(d).gjf (generated)

006112668.b3lyp_6-31g(d).firefly.inp (generated)

006112668.b3lyp_6-31g(d).smash.inp (generated)

006112668.b3lyp_6-31g(d).nwchem.inp (generated) 006112668.b3lyp_6-31g(d).log.xz 006112668.mol 006112668.PUBCHEM 006112668.mol (via Jmol)
006112669.b3lyp_6-31g(d).inp

006112669.b3lyp_6-31g(d).qchem.inp (generated)

006112669.b3lyp_6-31g(d).gjf (generated)

006112669.b3lyp_6-31g(d).firefly.inp (generated)

006112669.b3lyp_6-31g(d).smash.inp (generated)

006112669.b3lyp_6-31g(d).nwchem.inp (generated) 006112669.b3lyp_6-31g(d).log.xz 006112669.mol 006112669.PUBCHEM 006112669.mol (via Jmol)
006112709.b3lyp_6-31g(d).inp

006112709.b3lyp_6-31g(d).qchem.inp (generated)

006112709.b3lyp_6-31g(d).gjf (generated)

006112709.b3lyp_6-31g(d).firefly.inp (generated)

006112709.b3lyp_6-31g(d).smash.inp (generated)

006112709.b3lyp_6-31g(d).nwchem.inp (generated) 006112709.b3lyp_6-31g(d).log.xz 006112709.td-b3lyp_6-31g+(d).inp 006112709.td-b3lyp_6-31g+(d).log.xz

006112709.td-b3lyp_6-31+g(d).qchem.inp (generated)

006112709.td-b3lyp_6-31+g(d).gjf (generated)

006112709.td-b3lyp_6-31+g(d).firefly.inp (generated)

006112709.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006112709.mol 006112709.PUBCHEM 006112709.mol (via Jmol)
006112717.b3lyp_6-31g(d).inp

006112717.b3lyp_6-31g(d).qchem.inp (generated)

006112717.b3lyp_6-31g(d).gjf (generated)

006112717.b3lyp_6-31g(d).firefly.inp (generated)

006112717.b3lyp_6-31g(d).smash.inp (generated)

006112717.b3lyp_6-31g(d).nwchem.inp (generated) 006112717.b3lyp_6-31g(d).log.xz 006112717.td-b3lyp_6-31g+(d).inp 006112717.td-b3lyp_6-31g+(d).log.xz

006112717.td-b3lyp_6-31+g(d).qchem.inp (generated)

006112717.td-b3lyp_6-31+g(d).gjf (generated)

006112717.td-b3lyp_6-31+g(d).firefly.inp (generated)

006112717.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006112717.mol 006112717.PUBCHEM 006112717.mol (via Jmol)
006112777.b3lyp_6-31g(d).inp

006112777.b3lyp_6-31g(d).qchem.inp (generated)

006112777.b3lyp_6-31g(d).gjf (generated)

006112777.b3lyp_6-31g(d).firefly.inp (generated)

006112777.b3lyp_6-31g(d).smash.inp (generated)

006112777.b3lyp_6-31g(d).nwchem.inp (generated) 006112777.b3lyp_6-31g(d).log.xz 006112777.td-b3lyp_6-31g+(d).inp 006112777.td-b3lyp_6-31g+(d).log.xz

006112777.td-b3lyp_6-31+g(d).qchem.inp (generated)

006112777.td-b3lyp_6-31+g(d).gjf (generated)

006112777.td-b3lyp_6-31+g(d).firefly.inp (generated)

006112777.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006112777.mol 006112777.PUBCHEM 006112777.mol (via Jmol)
006112842.b3lyp_6-31g(d).inp

006112842.b3lyp_6-31g(d).qchem.inp (generated)

006112842.b3lyp_6-31g(d).gjf (generated)

006112842.b3lyp_6-31g(d).firefly.inp (generated)

006112842.b3lyp_6-31g(d).smash.inp (generated)

006112842.b3lyp_6-31g(d).nwchem.inp (generated) 006112842.b3lyp_6-31g(d).log.xz 006112842.td-b3lyp_6-31g+(d).inp 006112842.td-b3lyp_6-31g+(d).log.xz

006112842.td-b3lyp_6-31+g(d).qchem.inp (generated)

006112842.td-b3lyp_6-31+g(d).gjf (generated)

006112842.td-b3lyp_6-31+g(d).firefly.inp (generated)

006112842.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006112842.mol 006112842.PUBCHEM 006112842.mol (via Jmol)
006112978.b3lyp_6-31g(d).inp

006112978.b3lyp_6-31g(d).qchem.inp (generated)

006112978.b3lyp_6-31g(d).gjf (generated)

006112978.b3lyp_6-31g(d).firefly.inp (generated)

006112978.b3lyp_6-31g(d).smash.inp (generated)

006112978.b3lyp_6-31g(d).nwchem.inp (generated) 006112978.b3lyp_6-31g(d).log.xz 006112978.td-b3lyp_6-31g+(d).inp 006112978.td-b3lyp_6-31g+(d).log.xz

006112978.td-b3lyp_6-31+g(d).qchem.inp (generated)

006112978.td-b3lyp_6-31+g(d).gjf (generated)

006112978.td-b3lyp_6-31+g(d).firefly.inp (generated)

006112978.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006112978.mol 006112978.PUBCHEM 006112978.mol (via Jmol)
006112997.b3lyp_6-31g(d).inp

006112997.b3lyp_6-31g(d).qchem.inp (generated)

006112997.b3lyp_6-31g(d).gjf (generated)

006112997.b3lyp_6-31g(d).firefly.inp (generated)

006112997.b3lyp_6-31g(d).smash.inp (generated)

006112997.b3lyp_6-31g(d).nwchem.inp (generated) 006112997.b3lyp_6-31g(d).log.xz 006112997.td-b3lyp_6-31g+(d).inp 006112997.td-b3lyp_6-31g+(d).log.xz

006112997.td-b3lyp_6-31+g(d).qchem.inp (generated)

006112997.td-b3lyp_6-31+g(d).gjf (generated)

006112997.td-b3lyp_6-31+g(d).firefly.inp (generated)

006112997.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006112997.mol 006112997.PUBCHEM 006112997.mol (via Jmol)
006113054.b3lyp_6-31g(d).inp

006113054.b3lyp_6-31g(d).qchem.inp (generated)

006113054.b3lyp_6-31g(d).gjf (generated)

006113054.b3lyp_6-31g(d).firefly.inp (generated)

006113054.b3lyp_6-31g(d).smash.inp (generated)

006113054.b3lyp_6-31g(d).nwchem.inp (generated) 006113054.b3lyp_6-31g(d).log.xz 006113054.mol 006113054.PUBCHEM 006113054.mol (via Jmol)
006113170.b3lyp_6-31g(d).inp

006113170.b3lyp_6-31g(d).qchem.inp (generated)

006113170.b3lyp_6-31g(d).gjf (generated)

006113170.b3lyp_6-31g(d).firefly.inp (generated)

006113170.b3lyp_6-31g(d).smash.inp (generated)

006113170.b3lyp_6-31g(d).nwchem.inp (generated) 006113170.b3lyp_6-31g(d).log.xz 006113170.td-b3lyp_6-31g+(d).inp 006113170.td-b3lyp_6-31g+(d).log.xz

006113170.td-b3lyp_6-31+g(d).qchem.inp (generated)

006113170.td-b3lyp_6-31+g(d).gjf (generated)

006113170.td-b3lyp_6-31+g(d).firefly.inp (generated)

006113170.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006113170.mol 006113170.PUBCHEM 006113170.mol (via Jmol)
006113267.b3lyp_6-31g(d).inp

006113267.b3lyp_6-31g(d).qchem.inp (generated)

006113267.b3lyp_6-31g(d).gjf (generated)

006113267.b3lyp_6-31g(d).firefly.inp (generated)

006113267.b3lyp_6-31g(d).smash.inp (generated)

006113267.b3lyp_6-31g(d).nwchem.inp (generated) 006113267.b3lyp_6-31g(d).log.xz 006113267.td-b3lyp_6-31g+(d).inp 006113267.td-b3lyp_6-31g+(d).log.xz

006113267.td-b3lyp_6-31+g(d).qchem.inp (generated)

006113267.td-b3lyp_6-31+g(d).gjf (generated)

006113267.td-b3lyp_6-31+g(d).firefly.inp (generated)

006113267.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006113267.mol 006113267.PUBCHEM 006113267.mol (via Jmol)
006113402.b3lyp_6-31g(d).inp

006113402.b3lyp_6-31g(d).qchem.inp (generated)

006113402.b3lyp_6-31g(d).gjf (generated)

006113402.b3lyp_6-31g(d).firefly.inp (generated)

006113402.b3lyp_6-31g(d).smash.inp (generated)

006113402.b3lyp_6-31g(d).nwchem.inp (generated) 006113402.b3lyp_6-31g(d).log.xz 006113402.mol 006113402.PUBCHEM 006113402.mol (via Jmol)
006113483.b3lyp_6-31g(d).inp

006113483.b3lyp_6-31g(d).qchem.inp (generated)

006113483.b3lyp_6-31g(d).gjf (generated)

006113483.b3lyp_6-31g(d).firefly.inp (generated)

006113483.b3lyp_6-31g(d).smash.inp (generated)

006113483.b3lyp_6-31g(d).nwchem.inp (generated) 006113483.b3lyp_6-31g(d).log.xz 006113483.td-b3lyp_6-31g+(d).inp 006113483.td-b3lyp_6-31g+(d).log.xz

006113483.td-b3lyp_6-31+g(d).qchem.inp (generated)

006113483.td-b3lyp_6-31+g(d).gjf (generated)

006113483.td-b3lyp_6-31+g(d).firefly.inp (generated)

006113483.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006113483.mol 006113483.PUBCHEM 006113483.mol (via Jmol)
006113486.b3lyp_6-31g(d).inp

006113486.b3lyp_6-31g(d).qchem.inp (generated)

006113486.b3lyp_6-31g(d).gjf (generated)

006113486.b3lyp_6-31g(d).firefly.inp (generated)

006113486.b3lyp_6-31g(d).smash.inp (generated)

006113486.b3lyp_6-31g(d).nwchem.inp (generated) 006113486.b3lyp_6-31g(d).log.xz 006113486.mol 006113486.PUBCHEM 006113486.mol (via Jmol)
006113576.b3lyp_6-31g(d).inp

006113576.b3lyp_6-31g(d).qchem.inp (generated)

006113576.b3lyp_6-31g(d).gjf (generated)

006113576.b3lyp_6-31g(d).firefly.inp (generated)

006113576.b3lyp_6-31g(d).smash.inp (generated)

006113576.b3lyp_6-31g(d).nwchem.inp (generated) 006113576.b3lyp_6-31g(d).log.xz 006113576.td-b3lyp_6-31g+(d).inp 006113576.td-b3lyp_6-31g+(d).log.xz

006113576.td-b3lyp_6-31+g(d).qchem.inp (generated)

006113576.td-b3lyp_6-31+g(d).gjf (generated)

006113576.td-b3lyp_6-31+g(d).firefly.inp (generated)

006113576.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006113576.mol 006113576.PUBCHEM 006113576.mol (via Jmol)
006113577.b3lyp_6-31g(d).inp

006113577.b3lyp_6-31g(d).qchem.inp (generated)

006113577.b3lyp_6-31g(d).gjf (generated)

006113577.b3lyp_6-31g(d).firefly.inp (generated)

006113577.b3lyp_6-31g(d).smash.inp (generated)

006113577.b3lyp_6-31g(d).nwchem.inp (generated) 006113577.b3lyp_6-31g(d).log.xz 006113577.mol 006113577.PUBCHEM 006113577.mol (via Jmol)
006113593.b3lyp_6-31g(d).inp

006113593.b3lyp_6-31g(d).qchem.inp (generated)

006113593.b3lyp_6-31g(d).gjf (generated)

006113593.b3lyp_6-31g(d).firefly.inp (generated)

006113593.b3lyp_6-31g(d).smash.inp (generated)

006113593.b3lyp_6-31g(d).nwchem.inp (generated) 006113593.b3lyp_6-31g(d).log.xz 006113593.td-b3lyp_6-31g+(d).inp 006113593.td-b3lyp_6-31g+(d).log.xz

006113593.td-b3lyp_6-31+g(d).qchem.inp (generated)

006113593.td-b3lyp_6-31+g(d).gjf (generated)

006113593.td-b3lyp_6-31+g(d).firefly.inp (generated)

006113593.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006113593.mol 006113593.PUBCHEM 006113593.mol (via Jmol)
006113607.b3lyp_6-31g(d).inp

006113607.b3lyp_6-31g(d).qchem.inp (generated)

006113607.b3lyp_6-31g(d).gjf (generated)

006113607.b3lyp_6-31g(d).firefly.inp (generated)

006113607.b3lyp_6-31g(d).smash.inp (generated)

006113607.b3lyp_6-31g(d).nwchem.inp (generated) 006113607.b3lyp_6-31g(d).log.xz 006113607.td-b3lyp_6-31g+(d).inp 006113607.td-b3lyp_6-31g+(d).log.xz

006113607.td-b3lyp_6-31+g(d).qchem.inp (generated)

006113607.td-b3lyp_6-31+g(d).gjf (generated)

006113607.td-b3lyp_6-31+g(d).firefly.inp (generated)

006113607.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006113607.mol 006113607.PUBCHEM 006113607.mol (via Jmol)
006113646.b3lyp_6-31g(d).inp

006113646.b3lyp_6-31g(d).qchem.inp (generated)

006113646.b3lyp_6-31g(d).gjf (generated)

006113646.b3lyp_6-31g(d).firefly.inp (generated)

006113646.b3lyp_6-31g(d).smash.inp (generated)

006113646.b3lyp_6-31g(d).nwchem.inp (generated) 006113646.b3lyp_6-31g(d).log.xz 006113646.td-b3lyp_6-31g+(d).inp 006113646.td-b3lyp_6-31g+(d).log.xz

006113646.td-b3lyp_6-31+g(d).qchem.inp (generated)

006113646.td-b3lyp_6-31+g(d).gjf (generated)

006113646.td-b3lyp_6-31+g(d).firefly.inp (generated)

006113646.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006113646.mol 006113646.PUBCHEM 006113646.mol (via Jmol)
006113665.b3lyp_6-31g(d).inp

006113665.b3lyp_6-31g(d).qchem.inp (generated)

006113665.b3lyp_6-31g(d).gjf (generated)

006113665.b3lyp_6-31g(d).firefly.inp (generated)

006113665.b3lyp_6-31g(d).smash.inp (generated)

006113665.b3lyp_6-31g(d).nwchem.inp (generated) 006113665.b3lyp_6-31g(d).log.xz 006113665.td-b3lyp_6-31g+(d).inp 006113665.td-b3lyp_6-31g+(d).log.xz

006113665.td-b3lyp_6-31+g(d).qchem.inp (generated)

006113665.td-b3lyp_6-31+g(d).gjf (generated)

006113665.td-b3lyp_6-31+g(d).firefly.inp (generated)

006113665.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006113665.mol 006113665.PUBCHEM 006113665.mol (via Jmol)
006113711.b3lyp_6-31g(d).inp

006113711.b3lyp_6-31g(d).qchem.inp (generated)

006113711.b3lyp_6-31g(d).gjf (generated)

006113711.b3lyp_6-31g(d).firefly.inp (generated)

006113711.b3lyp_6-31g(d).smash.inp (generated)

006113711.b3lyp_6-31g(d).nwchem.inp (generated) 006113711.b3lyp_6-31g(d).log.xz 006113711.td-b3lyp_6-31g+(d).inp 006113711.td-b3lyp_6-31g+(d).log.xz

006113711.td-b3lyp_6-31+g(d).qchem.inp (generated)

006113711.td-b3lyp_6-31+g(d).gjf (generated)

006113711.td-b3lyp_6-31+g(d).firefly.inp (generated)

006113711.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006113711.mol 006113711.PUBCHEM 006113711.mol (via Jmol)
006113853.b3lyp_6-31g(d).inp

006113853.b3lyp_6-31g(d).qchem.inp (generated)

006113853.b3lyp_6-31g(d).gjf (generated)

006113853.b3lyp_6-31g(d).firefly.inp (generated)

006113853.b3lyp_6-31g(d).smash.inp (generated)

006113853.b3lyp_6-31g(d).nwchem.inp (generated) 006113853.b3lyp_6-31g(d).log.xz 006113853.mol 006113853.PUBCHEM 006113853.mol (via Jmol)
006113902.b3lyp_6-31g(d).inp

006113902.b3lyp_6-31g(d).qchem.inp (generated)

006113902.b3lyp_6-31g(d).gjf (generated)

006113902.b3lyp_6-31g(d).firefly.inp (generated)

006113902.b3lyp_6-31g(d).smash.inp (generated)

006113902.b3lyp_6-31g(d).nwchem.inp (generated) 006113902.b3lyp_6-31g(d).log.xz 006113902.mol 006113902.PUBCHEM 006113902.mol (via Jmol)
006113975.b3lyp_6-31g(d).inp

006113975.b3lyp_6-31g(d).qchem.inp (generated)

006113975.b3lyp_6-31g(d).gjf (generated)

006113975.b3lyp_6-31g(d).firefly.inp (generated)

006113975.b3lyp_6-31g(d).smash.inp (generated)

006113975.b3lyp_6-31g(d).nwchem.inp (generated) 006113975.b3lyp_6-31g(d).log.xz 006113975.td-b3lyp_6-31g+(d).inp 006113975.td-b3lyp_6-31g+(d).log.xz

006113975.td-b3lyp_6-31+g(d).qchem.inp (generated)

006113975.td-b3lyp_6-31+g(d).gjf (generated)

006113975.td-b3lyp_6-31+g(d).firefly.inp (generated)

006113975.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006113975.mol 006113975.PUBCHEM 006113975.mol (via Jmol)
006114041.b3lyp_6-31g(d).inp

006114041.b3lyp_6-31g(d).qchem.inp (generated)

006114041.b3lyp_6-31g(d).gjf (generated)

006114041.b3lyp_6-31g(d).firefly.inp (generated)

006114041.b3lyp_6-31g(d).smash.inp (generated)

006114041.b3lyp_6-31g(d).nwchem.inp (generated) 006114041.b3lyp_6-31g(d).log.xz 006114041.td-b3lyp_6-31g+(d).inp 006114041.td-b3lyp_6-31g+(d).log.xz

006114041.td-b3lyp_6-31+g(d).qchem.inp (generated)

006114041.td-b3lyp_6-31+g(d).gjf (generated)

006114041.td-b3lyp_6-31+g(d).firefly.inp (generated)

006114041.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006114041.mol 006114041.PUBCHEM 006114041.mol (via Jmol)
006114067.b3lyp_6-31g(d).inp

006114067.b3lyp_6-31g(d).qchem.inp (generated)

006114067.b3lyp_6-31g(d).gjf (generated)

006114067.b3lyp_6-31g(d).firefly.inp (generated)

006114067.b3lyp_6-31g(d).smash.inp (generated)

006114067.b3lyp_6-31g(d).nwchem.inp (generated) 006114067.b3lyp_6-31g(d).log.xz 006114067.td-b3lyp_6-31g+(d).inp 006114067.td-b3lyp_6-31g+(d).log.xz

006114067.td-b3lyp_6-31+g(d).qchem.inp (generated)

006114067.td-b3lyp_6-31+g(d).gjf (generated)

006114067.td-b3lyp_6-31+g(d).firefly.inp (generated)

006114067.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006114067.mol 006114067.PUBCHEM 006114067.mol (via Jmol)
006114128.b3lyp_6-31g(d).inp

006114128.b3lyp_6-31g(d).qchem.inp (generated)

006114128.b3lyp_6-31g(d).gjf (generated)

006114128.b3lyp_6-31g(d).firefly.inp (generated)

006114128.b3lyp_6-31g(d).smash.inp (generated)

006114128.b3lyp_6-31g(d).nwchem.inp (generated) 006114128.b3lyp_6-31g(d).log.xz 006114128.td-b3lyp_6-31g+(d).inp 006114128.td-b3lyp_6-31g+(d).log.xz

006114128.td-b3lyp_6-31+g(d).qchem.inp (generated)

006114128.td-b3lyp_6-31+g(d).gjf (generated)

006114128.td-b3lyp_6-31+g(d).firefly.inp (generated)

006114128.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006114128.mol 006114128.PUBCHEM 006114128.mol (via Jmol)
006114286.b3lyp_6-31g(d).inp

006114286.b3lyp_6-31g(d).qchem.inp (generated)

006114286.b3lyp_6-31g(d).gjf (generated)

006114286.b3lyp_6-31g(d).firefly.inp (generated)

006114286.b3lyp_6-31g(d).smash.inp (generated)

006114286.b3lyp_6-31g(d).nwchem.inp (generated) 006114286.b3lyp_6-31g(d).log.xz 006114286.td-b3lyp_6-31g+(d).inp 006114286.td-b3lyp_6-31g+(d).log.xz

006114286.td-b3lyp_6-31+g(d).qchem.inp (generated)

006114286.td-b3lyp_6-31+g(d).gjf (generated)

006114286.td-b3lyp_6-31+g(d).firefly.inp (generated)

006114286.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006114286.mol 006114286.PUBCHEM 006114286.mol (via Jmol)
006114339.b3lyp_6-31g(d).inp

006114339.b3lyp_6-31g(d).qchem.inp (generated)

006114339.b3lyp_6-31g(d).gjf (generated)

006114339.b3lyp_6-31g(d).firefly.inp (generated)

006114339.b3lyp_6-31g(d).smash.inp (generated)

006114339.b3lyp_6-31g(d).nwchem.inp (generated) 006114339.b3lyp_6-31g(d).log.xz 006114339.td-b3lyp_6-31g+(d).inp 006114339.td-b3lyp_6-31g+(d).log.xz

006114339.td-b3lyp_6-31+g(d).qchem.inp (generated)

006114339.td-b3lyp_6-31+g(d).gjf (generated)

006114339.td-b3lyp_6-31+g(d).firefly.inp (generated)

006114339.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006114339.mol 006114339.PUBCHEM 006114339.mol (via Jmol)
006114359.b3lyp_6-31g(d).inp

006114359.b3lyp_6-31g(d).qchem.inp (generated)

006114359.b3lyp_6-31g(d).gjf (generated)

006114359.b3lyp_6-31g(d).firefly.inp (generated)

006114359.b3lyp_6-31g(d).smash.inp (generated)

006114359.b3lyp_6-31g(d).nwchem.inp (generated) 006114359.b3lyp_6-31g(d).log.xz 006114359.mol 006114359.PUBCHEM 006114359.mol (via Jmol)
006114532.b3lyp_6-31g(d).inp

006114532.b3lyp_6-31g(d).qchem.inp (generated)

006114532.b3lyp_6-31g(d).gjf (generated)

006114532.b3lyp_6-31g(d).firefly.inp (generated)

006114532.b3lyp_6-31g(d).smash.inp (generated)

006114532.b3lyp_6-31g(d).nwchem.inp (generated) 006114532.b3lyp_6-31g(d).log.xz 006114532.mol 006114532.PUBCHEM 006114532.mol (via Jmol)
006114721.b3lyp_6-31g(d).inp

006114721.b3lyp_6-31g(d).qchem.inp (generated)

006114721.b3lyp_6-31g(d).gjf (generated)

006114721.b3lyp_6-31g(d).firefly.inp (generated)

006114721.b3lyp_6-31g(d).smash.inp (generated)

006114721.b3lyp_6-31g(d).nwchem.inp (generated) 006114721.b3lyp_6-31g(d).log.xz 006114721.td-b3lyp_6-31g+(d).inp 006114721.td-b3lyp_6-31g+(d).log.xz

006114721.td-b3lyp_6-31+g(d).qchem.inp (generated)

006114721.td-b3lyp_6-31+g(d).gjf (generated)

006114721.td-b3lyp_6-31+g(d).firefly.inp (generated)

006114721.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006114721.mol 006114721.PUBCHEM 006114721.mol (via Jmol)
006114762.b3lyp_6-31g(d).inp

006114762.b3lyp_6-31g(d).qchem.inp (generated)

006114762.b3lyp_6-31g(d).gjf (generated)

006114762.b3lyp_6-31g(d).firefly.inp (generated)

006114762.b3lyp_6-31g(d).smash.inp (generated)

006114762.b3lyp_6-31g(d).nwchem.inp (generated) 006114762.b3lyp_6-31g(d).log.xz 006114762.td-b3lyp_6-31g+(d).inp 006114762.td-b3lyp_6-31g+(d).log.xz

006114762.td-b3lyp_6-31+g(d).qchem.inp (generated)

006114762.td-b3lyp_6-31+g(d).gjf (generated)

006114762.td-b3lyp_6-31+g(d).firefly.inp (generated)

006114762.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006114762.mol 006114762.PUBCHEM 006114762.mol (via Jmol)
006114813.b3lyp_6-31g(d).inp

006114813.b3lyp_6-31g(d).qchem.inp (generated)

006114813.b3lyp_6-31g(d).gjf (generated)

006114813.b3lyp_6-31g(d).firefly.inp (generated)

006114813.b3lyp_6-31g(d).smash.inp (generated)

006114813.b3lyp_6-31g(d).nwchem.inp (generated) 006114813.b3lyp_6-31g(d).log.xz 006114813.td-b3lyp_6-31g+(d).inp 006114813.td-b3lyp_6-31g+(d).log.xz

006114813.td-b3lyp_6-31+g(d).qchem.inp (generated)

006114813.td-b3lyp_6-31+g(d).gjf (generated)

006114813.td-b3lyp_6-31+g(d).firefly.inp (generated)

006114813.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006114813.mol 006114813.PUBCHEM 006114813.mol (via Jmol)
006114815.b3lyp_6-31g(d).inp

006114815.b3lyp_6-31g(d).qchem.inp (generated)

006114815.b3lyp_6-31g(d).gjf (generated)

006114815.b3lyp_6-31g(d).firefly.inp (generated)

006114815.b3lyp_6-31g(d).smash.inp (generated)

006114815.b3lyp_6-31g(d).nwchem.inp (generated) 006114815.b3lyp_6-31g(d).log.xz 006114815.td-b3lyp_6-31g+(d).inp 006114815.td-b3lyp_6-31g+(d).log.xz

006114815.td-b3lyp_6-31+g(d).qchem.inp (generated)

006114815.td-b3lyp_6-31+g(d).gjf (generated)

006114815.td-b3lyp_6-31+g(d).firefly.inp (generated)

006114815.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006114815.mol 006114815.PUBCHEM 006114815.mol (via Jmol)
006114854.b3lyp_6-31g(d).inp

006114854.b3lyp_6-31g(d).qchem.inp (generated)

006114854.b3lyp_6-31g(d).gjf (generated)

006114854.b3lyp_6-31g(d).firefly.inp (generated)

006114854.b3lyp_6-31g(d).smash.inp (generated)

006114854.b3lyp_6-31g(d).nwchem.inp (generated) 006114854.b3lyp_6-31g(d).log.xz 006114854.td-b3lyp_6-31g+(d).inp 006114854.td-b3lyp_6-31g+(d).log.xz

006114854.td-b3lyp_6-31+g(d).qchem.inp (generated)

006114854.td-b3lyp_6-31+g(d).gjf (generated)

006114854.td-b3lyp_6-31+g(d).firefly.inp (generated)

006114854.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006114854.mol 006114854.PUBCHEM 006114854.mol (via Jmol)
006114953.b3lyp_6-31g(d).inp

006114953.b3lyp_6-31g(d).qchem.inp (generated)

006114953.b3lyp_6-31g(d).gjf (generated)

006114953.b3lyp_6-31g(d).firefly.inp (generated)

006114953.b3lyp_6-31g(d).smash.inp (generated)

006114953.b3lyp_6-31g(d).nwchem.inp (generated) 006114953.b3lyp_6-31g(d).log.xz 006114953.mol 006114953.PUBCHEM 006114953.mol (via Jmol)
006115171.b3lyp_6-31g(d).inp

006115171.b3lyp_6-31g(d).qchem.inp (generated)

006115171.b3lyp_6-31g(d).gjf (generated)

006115171.b3lyp_6-31g(d).firefly.inp (generated)

006115171.b3lyp_6-31g(d).smash.inp (generated)

006115171.b3lyp_6-31g(d).nwchem.inp (generated) 006115171.b3lyp_6-31g(d).log.xz 006115171.mol 006115171.PUBCHEM 006115171.mol (via Jmol)
006115239.b3lyp_6-31g(d).inp

006115239.b3lyp_6-31g(d).qchem.inp (generated)

006115239.b3lyp_6-31g(d).gjf (generated)

006115239.b3lyp_6-31g(d).firefly.inp (generated)

006115239.b3lyp_6-31g(d).smash.inp (generated)

006115239.b3lyp_6-31g(d).nwchem.inp (generated) 006115239.b3lyp_6-31g(d).log.xz 006115239.td-b3lyp_6-31g+(d).inp 006115239.td-b3lyp_6-31g+(d).log.xz

006115239.td-b3lyp_6-31+g(d).qchem.inp (generated)

006115239.td-b3lyp_6-31+g(d).gjf (generated)

006115239.td-b3lyp_6-31+g(d).firefly.inp (generated)

006115239.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006115239.mol 006115239.PUBCHEM 006115239.mol (via Jmol)
006115285.b3lyp_6-31g(d).inp

006115285.b3lyp_6-31g(d).qchem.inp (generated)

006115285.b3lyp_6-31g(d).gjf (generated)

006115285.b3lyp_6-31g(d).firefly.inp (generated)

006115285.b3lyp_6-31g(d).smash.inp (generated)

006115285.b3lyp_6-31g(d).nwchem.inp (generated) 006115285.b3lyp_6-31g(d).log.xz 006115285.td-b3lyp_6-31g+(d).inp 006115285.td-b3lyp_6-31g+(d).log.xz

006115285.td-b3lyp_6-31+g(d).qchem.inp (generated)

006115285.td-b3lyp_6-31+g(d).gjf (generated)

006115285.td-b3lyp_6-31+g(d).firefly.inp (generated)

006115285.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006115285.mol 006115285.PUBCHEM 006115285.mol (via Jmol)
006115325.b3lyp_6-31g(d).inp

006115325.b3lyp_6-31g(d).qchem.inp (generated)

006115325.b3lyp_6-31g(d).gjf (generated)

006115325.b3lyp_6-31g(d).firefly.inp (generated)

006115325.b3lyp_6-31g(d).smash.inp (generated)

006115325.b3lyp_6-31g(d).nwchem.inp (generated) 006115325.b3lyp_6-31g(d).log.xz 006115325.td-b3lyp_6-31g+(d).inp 006115325.td-b3lyp_6-31g+(d).log.xz

006115325.td-b3lyp_6-31+g(d).qchem.inp (generated)

006115325.td-b3lyp_6-31+g(d).gjf (generated)

006115325.td-b3lyp_6-31+g(d).firefly.inp (generated)

006115325.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006115325.mol 006115325.PUBCHEM 006115325.mol (via Jmol)
006115411.b3lyp_6-31g(d).inp

006115411.b3lyp_6-31g(d).qchem.inp (generated)

006115411.b3lyp_6-31g(d).gjf (generated)

006115411.b3lyp_6-31g(d).firefly.inp (generated)

006115411.b3lyp_6-31g(d).smash.inp (generated)

006115411.b3lyp_6-31g(d).nwchem.inp (generated) 006115411.b3lyp_6-31g(d).log.xz 006115411.td-b3lyp_6-31g+(d).inp 006115411.td-b3lyp_6-31g+(d).log.xz

006115411.td-b3lyp_6-31+g(d).qchem.inp (generated)

006115411.td-b3lyp_6-31+g(d).gjf (generated)

006115411.td-b3lyp_6-31+g(d).firefly.inp (generated)

006115411.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006115411.mol 006115411.PUBCHEM 006115411.mol (via Jmol)
006115436.b3lyp_6-31g(d).inp

006115436.b3lyp_6-31g(d).qchem.inp (generated)

006115436.b3lyp_6-31g(d).gjf (generated)

006115436.b3lyp_6-31g(d).firefly.inp (generated)

006115436.b3lyp_6-31g(d).smash.inp (generated)

006115436.b3lyp_6-31g(d).nwchem.inp (generated) 006115436.b3lyp_6-31g(d).log.xz 006115436.td-b3lyp_6-31g+(d).inp 006115436.td-b3lyp_6-31g+(d).log.xz

006115436.td-b3lyp_6-31+g(d).qchem.inp (generated)

006115436.td-b3lyp_6-31+g(d).gjf (generated)

006115436.td-b3lyp_6-31+g(d).firefly.inp (generated)

006115436.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006115436.mol 006115436.PUBCHEM 006115436.mol (via Jmol)
006115554.b3lyp_6-31g(d).inp

006115554.b3lyp_6-31g(d).qchem.inp (generated)

006115554.b3lyp_6-31g(d).gjf (generated)

006115554.b3lyp_6-31g(d).firefly.inp (generated)

006115554.b3lyp_6-31g(d).smash.inp (generated)

006115554.b3lyp_6-31g(d).nwchem.inp (generated) 006115554.b3lyp_6-31g(d).log.xz 006115554.td-b3lyp_6-31g+(d).inp 006115554.td-b3lyp_6-31g+(d).log.xz

006115554.td-b3lyp_6-31+g(d).qchem.inp (generated)

006115554.td-b3lyp_6-31+g(d).gjf (generated)

006115554.td-b3lyp_6-31+g(d).firefly.inp (generated)

006115554.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006115554.mol 006115554.PUBCHEM 006115554.mol (via Jmol)
006115582.b3lyp_6-31g(d).inp

006115582.b3lyp_6-31g(d).qchem.inp (generated)

006115582.b3lyp_6-31g(d).gjf (generated)

006115582.b3lyp_6-31g(d).firefly.inp (generated)

006115582.b3lyp_6-31g(d).smash.inp (generated)

006115582.b3lyp_6-31g(d).nwchem.inp (generated) 006115582.b3lyp_6-31g(d).log.xz 006115582.td-b3lyp_6-31g+(d).inp 006115582.td-b3lyp_6-31g+(d).log.xz

006115582.td-b3lyp_6-31+g(d).qchem.inp (generated)

006115582.td-b3lyp_6-31+g(d).gjf (generated)

006115582.td-b3lyp_6-31+g(d).firefly.inp (generated)

006115582.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006115582.mol 006115582.PUBCHEM 006115582.mol (via Jmol)
006115689.b3lyp_6-31g(d).inp

006115689.b3lyp_6-31g(d).qchem.inp (generated)

006115689.b3lyp_6-31g(d).gjf (generated)

006115689.b3lyp_6-31g(d).firefly.inp (generated)

006115689.b3lyp_6-31g(d).smash.inp (generated)

006115689.b3lyp_6-31g(d).nwchem.inp (generated) 006115689.b3lyp_6-31g(d).log.xz 006115689.td-b3lyp_6-31g+(d).inp 006115689.td-b3lyp_6-31g+(d).log.xz

006115689.td-b3lyp_6-31+g(d).qchem.inp (generated)

006115689.td-b3lyp_6-31+g(d).gjf (generated)

006115689.td-b3lyp_6-31+g(d).firefly.inp (generated)

006115689.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006115689.mol 006115689.PUBCHEM 006115689.mol (via Jmol)
006115690.b3lyp_6-31g(d).inp

006115690.b3lyp_6-31g(d).qchem.inp (generated)

006115690.b3lyp_6-31g(d).gjf (generated)

006115690.b3lyp_6-31g(d).firefly.inp (generated)

006115690.b3lyp_6-31g(d).smash.inp (generated)

006115690.b3lyp_6-31g(d).nwchem.inp (generated) 006115690.b3lyp_6-31g(d).log.xz 006115690.td-b3lyp_6-31g+(d).inp 006115690.td-b3lyp_6-31g+(d).log.xz

006115690.td-b3lyp_6-31+g(d).qchem.inp (generated)

006115690.td-b3lyp_6-31+g(d).gjf (generated)

006115690.td-b3lyp_6-31+g(d).firefly.inp (generated)

006115690.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006115690.mol 006115690.PUBCHEM 006115690.mol (via Jmol)
006115779.b3lyp_6-31g(d).inp

006115779.b3lyp_6-31g(d).qchem.inp (generated)

006115779.b3lyp_6-31g(d).gjf (generated)

006115779.b3lyp_6-31g(d).firefly.inp (generated)

006115779.b3lyp_6-31g(d).smash.inp (generated)

006115779.b3lyp_6-31g(d).nwchem.inp (generated) 006115779.b3lyp_6-31g(d).log.xz 006115779.td-b3lyp_6-31g+(d).inp 006115779.td-b3lyp_6-31g+(d).log.xz

006115779.td-b3lyp_6-31+g(d).qchem.inp (generated)

006115779.td-b3lyp_6-31+g(d).gjf (generated)

006115779.td-b3lyp_6-31+g(d).firefly.inp (generated)

006115779.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006115779.mol 006115779.PUBCHEM 006115779.mol (via Jmol)
006115823.b3lyp_6-31g(d).inp

006115823.b3lyp_6-31g(d).qchem.inp (generated)

006115823.b3lyp_6-31g(d).gjf (generated)

006115823.b3lyp_6-31g(d).firefly.inp (generated)

006115823.b3lyp_6-31g(d).smash.inp (generated)

006115823.b3lyp_6-31g(d).nwchem.inp (generated) 006115823.b3lyp_6-31g(d).log.xz 006115823.td-b3lyp_6-31g+(d).inp 006115823.td-b3lyp_6-31g+(d).log.xz

006115823.td-b3lyp_6-31+g(d).qchem.inp (generated)

006115823.td-b3lyp_6-31+g(d).gjf (generated)

006115823.td-b3lyp_6-31+g(d).firefly.inp (generated)

006115823.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006115823.mol 006115823.PUBCHEM 006115823.mol (via Jmol)
006115828.b3lyp_6-31g(d).inp

006115828.b3lyp_6-31g(d).qchem.inp (generated)

006115828.b3lyp_6-31g(d).gjf (generated)

006115828.b3lyp_6-31g(d).firefly.inp (generated)

006115828.b3lyp_6-31g(d).smash.inp (generated)

006115828.b3lyp_6-31g(d).nwchem.inp (generated) 006115828.b3lyp_6-31g(d).log.xz 006115828.td-b3lyp_6-31g+(d).inp 006115828.td-b3lyp_6-31g+(d).log.xz

006115828.td-b3lyp_6-31+g(d).qchem.inp (generated)

006115828.td-b3lyp_6-31+g(d).gjf (generated)

006115828.td-b3lyp_6-31+g(d).firefly.inp (generated)

006115828.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006115828.mol 006115828.PUBCHEM 006115828.mol (via Jmol)
006115855.b3lyp_6-31g(d).inp

006115855.b3lyp_6-31g(d).qchem.inp (generated)

006115855.b3lyp_6-31g(d).gjf (generated)

006115855.b3lyp_6-31g(d).firefly.inp (generated)

006115855.b3lyp_6-31g(d).smash.inp (generated)

006115855.b3lyp_6-31g(d).nwchem.inp (generated) 006115855.b3lyp_6-31g(d).log.xz 006115855.mol 006115855.PUBCHEM 006115855.mol (via Jmol)
006115878.b3lyp_6-31g(d).inp

006115878.b3lyp_6-31g(d).qchem.inp (generated)

006115878.b3lyp_6-31g(d).gjf (generated)

006115878.b3lyp_6-31g(d).firefly.inp (generated)

006115878.b3lyp_6-31g(d).smash.inp (generated)

006115878.b3lyp_6-31g(d).nwchem.inp (generated) 006115878.b3lyp_6-31g(d).log.xz 006115878.td-b3lyp_6-31g+(d).inp 006115878.td-b3lyp_6-31g+(d).log.xz

006115878.td-b3lyp_6-31+g(d).qchem.inp (generated)

006115878.td-b3lyp_6-31+g(d).gjf (generated)

006115878.td-b3lyp_6-31+g(d).firefly.inp (generated)

006115878.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006115878.mol 006115878.PUBCHEM 006115878.mol (via Jmol)
006115911.b3lyp_6-31g(d).inp

006115911.b3lyp_6-31g(d).qchem.inp (generated)

006115911.b3lyp_6-31g(d).gjf (generated)

006115911.b3lyp_6-31g(d).firefly.inp (generated)

006115911.b3lyp_6-31g(d).smash.inp (generated)

006115911.b3lyp_6-31g(d).nwchem.inp (generated) 006115911.b3lyp_6-31g(d).log.xz 006115911.td-b3lyp_6-31g+(d).inp 006115911.td-b3lyp_6-31g+(d).log.xz

006115911.td-b3lyp_6-31+g(d).qchem.inp (generated)

006115911.td-b3lyp_6-31+g(d).gjf (generated)

006115911.td-b3lyp_6-31+g(d).firefly.inp (generated)

006115911.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006115911.mol 006115911.PUBCHEM 006115911.mol (via Jmol)
006115928.b3lyp_6-31g(d).inp

006115928.b3lyp_6-31g(d).qchem.inp (generated)

006115928.b3lyp_6-31g(d).gjf (generated)

006115928.b3lyp_6-31g(d).firefly.inp (generated)

006115928.b3lyp_6-31g(d).smash.inp (generated)

006115928.b3lyp_6-31g(d).nwchem.inp (generated) 006115928.b3lyp_6-31g(d).log.xz 006115928.td-b3lyp_6-31g+(d).inp 006115928.td-b3lyp_6-31g+(d).log.xz

006115928.td-b3lyp_6-31+g(d).qchem.inp (generated)

006115928.td-b3lyp_6-31+g(d).gjf (generated)

006115928.td-b3lyp_6-31+g(d).firefly.inp (generated)

006115928.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006115928.mol 006115928.PUBCHEM 006115928.mol (via Jmol)
006115942.b3lyp_6-31g(d).inp

006115942.b3lyp_6-31g(d).qchem.inp (generated)

006115942.b3lyp_6-31g(d).gjf (generated)

006115942.b3lyp_6-31g(d).firefly.inp (generated)

006115942.b3lyp_6-31g(d).smash.inp (generated)

006115942.b3lyp_6-31g(d).nwchem.inp (generated) 006115942.b3lyp_6-31g(d).log.xz 006115942.td-b3lyp_6-31g+(d).inp 006115942.td-b3lyp_6-31g+(d).log.xz

006115942.td-b3lyp_6-31+g(d).qchem.inp (generated)

006115942.td-b3lyp_6-31+g(d).gjf (generated)

006115942.td-b3lyp_6-31+g(d).firefly.inp (generated)

006115942.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006115942.mol 006115942.PUBCHEM 006115942.mol (via Jmol)
006116023.b3lyp_6-31g(d).inp

006116023.b3lyp_6-31g(d).qchem.inp (generated)

006116023.b3lyp_6-31g(d).gjf (generated)

006116023.b3lyp_6-31g(d).firefly.inp (generated)

006116023.b3lyp_6-31g(d).smash.inp (generated)

006116023.b3lyp_6-31g(d).nwchem.inp (generated) 006116023.b3lyp_6-31g(d).log.xz 006116023.td-b3lyp_6-31g+(d).inp 006116023.td-b3lyp_6-31g+(d).log.xz

006116023.td-b3lyp_6-31+g(d).qchem.inp (generated)

006116023.td-b3lyp_6-31+g(d).gjf (generated)

006116023.td-b3lyp_6-31+g(d).firefly.inp (generated)

006116023.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006116023.mol 006116023.PUBCHEM 006116023.mol (via Jmol)
006116096.b3lyp_6-31g(d).inp

006116096.b3lyp_6-31g(d).qchem.inp (generated)

006116096.b3lyp_6-31g(d).gjf (generated)

006116096.b3lyp_6-31g(d).firefly.inp (generated)

006116096.b3lyp_6-31g(d).smash.inp (generated)

006116096.b3lyp_6-31g(d).nwchem.inp (generated) 006116096.b3lyp_6-31g(d).log.xz 006116096.td-b3lyp_6-31g+(d).inp 006116096.td-b3lyp_6-31g+(d).log.xz

006116096.td-b3lyp_6-31+g(d).qchem.inp (generated)

006116096.td-b3lyp_6-31+g(d).gjf (generated)

006116096.td-b3lyp_6-31+g(d).firefly.inp (generated)

006116096.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006116096.mol 006116096.PUBCHEM 006116096.mol (via Jmol)
006116107.b3lyp_6-31g(d).inp

006116107.b3lyp_6-31g(d).qchem.inp (generated)

006116107.b3lyp_6-31g(d).gjf (generated)

006116107.b3lyp_6-31g(d).firefly.inp (generated)

006116107.b3lyp_6-31g(d).smash.inp (generated)

006116107.b3lyp_6-31g(d).nwchem.inp (generated) 006116107.b3lyp_6-31g(d).log.xz 006116107.td-b3lyp_6-31g+(d).inp 006116107.td-b3lyp_6-31g+(d).log.xz

006116107.td-b3lyp_6-31+g(d).qchem.inp (generated)

006116107.td-b3lyp_6-31+g(d).gjf (generated)

006116107.td-b3lyp_6-31+g(d).firefly.inp (generated)

006116107.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006116107.mol 006116107.PUBCHEM 006116107.mol (via Jmol)
006116235.b3lyp_6-31g(d).inp

006116235.b3lyp_6-31g(d).qchem.inp (generated)

006116235.b3lyp_6-31g(d).gjf (generated)

006116235.b3lyp_6-31g(d).firefly.inp (generated)

006116235.b3lyp_6-31g(d).smash.inp (generated)

006116235.b3lyp_6-31g(d).nwchem.inp (generated) 006116235.b3lyp_6-31g(d).log.xz 006116235.mol 006116235.PUBCHEM 006116235.mol (via Jmol)
006116242.b3lyp_6-31g(d).inp

006116242.b3lyp_6-31g(d).qchem.inp (generated)

006116242.b3lyp_6-31g(d).gjf (generated)

006116242.b3lyp_6-31g(d).firefly.inp (generated)

006116242.b3lyp_6-31g(d).smash.inp (generated)

006116242.b3lyp_6-31g(d).nwchem.inp (generated) 006116242.b3lyp_6-31g(d).log.xz 006116242.td-b3lyp_6-31g+(d).inp 006116242.td-b3lyp_6-31g+(d).log.xz

006116242.td-b3lyp_6-31+g(d).qchem.inp (generated)

006116242.td-b3lyp_6-31+g(d).gjf (generated)

006116242.td-b3lyp_6-31+g(d).firefly.inp (generated)

006116242.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006116242.mol 006116242.PUBCHEM 006116242.mol (via Jmol)
006116474.b3lyp_6-31g(d).inp

006116474.b3lyp_6-31g(d).qchem.inp (generated)

006116474.b3lyp_6-31g(d).gjf (generated)

006116474.b3lyp_6-31g(d).firefly.inp (generated)

006116474.b3lyp_6-31g(d).smash.inp (generated)

006116474.b3lyp_6-31g(d).nwchem.inp (generated) 006116474.b3lyp_6-31g(d).log.xz 006116474.td-b3lyp_6-31g+(d).inp 006116474.td-b3lyp_6-31g+(d).log.xz

006116474.td-b3lyp_6-31+g(d).qchem.inp (generated)

006116474.td-b3lyp_6-31+g(d).gjf (generated)

006116474.td-b3lyp_6-31+g(d).firefly.inp (generated)

006116474.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006116474.mol 006116474.PUBCHEM 006116474.mol (via Jmol)
006116477.b3lyp_6-31g(d).inp

006116477.b3lyp_6-31g(d).qchem.inp (generated)

006116477.b3lyp_6-31g(d).gjf (generated)

006116477.b3lyp_6-31g(d).firefly.inp (generated)

006116477.b3lyp_6-31g(d).smash.inp (generated)

006116477.b3lyp_6-31g(d).nwchem.inp (generated) 006116477.b3lyp_6-31g(d).log.xz 006116477.td-b3lyp_6-31g+(d).inp 006116477.td-b3lyp_6-31g+(d).log.xz

006116477.td-b3lyp_6-31+g(d).qchem.inp (generated)

006116477.td-b3lyp_6-31+g(d).gjf (generated)

006116477.td-b3lyp_6-31+g(d).firefly.inp (generated)

006116477.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006116477.mol 006116477.PUBCHEM 006116477.mol (via Jmol)
006116576.b3lyp_6-31g(d).inp

006116576.b3lyp_6-31g(d).qchem.inp (generated)

006116576.b3lyp_6-31g(d).gjf (generated)

006116576.b3lyp_6-31g(d).firefly.inp (generated)

006116576.b3lyp_6-31g(d).smash.inp (generated)

006116576.b3lyp_6-31g(d).nwchem.inp (generated) 006116576.b3lyp_6-31g(d).log.xz 006116576.td-b3lyp_6-31g+(d).inp 006116576.td-b3lyp_6-31g+(d).log.xz

006116576.td-b3lyp_6-31+g(d).qchem.inp (generated)

006116576.td-b3lyp_6-31+g(d).gjf (generated)

006116576.td-b3lyp_6-31+g(d).firefly.inp (generated)

006116576.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006116576.mol 006116576.PUBCHEM 006116576.mol (via Jmol)
006116794.b3lyp_6-31g(d).inp

006116794.b3lyp_6-31g(d).qchem.inp (generated)

006116794.b3lyp_6-31g(d).gjf (generated)

006116794.b3lyp_6-31g(d).firefly.inp (generated)

006116794.b3lyp_6-31g(d).smash.inp (generated)

006116794.b3lyp_6-31g(d).nwchem.inp (generated) 006116794.b3lyp_6-31g(d).log.xz 006116794.td-b3lyp_6-31g+(d).inp 006116794.td-b3lyp_6-31g+(d).log.xz

006116794.td-b3lyp_6-31+g(d).qchem.inp (generated)

006116794.td-b3lyp_6-31+g(d).gjf (generated)

006116794.td-b3lyp_6-31+g(d).firefly.inp (generated)

006116794.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006116794.mol 006116794.PUBCHEM 006116794.mol (via Jmol)
006116919.b3lyp_6-31g(d).inp

006116919.b3lyp_6-31g(d).qchem.inp (generated)

006116919.b3lyp_6-31g(d).gjf (generated)

006116919.b3lyp_6-31g(d).firefly.inp (generated)

006116919.b3lyp_6-31g(d).smash.inp (generated)

006116919.b3lyp_6-31g(d).nwchem.inp (generated) 006116919.b3lyp_6-31g(d).log.xz 006116919.td-b3lyp_6-31g+(d).inp 006116919.td-b3lyp_6-31g+(d).log.xz

006116919.td-b3lyp_6-31+g(d).qchem.inp (generated)

006116919.td-b3lyp_6-31+g(d).gjf (generated)

006116919.td-b3lyp_6-31+g(d).firefly.inp (generated)

006116919.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006116919.mol 006116919.PUBCHEM 006116919.mol (via Jmol)
006116955.b3lyp_6-31g(d).inp

006116955.b3lyp_6-31g(d).qchem.inp (generated)

006116955.b3lyp_6-31g(d).gjf (generated)

006116955.b3lyp_6-31g(d).firefly.inp (generated)

006116955.b3lyp_6-31g(d).smash.inp (generated)

006116955.b3lyp_6-31g(d).nwchem.inp (generated) 006116955.b3lyp_6-31g(d).log.xz 006116955.td-b3lyp_6-31g+(d).inp 006116955.td-b3lyp_6-31g+(d).log.xz

006116955.td-b3lyp_6-31+g(d).qchem.inp (generated)

006116955.td-b3lyp_6-31+g(d).gjf (generated)

006116955.td-b3lyp_6-31+g(d).firefly.inp (generated)

006116955.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006116955.mol 006116955.PUBCHEM 006116955.mol (via Jmol)
006117102.b3lyp_6-31g(d).inp

006117102.b3lyp_6-31g(d).qchem.inp (generated)

006117102.b3lyp_6-31g(d).gjf (generated)

006117102.b3lyp_6-31g(d).firefly.inp (generated)

006117102.b3lyp_6-31g(d).smash.inp (generated)

006117102.b3lyp_6-31g(d).nwchem.inp (generated) 006117102.b3lyp_6-31g(d).log.xz 006117102.td-b3lyp_6-31g+(d).inp 006117102.td-b3lyp_6-31g+(d).log.xz

006117102.td-b3lyp_6-31+g(d).qchem.inp (generated)

006117102.td-b3lyp_6-31+g(d).gjf (generated)

006117102.td-b3lyp_6-31+g(d).firefly.inp (generated)

006117102.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006117102.mol 006117102.PUBCHEM 006117102.mol (via Jmol)
006117145.b3lyp_6-31g(d).inp

006117145.b3lyp_6-31g(d).qchem.inp (generated)

006117145.b3lyp_6-31g(d).gjf (generated)

006117145.b3lyp_6-31g(d).firefly.inp (generated)

006117145.b3lyp_6-31g(d).smash.inp (generated)

006117145.b3lyp_6-31g(d).nwchem.inp (generated) 006117145.b3lyp_6-31g(d).log.xz 006117145.td-b3lyp_6-31g+(d).inp 006117145.td-b3lyp_6-31g+(d).log.xz

006117145.td-b3lyp_6-31+g(d).qchem.inp (generated)

006117145.td-b3lyp_6-31+g(d).gjf (generated)

006117145.td-b3lyp_6-31+g(d).firefly.inp (generated)

006117145.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006117145.mol 006117145.PUBCHEM 006117145.mol (via Jmol)
006117150.b3lyp_6-31g(d).inp

006117150.b3lyp_6-31g(d).qchem.inp (generated)

006117150.b3lyp_6-31g(d).gjf (generated)

006117150.b3lyp_6-31g(d).firefly.inp (generated)

006117150.b3lyp_6-31g(d).smash.inp (generated)

006117150.b3lyp_6-31g(d).nwchem.inp (generated) 006117150.b3lyp_6-31g(d).log.xz 006117150.td-b3lyp_6-31g+(d).inp 006117150.td-b3lyp_6-31g+(d).log.xz

006117150.td-b3lyp_6-31+g(d).qchem.inp (generated)

006117150.td-b3lyp_6-31+g(d).gjf (generated)

006117150.td-b3lyp_6-31+g(d).firefly.inp (generated)

006117150.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006117150.mol 006117150.PUBCHEM 006117150.mol (via Jmol)
006118180.b3lyp_6-31g(d).inp

006118180.b3lyp_6-31g(d).qchem.inp (generated)

006118180.b3lyp_6-31g(d).gjf (generated)

006118180.b3lyp_6-31g(d).firefly.inp (generated)

006118180.b3lyp_6-31g(d).smash.inp (generated)

006118180.b3lyp_6-31g(d).nwchem.inp (generated) 006118180.b3lyp_6-31g(d).log.xz 006118180.td-b3lyp_6-31g+(d).inp 006118180.td-b3lyp_6-31g+(d).log.xz

006118180.td-b3lyp_6-31+g(d).qchem.inp (generated)

006118180.td-b3lyp_6-31+g(d).gjf (generated)

006118180.td-b3lyp_6-31+g(d).firefly.inp (generated)

006118180.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006118180.mol 006118180.PUBCHEM 006118180.mol (via Jmol)
006118271.b3lyp_6-31g(d).inp

006118271.b3lyp_6-31g(d).qchem.inp (generated)

006118271.b3lyp_6-31g(d).gjf (generated)

006118271.b3lyp_6-31g(d).firefly.inp (generated)

006118271.b3lyp_6-31g(d).smash.inp (generated)

006118271.b3lyp_6-31g(d).nwchem.inp (generated) 006118271.b3lyp_6-31g(d).log.xz 006118271.mol 006118271.PUBCHEM 006118271.mol (via Jmol)
006118420.b3lyp_6-31g(d).inp

006118420.b3lyp_6-31g(d).qchem.inp (generated)

006118420.b3lyp_6-31g(d).gjf (generated)

006118420.b3lyp_6-31g(d).firefly.inp (generated)

006118420.b3lyp_6-31g(d).smash.inp (generated)

006118420.b3lyp_6-31g(d).nwchem.inp (generated) 006118420.b3lyp_6-31g(d).log.xz 006118420.td-b3lyp_6-31g+(d).inp 006118420.td-b3lyp_6-31g+(d).log.xz

006118420.td-b3lyp_6-31+g(d).qchem.inp (generated)

006118420.td-b3lyp_6-31+g(d).gjf (generated)

006118420.td-b3lyp_6-31+g(d).firefly.inp (generated)

006118420.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006118420.mol 006118420.PUBCHEM 006118420.mol (via Jmol)
006118800.b3lyp_6-31g(d).inp

006118800.b3lyp_6-31g(d).qchem.inp (generated)

006118800.b3lyp_6-31g(d).gjf (generated)

006118800.b3lyp_6-31g(d).firefly.inp (generated)

006118800.b3lyp_6-31g(d).smash.inp (generated)

006118800.b3lyp_6-31g(d).nwchem.inp (generated) 006118800.b3lyp_6-31g(d).log.xz 006118800.mol 006118800.PUBCHEM 006118800.mol (via Jmol)
006118974.b3lyp_6-31g(d).inp

006118974.b3lyp_6-31g(d).qchem.inp (generated)

006118974.b3lyp_6-31g(d).gjf (generated)

006118974.b3lyp_6-31g(d).firefly.inp (generated)

006118974.b3lyp_6-31g(d).smash.inp (generated)

006118974.b3lyp_6-31g(d).nwchem.inp (generated) 006118974.b3lyp_6-31g(d).log.xz 006118974.td-b3lyp_6-31g+(d).inp 006118974.td-b3lyp_6-31g+(d).log.xz

006118974.td-b3lyp_6-31+g(d).qchem.inp (generated)

006118974.td-b3lyp_6-31+g(d).gjf (generated)

006118974.td-b3lyp_6-31+g(d).firefly.inp (generated)

006118974.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006118974.mol 006118974.PUBCHEM 006118974.mol (via Jmol)
006119036.b3lyp_6-31g(d).inp

006119036.b3lyp_6-31g(d).qchem.inp (generated)

006119036.b3lyp_6-31g(d).gjf (generated)

006119036.b3lyp_6-31g(d).firefly.inp (generated)

006119036.b3lyp_6-31g(d).smash.inp (generated)

006119036.b3lyp_6-31g(d).nwchem.inp (generated) 006119036.b3lyp_6-31g(d).log.xz 006119036.td-b3lyp_6-31g+(d).inp 006119036.td-b3lyp_6-31g+(d).log.xz

006119036.td-b3lyp_6-31+g(d).qchem.inp (generated)

006119036.td-b3lyp_6-31+g(d).gjf (generated)

006119036.td-b3lyp_6-31+g(d).firefly.inp (generated)

006119036.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006119036.mol 006119036.PUBCHEM 006119036.mol (via Jmol)
006119037.b3lyp_6-31g(d).inp

006119037.b3lyp_6-31g(d).qchem.inp (generated)

006119037.b3lyp_6-31g(d).gjf (generated)

006119037.b3lyp_6-31g(d).firefly.inp (generated)

006119037.b3lyp_6-31g(d).smash.inp (generated)

006119037.b3lyp_6-31g(d).nwchem.inp (generated) 006119037.b3lyp_6-31g(d).log.xz 006119037.td-b3lyp_6-31g+(d).inp 006119037.td-b3lyp_6-31g+(d).log.xz

006119037.td-b3lyp_6-31+g(d).qchem.inp (generated)

006119037.td-b3lyp_6-31+g(d).gjf (generated)

006119037.td-b3lyp_6-31+g(d).firefly.inp (generated)

006119037.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006119037.mol 006119037.PUBCHEM 006119037.mol (via Jmol)
006119038.b3lyp_6-31g(d).inp

006119038.b3lyp_6-31g(d).qchem.inp (generated)

006119038.b3lyp_6-31g(d).gjf (generated)

006119038.b3lyp_6-31g(d).firefly.inp (generated)

006119038.b3lyp_6-31g(d).smash.inp (generated)

006119038.b3lyp_6-31g(d).nwchem.inp (generated) 006119038.b3lyp_6-31g(d).log.xz 006119038.td-b3lyp_6-31g+(d).inp 006119038.td-b3lyp_6-31g+(d).log.xz

006119038.td-b3lyp_6-31+g(d).qchem.inp (generated)

006119038.td-b3lyp_6-31+g(d).gjf (generated)

006119038.td-b3lyp_6-31+g(d).firefly.inp (generated)

006119038.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006119038.mol 006119038.PUBCHEM 006119038.mol (via Jmol)
006119041.b3lyp_6-31g(d).inp

006119041.b3lyp_6-31g(d).qchem.inp (generated)

006119041.b3lyp_6-31g(d).gjf (generated)

006119041.b3lyp_6-31g(d).firefly.inp (generated)

006119041.b3lyp_6-31g(d).smash.inp (generated)

006119041.b3lyp_6-31g(d).nwchem.inp (generated) 006119041.b3lyp_6-31g(d).log.xz 006119041.td-b3lyp_6-31g+(d).inp 006119041.td-b3lyp_6-31g+(d).log.xz

006119041.td-b3lyp_6-31+g(d).qchem.inp (generated)

006119041.td-b3lyp_6-31+g(d).gjf (generated)

006119041.td-b3lyp_6-31+g(d).firefly.inp (generated)

006119041.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006119041.mol 006119041.PUBCHEM 006119041.mol (via Jmol)
006119144.b3lyp_6-31g(d).inp

006119144.b3lyp_6-31g(d).qchem.inp (generated)

006119144.b3lyp_6-31g(d).gjf (generated)

006119144.b3lyp_6-31g(d).firefly.inp (generated)

006119144.b3lyp_6-31g(d).smash.inp (generated)

006119144.b3lyp_6-31g(d).nwchem.inp (generated) 006119144.b3lyp_6-31g(d).log.xz 006119144.td-b3lyp_6-31g+(d).inp 006119144.td-b3lyp_6-31g+(d).log.xz

006119144.td-b3lyp_6-31+g(d).qchem.inp (generated)

006119144.td-b3lyp_6-31+g(d).gjf (generated)

006119144.td-b3lyp_6-31+g(d).firefly.inp (generated)

006119144.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006119144.mol 006119144.PUBCHEM 006119144.mol (via Jmol)
006119209.b3lyp_6-31g(d).inp

006119209.b3lyp_6-31g(d).qchem.inp (generated)

006119209.b3lyp_6-31g(d).gjf (generated)

006119209.b3lyp_6-31g(d).firefly.inp (generated)

006119209.b3lyp_6-31g(d).smash.inp (generated)

006119209.b3lyp_6-31g(d).nwchem.inp (generated) 006119209.b3lyp_6-31g(d).log.xz 006119209.td-b3lyp_6-31g+(d).inp 006119209.td-b3lyp_6-31g+(d).log.xz

006119209.td-b3lyp_6-31+g(d).qchem.inp (generated)

006119209.td-b3lyp_6-31+g(d).gjf (generated)

006119209.td-b3lyp_6-31+g(d).firefly.inp (generated)

006119209.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006119209.mol 006119209.PUBCHEM 006119209.mol (via Jmol)
006119376.b3lyp_6-31g(d).inp

006119376.b3lyp_6-31g(d).qchem.inp (generated)

006119376.b3lyp_6-31g(d).gjf (generated)

006119376.b3lyp_6-31g(d).firefly.inp (generated)

006119376.b3lyp_6-31g(d).smash.inp (generated)

006119376.b3lyp_6-31g(d).nwchem.inp (generated) 006119376.b3lyp_6-31g(d).log.xz 006119376.mol 006119376.PUBCHEM 006119376.mol (via Jmol)
006119966.b3lyp_6-31g(d).inp

006119966.b3lyp_6-31g(d).qchem.inp (generated)

006119966.b3lyp_6-31g(d).gjf (generated)

006119966.b3lyp_6-31g(d).firefly.inp (generated)

006119966.b3lyp_6-31g(d).smash.inp (generated)

006119966.b3lyp_6-31g(d).nwchem.inp (generated) 006119966.b3lyp_6-31g(d).log.xz 006119966.td-b3lyp_6-31g+(d).inp 006119966.td-b3lyp_6-31g+(d).log.xz

006119966.td-b3lyp_6-31+g(d).qchem.inp (generated)

006119966.td-b3lyp_6-31+g(d).gjf (generated)

006119966.td-b3lyp_6-31+g(d).firefly.inp (generated)

006119966.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006119966.mol 006119966.PUBCHEM 006119966.mol (via Jmol)
006120722.b3lyp_6-31g(d).inp

006120722.b3lyp_6-31g(d).qchem.inp (generated)

006120722.b3lyp_6-31g(d).gjf (generated)

006120722.b3lyp_6-31g(d).firefly.inp (generated)

006120722.b3lyp_6-31g(d).smash.inp (generated)

006120722.b3lyp_6-31g(d).nwchem.inp (generated) 006120722.b3lyp_6-31g(d).log.xz 006120722.td-b3lyp_6-31g+(d).inp 006120722.td-b3lyp_6-31g+(d).log.xz

006120722.td-b3lyp_6-31+g(d).qchem.inp (generated)

006120722.td-b3lyp_6-31+g(d).gjf (generated)

006120722.td-b3lyp_6-31+g(d).firefly.inp (generated)

006120722.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006120722.mol 006120722.PUBCHEM 006120722.mol (via Jmol)
006121908.b3lyp_6-31g(d).inp

006121908.b3lyp_6-31g(d).qchem.inp (generated)

006121908.b3lyp_6-31g(d).gjf (generated)

006121908.b3lyp_6-31g(d).firefly.inp (generated)

006121908.b3lyp_6-31g(d).smash.inp (generated)

006121908.b3lyp_6-31g(d).nwchem.inp (generated) 006121908.b3lyp_6-31g(d).log.xz 006121908.td-b3lyp_6-31g+(d).inp 006121908.td-b3lyp_6-31g+(d).log.xz

006121908.td-b3lyp_6-31+g(d).qchem.inp (generated)

006121908.td-b3lyp_6-31+g(d).gjf (generated)

006121908.td-b3lyp_6-31+g(d).firefly.inp (generated)

006121908.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006121908.mol 006121908.PUBCHEM 006121908.mol (via Jmol)
006121965.b3lyp_6-31g(d).inp

006121965.b3lyp_6-31g(d).qchem.inp (generated)

006121965.b3lyp_6-31g(d).gjf (generated)

006121965.b3lyp_6-31g(d).firefly.inp (generated)

006121965.b3lyp_6-31g(d).smash.inp (generated)

006121965.b3lyp_6-31g(d).nwchem.inp (generated) 006121965.b3lyp_6-31g(d).log.xz 006121965.td-b3lyp_6-31g+(d).inp 006121965.td-b3lyp_6-31g+(d).log.xz

006121965.td-b3lyp_6-31+g(d).qchem.inp (generated)

006121965.td-b3lyp_6-31+g(d).gjf (generated)

006121965.td-b3lyp_6-31+g(d).firefly.inp (generated)

006121965.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006121965.mol 006121965.PUBCHEM 006121965.mol (via Jmol)
006122349.b3lyp_6-31g(d).inp

006122349.b3lyp_6-31g(d).qchem.inp (generated)

006122349.b3lyp_6-31g(d).gjf (generated)

006122349.b3lyp_6-31g(d).firefly.inp (generated)

006122349.b3lyp_6-31g(d).smash.inp (generated)

006122349.b3lyp_6-31g(d).nwchem.inp (generated) 006122349.b3lyp_6-31g(d).log.xz 006122349.td-b3lyp_6-31g+(d).inp 006122349.td-b3lyp_6-31g+(d).log.xz

006122349.td-b3lyp_6-31+g(d).qchem.inp (generated)

006122349.td-b3lyp_6-31+g(d).gjf (generated)

006122349.td-b3lyp_6-31+g(d).firefly.inp (generated)

006122349.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006122349.mol 006122349.PUBCHEM 006122349.mol (via Jmol)
006122854.b3lyp_6-31g(d).inp

006122854.b3lyp_6-31g(d).qchem.inp (generated)

006122854.b3lyp_6-31g(d).gjf (generated)

006122854.b3lyp_6-31g(d).firefly.inp (generated)

006122854.b3lyp_6-31g(d).smash.inp (generated)

006122854.b3lyp_6-31g(d).nwchem.inp (generated) 006122854.b3lyp_6-31g(d).log.xz 006122854.mol 006122854.PUBCHEM 006122854.mol (via Jmol)
006122879.b3lyp_6-31g(d).inp

006122879.b3lyp_6-31g(d).qchem.inp (generated)

006122879.b3lyp_6-31g(d).gjf (generated)

006122879.b3lyp_6-31g(d).firefly.inp (generated)

006122879.b3lyp_6-31g(d).smash.inp (generated)

006122879.b3lyp_6-31g(d).nwchem.inp (generated) 006122879.b3lyp_6-31g(d).log.xz 006122879.td-b3lyp_6-31g+(d).inp 006122879.td-b3lyp_6-31g+(d).log.xz

006122879.td-b3lyp_6-31+g(d).qchem.inp (generated)

006122879.td-b3lyp_6-31+g(d).gjf (generated)

006122879.td-b3lyp_6-31+g(d).firefly.inp (generated)

006122879.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006122879.mol 006122879.PUBCHEM 006122879.mol (via Jmol)
006123005.b3lyp_6-31g(d).inp

006123005.b3lyp_6-31g(d).qchem.inp (generated)

006123005.b3lyp_6-31g(d).gjf (generated)

006123005.b3lyp_6-31g(d).firefly.inp (generated)

006123005.b3lyp_6-31g(d).smash.inp (generated)

006123005.b3lyp_6-31g(d).nwchem.inp (generated) 006123005.b3lyp_6-31g(d).log.xz 006123005.td-b3lyp_6-31g+(d).inp 006123005.td-b3lyp_6-31g+(d).log.xz

006123005.td-b3lyp_6-31+g(d).qchem.inp (generated)

006123005.td-b3lyp_6-31+g(d).gjf (generated)

006123005.td-b3lyp_6-31+g(d).firefly.inp (generated)

006123005.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006123005.mol 006123005.PUBCHEM 006123005.mol (via Jmol)
006123039.b3lyp_6-31g(d).inp

006123039.b3lyp_6-31g(d).qchem.inp (generated)

006123039.b3lyp_6-31g(d).gjf (generated)

006123039.b3lyp_6-31g(d).firefly.inp (generated)

006123039.b3lyp_6-31g(d).smash.inp (generated)

006123039.b3lyp_6-31g(d).nwchem.inp (generated) 006123039.b3lyp_6-31g(d).log.xz 006123039.td-b3lyp_6-31g+(d).inp 006123039.td-b3lyp_6-31g+(d).log.xz

006123039.td-b3lyp_6-31+g(d).qchem.inp (generated)

006123039.td-b3lyp_6-31+g(d).gjf (generated)

006123039.td-b3lyp_6-31+g(d).firefly.inp (generated)

006123039.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006123039.mol 006123039.PUBCHEM 006123039.mol (via Jmol)
006123042.b3lyp_6-31g(d).inp

006123042.b3lyp_6-31g(d).qchem.inp (generated)

006123042.b3lyp_6-31g(d).gjf (generated)

006123042.b3lyp_6-31g(d).firefly.inp (generated)

006123042.b3lyp_6-31g(d).smash.inp (generated)

006123042.b3lyp_6-31g(d).nwchem.inp (generated) 006123042.b3lyp_6-31g(d).log.xz 006123042.td-b3lyp_6-31g+(d).inp 006123042.td-b3lyp_6-31g+(d).log.xz

006123042.td-b3lyp_6-31+g(d).qchem.inp (generated)

006123042.td-b3lyp_6-31+g(d).gjf (generated)

006123042.td-b3lyp_6-31+g(d).firefly.inp (generated)

006123042.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006123042.mol 006123042.PUBCHEM 006123042.mol (via Jmol)
006123158.b3lyp_6-31g(d).inp

006123158.b3lyp_6-31g(d).qchem.inp (generated)

006123158.b3lyp_6-31g(d).gjf (generated)

006123158.b3lyp_6-31g(d).firefly.inp (generated)

006123158.b3lyp_6-31g(d).smash.inp (generated)

006123158.b3lyp_6-31g(d).nwchem.inp (generated) 006123158.b3lyp_6-31g(d).log.xz 006123158.mol 006123158.PUBCHEM 006123158.mol (via Jmol)
006123164.b3lyp_6-31g(d).inp

006123164.b3lyp_6-31g(d).qchem.inp (generated)

006123164.b3lyp_6-31g(d).gjf (generated)

006123164.b3lyp_6-31g(d).firefly.inp (generated)

006123164.b3lyp_6-31g(d).smash.inp (generated)

006123164.b3lyp_6-31g(d).nwchem.inp (generated) 006123164.b3lyp_6-31g(d).log.xz 006123164.mol 006123164.PUBCHEM 006123164.mol (via Jmol)
006123236.b3lyp_6-31g(d).inp

006123236.b3lyp_6-31g(d).qchem.inp (generated)

006123236.b3lyp_6-31g(d).gjf (generated)

006123236.b3lyp_6-31g(d).firefly.inp (generated)

006123236.b3lyp_6-31g(d).smash.inp (generated)

006123236.b3lyp_6-31g(d).nwchem.inp (generated) 006123236.b3lyp_6-31g(d).log.xz 006123236.td-b3lyp_6-31g+(d).inp 006123236.td-b3lyp_6-31g+(d).log.xz

006123236.td-b3lyp_6-31+g(d).qchem.inp (generated)

006123236.td-b3lyp_6-31+g(d).gjf (generated)

006123236.td-b3lyp_6-31+g(d).firefly.inp (generated)

006123236.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006123236.mol 006123236.PUBCHEM 006123236.mol (via Jmol)
006123338.b3lyp_6-31g(d).inp

006123338.b3lyp_6-31g(d).qchem.inp (generated)

006123338.b3lyp_6-31g(d).gjf (generated)

006123338.b3lyp_6-31g(d).firefly.inp (generated)

006123338.b3lyp_6-31g(d).smash.inp (generated)

006123338.b3lyp_6-31g(d).nwchem.inp (generated) 006123338.b3lyp_6-31g(d).log.xz 006123338.td-b3lyp_6-31g+(d).inp 006123338.td-b3lyp_6-31g+(d).log.xz

006123338.td-b3lyp_6-31+g(d).qchem.inp (generated)

006123338.td-b3lyp_6-31+g(d).gjf (generated)

006123338.td-b3lyp_6-31+g(d).firefly.inp (generated)

006123338.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006123338.mol 006123338.PUBCHEM 006123338.mol (via Jmol)
006124993.b3lyp_6-31g(d).inp

006124993.b3lyp_6-31g(d).qchem.inp (generated)

006124993.b3lyp_6-31g(d).gjf (generated)

006124993.b3lyp_6-31g(d).firefly.inp (generated)

006124993.b3lyp_6-31g(d).smash.inp (generated)

006124993.b3lyp_6-31g(d).nwchem.inp (generated) 006124993.b3lyp_6-31g(d).log.xz 006124993.td-b3lyp_6-31g+(d).inp 006124993.td-b3lyp_6-31g+(d).log.xz

006124993.td-b3lyp_6-31+g(d).qchem.inp (generated)

006124993.td-b3lyp_6-31+g(d).gjf (generated)

006124993.td-b3lyp_6-31+g(d).firefly.inp (generated)

006124993.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006124993.mol 006124993.PUBCHEM 006124993.mol (via Jmol)


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