Index of

Last updated : Thu Mar 23 01:58:55 JST 2017
Total : 58 (44) in this page
033508667.b3lyp_6-31g(d).inp

033508667.b3lyp_6-31g(d).qchem.inp (generated)

033508667.b3lyp_6-31g(d).gjf (generated)

033508667.b3lyp_6-31g(d).firefly.inp (generated)

033508667.b3lyp_6-31g(d).smash.inp (generated)

033508667.b3lyp_6-31g(d).nwchem.inp (generated) 033508667.b3lyp_6-31g(d).log.xz 033508667.td-b3lyp_6-31g+(d).inp 033508667.td-b3lyp_6-31g+(d).log.xz

033508667.td-b3lyp_6-31+g(d).qchem.inp (generated)

033508667.td-b3lyp_6-31+g(d).gjf (generated)

033508667.td-b3lyp_6-31+g(d).firefly.inp (generated)

033508667.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033508667.mol 033508667.PUBCHEM 033508667.mol (via Jmol)
033508687.b3lyp_6-31g(d).inp

033508687.b3lyp_6-31g(d).qchem.inp (generated)

033508687.b3lyp_6-31g(d).gjf (generated)

033508687.b3lyp_6-31g(d).firefly.inp (generated)

033508687.b3lyp_6-31g(d).smash.inp (generated)

033508687.b3lyp_6-31g(d).nwchem.inp (generated) 033508687.b3lyp_6-31g(d).log.xz 033508687.td-b3lyp_6-31g+(d).inp 033508687.td-b3lyp_6-31g+(d).log.xz

033508687.td-b3lyp_6-31+g(d).qchem.inp (generated)

033508687.td-b3lyp_6-31+g(d).gjf (generated)

033508687.td-b3lyp_6-31+g(d).firefly.inp (generated)

033508687.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033508687.mol 033508687.PUBCHEM 033508687.mol (via Jmol)
033509903.b3lyp_6-31g(d).inp

033509903.b3lyp_6-31g(d).qchem.inp (generated)

033509903.b3lyp_6-31g(d).gjf (generated)

033509903.b3lyp_6-31g(d).firefly.inp (generated)

033509903.b3lyp_6-31g(d).smash.inp (generated)

033509903.b3lyp_6-31g(d).nwchem.inp (generated) 033509903.b3lyp_6-31g(d).log.xz 033509903.mol 033509903.PUBCHEM 033509903.mol (via Jmol)
033510242.b3lyp_6-31g(d).inp

033510242.b3lyp_6-31g(d).qchem.inp (generated)

033510242.b3lyp_6-31g(d).gjf (generated)

033510242.b3lyp_6-31g(d).firefly.inp (generated)

033510242.b3lyp_6-31g(d).smash.inp (generated)

033510242.b3lyp_6-31g(d).nwchem.inp (generated) 033510242.b3lyp_6-31g(d).log.xz 033510242.td-b3lyp_6-31g+(d).inp 033510242.td-b3lyp_6-31g+(d).log.xz

033510242.td-b3lyp_6-31+g(d).qchem.inp (generated)

033510242.td-b3lyp_6-31+g(d).gjf (generated)

033510242.td-b3lyp_6-31+g(d).firefly.inp (generated)

033510242.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033510242.mol 033510242.PUBCHEM 033510242.mol (via Jmol)
033510490.b3lyp_6-31g(d).inp

033510490.b3lyp_6-31g(d).qchem.inp (generated)

033510490.b3lyp_6-31g(d).gjf (generated)

033510490.b3lyp_6-31g(d).firefly.inp (generated)

033510490.b3lyp_6-31g(d).smash.inp (generated)

033510490.b3lyp_6-31g(d).nwchem.inp (generated) 033510490.b3lyp_6-31g(d).log.xz 033510490.td-b3lyp_6-31g+(d).inp 033510490.td-b3lyp_6-31g+(d).log.xz

033510490.td-b3lyp_6-31+g(d).qchem.inp (generated)

033510490.td-b3lyp_6-31+g(d).gjf (generated)

033510490.td-b3lyp_6-31+g(d).firefly.inp (generated)

033510490.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033510490.mol 033510490.PUBCHEM 033510490.mol (via Jmol)
033510491.b3lyp_6-31g(d).inp

033510491.b3lyp_6-31g(d).qchem.inp (generated)

033510491.b3lyp_6-31g(d).gjf (generated)

033510491.b3lyp_6-31g(d).firefly.inp (generated)

033510491.b3lyp_6-31g(d).smash.inp (generated)

033510491.b3lyp_6-31g(d).nwchem.inp (generated) 033510491.b3lyp_6-31g(d).log.xz 033510491.td-b3lyp_6-31g+(d).inp 033510491.td-b3lyp_6-31g+(d).log.xz

033510491.td-b3lyp_6-31+g(d).qchem.inp (generated)

033510491.td-b3lyp_6-31+g(d).gjf (generated)

033510491.td-b3lyp_6-31+g(d).firefly.inp (generated)

033510491.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033510491.mol 033510491.PUBCHEM 033510491.mol (via Jmol)
033510513.b3lyp_6-31g(d).inp

033510513.b3lyp_6-31g(d).qchem.inp (generated)

033510513.b3lyp_6-31g(d).gjf (generated)

033510513.b3lyp_6-31g(d).firefly.inp (generated)

033510513.b3lyp_6-31g(d).smash.inp (generated)

033510513.b3lyp_6-31g(d).nwchem.inp (generated) 033510513.b3lyp_6-31g(d).log.xz 033510513.td-b3lyp_6-31g+(d).inp 033510513.td-b3lyp_6-31g+(d).log.xz

033510513.td-b3lyp_6-31+g(d).qchem.inp (generated)

033510513.td-b3lyp_6-31+g(d).gjf (generated)

033510513.td-b3lyp_6-31+g(d).firefly.inp (generated)

033510513.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033510513.mol 033510513.PUBCHEM 033510513.mol (via Jmol)
033510765.b3lyp_6-31g(d).inp

033510765.b3lyp_6-31g(d).qchem.inp (generated)

033510765.b3lyp_6-31g(d).gjf (generated)

033510765.b3lyp_6-31g(d).firefly.inp (generated)

033510765.b3lyp_6-31g(d).smash.inp (generated)

033510765.b3lyp_6-31g(d).nwchem.inp (generated) 033510765.b3lyp_6-31g(d).log.xz 033510765.td-b3lyp_6-31g+(d).inp 033510765.td-b3lyp_6-31g+(d).log.xz

033510765.td-b3lyp_6-31+g(d).qchem.inp (generated)

033510765.td-b3lyp_6-31+g(d).gjf (generated)

033510765.td-b3lyp_6-31+g(d).firefly.inp (generated)

033510765.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033510765.mol 033510765.PUBCHEM 033510765.mol (via Jmol)
033510824.b3lyp_6-31g(d).inp

033510824.b3lyp_6-31g(d).qchem.inp (generated)

033510824.b3lyp_6-31g(d).gjf (generated)

033510824.b3lyp_6-31g(d).firefly.inp (generated)

033510824.b3lyp_6-31g(d).smash.inp (generated)

033510824.b3lyp_6-31g(d).nwchem.inp (generated) 033510824.b3lyp_6-31g(d).log.xz 033510824.td-b3lyp_6-31g+(d).inp 033510824.td-b3lyp_6-31g+(d).log.xz

033510824.td-b3lyp_6-31+g(d).qchem.inp (generated)

033510824.td-b3lyp_6-31+g(d).gjf (generated)

033510824.td-b3lyp_6-31+g(d).firefly.inp (generated)

033510824.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033510824.mol 033510824.PUBCHEM 033510824.mol (via Jmol)
033510825.b3lyp_6-31g(d).inp

033510825.b3lyp_6-31g(d).qchem.inp (generated)

033510825.b3lyp_6-31g(d).gjf (generated)

033510825.b3lyp_6-31g(d).firefly.inp (generated)

033510825.b3lyp_6-31g(d).smash.inp (generated)

033510825.b3lyp_6-31g(d).nwchem.inp (generated) 033510825.b3lyp_6-31g(d).log.xz 033510825.td-b3lyp_6-31g+(d).inp 033510825.td-b3lyp_6-31g+(d).log.xz

033510825.td-b3lyp_6-31+g(d).qchem.inp (generated)

033510825.td-b3lyp_6-31+g(d).gjf (generated)

033510825.td-b3lyp_6-31+g(d).firefly.inp (generated)

033510825.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033510825.mol 033510825.PUBCHEM 033510825.mol (via Jmol)
033510998.b3lyp_6-31g(d).inp

033510998.b3lyp_6-31g(d).qchem.inp (generated)

033510998.b3lyp_6-31g(d).gjf (generated)

033510998.b3lyp_6-31g(d).firefly.inp (generated)

033510998.b3lyp_6-31g(d).smash.inp (generated)

033510998.b3lyp_6-31g(d).nwchem.inp (generated) 033510998.b3lyp_6-31g(d).log.xz 033510998.mol 033510998.PUBCHEM 033510998.mol (via Jmol)
033511008.b3lyp_6-31g(d).inp

033511008.b3lyp_6-31g(d).qchem.inp (generated)

033511008.b3lyp_6-31g(d).gjf (generated)

033511008.b3lyp_6-31g(d).firefly.inp (generated)

033511008.b3lyp_6-31g(d).smash.inp (generated)

033511008.b3lyp_6-31g(d).nwchem.inp (generated) 033511008.b3lyp_6-31g(d).log.xz 033511008.td-b3lyp_6-31g+(d).inp 033511008.td-b3lyp_6-31g+(d).log.xz

033511008.td-b3lyp_6-31+g(d).qchem.inp (generated)

033511008.td-b3lyp_6-31+g(d).gjf (generated)

033511008.td-b3lyp_6-31+g(d).firefly.inp (generated)

033511008.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033511008.mol 033511008.PUBCHEM 033511008.mol (via Jmol)
033511074.b3lyp_6-31g(d).inp

033511074.b3lyp_6-31g(d).qchem.inp (generated)

033511074.b3lyp_6-31g(d).gjf (generated)

033511074.b3lyp_6-31g(d).firefly.inp (generated)

033511074.b3lyp_6-31g(d).smash.inp (generated)

033511074.b3lyp_6-31g(d).nwchem.inp (generated) 033511074.b3lyp_6-31g(d).log.xz 033511074.mol 033511074.PUBCHEM 033511074.mol (via Jmol)
033511104.b3lyp_6-31g(d).inp

033511104.b3lyp_6-31g(d).qchem.inp (generated)

033511104.b3lyp_6-31g(d).gjf (generated)

033511104.b3lyp_6-31g(d).firefly.inp (generated)

033511104.b3lyp_6-31g(d).smash.inp (generated)

033511104.b3lyp_6-31g(d).nwchem.inp (generated) 033511104.b3lyp_6-31g(d).log.xz 033511104.td-b3lyp_6-31g+(d).inp 033511104.td-b3lyp_6-31g+(d).log.xz

033511104.td-b3lyp_6-31+g(d).qchem.inp (generated)

033511104.td-b3lyp_6-31+g(d).gjf (generated)

033511104.td-b3lyp_6-31+g(d).firefly.inp (generated)

033511104.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033511104.mol 033511104.PUBCHEM 033511104.mol (via Jmol)
033511228.b3lyp_6-31g(d).inp

033511228.b3lyp_6-31g(d).qchem.inp (generated)

033511228.b3lyp_6-31g(d).gjf (generated)

033511228.b3lyp_6-31g(d).firefly.inp (generated)

033511228.b3lyp_6-31g(d).smash.inp (generated)

033511228.b3lyp_6-31g(d).nwchem.inp (generated) 033511228.b3lyp_6-31g(d).log.xz 033511228.td-b3lyp_6-31g+(d).inp 033511228.td-b3lyp_6-31g+(d).log.xz

033511228.td-b3lyp_6-31+g(d).qchem.inp (generated)

033511228.td-b3lyp_6-31+g(d).gjf (generated)

033511228.td-b3lyp_6-31+g(d).firefly.inp (generated)

033511228.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033511228.mol 033511228.PUBCHEM 033511228.mol (via Jmol)
033511229.b3lyp_6-31g(d).inp

033511229.b3lyp_6-31g(d).qchem.inp (generated)

033511229.b3lyp_6-31g(d).gjf (generated)

033511229.b3lyp_6-31g(d).firefly.inp (generated)

033511229.b3lyp_6-31g(d).smash.inp (generated)

033511229.b3lyp_6-31g(d).nwchem.inp (generated) 033511229.b3lyp_6-31g(d).log.xz 033511229.td-b3lyp_6-31g+(d).inp 033511229.td-b3lyp_6-31g+(d).log.xz

033511229.td-b3lyp_6-31+g(d).qchem.inp (generated)

033511229.td-b3lyp_6-31+g(d).gjf (generated)

033511229.td-b3lyp_6-31+g(d).firefly.inp (generated)

033511229.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033511229.mol 033511229.PUBCHEM 033511229.mol (via Jmol)
033511280.b3lyp_6-31g(d).inp

033511280.b3lyp_6-31g(d).qchem.inp (generated)

033511280.b3lyp_6-31g(d).gjf (generated)

033511280.b3lyp_6-31g(d).firefly.inp (generated)

033511280.b3lyp_6-31g(d).smash.inp (generated)

033511280.b3lyp_6-31g(d).nwchem.inp (generated) 033511280.b3lyp_6-31g(d).log.xz 033511280.td-b3lyp_6-31g+(d).inp 033511280.td-b3lyp_6-31g+(d).log.xz

033511280.td-b3lyp_6-31+g(d).qchem.inp (generated)

033511280.td-b3lyp_6-31+g(d).gjf (generated)

033511280.td-b3lyp_6-31+g(d).firefly.inp (generated)

033511280.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033511280.mol 033511280.PUBCHEM 033511280.mol (via Jmol)
033511482.b3lyp_6-31g(d).inp

033511482.b3lyp_6-31g(d).qchem.inp (generated)

033511482.b3lyp_6-31g(d).gjf (generated)

033511482.b3lyp_6-31g(d).firefly.inp (generated)

033511482.b3lyp_6-31g(d).smash.inp (generated)

033511482.b3lyp_6-31g(d).nwchem.inp (generated) 033511482.b3lyp_6-31g(d).log.xz 033511482.mol 033511482.PUBCHEM 033511482.mol (via Jmol)
033511631.b3lyp_6-31g(d).inp

033511631.b3lyp_6-31g(d).qchem.inp (generated)

033511631.b3lyp_6-31g(d).gjf (generated)

033511631.b3lyp_6-31g(d).firefly.inp (generated)

033511631.b3lyp_6-31g(d).smash.inp (generated)

033511631.b3lyp_6-31g(d).nwchem.inp (generated) 033511631.b3lyp_6-31g(d).log.xz 033511631.td-b3lyp_6-31g+(d).inp 033511631.td-b3lyp_6-31g+(d).log.xz

033511631.td-b3lyp_6-31+g(d).qchem.inp (generated)

033511631.td-b3lyp_6-31+g(d).gjf (generated)

033511631.td-b3lyp_6-31+g(d).firefly.inp (generated)

033511631.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033511631.mol 033511631.PUBCHEM 033511631.mol (via Jmol)
033511758.b3lyp_6-31g(d).inp

033511758.b3lyp_6-31g(d).qchem.inp (generated)

033511758.b3lyp_6-31g(d).gjf (generated)

033511758.b3lyp_6-31g(d).firefly.inp (generated)

033511758.b3lyp_6-31g(d).smash.inp (generated)

033511758.b3lyp_6-31g(d).nwchem.inp (generated) 033511758.b3lyp_6-31g(d).log.xz 033511758.mol 033511758.PUBCHEM 033511758.mol (via Jmol)
033511826.b3lyp_6-31g(d).inp

033511826.b3lyp_6-31g(d).qchem.inp (generated)

033511826.b3lyp_6-31g(d).gjf (generated)

033511826.b3lyp_6-31g(d).firefly.inp (generated)

033511826.b3lyp_6-31g(d).smash.inp (generated)

033511826.b3lyp_6-31g(d).nwchem.inp (generated) 033511826.b3lyp_6-31g(d).log.xz 033511826.td-b3lyp_6-31g+(d).inp 033511826.td-b3lyp_6-31g+(d).log.xz

033511826.td-b3lyp_6-31+g(d).qchem.inp (generated)

033511826.td-b3lyp_6-31+g(d).gjf (generated)

033511826.td-b3lyp_6-31+g(d).firefly.inp (generated)

033511826.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033511826.mol 033511826.PUBCHEM 033511826.mol (via Jmol)
033511884.b3lyp_6-31g(d).inp

033511884.b3lyp_6-31g(d).qchem.inp (generated)

033511884.b3lyp_6-31g(d).gjf (generated)

033511884.b3lyp_6-31g(d).firefly.inp (generated)

033511884.b3lyp_6-31g(d).smash.inp (generated)

033511884.b3lyp_6-31g(d).nwchem.inp (generated) 033511884.b3lyp_6-31g(d).log.xz 033511884.mol 033511884.PUBCHEM 033511884.mol (via Jmol)
033511994.b3lyp_6-31g(d).inp

033511994.b3lyp_6-31g(d).qchem.inp (generated)

033511994.b3lyp_6-31g(d).gjf (generated)

033511994.b3lyp_6-31g(d).firefly.inp (generated)

033511994.b3lyp_6-31g(d).smash.inp (generated)

033511994.b3lyp_6-31g(d).nwchem.inp (generated) 033511994.b3lyp_6-31g(d).log.xz 033511994.td-b3lyp_6-31g+(d).inp 033511994.td-b3lyp_6-31g+(d).log.xz

033511994.td-b3lyp_6-31+g(d).qchem.inp (generated)

033511994.td-b3lyp_6-31+g(d).gjf (generated)

033511994.td-b3lyp_6-31+g(d).firefly.inp (generated)

033511994.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033511994.mol 033511994.PUBCHEM 033511994.mol (via Jmol)
033511995.b3lyp_6-31g(d).inp

033511995.b3lyp_6-31g(d).qchem.inp (generated)

033511995.b3lyp_6-31g(d).gjf (generated)

033511995.b3lyp_6-31g(d).firefly.inp (generated)

033511995.b3lyp_6-31g(d).smash.inp (generated)

033511995.b3lyp_6-31g(d).nwchem.inp (generated) 033511995.b3lyp_6-31g(d).log.xz 033511995.mol 033511995.PUBCHEM 033511995.mol (via Jmol)
033512120.b3lyp_6-31g(d).inp

033512120.b3lyp_6-31g(d).qchem.inp (generated)

033512120.b3lyp_6-31g(d).gjf (generated)

033512120.b3lyp_6-31g(d).firefly.inp (generated)

033512120.b3lyp_6-31g(d).smash.inp (generated)

033512120.b3lyp_6-31g(d).nwchem.inp (generated) 033512120.b3lyp_6-31g(d).log.xz 033512120.td-b3lyp_6-31g+(d).inp 033512120.td-b3lyp_6-31g+(d).log.xz

033512120.td-b3lyp_6-31+g(d).qchem.inp (generated)

033512120.td-b3lyp_6-31+g(d).gjf (generated)

033512120.td-b3lyp_6-31+g(d).firefly.inp (generated)

033512120.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033512120.mol 033512120.PUBCHEM 033512120.mol (via Jmol)
033512411.b3lyp_6-31g(d).inp

033512411.b3lyp_6-31g(d).qchem.inp (generated)

033512411.b3lyp_6-31g(d).gjf (generated)

033512411.b3lyp_6-31g(d).firefly.inp (generated)

033512411.b3lyp_6-31g(d).smash.inp (generated)

033512411.b3lyp_6-31g(d).nwchem.inp (generated) 033512411.b3lyp_6-31g(d).log.xz 033512411.mol 033512411.PUBCHEM 033512411.mol (via Jmol)
033512425.b3lyp_6-31g(d).inp

033512425.b3lyp_6-31g(d).qchem.inp (generated)

033512425.b3lyp_6-31g(d).gjf (generated)

033512425.b3lyp_6-31g(d).firefly.inp (generated)

033512425.b3lyp_6-31g(d).smash.inp (generated)

033512425.b3lyp_6-31g(d).nwchem.inp (generated) 033512425.b3lyp_6-31g(d).log.xz 033512425.td-b3lyp_6-31g+(d).inp 033512425.td-b3lyp_6-31g+(d).log.xz

033512425.td-b3lyp_6-31+g(d).qchem.inp (generated)

033512425.td-b3lyp_6-31+g(d).gjf (generated)

033512425.td-b3lyp_6-31+g(d).firefly.inp (generated)

033512425.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033512425.mol 033512425.PUBCHEM 033512425.mol (via Jmol)
033512426.b3lyp_6-31g(d).inp

033512426.b3lyp_6-31g(d).qchem.inp (generated)

033512426.b3lyp_6-31g(d).gjf (generated)

033512426.b3lyp_6-31g(d).firefly.inp (generated)

033512426.b3lyp_6-31g(d).smash.inp (generated)

033512426.b3lyp_6-31g(d).nwchem.inp (generated) 033512426.b3lyp_6-31g(d).log.xz 033512426.td-b3lyp_6-31g+(d).inp 033512426.td-b3lyp_6-31g+(d).log.xz

033512426.td-b3lyp_6-31+g(d).qchem.inp (generated)

033512426.td-b3lyp_6-31+g(d).gjf (generated)

033512426.td-b3lyp_6-31+g(d).firefly.inp (generated)

033512426.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033512426.mol 033512426.PUBCHEM 033512426.mol (via Jmol)
033512628.b3lyp_6-31g(d).inp

033512628.b3lyp_6-31g(d).qchem.inp (generated)

033512628.b3lyp_6-31g(d).gjf (generated)

033512628.b3lyp_6-31g(d).firefly.inp (generated)

033512628.b3lyp_6-31g(d).smash.inp (generated)

033512628.b3lyp_6-31g(d).nwchem.inp (generated) 033512628.b3lyp_6-31g(d).log.xz 033512628.mol 033512628.PUBCHEM 033512628.mol (via Jmol)
033512669.b3lyp_6-31g(d).inp

033512669.b3lyp_6-31g(d).qchem.inp (generated)

033512669.b3lyp_6-31g(d).gjf (generated)

033512669.b3lyp_6-31g(d).firefly.inp (generated)

033512669.b3lyp_6-31g(d).smash.inp (generated)

033512669.b3lyp_6-31g(d).nwchem.inp (generated) 033512669.b3lyp_6-31g(d).log.xz 033512669.mol 033512669.PUBCHEM 033512669.mol (via Jmol)
033512725.b3lyp_6-31g(d).inp

033512725.b3lyp_6-31g(d).qchem.inp (generated)

033512725.b3lyp_6-31g(d).gjf (generated)

033512725.b3lyp_6-31g(d).firefly.inp (generated)

033512725.b3lyp_6-31g(d).smash.inp (generated)

033512725.b3lyp_6-31g(d).nwchem.inp (generated) 033512725.b3lyp_6-31g(d).log.xz 033512725.td-b3lyp_6-31g+(d).inp 033512725.td-b3lyp_6-31g+(d).log.xz

033512725.td-b3lyp_6-31+g(d).qchem.inp (generated)

033512725.td-b3lyp_6-31+g(d).gjf (generated)

033512725.td-b3lyp_6-31+g(d).firefly.inp (generated)

033512725.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033512725.mol 033512725.PUBCHEM 033512725.mol (via Jmol)
033512732.b3lyp_6-31g(d).inp

033512732.b3lyp_6-31g(d).qchem.inp (generated)

033512732.b3lyp_6-31g(d).gjf (generated)

033512732.b3lyp_6-31g(d).firefly.inp (generated)

033512732.b3lyp_6-31g(d).smash.inp (generated)

033512732.b3lyp_6-31g(d).nwchem.inp (generated) 033512732.b3lyp_6-31g(d).log.xz 033512732.td-b3lyp_6-31g+(d).inp 033512732.td-b3lyp_6-31g+(d).log.xz

033512732.td-b3lyp_6-31+g(d).qchem.inp (generated)

033512732.td-b3lyp_6-31+g(d).gjf (generated)

033512732.td-b3lyp_6-31+g(d).firefly.inp (generated)

033512732.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033512732.mol 033512732.PUBCHEM 033512732.mol (via Jmol)
033512814.b3lyp_6-31g(d).inp

033512814.b3lyp_6-31g(d).qchem.inp (generated)

033512814.b3lyp_6-31g(d).gjf (generated)

033512814.b3lyp_6-31g(d).firefly.inp (generated)

033512814.b3lyp_6-31g(d).smash.inp (generated)

033512814.b3lyp_6-31g(d).nwchem.inp (generated) 033512814.b3lyp_6-31g(d).log.xz 033512814.mol 033512814.PUBCHEM 033512814.mol (via Jmol)
033512835.b3lyp_6-31g(d).inp

033512835.b3lyp_6-31g(d).qchem.inp (generated)

033512835.b3lyp_6-31g(d).gjf (generated)

033512835.b3lyp_6-31g(d).firefly.inp (generated)

033512835.b3lyp_6-31g(d).smash.inp (generated)

033512835.b3lyp_6-31g(d).nwchem.inp (generated) 033512835.b3lyp_6-31g(d).log.xz 033512835.mol 033512835.PUBCHEM 033512835.mol (via Jmol)
033512903.b3lyp_6-31g(d).inp

033512903.b3lyp_6-31g(d).qchem.inp (generated)

033512903.b3lyp_6-31g(d).gjf (generated)

033512903.b3lyp_6-31g(d).firefly.inp (generated)

033512903.b3lyp_6-31g(d).smash.inp (generated)

033512903.b3lyp_6-31g(d).nwchem.inp (generated) 033512903.b3lyp_6-31g(d).log.xz 033512903.mol 033512903.PUBCHEM 033512903.mol (via Jmol)
033512908.b3lyp_6-31g(d).inp

033512908.b3lyp_6-31g(d).qchem.inp (generated)

033512908.b3lyp_6-31g(d).gjf (generated)

033512908.b3lyp_6-31g(d).firefly.inp (generated)

033512908.b3lyp_6-31g(d).smash.inp (generated)

033512908.b3lyp_6-31g(d).nwchem.inp (generated) 033512908.b3lyp_6-31g(d).log.xz 033512908.td-b3lyp_6-31g+(d).inp 033512908.td-b3lyp_6-31g+(d).log.xz

033512908.td-b3lyp_6-31+g(d).qchem.inp (generated)

033512908.td-b3lyp_6-31+g(d).gjf (generated)

033512908.td-b3lyp_6-31+g(d).firefly.inp (generated)

033512908.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033512908.mol 033512908.PUBCHEM 033512908.mol (via Jmol)
033512909.b3lyp_6-31g(d).inp

033512909.b3lyp_6-31g(d).qchem.inp (generated)

033512909.b3lyp_6-31g(d).gjf (generated)

033512909.b3lyp_6-31g(d).firefly.inp (generated)

033512909.b3lyp_6-31g(d).smash.inp (generated)

033512909.b3lyp_6-31g(d).nwchem.inp (generated) 033512909.b3lyp_6-31g(d).log.xz 033512909.td-b3lyp_6-31g+(d).inp 033512909.td-b3lyp_6-31g+(d).log.xz

033512909.td-b3lyp_6-31+g(d).qchem.inp (generated)

033512909.td-b3lyp_6-31+g(d).gjf (generated)

033512909.td-b3lyp_6-31+g(d).firefly.inp (generated)

033512909.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033512909.mol 033512909.PUBCHEM 033512909.mol (via Jmol)
033512932.b3lyp_6-31g(d).inp

033512932.b3lyp_6-31g(d).qchem.inp (generated)

033512932.b3lyp_6-31g(d).gjf (generated)

033512932.b3lyp_6-31g(d).firefly.inp (generated)

033512932.b3lyp_6-31g(d).smash.inp (generated)

033512932.b3lyp_6-31g(d).nwchem.inp (generated) 033512932.b3lyp_6-31g(d).log.xz 033512932.td-b3lyp_6-31g+(d).inp 033512932.td-b3lyp_6-31g+(d).log.xz

033512932.td-b3lyp_6-31+g(d).qchem.inp (generated)

033512932.td-b3lyp_6-31+g(d).gjf (generated)

033512932.td-b3lyp_6-31+g(d).firefly.inp (generated)

033512932.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033512932.mol 033512932.PUBCHEM 033512932.mol (via Jmol)
033512960.b3lyp_6-31g(d).inp

033512960.b3lyp_6-31g(d).qchem.inp (generated)

033512960.b3lyp_6-31g(d).gjf (generated)

033512960.b3lyp_6-31g(d).firefly.inp (generated)

033512960.b3lyp_6-31g(d).smash.inp (generated)

033512960.b3lyp_6-31g(d).nwchem.inp (generated) 033512960.b3lyp_6-31g(d).log.xz 033512960.td-b3lyp_6-31g+(d).inp 033512960.td-b3lyp_6-31g+(d).log.xz

033512960.td-b3lyp_6-31+g(d).qchem.inp (generated)

033512960.td-b3lyp_6-31+g(d).gjf (generated)

033512960.td-b3lyp_6-31+g(d).firefly.inp (generated)

033512960.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033512960.mol 033512960.PUBCHEM 033512960.mol (via Jmol)
033513004.b3lyp_6-31g(d).inp

033513004.b3lyp_6-31g(d).qchem.inp (generated)

033513004.b3lyp_6-31g(d).gjf (generated)

033513004.b3lyp_6-31g(d).firefly.inp (generated)

033513004.b3lyp_6-31g(d).smash.inp (generated)

033513004.b3lyp_6-31g(d).nwchem.inp (generated) 033513004.b3lyp_6-31g(d).log.xz 033513004.td-b3lyp_6-31g+(d).inp 033513004.td-b3lyp_6-31g+(d).log.xz

033513004.td-b3lyp_6-31+g(d).qchem.inp (generated)

033513004.td-b3lyp_6-31+g(d).gjf (generated)

033513004.td-b3lyp_6-31+g(d).firefly.inp (generated)

033513004.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033513004.mol 033513004.PUBCHEM 033513004.mol (via Jmol)
033513334.b3lyp_6-31g(d).inp

033513334.b3lyp_6-31g(d).qchem.inp (generated)

033513334.b3lyp_6-31g(d).gjf (generated)

033513334.b3lyp_6-31g(d).firefly.inp (generated)

033513334.b3lyp_6-31g(d).smash.inp (generated)

033513334.b3lyp_6-31g(d).nwchem.inp (generated) 033513334.b3lyp_6-31g(d).log.xz 033513334.td-b3lyp_6-31g+(d).inp 033513334.td-b3lyp_6-31g+(d).log.xz

033513334.td-b3lyp_6-31+g(d).qchem.inp (generated)

033513334.td-b3lyp_6-31+g(d).gjf (generated)

033513334.td-b3lyp_6-31+g(d).firefly.inp (generated)

033513334.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033513334.mol 033513334.PUBCHEM 033513334.mol (via Jmol)
033513507.b3lyp_6-31g(d).inp

033513507.b3lyp_6-31g(d).qchem.inp (generated)

033513507.b3lyp_6-31g(d).gjf (generated)

033513507.b3lyp_6-31g(d).firefly.inp (generated)

033513507.b3lyp_6-31g(d).smash.inp (generated)

033513507.b3lyp_6-31g(d).nwchem.inp (generated) 033513507.b3lyp_6-31g(d).log.xz 033513507.td-b3lyp_6-31g+(d).inp 033513507.td-b3lyp_6-31g+(d).log.xz

033513507.td-b3lyp_6-31+g(d).qchem.inp (generated)

033513507.td-b3lyp_6-31+g(d).gjf (generated)

033513507.td-b3lyp_6-31+g(d).firefly.inp (generated)

033513507.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033513507.mol 033513507.PUBCHEM 033513507.mol (via Jmol)
033513517.b3lyp_6-31g(d).inp

033513517.b3lyp_6-31g(d).qchem.inp (generated)

033513517.b3lyp_6-31g(d).gjf (generated)

033513517.b3lyp_6-31g(d).firefly.inp (generated)

033513517.b3lyp_6-31g(d).smash.inp (generated)

033513517.b3lyp_6-31g(d).nwchem.inp (generated) 033513517.b3lyp_6-31g(d).log.xz 033513517.td-b3lyp_6-31g+(d).inp 033513517.td-b3lyp_6-31g+(d).log.xz

033513517.td-b3lyp_6-31+g(d).qchem.inp (generated)

033513517.td-b3lyp_6-31+g(d).gjf (generated)

033513517.td-b3lyp_6-31+g(d).firefly.inp (generated)

033513517.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033513517.mol 033513517.PUBCHEM 033513517.mol (via Jmol)
033513518.b3lyp_6-31g(d).inp

033513518.b3lyp_6-31g(d).qchem.inp (generated)

033513518.b3lyp_6-31g(d).gjf (generated)

033513518.b3lyp_6-31g(d).firefly.inp (generated)

033513518.b3lyp_6-31g(d).smash.inp (generated)

033513518.b3lyp_6-31g(d).nwchem.inp (generated) 033513518.b3lyp_6-31g(d).log.xz 033513518.td-b3lyp_6-31g+(d).inp 033513518.td-b3lyp_6-31g+(d).log.xz

033513518.td-b3lyp_6-31+g(d).qchem.inp (generated)

033513518.td-b3lyp_6-31+g(d).gjf (generated)

033513518.td-b3lyp_6-31+g(d).firefly.inp (generated)

033513518.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033513518.mol 033513518.PUBCHEM 033513518.mol (via Jmol)
033513536.b3lyp_6-31g(d).inp

033513536.b3lyp_6-31g(d).qchem.inp (generated)

033513536.b3lyp_6-31g(d).gjf (generated)

033513536.b3lyp_6-31g(d).firefly.inp (generated)

033513536.b3lyp_6-31g(d).smash.inp (generated)

033513536.b3lyp_6-31g(d).nwchem.inp (generated) 033513536.b3lyp_6-31g(d).log.xz 033513536.td-b3lyp_6-31g+(d).inp 033513536.td-b3lyp_6-31g+(d).log.xz

033513536.td-b3lyp_6-31+g(d).qchem.inp (generated)

033513536.td-b3lyp_6-31+g(d).gjf (generated)

033513536.td-b3lyp_6-31+g(d).firefly.inp (generated)

033513536.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033513536.mol 033513536.PUBCHEM 033513536.mol (via Jmol)
033513544.b3lyp_6-31g(d).inp

033513544.b3lyp_6-31g(d).qchem.inp (generated)

033513544.b3lyp_6-31g(d).gjf (generated)

033513544.b3lyp_6-31g(d).firefly.inp (generated)

033513544.b3lyp_6-31g(d).smash.inp (generated)

033513544.b3lyp_6-31g(d).nwchem.inp (generated) 033513544.b3lyp_6-31g(d).log.xz 033513544.td-b3lyp_6-31g+(d).inp 033513544.td-b3lyp_6-31g+(d).log.xz

033513544.td-b3lyp_6-31+g(d).qchem.inp (generated)

033513544.td-b3lyp_6-31+g(d).gjf (generated)

033513544.td-b3lyp_6-31+g(d).firefly.inp (generated)

033513544.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033513544.mol 033513544.PUBCHEM 033513544.mol (via Jmol)
033513578.b3lyp_6-31g(d).inp

033513578.b3lyp_6-31g(d).qchem.inp (generated)

033513578.b3lyp_6-31g(d).gjf (generated)

033513578.b3lyp_6-31g(d).firefly.inp (generated)

033513578.b3lyp_6-31g(d).smash.inp (generated)

033513578.b3lyp_6-31g(d).nwchem.inp (generated) 033513578.b3lyp_6-31g(d).log.xz 033513578.td-b3lyp_6-31g+(d).inp 033513578.td-b3lyp_6-31g+(d).log.xz

033513578.td-b3lyp_6-31+g(d).qchem.inp (generated)

033513578.td-b3lyp_6-31+g(d).gjf (generated)

033513578.td-b3lyp_6-31+g(d).firefly.inp (generated)

033513578.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033513578.mol 033513578.PUBCHEM 033513578.mol (via Jmol)
033513579.b3lyp_6-31g(d).inp

033513579.b3lyp_6-31g(d).qchem.inp (generated)

033513579.b3lyp_6-31g(d).gjf (generated)

033513579.b3lyp_6-31g(d).firefly.inp (generated)

033513579.b3lyp_6-31g(d).smash.inp (generated)

033513579.b3lyp_6-31g(d).nwchem.inp (generated) 033513579.b3lyp_6-31g(d).log.xz 033513579.td-b3lyp_6-31g+(d).inp 033513579.td-b3lyp_6-31g+(d).log.xz

033513579.td-b3lyp_6-31+g(d).qchem.inp (generated)

033513579.td-b3lyp_6-31+g(d).gjf (generated)

033513579.td-b3lyp_6-31+g(d).firefly.inp (generated)

033513579.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033513579.mol 033513579.PUBCHEM 033513579.mol (via Jmol)
033513656.b3lyp_6-31g(d).inp

033513656.b3lyp_6-31g(d).qchem.inp (generated)

033513656.b3lyp_6-31g(d).gjf (generated)

033513656.b3lyp_6-31g(d).firefly.inp (generated)

033513656.b3lyp_6-31g(d).smash.inp (generated)

033513656.b3lyp_6-31g(d).nwchem.inp (generated) 033513656.b3lyp_6-31g(d).log.xz 033513656.td-b3lyp_6-31g+(d).inp 033513656.td-b3lyp_6-31g+(d).log.xz

033513656.td-b3lyp_6-31+g(d).qchem.inp (generated)

033513656.td-b3lyp_6-31+g(d).gjf (generated)

033513656.td-b3lyp_6-31+g(d).firefly.inp (generated)

033513656.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033513656.mol 033513656.PUBCHEM 033513656.mol (via Jmol)
033513959.b3lyp_6-31g(d).inp

033513959.b3lyp_6-31g(d).qchem.inp (generated)

033513959.b3lyp_6-31g(d).gjf (generated)

033513959.b3lyp_6-31g(d).firefly.inp (generated)

033513959.b3lyp_6-31g(d).smash.inp (generated)

033513959.b3lyp_6-31g(d).nwchem.inp (generated) 033513959.b3lyp_6-31g(d).log.xz 033513959.td-b3lyp_6-31g+(d).inp 033513959.td-b3lyp_6-31g+(d).log.xz

033513959.td-b3lyp_6-31+g(d).qchem.inp (generated)

033513959.td-b3lyp_6-31+g(d).gjf (generated)

033513959.td-b3lyp_6-31+g(d).firefly.inp (generated)

033513959.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033513959.mol 033513959.PUBCHEM 033513959.mol (via Jmol)
033514173.b3lyp_6-31g(d).inp

033514173.b3lyp_6-31g(d).qchem.inp (generated)

033514173.b3lyp_6-31g(d).gjf (generated)

033514173.b3lyp_6-31g(d).firefly.inp (generated)

033514173.b3lyp_6-31g(d).smash.inp (generated)

033514173.b3lyp_6-31g(d).nwchem.inp (generated) 033514173.b3lyp_6-31g(d).log.xz 033514173.td-b3lyp_6-31g+(d).inp 033514173.td-b3lyp_6-31g+(d).log.xz

033514173.td-b3lyp_6-31+g(d).qchem.inp (generated)

033514173.td-b3lyp_6-31+g(d).gjf (generated)

033514173.td-b3lyp_6-31+g(d).firefly.inp (generated)

033514173.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033514173.mol 033514173.PUBCHEM 033514173.mol (via Jmol)
033514197.b3lyp_6-31g(d).inp

033514197.b3lyp_6-31g(d).qchem.inp (generated)

033514197.b3lyp_6-31g(d).gjf (generated)

033514197.b3lyp_6-31g(d).firefly.inp (generated)

033514197.b3lyp_6-31g(d).smash.inp (generated)

033514197.b3lyp_6-31g(d).nwchem.inp (generated) 033514197.b3lyp_6-31g(d).log.xz 033514197.td-b3lyp_6-31g+(d).inp 033514197.td-b3lyp_6-31g+(d).log.xz

033514197.td-b3lyp_6-31+g(d).qchem.inp (generated)

033514197.td-b3lyp_6-31+g(d).gjf (generated)

033514197.td-b3lyp_6-31+g(d).firefly.inp (generated)

033514197.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033514197.mol 033514197.PUBCHEM 033514197.mol (via Jmol)
033514577.b3lyp_6-31g(d).inp

033514577.b3lyp_6-31g(d).qchem.inp (generated)

033514577.b3lyp_6-31g(d).gjf (generated)

033514577.b3lyp_6-31g(d).firefly.inp (generated)

033514577.b3lyp_6-31g(d).smash.inp (generated)

033514577.b3lyp_6-31g(d).nwchem.inp (generated) 033514577.b3lyp_6-31g(d).log.xz 033514577.mol 033514577.PUBCHEM 033514577.mol (via Jmol)
033514945.b3lyp_6-31g(d).inp

033514945.b3lyp_6-31g(d).qchem.inp (generated)

033514945.b3lyp_6-31g(d).gjf (generated)

033514945.b3lyp_6-31g(d).firefly.inp (generated)

033514945.b3lyp_6-31g(d).smash.inp (generated)

033514945.b3lyp_6-31g(d).nwchem.inp (generated) 033514945.b3lyp_6-31g(d).log.xz 033514945.td-b3lyp_6-31g+(d).inp 033514945.td-b3lyp_6-31g+(d).log.xz

033514945.td-b3lyp_6-31+g(d).qchem.inp (generated)

033514945.td-b3lyp_6-31+g(d).gjf (generated)

033514945.td-b3lyp_6-31+g(d).firefly.inp (generated)

033514945.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033514945.mol 033514945.PUBCHEM 033514945.mol (via Jmol)
033519998.b3lyp_6-31g(d).inp

033519998.b3lyp_6-31g(d).qchem.inp (generated)

033519998.b3lyp_6-31g(d).gjf (generated)

033519998.b3lyp_6-31g(d).firefly.inp (generated)

033519998.b3lyp_6-31g(d).smash.inp (generated)

033519998.b3lyp_6-31g(d).nwchem.inp (generated) 033519998.b3lyp_6-31g(d).log.xz 033519998.td-b3lyp_6-31g+(d).inp 033519998.td-b3lyp_6-31g+(d).log.xz

033519998.td-b3lyp_6-31+g(d).qchem.inp (generated)

033519998.td-b3lyp_6-31+g(d).gjf (generated)

033519998.td-b3lyp_6-31+g(d).firefly.inp (generated)

033519998.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033519998.mol 033519998.PUBCHEM 033519998.mol (via Jmol)
033520295.b3lyp_6-31g(d).inp

033520295.b3lyp_6-31g(d).qchem.inp (generated)

033520295.b3lyp_6-31g(d).gjf (generated)

033520295.b3lyp_6-31g(d).firefly.inp (generated)

033520295.b3lyp_6-31g(d).smash.inp (generated)

033520295.b3lyp_6-31g(d).nwchem.inp (generated) 033520295.b3lyp_6-31g(d).log.xz 033520295.td-b3lyp_6-31g+(d).inp 033520295.td-b3lyp_6-31g+(d).log.xz

033520295.td-b3lyp_6-31+g(d).qchem.inp (generated)

033520295.td-b3lyp_6-31+g(d).gjf (generated)

033520295.td-b3lyp_6-31+g(d).firefly.inp (generated)

033520295.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033520295.mol 033520295.PUBCHEM 033520295.mol (via Jmol)
033520299.b3lyp_6-31g(d).inp

033520299.b3lyp_6-31g(d).qchem.inp (generated)

033520299.b3lyp_6-31g(d).gjf (generated)

033520299.b3lyp_6-31g(d).firefly.inp (generated)

033520299.b3lyp_6-31g(d).smash.inp (generated)

033520299.b3lyp_6-31g(d).nwchem.inp (generated) 033520299.b3lyp_6-31g(d).log.xz 033520299.td-b3lyp_6-31g+(d).inp 033520299.td-b3lyp_6-31g+(d).log.xz

033520299.td-b3lyp_6-31+g(d).qchem.inp (generated)

033520299.td-b3lyp_6-31+g(d).gjf (generated)

033520299.td-b3lyp_6-31+g(d).firefly.inp (generated)

033520299.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033520299.mol 033520299.PUBCHEM 033520299.mol (via Jmol)
033520967.b3lyp_6-31g(d).inp

033520967.b3lyp_6-31g(d).qchem.inp (generated)

033520967.b3lyp_6-31g(d).gjf (generated)

033520967.b3lyp_6-31g(d).firefly.inp (generated)

033520967.b3lyp_6-31g(d).smash.inp (generated)

033520967.b3lyp_6-31g(d).nwchem.inp (generated) 033520967.b3lyp_6-31g(d).log.xz 033520967.td-b3lyp_6-31g+(d).inp 033520967.td-b3lyp_6-31g+(d).log.xz

033520967.td-b3lyp_6-31+g(d).qchem.inp (generated)

033520967.td-b3lyp_6-31+g(d).gjf (generated)

033520967.td-b3lyp_6-31+g(d).firefly.inp (generated)

033520967.td-b3lyp_6-31+g(d).nwchem.inp (generated) 033520967.mol 033520967.PUBCHEM 033520967.mol (via Jmol)


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