Index of

Last updated : Thu Feb 23 01:59:54 JST 2017
Total : 1236 (986) in this page
000950003.b3lyp_6-31g(d).inp

000950003.b3lyp_6-31g(d).qchem.inp (generated)

000950003.b3lyp_6-31g(d).gjf (generated)

000950003.b3lyp_6-31g(d).firefly.inp (generated)

000950003.b3lyp_6-31g(d).smash.inp (generated)

000950003.b3lyp_6-31g(d).nwchem.inp (generated) 000950003.b3lyp_6-31g(d).log.xz 000950003.td-b3lyp_6-31g+(d).inp 000950003.td-b3lyp_6-31g+(d).log.xz

000950003.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950003.td-b3lyp_6-31+g(d).gjf (generated)

000950003.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950003.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950003.mol 000950003.PUBCHEM 000950003.mol (via Jmol)
000950056.b3lyp_6-31g(d).inp

000950056.b3lyp_6-31g(d).qchem.inp (generated)

000950056.b3lyp_6-31g(d).gjf (generated)

000950056.b3lyp_6-31g(d).firefly.inp (generated)

000950056.b3lyp_6-31g(d).smash.inp (generated)

000950056.b3lyp_6-31g(d).nwchem.inp (generated) 000950056.b3lyp_6-31g(d).log.xz 000950056.td-b3lyp_6-31g+(d).inp 000950056.td-b3lyp_6-31g+(d).log.xz

000950056.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950056.td-b3lyp_6-31+g(d).gjf (generated)

000950056.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950056.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950056.mol 000950056.PUBCHEM 000950056.mol (via Jmol)
000950057.b3lyp_6-31g(d).inp

000950057.b3lyp_6-31g(d).qchem.inp (generated)

000950057.b3lyp_6-31g(d).gjf (generated)

000950057.b3lyp_6-31g(d).firefly.inp (generated)

000950057.b3lyp_6-31g(d).smash.inp (generated)

000950057.b3lyp_6-31g(d).nwchem.inp (generated) 000950057.b3lyp_6-31g(d).log.xz 000950057.td-b3lyp_6-31g+(d).inp 000950057.td-b3lyp_6-31g+(d).log.xz

000950057.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950057.td-b3lyp_6-31+g(d).gjf (generated)

000950057.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950057.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950057.mol 000950057.PUBCHEM 000950057.mol (via Jmol)
000950072.b3lyp_6-31g(d).inp

000950072.b3lyp_6-31g(d).qchem.inp (generated)

000950072.b3lyp_6-31g(d).gjf (generated)

000950072.b3lyp_6-31g(d).firefly.inp (generated)

000950072.b3lyp_6-31g(d).smash.inp (generated)

000950072.b3lyp_6-31g(d).nwchem.inp (generated) 000950072.b3lyp_6-31g(d).log.xz 000950072.td-b3lyp_6-31g+(d).inp 000950072.td-b3lyp_6-31g+(d).log.xz

000950072.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950072.td-b3lyp_6-31+g(d).gjf (generated)

000950072.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950072.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950072.mol 000950072.PUBCHEM 000950072.mol (via Jmol)
000950107.b3lyp_6-31g(d).inp

000950107.b3lyp_6-31g(d).qchem.inp (generated)

000950107.b3lyp_6-31g(d).gjf (generated)

000950107.b3lyp_6-31g(d).firefly.inp (generated)

000950107.b3lyp_6-31g(d).smash.inp (generated)

000950107.b3lyp_6-31g(d).nwchem.inp (generated) 000950107.b3lyp_6-31g(d).log.xz 000950107.td-b3lyp_6-31g+(d).inp 000950107.td-b3lyp_6-31g+(d).log.xz

000950107.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950107.td-b3lyp_6-31+g(d).gjf (generated)

000950107.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950107.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950107.mol 000950107.PUBCHEM 000950107.mol (via Jmol)
000950108.b3lyp_6-31g(d).inp

000950108.b3lyp_6-31g(d).qchem.inp (generated)

000950108.b3lyp_6-31g(d).gjf (generated)

000950108.b3lyp_6-31g(d).firefly.inp (generated)

000950108.b3lyp_6-31g(d).smash.inp (generated)

000950108.b3lyp_6-31g(d).nwchem.inp (generated) 000950108.b3lyp_6-31g(d).log.xz 000950108.td-b3lyp_6-31g+(d).inp 000950108.td-b3lyp_6-31g+(d).log.xz

000950108.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950108.td-b3lyp_6-31+g(d).gjf (generated)

000950108.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950108.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950108.mol 000950108.PUBCHEM 000950108.mol (via Jmol)
000950118.b3lyp_6-31g(d).inp

000950118.b3lyp_6-31g(d).qchem.inp (generated)

000950118.b3lyp_6-31g(d).gjf (generated)

000950118.b3lyp_6-31g(d).firefly.inp (generated)

000950118.b3lyp_6-31g(d).smash.inp (generated)

000950118.b3lyp_6-31g(d).nwchem.inp (generated) 000950118.b3lyp_6-31g(d).log.xz 000950118.td-b3lyp_6-31g+(d).inp 000950118.td-b3lyp_6-31g+(d).log.xz

000950118.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950118.td-b3lyp_6-31+g(d).gjf (generated)

000950118.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950118.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950118.mol 000950118.PUBCHEM 000950118.mol (via Jmol)
000950124.b3lyp_6-31g(d).inp

000950124.b3lyp_6-31g(d).qchem.inp (generated)

000950124.b3lyp_6-31g(d).gjf (generated)

000950124.b3lyp_6-31g(d).firefly.inp (generated)

000950124.b3lyp_6-31g(d).smash.inp (generated)

000950124.b3lyp_6-31g(d).nwchem.inp (generated) 000950124.b3lyp_6-31g(d).log.xz 000950124.td-b3lyp_6-31g+(d).inp 000950124.td-b3lyp_6-31g+(d).log.xz

000950124.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950124.td-b3lyp_6-31+g(d).gjf (generated)

000950124.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950124.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950124.mol 000950124.PUBCHEM 000950124.mol (via Jmol)
000950136.b3lyp_6-31g(d).inp

000950136.b3lyp_6-31g(d).qchem.inp (generated)

000950136.b3lyp_6-31g(d).gjf (generated)

000950136.b3lyp_6-31g(d).firefly.inp (generated)

000950136.b3lyp_6-31g(d).smash.inp (generated)

000950136.b3lyp_6-31g(d).nwchem.inp (generated) 000950136.b3lyp_6-31g(d).log.xz 000950136.mol 000950136.PUBCHEM 000950136.mol (via Jmol)
000950234.b3lyp_6-31g(d).inp

000950234.b3lyp_6-31g(d).qchem.inp (generated)

000950234.b3lyp_6-31g(d).gjf (generated)

000950234.b3lyp_6-31g(d).firefly.inp (generated)

000950234.b3lyp_6-31g(d).smash.inp (generated)

000950234.b3lyp_6-31g(d).nwchem.inp (generated) 000950234.b3lyp_6-31g(d).log.xz 000950234.td-b3lyp_6-31g+(d).inp 000950234.td-b3lyp_6-31g+(d).log.xz

000950234.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950234.td-b3lyp_6-31+g(d).gjf (generated)

000950234.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950234.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950234.mol 000950234.PUBCHEM 000950234.mol (via Jmol)
000950278.b3lyp_6-31g(d).inp

000950278.b3lyp_6-31g(d).qchem.inp (generated)

000950278.b3lyp_6-31g(d).gjf (generated)

000950278.b3lyp_6-31g(d).firefly.inp (generated)

000950278.b3lyp_6-31g(d).smash.inp (generated)

000950278.b3lyp_6-31g(d).nwchem.inp (generated) 000950278.b3lyp_6-31g(d).log.xz 000950278.mol 000950278.PUBCHEM 000950278.mol (via Jmol)
000950334.b3lyp_6-31g(d).inp

000950334.b3lyp_6-31g(d).qchem.inp (generated)

000950334.b3lyp_6-31g(d).gjf (generated)

000950334.b3lyp_6-31g(d).firefly.inp (generated)

000950334.b3lyp_6-31g(d).smash.inp (generated)

000950334.b3lyp_6-31g(d).nwchem.inp (generated) 000950334.b3lyp_6-31g(d).log.xz 000950334.td-b3lyp_6-31g+(d).inp 000950334.td-b3lyp_6-31g+(d).log.xz

000950334.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950334.td-b3lyp_6-31+g(d).gjf (generated)

000950334.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950334.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950334.mol 000950334.PUBCHEM 000950334.mol (via Jmol)
000950335.b3lyp_6-31g(d).inp

000950335.b3lyp_6-31g(d).qchem.inp (generated)

000950335.b3lyp_6-31g(d).gjf (generated)

000950335.b3lyp_6-31g(d).firefly.inp (generated)

000950335.b3lyp_6-31g(d).smash.inp (generated)

000950335.b3lyp_6-31g(d).nwchem.inp (generated) 000950335.b3lyp_6-31g(d).log.xz 000950335.td-b3lyp_6-31g+(d).inp 000950335.td-b3lyp_6-31g+(d).log.xz

000950335.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950335.td-b3lyp_6-31+g(d).gjf (generated)

000950335.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950335.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950335.mol 000950335.PUBCHEM 000950335.mol (via Jmol)
000950336.b3lyp_6-31g(d).inp

000950336.b3lyp_6-31g(d).qchem.inp (generated)

000950336.b3lyp_6-31g(d).gjf (generated)

000950336.b3lyp_6-31g(d).firefly.inp (generated)

000950336.b3lyp_6-31g(d).smash.inp (generated)

000950336.b3lyp_6-31g(d).nwchem.inp (generated) 000950336.b3lyp_6-31g(d).log.xz 000950336.td-b3lyp_6-31g+(d).inp 000950336.td-b3lyp_6-31g+(d).log.xz

000950336.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950336.td-b3lyp_6-31+g(d).gjf (generated)

000950336.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950336.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950336.mol 000950336.PUBCHEM 000950336.mol (via Jmol)
000950415.b3lyp_6-31g(d).inp

000950415.b3lyp_6-31g(d).qchem.inp (generated)

000950415.b3lyp_6-31g(d).gjf (generated)

000950415.b3lyp_6-31g(d).firefly.inp (generated)

000950415.b3lyp_6-31g(d).smash.inp (generated)

000950415.b3lyp_6-31g(d).nwchem.inp (generated) 000950415.b3lyp_6-31g(d).log.xz 000950415.mol 000950415.PUBCHEM 000950415.mol (via Jmol)
000950443.b3lyp_6-31g(d).inp

000950443.b3lyp_6-31g(d).qchem.inp (generated)

000950443.b3lyp_6-31g(d).gjf (generated)

000950443.b3lyp_6-31g(d).firefly.inp (generated)

000950443.b3lyp_6-31g(d).smash.inp (generated)

000950443.b3lyp_6-31g(d).nwchem.inp (generated) 000950443.b3lyp_6-31g(d).log.xz 000950443.td-b3lyp_6-31g+(d).inp 000950443.td-b3lyp_6-31g+(d).log.xz

000950443.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950443.td-b3lyp_6-31+g(d).gjf (generated)

000950443.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950443.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950443.mol 000950443.PUBCHEM 000950443.mol (via Jmol)
000950509.b3lyp_6-31g(d).inp

000950509.b3lyp_6-31g(d).qchem.inp (generated)

000950509.b3lyp_6-31g(d).gjf (generated)

000950509.b3lyp_6-31g(d).firefly.inp (generated)

000950509.b3lyp_6-31g(d).smash.inp (generated)

000950509.b3lyp_6-31g(d).nwchem.inp (generated) 000950509.b3lyp_6-31g(d).log.xz 000950509.td-b3lyp_6-31g+(d).inp 000950509.td-b3lyp_6-31g+(d).log.xz

000950509.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950509.td-b3lyp_6-31+g(d).gjf (generated)

000950509.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950509.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950509.mol 000950509.PUBCHEM 000950509.mol (via Jmol)
000950552.b3lyp_6-31g(d).inp

000950552.b3lyp_6-31g(d).qchem.inp (generated)

000950552.b3lyp_6-31g(d).gjf (generated)

000950552.b3lyp_6-31g(d).firefly.inp (generated)

000950552.b3lyp_6-31g(d).smash.inp (generated)

000950552.b3lyp_6-31g(d).nwchem.inp (generated) 000950552.b3lyp_6-31g(d).log.xz 000950552.td-b3lyp_6-31g+(d).inp 000950552.td-b3lyp_6-31g+(d).log.xz

000950552.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950552.td-b3lyp_6-31+g(d).gjf (generated)

000950552.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950552.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950552.mol 000950552.PUBCHEM 000950552.mol (via Jmol)
000950592.b3lyp_6-31g(d).inp

000950592.b3lyp_6-31g(d).qchem.inp (generated)

000950592.b3lyp_6-31g(d).gjf (generated)

000950592.b3lyp_6-31g(d).firefly.inp (generated)

000950592.b3lyp_6-31g(d).smash.inp (generated)

000950592.b3lyp_6-31g(d).nwchem.inp (generated) 000950592.b3lyp_6-31g(d).log.xz 000950592.td-b3lyp_6-31g+(d).inp 000950592.td-b3lyp_6-31g+(d).log.xz

000950592.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950592.td-b3lyp_6-31+g(d).gjf (generated)

000950592.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950592.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950592.mol 000950592.PUBCHEM 000950592.mol (via Jmol)
000950644.b3lyp_6-31g(d).inp

000950644.b3lyp_6-31g(d).qchem.inp (generated)

000950644.b3lyp_6-31g(d).gjf (generated)

000950644.b3lyp_6-31g(d).firefly.inp (generated)

000950644.b3lyp_6-31g(d).smash.inp (generated)

000950644.b3lyp_6-31g(d).nwchem.inp (generated) 000950644.b3lyp_6-31g(d).log.xz 000950644.td-b3lyp_6-31g+(d).inp 000950644.td-b3lyp_6-31g+(d).log.xz

000950644.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950644.td-b3lyp_6-31+g(d).gjf (generated)

000950644.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950644.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950644.mol 000950644.PUBCHEM 000950644.mol (via Jmol)
000950650.b3lyp_6-31g(d).inp

000950650.b3lyp_6-31g(d).qchem.inp (generated)

000950650.b3lyp_6-31g(d).gjf (generated)

000950650.b3lyp_6-31g(d).firefly.inp (generated)

000950650.b3lyp_6-31g(d).smash.inp (generated)

000950650.b3lyp_6-31g(d).nwchem.inp (generated) 000950650.b3lyp_6-31g(d).log.xz 000950650.td-b3lyp_6-31g+(d).inp 000950650.td-b3lyp_6-31g+(d).log.xz

000950650.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950650.td-b3lyp_6-31+g(d).gjf (generated)

000950650.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950650.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950650.mol 000950650.PUBCHEM 000950650.mol (via Jmol)
000950656.b3lyp_6-31g(d).inp

000950656.b3lyp_6-31g(d).qchem.inp (generated)

000950656.b3lyp_6-31g(d).gjf (generated)

000950656.b3lyp_6-31g(d).firefly.inp (generated)

000950656.b3lyp_6-31g(d).smash.inp (generated)

000950656.b3lyp_6-31g(d).nwchem.inp (generated) 000950656.b3lyp_6-31g(d).log.xz 000950656.mol 000950656.PUBCHEM 000950656.mol (via Jmol)
000950664.b3lyp_6-31g(d).inp

000950664.b3lyp_6-31g(d).qchem.inp (generated)

000950664.b3lyp_6-31g(d).gjf (generated)

000950664.b3lyp_6-31g(d).firefly.inp (generated)

000950664.b3lyp_6-31g(d).smash.inp (generated)

000950664.b3lyp_6-31g(d).nwchem.inp (generated) 000950664.b3lyp_6-31g(d).log.xz 000950664.td-b3lyp_6-31g+(d).inp 000950664.td-b3lyp_6-31g+(d).log.xz

000950664.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950664.td-b3lyp_6-31+g(d).gjf (generated)

000950664.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950664.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950664.mol 000950664.PUBCHEM 000950664.mol (via Jmol)
000950666.b3lyp_6-31g(d).inp

000950666.b3lyp_6-31g(d).qchem.inp (generated)

000950666.b3lyp_6-31g(d).gjf (generated)

000950666.b3lyp_6-31g(d).firefly.inp (generated)

000950666.b3lyp_6-31g(d).smash.inp (generated)

000950666.b3lyp_6-31g(d).nwchem.inp (generated) 000950666.b3lyp_6-31g(d).log.xz 000950666.td-b3lyp_6-31g+(d).inp 000950666.td-b3lyp_6-31g+(d).log.xz

000950666.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950666.td-b3lyp_6-31+g(d).gjf (generated)

000950666.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950666.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950666.mol 000950666.PUBCHEM 000950666.mol (via Jmol)
000950683.b3lyp_6-31g(d).inp

000950683.b3lyp_6-31g(d).qchem.inp (generated)

000950683.b3lyp_6-31g(d).gjf (generated)

000950683.b3lyp_6-31g(d).firefly.inp (generated)

000950683.b3lyp_6-31g(d).smash.inp (generated)

000950683.b3lyp_6-31g(d).nwchem.inp (generated) 000950683.b3lyp_6-31g(d).log.xz 000950683.td-b3lyp_6-31g+(d).inp 000950683.td-b3lyp_6-31g+(d).log.xz

000950683.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950683.td-b3lyp_6-31+g(d).gjf (generated)

000950683.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950683.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950683.mol 000950683.PUBCHEM 000950683.mol (via Jmol)
000950685.b3lyp_6-31g(d).inp

000950685.b3lyp_6-31g(d).qchem.inp (generated)

000950685.b3lyp_6-31g(d).gjf (generated)

000950685.b3lyp_6-31g(d).firefly.inp (generated)

000950685.b3lyp_6-31g(d).smash.inp (generated)

000950685.b3lyp_6-31g(d).nwchem.inp (generated) 000950685.b3lyp_6-31g(d).log.xz 000950685.mol 000950685.PUBCHEM 000950685.mol (via Jmol)
000950686.b3lyp_6-31g(d).inp

000950686.b3lyp_6-31g(d).qchem.inp (generated)

000950686.b3lyp_6-31g(d).gjf (generated)

000950686.b3lyp_6-31g(d).firefly.inp (generated)

000950686.b3lyp_6-31g(d).smash.inp (generated)

000950686.b3lyp_6-31g(d).nwchem.inp (generated) 000950686.b3lyp_6-31g(d).log.xz 000950686.mol 000950686.PUBCHEM 000950686.mol (via Jmol)
000950718.b3lyp_6-31g(d).inp

000950718.b3lyp_6-31g(d).qchem.inp (generated)

000950718.b3lyp_6-31g(d).gjf (generated)

000950718.b3lyp_6-31g(d).firefly.inp (generated)

000950718.b3lyp_6-31g(d).smash.inp (generated)

000950718.b3lyp_6-31g(d).nwchem.inp (generated) 000950718.b3lyp_6-31g(d).log.xz 000950718.td-b3lyp_6-31g+(d).inp 000950718.td-b3lyp_6-31g+(d).log.xz

000950718.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950718.td-b3lyp_6-31+g(d).gjf (generated)

000950718.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950718.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950718.mol 000950718.PUBCHEM 000950718.mol (via Jmol)
000950738.b3lyp_6-31g(d).inp

000950738.b3lyp_6-31g(d).qchem.inp (generated)

000950738.b3lyp_6-31g(d).gjf (generated)

000950738.b3lyp_6-31g(d).firefly.inp (generated)

000950738.b3lyp_6-31g(d).smash.inp (generated)

000950738.b3lyp_6-31g(d).nwchem.inp (generated) 000950738.b3lyp_6-31g(d).log.xz 000950738.td-b3lyp_6-31g+(d).inp 000950738.td-b3lyp_6-31g+(d).log.xz

000950738.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950738.td-b3lyp_6-31+g(d).gjf (generated)

000950738.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950738.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950738.mol 000950738.PUBCHEM 000950738.mol (via Jmol)
000950750.b3lyp_6-31g(d).inp

000950750.b3lyp_6-31g(d).qchem.inp (generated)

000950750.b3lyp_6-31g(d).gjf (generated)

000950750.b3lyp_6-31g(d).firefly.inp (generated)

000950750.b3lyp_6-31g(d).smash.inp (generated)

000950750.b3lyp_6-31g(d).nwchem.inp (generated) 000950750.b3lyp_6-31g(d).log.xz 000950750.mol 000950750.PUBCHEM 000950750.mol (via Jmol)
000950765.b3lyp_6-31g(d).inp

000950765.b3lyp_6-31g(d).qchem.inp (generated)

000950765.b3lyp_6-31g(d).gjf (generated)

000950765.b3lyp_6-31g(d).firefly.inp (generated)

000950765.b3lyp_6-31g(d).smash.inp (generated)

000950765.b3lyp_6-31g(d).nwchem.inp (generated) 000950765.b3lyp_6-31g(d).log.xz 000950765.td-b3lyp_6-31g+(d).inp 000950765.td-b3lyp_6-31g+(d).log.xz

000950765.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950765.td-b3lyp_6-31+g(d).gjf (generated)

000950765.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950765.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950765.mol 000950765.PUBCHEM 000950765.mol (via Jmol)
000950792.b3lyp_6-31g(d).inp

000950792.b3lyp_6-31g(d).qchem.inp (generated)

000950792.b3lyp_6-31g(d).gjf (generated)

000950792.b3lyp_6-31g(d).firefly.inp (generated)

000950792.b3lyp_6-31g(d).smash.inp (generated)

000950792.b3lyp_6-31g(d).nwchem.inp (generated) 000950792.b3lyp_6-31g(d).log.xz 000950792.mol 000950792.PUBCHEM 000950792.mol (via Jmol)
000950807.b3lyp_6-31g(d).inp

000950807.b3lyp_6-31g(d).qchem.inp (generated)

000950807.b3lyp_6-31g(d).gjf (generated)

000950807.b3lyp_6-31g(d).firefly.inp (generated)

000950807.b3lyp_6-31g(d).smash.inp (generated)

000950807.b3lyp_6-31g(d).nwchem.inp (generated) 000950807.b3lyp_6-31g(d).log.xz 000950807.td-b3lyp_6-31g+(d).inp 000950807.td-b3lyp_6-31g+(d).log.xz

000950807.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950807.td-b3lyp_6-31+g(d).gjf (generated)

000950807.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950807.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950807.mol 000950807.PUBCHEM 000950807.mol (via Jmol)
000950831.b3lyp_6-31g(d).inp

000950831.b3lyp_6-31g(d).qchem.inp (generated)

000950831.b3lyp_6-31g(d).gjf (generated)

000950831.b3lyp_6-31g(d).firefly.inp (generated)

000950831.b3lyp_6-31g(d).smash.inp (generated)

000950831.b3lyp_6-31g(d).nwchem.inp (generated) 000950831.b3lyp_6-31g(d).log.xz 000950831.td-b3lyp_6-31g+(d).inp 000950831.td-b3lyp_6-31g+(d).log.xz

000950831.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950831.td-b3lyp_6-31+g(d).gjf (generated)

000950831.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950831.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950831.mol 000950831.PUBCHEM 000950831.mol (via Jmol)
000950840.b3lyp_6-31g(d).inp

000950840.b3lyp_6-31g(d).qchem.inp (generated)

000950840.b3lyp_6-31g(d).gjf (generated)

000950840.b3lyp_6-31g(d).firefly.inp (generated)

000950840.b3lyp_6-31g(d).smash.inp (generated)

000950840.b3lyp_6-31g(d).nwchem.inp (generated) 000950840.b3lyp_6-31g(d).log.xz 000950840.td-b3lyp_6-31g+(d).inp 000950840.td-b3lyp_6-31g+(d).log.xz

000950840.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950840.td-b3lyp_6-31+g(d).gjf (generated)

000950840.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950840.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950840.mol 000950840.PUBCHEM 000950840.mol (via Jmol)
000950841.b3lyp_6-31g(d).inp

000950841.b3lyp_6-31g(d).qchem.inp (generated)

000950841.b3lyp_6-31g(d).gjf (generated)

000950841.b3lyp_6-31g(d).firefly.inp (generated)

000950841.b3lyp_6-31g(d).smash.inp (generated)

000950841.b3lyp_6-31g(d).nwchem.inp (generated) 000950841.b3lyp_6-31g(d).log.xz 000950841.td-b3lyp_6-31g+(d).inp 000950841.td-b3lyp_6-31g+(d).log.xz

000950841.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950841.td-b3lyp_6-31+g(d).gjf (generated)

000950841.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950841.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950841.mol 000950841.PUBCHEM 000950841.mol (via Jmol)
000950861.b3lyp_6-31g(d).inp

000950861.b3lyp_6-31g(d).qchem.inp (generated)

000950861.b3lyp_6-31g(d).gjf (generated)

000950861.b3lyp_6-31g(d).firefly.inp (generated)

000950861.b3lyp_6-31g(d).smash.inp (generated)

000950861.b3lyp_6-31g(d).nwchem.inp (generated) 000950861.b3lyp_6-31g(d).log.xz 000950861.td-b3lyp_6-31g+(d).inp 000950861.td-b3lyp_6-31g+(d).log.xz

000950861.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950861.td-b3lyp_6-31+g(d).gjf (generated)

000950861.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950861.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950861.mol 000950861.PUBCHEM 000950861.mol (via Jmol)
000950881.b3lyp_6-31g(d).inp

000950881.b3lyp_6-31g(d).qchem.inp (generated)

000950881.b3lyp_6-31g(d).gjf (generated)

000950881.b3lyp_6-31g(d).firefly.inp (generated)

000950881.b3lyp_6-31g(d).smash.inp (generated)

000950881.b3lyp_6-31g(d).nwchem.inp (generated) 000950881.b3lyp_6-31g(d).log.xz 000950881.td-b3lyp_6-31g+(d).inp 000950881.td-b3lyp_6-31g+(d).log.xz

000950881.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950881.td-b3lyp_6-31+g(d).gjf (generated)

000950881.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950881.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950881.mol 000950881.PUBCHEM 000950881.mol (via Jmol)
000950890.b3lyp_6-31g(d).inp

000950890.b3lyp_6-31g(d).qchem.inp (generated)

000950890.b3lyp_6-31g(d).gjf (generated)

000950890.b3lyp_6-31g(d).firefly.inp (generated)

000950890.b3lyp_6-31g(d).smash.inp (generated)

000950890.b3lyp_6-31g(d).nwchem.inp (generated) 000950890.b3lyp_6-31g(d).log.xz 000950890.td-b3lyp_6-31g+(d).inp 000950890.td-b3lyp_6-31g+(d).log.xz

000950890.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950890.td-b3lyp_6-31+g(d).gjf (generated)

000950890.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950890.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950890.mol 000950890.PUBCHEM 000950890.mol (via Jmol)
000950894.b3lyp_6-31g(d).inp

000950894.b3lyp_6-31g(d).qchem.inp (generated)

000950894.b3lyp_6-31g(d).gjf (generated)

000950894.b3lyp_6-31g(d).firefly.inp (generated)

000950894.b3lyp_6-31g(d).smash.inp (generated)

000950894.b3lyp_6-31g(d).nwchem.inp (generated) 000950894.b3lyp_6-31g(d).log.xz 000950894.td-b3lyp_6-31g+(d).inp 000950894.td-b3lyp_6-31g+(d).log.xz

000950894.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950894.td-b3lyp_6-31+g(d).gjf (generated)

000950894.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950894.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950894.mol 000950894.PUBCHEM 000950894.mol (via Jmol)
000950908.b3lyp_6-31g(d).inp

000950908.b3lyp_6-31g(d).qchem.inp (generated)

000950908.b3lyp_6-31g(d).gjf (generated)

000950908.b3lyp_6-31g(d).firefly.inp (generated)

000950908.b3lyp_6-31g(d).smash.inp (generated)

000950908.b3lyp_6-31g(d).nwchem.inp (generated) 000950908.b3lyp_6-31g(d).log.xz 000950908.td-b3lyp_6-31g+(d).inp 000950908.td-b3lyp_6-31g+(d).log.xz

000950908.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950908.td-b3lyp_6-31+g(d).gjf (generated)

000950908.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950908.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950908.mol 000950908.PUBCHEM 000950908.mol (via Jmol)
000950969.b3lyp_6-31g(d).inp

000950969.b3lyp_6-31g(d).qchem.inp (generated)

000950969.b3lyp_6-31g(d).gjf (generated)

000950969.b3lyp_6-31g(d).firefly.inp (generated)

000950969.b3lyp_6-31g(d).smash.inp (generated)

000950969.b3lyp_6-31g(d).nwchem.inp (generated) 000950969.b3lyp_6-31g(d).log.xz 000950969.td-b3lyp_6-31g+(d).inp 000950969.td-b3lyp_6-31g+(d).log.xz

000950969.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950969.td-b3lyp_6-31+g(d).gjf (generated)

000950969.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950969.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950969.mol 000950969.PUBCHEM 000950969.mol (via Jmol)
000950970.b3lyp_6-31g(d).inp

000950970.b3lyp_6-31g(d).qchem.inp (generated)

000950970.b3lyp_6-31g(d).gjf (generated)

000950970.b3lyp_6-31g(d).firefly.inp (generated)

000950970.b3lyp_6-31g(d).smash.inp (generated)

000950970.b3lyp_6-31g(d).nwchem.inp (generated) 000950970.b3lyp_6-31g(d).log.xz 000950970.td-b3lyp_6-31g+(d).inp 000950970.td-b3lyp_6-31g+(d).log.xz

000950970.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950970.td-b3lyp_6-31+g(d).gjf (generated)

000950970.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950970.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950970.mol 000950970.PUBCHEM 000950970.mol (via Jmol)
000950989.b3lyp_6-31g(d).inp

000950989.b3lyp_6-31g(d).qchem.inp (generated)

000950989.b3lyp_6-31g(d).gjf (generated)

000950989.b3lyp_6-31g(d).firefly.inp (generated)

000950989.b3lyp_6-31g(d).smash.inp (generated)

000950989.b3lyp_6-31g(d).nwchem.inp (generated) 000950989.b3lyp_6-31g(d).log.xz 000950989.td-b3lyp_6-31g+(d).inp 000950989.td-b3lyp_6-31g+(d).log.xz

000950989.td-b3lyp_6-31+g(d).qchem.inp (generated)

000950989.td-b3lyp_6-31+g(d).gjf (generated)

000950989.td-b3lyp_6-31+g(d).firefly.inp (generated)

000950989.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000950989.mol 000950989.PUBCHEM 000950989.mol (via Jmol)
000951001.b3lyp_6-31g(d).inp

000951001.b3lyp_6-31g(d).qchem.inp (generated)

000951001.b3lyp_6-31g(d).gjf (generated)

000951001.b3lyp_6-31g(d).firefly.inp (generated)

000951001.b3lyp_6-31g(d).smash.inp (generated)

000951001.b3lyp_6-31g(d).nwchem.inp (generated) 000951001.b3lyp_6-31g(d).log.xz 000951001.td-b3lyp_6-31g+(d).inp 000951001.td-b3lyp_6-31g+(d).log.xz

000951001.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951001.td-b3lyp_6-31+g(d).gjf (generated)

000951001.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951001.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951001.mol 000951001.PUBCHEM 000951001.mol (via Jmol)
000951003.b3lyp_6-31g(d).inp

000951003.b3lyp_6-31g(d).qchem.inp (generated)

000951003.b3lyp_6-31g(d).gjf (generated)

000951003.b3lyp_6-31g(d).firefly.inp (generated)

000951003.b3lyp_6-31g(d).smash.inp (generated)

000951003.b3lyp_6-31g(d).nwchem.inp (generated) 000951003.b3lyp_6-31g(d).log.xz 000951003.td-b3lyp_6-31g+(d).inp 000951003.td-b3lyp_6-31g+(d).log.xz

000951003.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951003.td-b3lyp_6-31+g(d).gjf (generated)

000951003.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951003.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951003.mol 000951003.PUBCHEM 000951003.mol (via Jmol)
000951048.b3lyp_6-31g(d).inp

000951048.b3lyp_6-31g(d).qchem.inp (generated)

000951048.b3lyp_6-31g(d).gjf (generated)

000951048.b3lyp_6-31g(d).firefly.inp (generated)

000951048.b3lyp_6-31g(d).smash.inp (generated)

000951048.b3lyp_6-31g(d).nwchem.inp (generated) 000951048.b3lyp_6-31g(d).log.xz 000951048.mol 000951048.PUBCHEM 000951048.mol (via Jmol)
000951049.b3lyp_6-31g(d).inp

000951049.b3lyp_6-31g(d).qchem.inp (generated)

000951049.b3lyp_6-31g(d).gjf (generated)

000951049.b3lyp_6-31g(d).firefly.inp (generated)

000951049.b3lyp_6-31g(d).smash.inp (generated)

000951049.b3lyp_6-31g(d).nwchem.inp (generated) 000951049.b3lyp_6-31g(d).log.xz 000951049.mol 000951049.PUBCHEM 000951049.mol (via Jmol)
000951054.b3lyp_6-31g(d).inp

000951054.b3lyp_6-31g(d).qchem.inp (generated)

000951054.b3lyp_6-31g(d).gjf (generated)

000951054.b3lyp_6-31g(d).firefly.inp (generated)

000951054.b3lyp_6-31g(d).smash.inp (generated)

000951054.b3lyp_6-31g(d).nwchem.inp (generated) 000951054.b3lyp_6-31g(d).log.xz 000951054.td-b3lyp_6-31g+(d).inp 000951054.td-b3lyp_6-31g+(d).log.xz

000951054.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951054.td-b3lyp_6-31+g(d).gjf (generated)

000951054.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951054.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951054.mol 000951054.PUBCHEM 000951054.mol (via Jmol)
000951068.b3lyp_6-31g(d).inp

000951068.b3lyp_6-31g(d).qchem.inp (generated)

000951068.b3lyp_6-31g(d).gjf (generated)

000951068.b3lyp_6-31g(d).firefly.inp (generated)

000951068.b3lyp_6-31g(d).smash.inp (generated)

000951068.b3lyp_6-31g(d).nwchem.inp (generated) 000951068.b3lyp_6-31g(d).log.xz 000951068.td-b3lyp_6-31g+(d).inp 000951068.td-b3lyp_6-31g+(d).log.xz

000951068.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951068.td-b3lyp_6-31+g(d).gjf (generated)

000951068.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951068.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951068.mol 000951068.PUBCHEM 000951068.mol (via Jmol)
000951105.b3lyp_6-31g(d).inp

000951105.b3lyp_6-31g(d).qchem.inp (generated)

000951105.b3lyp_6-31g(d).gjf (generated)

000951105.b3lyp_6-31g(d).firefly.inp (generated)

000951105.b3lyp_6-31g(d).smash.inp (generated)

000951105.b3lyp_6-31g(d).nwchem.inp (generated) 000951105.b3lyp_6-31g(d).log.xz 000951105.td-b3lyp_6-31g+(d).inp 000951105.td-b3lyp_6-31g+(d).log.xz

000951105.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951105.td-b3lyp_6-31+g(d).gjf (generated)

000951105.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951105.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951105.mol 000951105.PUBCHEM 000951105.mol (via Jmol)
000951107.b3lyp_6-31g(d).inp

000951107.b3lyp_6-31g(d).qchem.inp (generated)

000951107.b3lyp_6-31g(d).gjf (generated)

000951107.b3lyp_6-31g(d).firefly.inp (generated)

000951107.b3lyp_6-31g(d).smash.inp (generated)

000951107.b3lyp_6-31g(d).nwchem.inp (generated) 000951107.b3lyp_6-31g(d).log.xz 000951107.mol 000951107.PUBCHEM 000951107.mol (via Jmol)
000951108.b3lyp_6-31g(d).inp

000951108.b3lyp_6-31g(d).qchem.inp (generated)

000951108.b3lyp_6-31g(d).gjf (generated)

000951108.b3lyp_6-31g(d).firefly.inp (generated)

000951108.b3lyp_6-31g(d).smash.inp (generated)

000951108.b3lyp_6-31g(d).nwchem.inp (generated) 000951108.b3lyp_6-31g(d).log.xz 000951108.mol 000951108.PUBCHEM 000951108.mol (via Jmol)
000951152.b3lyp_6-31g(d).inp

000951152.b3lyp_6-31g(d).qchem.inp (generated)

000951152.b3lyp_6-31g(d).gjf (generated)

000951152.b3lyp_6-31g(d).firefly.inp (generated)

000951152.b3lyp_6-31g(d).smash.inp (generated)

000951152.b3lyp_6-31g(d).nwchem.inp (generated) 000951152.b3lyp_6-31g(d).log.xz 000951152.td-b3lyp_6-31g+(d).inp 000951152.td-b3lyp_6-31g+(d).log.xz

000951152.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951152.td-b3lyp_6-31+g(d).gjf (generated)

000951152.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951152.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951152.mol 000951152.PUBCHEM 000951152.mol (via Jmol)
000951157.b3lyp_6-31g(d).inp

000951157.b3lyp_6-31g(d).qchem.inp (generated)

000951157.b3lyp_6-31g(d).gjf (generated)

000951157.b3lyp_6-31g(d).firefly.inp (generated)

000951157.b3lyp_6-31g(d).smash.inp (generated)

000951157.b3lyp_6-31g(d).nwchem.inp (generated) 000951157.b3lyp_6-31g(d).log.xz 000951157.td-b3lyp_6-31g+(d).inp 000951157.td-b3lyp_6-31g+(d).log.xz

000951157.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951157.td-b3lyp_6-31+g(d).gjf (generated)

000951157.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951157.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951157.mol 000951157.PUBCHEM 000951157.mol (via Jmol)
000951200.b3lyp_6-31g(d).inp

000951200.b3lyp_6-31g(d).qchem.inp (generated)

000951200.b3lyp_6-31g(d).gjf (generated)

000951200.b3lyp_6-31g(d).firefly.inp (generated)

000951200.b3lyp_6-31g(d).smash.inp (generated)

000951200.b3lyp_6-31g(d).nwchem.inp (generated) 000951200.b3lyp_6-31g(d).log.xz 000951200.td-b3lyp_6-31g+(d).inp 000951200.td-b3lyp_6-31g+(d).log.xz

000951200.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951200.td-b3lyp_6-31+g(d).gjf (generated)

000951200.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951200.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951200.mol 000951200.PUBCHEM 000951200.mol (via Jmol)
000951232.b3lyp_6-31g(d).inp

000951232.b3lyp_6-31g(d).qchem.inp (generated)

000951232.b3lyp_6-31g(d).gjf (generated)

000951232.b3lyp_6-31g(d).firefly.inp (generated)

000951232.b3lyp_6-31g(d).smash.inp (generated)

000951232.b3lyp_6-31g(d).nwchem.inp (generated) 000951232.b3lyp_6-31g(d).log.xz 000951232.mol 000951232.PUBCHEM 000951232.mol (via Jmol)
000951283.b3lyp_6-31g(d).inp

000951283.b3lyp_6-31g(d).qchem.inp (generated)

000951283.b3lyp_6-31g(d).gjf (generated)

000951283.b3lyp_6-31g(d).firefly.inp (generated)

000951283.b3lyp_6-31g(d).smash.inp (generated)

000951283.b3lyp_6-31g(d).nwchem.inp (generated) 000951283.b3lyp_6-31g(d).log.xz 000951283.td-b3lyp_6-31g+(d).inp 000951283.td-b3lyp_6-31g+(d).log.xz

000951283.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951283.td-b3lyp_6-31+g(d).gjf (generated)

000951283.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951283.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951283.mol 000951283.PUBCHEM 000951283.mol (via Jmol)
000951348.b3lyp_6-31g(d).inp

000951348.b3lyp_6-31g(d).qchem.inp (generated)

000951348.b3lyp_6-31g(d).gjf (generated)

000951348.b3lyp_6-31g(d).firefly.inp (generated)

000951348.b3lyp_6-31g(d).smash.inp (generated)

000951348.b3lyp_6-31g(d).nwchem.inp (generated) 000951348.b3lyp_6-31g(d).log.xz 000951348.td-b3lyp_6-31g+(d).inp 000951348.td-b3lyp_6-31g+(d).log.xz

000951348.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951348.td-b3lyp_6-31+g(d).gjf (generated)

000951348.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951348.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951348.mol 000951348.PUBCHEM 000951348.mol (via Jmol)
000951359.b3lyp_6-31g(d).inp

000951359.b3lyp_6-31g(d).qchem.inp (generated)

000951359.b3lyp_6-31g(d).gjf (generated)

000951359.b3lyp_6-31g(d).firefly.inp (generated)

000951359.b3lyp_6-31g(d).smash.inp (generated)

000951359.b3lyp_6-31g(d).nwchem.inp (generated) 000951359.b3lyp_6-31g(d).log.xz 000951359.td-b3lyp_6-31g+(d).inp 000951359.td-b3lyp_6-31g+(d).log.xz

000951359.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951359.td-b3lyp_6-31+g(d).gjf (generated)

000951359.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951359.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951359.mol 000951359.PUBCHEM 000951359.mol (via Jmol)
000951378.b3lyp_6-31g(d).inp

000951378.b3lyp_6-31g(d).qchem.inp (generated)

000951378.b3lyp_6-31g(d).gjf (generated)

000951378.b3lyp_6-31g(d).firefly.inp (generated)

000951378.b3lyp_6-31g(d).smash.inp (generated)

000951378.b3lyp_6-31g(d).nwchem.inp (generated) 000951378.b3lyp_6-31g(d).log.xz 000951378.td-b3lyp_6-31g+(d).inp 000951378.td-b3lyp_6-31g+(d).log.xz

000951378.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951378.td-b3lyp_6-31+g(d).gjf (generated)

000951378.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951378.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951378.mol 000951378.PUBCHEM 000951378.mol (via Jmol)
000951381.b3lyp_6-31g(d).inp

000951381.b3lyp_6-31g(d).qchem.inp (generated)

000951381.b3lyp_6-31g(d).gjf (generated)

000951381.b3lyp_6-31g(d).firefly.inp (generated)

000951381.b3lyp_6-31g(d).smash.inp (generated)

000951381.b3lyp_6-31g(d).nwchem.inp (generated) 000951381.b3lyp_6-31g(d).log.xz 000951381.td-b3lyp_6-31g+(d).inp 000951381.td-b3lyp_6-31g+(d).log.xz

000951381.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951381.td-b3lyp_6-31+g(d).gjf (generated)

000951381.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951381.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951381.mol 000951381.PUBCHEM 000951381.mol (via Jmol)
000951382.b3lyp_6-31g(d).inp

000951382.b3lyp_6-31g(d).qchem.inp (generated)

000951382.b3lyp_6-31g(d).gjf (generated)

000951382.b3lyp_6-31g(d).firefly.inp (generated)

000951382.b3lyp_6-31g(d).smash.inp (generated)

000951382.b3lyp_6-31g(d).nwchem.inp (generated) 000951382.b3lyp_6-31g(d).log.xz 000951382.td-b3lyp_6-31g+(d).inp 000951382.td-b3lyp_6-31g+(d).log.xz

000951382.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951382.td-b3lyp_6-31+g(d).gjf (generated)

000951382.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951382.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951382.mol 000951382.PUBCHEM 000951382.mol (via Jmol)
000951427.b3lyp_6-31g(d).inp

000951427.b3lyp_6-31g(d).qchem.inp (generated)

000951427.b3lyp_6-31g(d).gjf (generated)

000951427.b3lyp_6-31g(d).firefly.inp (generated)

000951427.b3lyp_6-31g(d).smash.inp (generated)

000951427.b3lyp_6-31g(d).nwchem.inp (generated) 000951427.b3lyp_6-31g(d).log.xz 000951427.td-b3lyp_6-31g+(d).inp 000951427.td-b3lyp_6-31g+(d).log.xz

000951427.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951427.td-b3lyp_6-31+g(d).gjf (generated)

000951427.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951427.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951427.mol 000951427.PUBCHEM 000951427.mol (via Jmol)
000951477.b3lyp_6-31g(d).inp

000951477.b3lyp_6-31g(d).qchem.inp (generated)

000951477.b3lyp_6-31g(d).gjf (generated)

000951477.b3lyp_6-31g(d).firefly.inp (generated)

000951477.b3lyp_6-31g(d).smash.inp (generated)

000951477.b3lyp_6-31g(d).nwchem.inp (generated) 000951477.b3lyp_6-31g(d).log.xz 000951477.td-b3lyp_6-31g+(d).inp 000951477.td-b3lyp_6-31g+(d).log.xz

000951477.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951477.td-b3lyp_6-31+g(d).gjf (generated)

000951477.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951477.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951477.mol 000951477.PUBCHEM 000951477.mol (via Jmol)
000951594.b3lyp_6-31g(d).inp

000951594.b3lyp_6-31g(d).qchem.inp (generated)

000951594.b3lyp_6-31g(d).gjf (generated)

000951594.b3lyp_6-31g(d).firefly.inp (generated)

000951594.b3lyp_6-31g(d).smash.inp (generated)

000951594.b3lyp_6-31g(d).nwchem.inp (generated) 000951594.b3lyp_6-31g(d).log.xz 000951594.td-b3lyp_6-31g+(d).inp 000951594.td-b3lyp_6-31g+(d).log.xz

000951594.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951594.td-b3lyp_6-31+g(d).gjf (generated)

000951594.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951594.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951594.mol 000951594.PUBCHEM 000951594.mol (via Jmol)
000951595.b3lyp_6-31g(d).inp

000951595.b3lyp_6-31g(d).qchem.inp (generated)

000951595.b3lyp_6-31g(d).gjf (generated)

000951595.b3lyp_6-31g(d).firefly.inp (generated)

000951595.b3lyp_6-31g(d).smash.inp (generated)

000951595.b3lyp_6-31g(d).nwchem.inp (generated) 000951595.b3lyp_6-31g(d).log.xz 000951595.td-b3lyp_6-31g+(d).inp 000951595.td-b3lyp_6-31g+(d).log.xz

000951595.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951595.td-b3lyp_6-31+g(d).gjf (generated)

000951595.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951595.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951595.mol 000951595.PUBCHEM 000951595.mol (via Jmol)
000951601.b3lyp_6-31g(d).inp

000951601.b3lyp_6-31g(d).qchem.inp (generated)

000951601.b3lyp_6-31g(d).gjf (generated)

000951601.b3lyp_6-31g(d).firefly.inp (generated)

000951601.b3lyp_6-31g(d).smash.inp (generated)

000951601.b3lyp_6-31g(d).nwchem.inp (generated) 000951601.b3lyp_6-31g(d).log.xz 000951601.td-b3lyp_6-31g+(d).inp 000951601.td-b3lyp_6-31g+(d).log.xz

000951601.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951601.td-b3lyp_6-31+g(d).gjf (generated)

000951601.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951601.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951601.mol 000951601.PUBCHEM 000951601.mol (via Jmol)
000951604.b3lyp_6-31g(d).inp

000951604.b3lyp_6-31g(d).qchem.inp (generated)

000951604.b3lyp_6-31g(d).gjf (generated)

000951604.b3lyp_6-31g(d).firefly.inp (generated)

000951604.b3lyp_6-31g(d).smash.inp (generated)

000951604.b3lyp_6-31g(d).nwchem.inp (generated) 000951604.b3lyp_6-31g(d).log.xz 000951604.td-b3lyp_6-31g+(d).inp 000951604.td-b3lyp_6-31g+(d).log.xz

000951604.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951604.td-b3lyp_6-31+g(d).gjf (generated)

000951604.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951604.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951604.mol 000951604.PUBCHEM 000951604.mol (via Jmol)
000951605.b3lyp_6-31g(d).inp

000951605.b3lyp_6-31g(d).qchem.inp (generated)

000951605.b3lyp_6-31g(d).gjf (generated)

000951605.b3lyp_6-31g(d).firefly.inp (generated)

000951605.b3lyp_6-31g(d).smash.inp (generated)

000951605.b3lyp_6-31g(d).nwchem.inp (generated) 000951605.b3lyp_6-31g(d).log.xz 000951605.td-b3lyp_6-31g+(d).inp 000951605.td-b3lyp_6-31g+(d).log.xz

000951605.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951605.td-b3lyp_6-31+g(d).gjf (generated)

000951605.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951605.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951605.mol 000951605.PUBCHEM 000951605.mol (via Jmol)
000951623.b3lyp_6-31g(d).inp

000951623.b3lyp_6-31g(d).qchem.inp (generated)

000951623.b3lyp_6-31g(d).gjf (generated)

000951623.b3lyp_6-31g(d).firefly.inp (generated)

000951623.b3lyp_6-31g(d).smash.inp (generated)

000951623.b3lyp_6-31g(d).nwchem.inp (generated) 000951623.b3lyp_6-31g(d).log.xz 000951623.td-b3lyp_6-31g+(d).inp 000951623.td-b3lyp_6-31g+(d).log.xz

000951623.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951623.td-b3lyp_6-31+g(d).gjf (generated)

000951623.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951623.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951623.mol 000951623.PUBCHEM 000951623.mol (via Jmol)
000951646.b3lyp_6-31g(d).inp

000951646.b3lyp_6-31g(d).qchem.inp (generated)

000951646.b3lyp_6-31g(d).gjf (generated)

000951646.b3lyp_6-31g(d).firefly.inp (generated)

000951646.b3lyp_6-31g(d).smash.inp (generated)

000951646.b3lyp_6-31g(d).nwchem.inp (generated) 000951646.b3lyp_6-31g(d).log.xz 000951646.td-b3lyp_6-31g+(d).inp 000951646.td-b3lyp_6-31g+(d).log.xz

000951646.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951646.td-b3lyp_6-31+g(d).gjf (generated)

000951646.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951646.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951646.mol 000951646.PUBCHEM 000951646.mol (via Jmol)
000951671.b3lyp_6-31g(d).inp

000951671.b3lyp_6-31g(d).qchem.inp (generated)

000951671.b3lyp_6-31g(d).gjf (generated)

000951671.b3lyp_6-31g(d).firefly.inp (generated)

000951671.b3lyp_6-31g(d).smash.inp (generated)

000951671.b3lyp_6-31g(d).nwchem.inp (generated) 000951671.b3lyp_6-31g(d).log.xz 000951671.mol 000951671.PUBCHEM 000951671.mol (via Jmol)
000951681.b3lyp_6-31g(d).inp

000951681.b3lyp_6-31g(d).qchem.inp (generated)

000951681.b3lyp_6-31g(d).gjf (generated)

000951681.b3lyp_6-31g(d).firefly.inp (generated)

000951681.b3lyp_6-31g(d).smash.inp (generated)

000951681.b3lyp_6-31g(d).nwchem.inp (generated) 000951681.b3lyp_6-31g(d).log.xz 000951681.td-b3lyp_6-31g+(d).inp 000951681.td-b3lyp_6-31g+(d).log.xz

000951681.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951681.td-b3lyp_6-31+g(d).gjf (generated)

000951681.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951681.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951681.mol 000951681.PUBCHEM 000951681.mol (via Jmol)
000951683.b3lyp_6-31g(d).inp

000951683.b3lyp_6-31g(d).qchem.inp (generated)

000951683.b3lyp_6-31g(d).gjf (generated)

000951683.b3lyp_6-31g(d).firefly.inp (generated)

000951683.b3lyp_6-31g(d).smash.inp (generated)

000951683.b3lyp_6-31g(d).nwchem.inp (generated) 000951683.b3lyp_6-31g(d).log.xz 000951683.td-b3lyp_6-31g+(d).inp 000951683.td-b3lyp_6-31g+(d).log.xz

000951683.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951683.td-b3lyp_6-31+g(d).gjf (generated)

000951683.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951683.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951683.mol 000951683.PUBCHEM 000951683.mol (via Jmol)
000951702.b3lyp_6-31g(d).inp

000951702.b3lyp_6-31g(d).qchem.inp (generated)

000951702.b3lyp_6-31g(d).gjf (generated)

000951702.b3lyp_6-31g(d).firefly.inp (generated)

000951702.b3lyp_6-31g(d).smash.inp (generated)

000951702.b3lyp_6-31g(d).nwchem.inp (generated) 000951702.b3lyp_6-31g(d).log.xz 000951702.td-b3lyp_6-31g+(d).inp 000951702.td-b3lyp_6-31g+(d).log.xz

000951702.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951702.td-b3lyp_6-31+g(d).gjf (generated)

000951702.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951702.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951702.mol 000951702.PUBCHEM 000951702.mol (via Jmol)
000951732.b3lyp_6-31g(d).inp

000951732.b3lyp_6-31g(d).qchem.inp (generated)

000951732.b3lyp_6-31g(d).gjf (generated)

000951732.b3lyp_6-31g(d).firefly.inp (generated)

000951732.b3lyp_6-31g(d).smash.inp (generated)

000951732.b3lyp_6-31g(d).nwchem.inp (generated) 000951732.b3lyp_6-31g(d).log.xz 000951732.td-b3lyp_6-31g+(d).inp 000951732.td-b3lyp_6-31g+(d).log.xz

000951732.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951732.td-b3lyp_6-31+g(d).gjf (generated)

000951732.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951732.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951732.mol 000951732.PUBCHEM 000951732.mol (via Jmol)
000951763.b3lyp_6-31g(d).inp

000951763.b3lyp_6-31g(d).qchem.inp (generated)

000951763.b3lyp_6-31g(d).gjf (generated)

000951763.b3lyp_6-31g(d).firefly.inp (generated)

000951763.b3lyp_6-31g(d).smash.inp (generated)

000951763.b3lyp_6-31g(d).nwchem.inp (generated) 000951763.b3lyp_6-31g(d).log.xz 000951763.td-b3lyp_6-31g+(d).inp 000951763.td-b3lyp_6-31g+(d).log.xz

000951763.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951763.td-b3lyp_6-31+g(d).gjf (generated)

000951763.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951763.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951763.mol 000951763.PUBCHEM 000951763.mol (via Jmol)
000951766.b3lyp_6-31g(d).inp

000951766.b3lyp_6-31g(d).qchem.inp (generated)

000951766.b3lyp_6-31g(d).gjf (generated)

000951766.b3lyp_6-31g(d).firefly.inp (generated)

000951766.b3lyp_6-31g(d).smash.inp (generated)

000951766.b3lyp_6-31g(d).nwchem.inp (generated) 000951766.b3lyp_6-31g(d).log.xz 000951766.td-b3lyp_6-31g+(d).inp 000951766.td-b3lyp_6-31g+(d).log.xz

000951766.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951766.td-b3lyp_6-31+g(d).gjf (generated)

000951766.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951766.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951766.mol 000951766.PUBCHEM 000951766.mol (via Jmol)
000951798.b3lyp_6-31g(d).inp

000951798.b3lyp_6-31g(d).qchem.inp (generated)

000951798.b3lyp_6-31g(d).gjf (generated)

000951798.b3lyp_6-31g(d).firefly.inp (generated)

000951798.b3lyp_6-31g(d).smash.inp (generated)

000951798.b3lyp_6-31g(d).nwchem.inp (generated) 000951798.b3lyp_6-31g(d).log.xz 000951798.td-b3lyp_6-31g+(d).inp 000951798.td-b3lyp_6-31g+(d).log.xz

000951798.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951798.td-b3lyp_6-31+g(d).gjf (generated)

000951798.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951798.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951798.mol 000951798.PUBCHEM 000951798.mol (via Jmol)
000951812.b3lyp_6-31g(d).inp

000951812.b3lyp_6-31g(d).qchem.inp (generated)

000951812.b3lyp_6-31g(d).gjf (generated)

000951812.b3lyp_6-31g(d).firefly.inp (generated)

000951812.b3lyp_6-31g(d).smash.inp (generated)

000951812.b3lyp_6-31g(d).nwchem.inp (generated) 000951812.b3lyp_6-31g(d).log.xz 000951812.td-b3lyp_6-31g+(d).inp 000951812.td-b3lyp_6-31g+(d).log.xz

000951812.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951812.td-b3lyp_6-31+g(d).gjf (generated)

000951812.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951812.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951812.mol 000951812.PUBCHEM 000951812.mol (via Jmol)
000951870.b3lyp_6-31g(d).inp

000951870.b3lyp_6-31g(d).qchem.inp (generated)

000951870.b3lyp_6-31g(d).gjf (generated)

000951870.b3lyp_6-31g(d).firefly.inp (generated)

000951870.b3lyp_6-31g(d).smash.inp (generated)

000951870.b3lyp_6-31g(d).nwchem.inp (generated) 000951870.b3lyp_6-31g(d).log.xz 000951870.td-b3lyp_6-31g+(d).inp 000951870.td-b3lyp_6-31g+(d).log.xz

000951870.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951870.td-b3lyp_6-31+g(d).gjf (generated)

000951870.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951870.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951870.mol 000951870.PUBCHEM 000951870.mol (via Jmol)
000951871.b3lyp_6-31g(d).inp

000951871.b3lyp_6-31g(d).qchem.inp (generated)

000951871.b3lyp_6-31g(d).gjf (generated)

000951871.b3lyp_6-31g(d).firefly.inp (generated)

000951871.b3lyp_6-31g(d).smash.inp (generated)

000951871.b3lyp_6-31g(d).nwchem.inp (generated) 000951871.b3lyp_6-31g(d).log.xz 000951871.mol 000951871.PUBCHEM 000951871.mol (via Jmol)
000951872.b3lyp_6-31g(d).inp

000951872.b3lyp_6-31g(d).qchem.inp (generated)

000951872.b3lyp_6-31g(d).gjf (generated)

000951872.b3lyp_6-31g(d).firefly.inp (generated)

000951872.b3lyp_6-31g(d).smash.inp (generated)

000951872.b3lyp_6-31g(d).nwchem.inp (generated) 000951872.b3lyp_6-31g(d).log.xz 000951872.mol 000951872.PUBCHEM 000951872.mol (via Jmol)
000951873.b3lyp_6-31g(d).inp

000951873.b3lyp_6-31g(d).qchem.inp (generated)

000951873.b3lyp_6-31g(d).gjf (generated)

000951873.b3lyp_6-31g(d).firefly.inp (generated)

000951873.b3lyp_6-31g(d).smash.inp (generated)

000951873.b3lyp_6-31g(d).nwchem.inp (generated) 000951873.b3lyp_6-31g(d).log.xz 000951873.mol 000951873.PUBCHEM 000951873.mol (via Jmol)
000951874.b3lyp_6-31g(d).inp

000951874.b3lyp_6-31g(d).qchem.inp (generated)

000951874.b3lyp_6-31g(d).gjf (generated)

000951874.b3lyp_6-31g(d).firefly.inp (generated)

000951874.b3lyp_6-31g(d).smash.inp (generated)

000951874.b3lyp_6-31g(d).nwchem.inp (generated) 000951874.b3lyp_6-31g(d).log.xz 000951874.td-b3lyp_6-31g+(d).inp 000951874.td-b3lyp_6-31g+(d).log.xz

000951874.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951874.td-b3lyp_6-31+g(d).gjf (generated)

000951874.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951874.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951874.mol 000951874.PUBCHEM 000951874.mol (via Jmol)
000951876.b3lyp_6-31g(d).inp

000951876.b3lyp_6-31g(d).qchem.inp (generated)

000951876.b3lyp_6-31g(d).gjf (generated)

000951876.b3lyp_6-31g(d).firefly.inp (generated)

000951876.b3lyp_6-31g(d).smash.inp (generated)

000951876.b3lyp_6-31g(d).nwchem.inp (generated) 000951876.b3lyp_6-31g(d).log.xz 000951876.mol 000951876.PUBCHEM 000951876.mol (via Jmol)
000951886.b3lyp_6-31g(d).inp

000951886.b3lyp_6-31g(d).qchem.inp (generated)

000951886.b3lyp_6-31g(d).gjf (generated)

000951886.b3lyp_6-31g(d).firefly.inp (generated)

000951886.b3lyp_6-31g(d).smash.inp (generated)

000951886.b3lyp_6-31g(d).nwchem.inp (generated) 000951886.b3lyp_6-31g(d).log.xz 000951886.mol 000951886.PUBCHEM 000951886.mol (via Jmol)
000951951.b3lyp_6-31g(d).inp

000951951.b3lyp_6-31g(d).qchem.inp (generated)

000951951.b3lyp_6-31g(d).gjf (generated)

000951951.b3lyp_6-31g(d).firefly.inp (generated)

000951951.b3lyp_6-31g(d).smash.inp (generated)

000951951.b3lyp_6-31g(d).nwchem.inp (generated) 000951951.b3lyp_6-31g(d).log.xz 000951951.td-b3lyp_6-31g+(d).inp 000951951.td-b3lyp_6-31g+(d).log.xz

000951951.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951951.td-b3lyp_6-31+g(d).gjf (generated)

000951951.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951951.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951951.mol 000951951.PUBCHEM 000951951.mol (via Jmol)
000951953.b3lyp_6-31g(d).inp

000951953.b3lyp_6-31g(d).qchem.inp (generated)

000951953.b3lyp_6-31g(d).gjf (generated)

000951953.b3lyp_6-31g(d).firefly.inp (generated)

000951953.b3lyp_6-31g(d).smash.inp (generated)

000951953.b3lyp_6-31g(d).nwchem.inp (generated) 000951953.b3lyp_6-31g(d).log.xz 000951953.td-b3lyp_6-31g+(d).inp 000951953.td-b3lyp_6-31g+(d).log.xz

000951953.td-b3lyp_6-31+g(d).qchem.inp (generated)

000951953.td-b3lyp_6-31+g(d).gjf (generated)

000951953.td-b3lyp_6-31+g(d).firefly.inp (generated)

000951953.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000951953.mol 000951953.PUBCHEM 000951953.mol (via Jmol)
000952013.b3lyp_6-31g(d).inp

000952013.b3lyp_6-31g(d).qchem.inp (generated)

000952013.b3lyp_6-31g(d).gjf (generated)

000952013.b3lyp_6-31g(d).firefly.inp (generated)

000952013.b3lyp_6-31g(d).smash.inp (generated)

000952013.b3lyp_6-31g(d).nwchem.inp (generated) 000952013.b3lyp_6-31g(d).log.xz 000952013.mol 000952013.PUBCHEM 000952013.mol (via Jmol)
000952046.b3lyp_6-31g(d).inp

000952046.b3lyp_6-31g(d).qchem.inp (generated)

000952046.b3lyp_6-31g(d).gjf (generated)

000952046.b3lyp_6-31g(d).firefly.inp (generated)

000952046.b3lyp_6-31g(d).smash.inp (generated)

000952046.b3lyp_6-31g(d).nwchem.inp (generated) 000952046.b3lyp_6-31g(d).log.xz 000952046.mol 000952046.PUBCHEM 000952046.mol (via Jmol)
000952089.b3lyp_6-31g(d).inp

000952089.b3lyp_6-31g(d).qchem.inp (generated)

000952089.b3lyp_6-31g(d).gjf (generated)

000952089.b3lyp_6-31g(d).firefly.inp (generated)

000952089.b3lyp_6-31g(d).smash.inp (generated)

000952089.b3lyp_6-31g(d).nwchem.inp (generated) 000952089.b3lyp_6-31g(d).log.xz 000952089.td-b3lyp_6-31g+(d).inp 000952089.td-b3lyp_6-31g+(d).log.xz

000952089.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952089.td-b3lyp_6-31+g(d).gjf (generated)

000952089.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952089.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952089.mol 000952089.PUBCHEM 000952089.mol (via Jmol)
000952268.b3lyp_6-31g(d).inp

000952268.b3lyp_6-31g(d).qchem.inp (generated)

000952268.b3lyp_6-31g(d).gjf (generated)

000952268.b3lyp_6-31g(d).firefly.inp (generated)

000952268.b3lyp_6-31g(d).smash.inp (generated)

000952268.b3lyp_6-31g(d).nwchem.inp (generated) 000952268.b3lyp_6-31g(d).log.xz 000952268.td-b3lyp_6-31g+(d).inp 000952268.td-b3lyp_6-31g+(d).log.xz

000952268.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952268.td-b3lyp_6-31+g(d).gjf (generated)

000952268.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952268.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952268.mol 000952268.PUBCHEM 000952268.mol (via Jmol)
000952269.b3lyp_6-31g(d).inp

000952269.b3lyp_6-31g(d).qchem.inp (generated)

000952269.b3lyp_6-31g(d).gjf (generated)

000952269.b3lyp_6-31g(d).firefly.inp (generated)

000952269.b3lyp_6-31g(d).smash.inp (generated)

000952269.b3lyp_6-31g(d).nwchem.inp (generated) 000952269.b3lyp_6-31g(d).log.xz 000952269.td-b3lyp_6-31g+(d).inp 000952269.td-b3lyp_6-31g+(d).log.xz

000952269.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952269.td-b3lyp_6-31+g(d).gjf (generated)

000952269.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952269.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952269.mol 000952269.PUBCHEM 000952269.mol (via Jmol)
000952294.b3lyp_6-31g(d).inp

000952294.b3lyp_6-31g(d).qchem.inp (generated)

000952294.b3lyp_6-31g(d).gjf (generated)

000952294.b3lyp_6-31g(d).firefly.inp (generated)

000952294.b3lyp_6-31g(d).smash.inp (generated)

000952294.b3lyp_6-31g(d).nwchem.inp (generated) 000952294.b3lyp_6-31g(d).log.xz 000952294.td-b3lyp_6-31g+(d).inp 000952294.td-b3lyp_6-31g+(d).log.xz

000952294.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952294.td-b3lyp_6-31+g(d).gjf (generated)

000952294.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952294.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952294.mol 000952294.PUBCHEM 000952294.mol (via Jmol)
000952295.b3lyp_6-31g(d).inp

000952295.b3lyp_6-31g(d).qchem.inp (generated)

000952295.b3lyp_6-31g(d).gjf (generated)

000952295.b3lyp_6-31g(d).firefly.inp (generated)

000952295.b3lyp_6-31g(d).smash.inp (generated)

000952295.b3lyp_6-31g(d).nwchem.inp (generated) 000952295.b3lyp_6-31g(d).log.xz 000952295.td-b3lyp_6-31g+(d).inp 000952295.td-b3lyp_6-31g+(d).log.xz

000952295.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952295.td-b3lyp_6-31+g(d).gjf (generated)

000952295.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952295.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952295.mol 000952295.PUBCHEM 000952295.mol (via Jmol)
000952298.b3lyp_6-31g(d).inp

000952298.b3lyp_6-31g(d).qchem.inp (generated)

000952298.b3lyp_6-31g(d).gjf (generated)

000952298.b3lyp_6-31g(d).firefly.inp (generated)

000952298.b3lyp_6-31g(d).smash.inp (generated)

000952298.b3lyp_6-31g(d).nwchem.inp (generated) 000952298.b3lyp_6-31g(d).log.xz 000952298.td-b3lyp_6-31g+(d).inp 000952298.td-b3lyp_6-31g+(d).log.xz

000952298.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952298.td-b3lyp_6-31+g(d).gjf (generated)

000952298.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952298.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952298.mol 000952298.PUBCHEM 000952298.mol (via Jmol)
000952299.b3lyp_6-31g(d).inp

000952299.b3lyp_6-31g(d).qchem.inp (generated)

000952299.b3lyp_6-31g(d).gjf (generated)

000952299.b3lyp_6-31g(d).firefly.inp (generated)

000952299.b3lyp_6-31g(d).smash.inp (generated)

000952299.b3lyp_6-31g(d).nwchem.inp (generated) 000952299.b3lyp_6-31g(d).log.xz 000952299.td-b3lyp_6-31g+(d).inp 000952299.td-b3lyp_6-31g+(d).log.xz

000952299.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952299.td-b3lyp_6-31+g(d).gjf (generated)

000952299.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952299.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952299.mol 000952299.PUBCHEM 000952299.mol (via Jmol)
000952300.b3lyp_6-31g(d).inp

000952300.b3lyp_6-31g(d).qchem.inp (generated)

000952300.b3lyp_6-31g(d).gjf (generated)

000952300.b3lyp_6-31g(d).firefly.inp (generated)

000952300.b3lyp_6-31g(d).smash.inp (generated)

000952300.b3lyp_6-31g(d).nwchem.inp (generated) 000952300.b3lyp_6-31g(d).log.xz 000952300.td-b3lyp_6-31g+(d).inp 000952300.td-b3lyp_6-31g+(d).log.xz

000952300.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952300.td-b3lyp_6-31+g(d).gjf (generated)

000952300.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952300.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952300.mol 000952300.PUBCHEM 000952300.mol (via Jmol)
000952301.b3lyp_6-31g(d).inp

000952301.b3lyp_6-31g(d).qchem.inp (generated)

000952301.b3lyp_6-31g(d).gjf (generated)

000952301.b3lyp_6-31g(d).firefly.inp (generated)

000952301.b3lyp_6-31g(d).smash.inp (generated)

000952301.b3lyp_6-31g(d).nwchem.inp (generated) 000952301.b3lyp_6-31g(d).log.xz 000952301.td-b3lyp_6-31g+(d).inp 000952301.td-b3lyp_6-31g+(d).log.xz

000952301.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952301.td-b3lyp_6-31+g(d).gjf (generated)

000952301.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952301.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952301.mol 000952301.PUBCHEM 000952301.mol (via Jmol)
000952314.b3lyp_6-31g(d).inp

000952314.b3lyp_6-31g(d).qchem.inp (generated)

000952314.b3lyp_6-31g(d).gjf (generated)

000952314.b3lyp_6-31g(d).firefly.inp (generated)

000952314.b3lyp_6-31g(d).smash.inp (generated)

000952314.b3lyp_6-31g(d).nwchem.inp (generated) 000952314.b3lyp_6-31g(d).log.xz 000952314.td-b3lyp_6-31g+(d).inp 000952314.td-b3lyp_6-31g+(d).log.xz

000952314.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952314.td-b3lyp_6-31+g(d).gjf (generated)

000952314.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952314.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952314.mol 000952314.PUBCHEM 000952314.mol (via Jmol)
000952315.b3lyp_6-31g(d).inp

000952315.b3lyp_6-31g(d).qchem.inp (generated)

000952315.b3lyp_6-31g(d).gjf (generated)

000952315.b3lyp_6-31g(d).firefly.inp (generated)

000952315.b3lyp_6-31g(d).smash.inp (generated)

000952315.b3lyp_6-31g(d).nwchem.inp (generated) 000952315.b3lyp_6-31g(d).log.xz 000952315.td-b3lyp_6-31g+(d).inp 000952315.td-b3lyp_6-31g+(d).log.xz

000952315.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952315.td-b3lyp_6-31+g(d).gjf (generated)

000952315.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952315.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952315.mol 000952315.PUBCHEM 000952315.mol (via Jmol)
000952316.b3lyp_6-31g(d).inp

000952316.b3lyp_6-31g(d).qchem.inp (generated)

000952316.b3lyp_6-31g(d).gjf (generated)

000952316.b3lyp_6-31g(d).firefly.inp (generated)

000952316.b3lyp_6-31g(d).smash.inp (generated)

000952316.b3lyp_6-31g(d).nwchem.inp (generated) 000952316.b3lyp_6-31g(d).log.xz 000952316.td-b3lyp_6-31g+(d).inp 000952316.td-b3lyp_6-31g+(d).log.xz

000952316.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952316.td-b3lyp_6-31+g(d).gjf (generated)

000952316.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952316.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952316.mol 000952316.PUBCHEM 000952316.mol (via Jmol)
000952317.b3lyp_6-31g(d).inp

000952317.b3lyp_6-31g(d).qchem.inp (generated)

000952317.b3lyp_6-31g(d).gjf (generated)

000952317.b3lyp_6-31g(d).firefly.inp (generated)

000952317.b3lyp_6-31g(d).smash.inp (generated)

000952317.b3lyp_6-31g(d).nwchem.inp (generated) 000952317.b3lyp_6-31g(d).log.xz 000952317.td-b3lyp_6-31g+(d).inp 000952317.td-b3lyp_6-31g+(d).log.xz

000952317.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952317.td-b3lyp_6-31+g(d).gjf (generated)

000952317.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952317.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952317.mol 000952317.PUBCHEM 000952317.mol (via Jmol)
000952318.b3lyp_6-31g(d).inp

000952318.b3lyp_6-31g(d).qchem.inp (generated)

000952318.b3lyp_6-31g(d).gjf (generated)

000952318.b3lyp_6-31g(d).firefly.inp (generated)

000952318.b3lyp_6-31g(d).smash.inp (generated)

000952318.b3lyp_6-31g(d).nwchem.inp (generated) 000952318.b3lyp_6-31g(d).log.xz 000952318.td-b3lyp_6-31g+(d).inp 000952318.td-b3lyp_6-31g+(d).log.xz

000952318.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952318.td-b3lyp_6-31+g(d).gjf (generated)

000952318.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952318.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952318.mol 000952318.PUBCHEM 000952318.mol (via Jmol)
000952319.b3lyp_6-31g(d).inp

000952319.b3lyp_6-31g(d).qchem.inp (generated)

000952319.b3lyp_6-31g(d).gjf (generated)

000952319.b3lyp_6-31g(d).firefly.inp (generated)

000952319.b3lyp_6-31g(d).smash.inp (generated)

000952319.b3lyp_6-31g(d).nwchem.inp (generated) 000952319.b3lyp_6-31g(d).log.xz 000952319.td-b3lyp_6-31g+(d).inp 000952319.td-b3lyp_6-31g+(d).log.xz

000952319.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952319.td-b3lyp_6-31+g(d).gjf (generated)

000952319.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952319.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952319.mol 000952319.PUBCHEM 000952319.mol (via Jmol)
000952320.b3lyp_6-31g(d).inp

000952320.b3lyp_6-31g(d).qchem.inp (generated)

000952320.b3lyp_6-31g(d).gjf (generated)

000952320.b3lyp_6-31g(d).firefly.inp (generated)

000952320.b3lyp_6-31g(d).smash.inp (generated)

000952320.b3lyp_6-31g(d).nwchem.inp (generated) 000952320.b3lyp_6-31g(d).log.xz 000952320.td-b3lyp_6-31g+(d).inp 000952320.td-b3lyp_6-31g+(d).log.xz

000952320.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952320.td-b3lyp_6-31+g(d).gjf (generated)

000952320.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952320.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952320.mol 000952320.PUBCHEM 000952320.mol (via Jmol)
000952325.b3lyp_6-31g(d).inp

000952325.b3lyp_6-31g(d).qchem.inp (generated)

000952325.b3lyp_6-31g(d).gjf (generated)

000952325.b3lyp_6-31g(d).firefly.inp (generated)

000952325.b3lyp_6-31g(d).smash.inp (generated)

000952325.b3lyp_6-31g(d).nwchem.inp (generated) 000952325.b3lyp_6-31g(d).log.xz 000952325.td-b3lyp_6-31g+(d).inp 000952325.td-b3lyp_6-31g+(d).log.xz

000952325.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952325.td-b3lyp_6-31+g(d).gjf (generated)

000952325.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952325.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952325.mol 000952325.PUBCHEM 000952325.mol (via Jmol)
000952330.b3lyp_6-31g(d).inp

000952330.b3lyp_6-31g(d).qchem.inp (generated)

000952330.b3lyp_6-31g(d).gjf (generated)

000952330.b3lyp_6-31g(d).firefly.inp (generated)

000952330.b3lyp_6-31g(d).smash.inp (generated)

000952330.b3lyp_6-31g(d).nwchem.inp (generated) 000952330.b3lyp_6-31g(d).log.xz 000952330.td-b3lyp_6-31g+(d).inp 000952330.td-b3lyp_6-31g+(d).log.xz

000952330.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952330.td-b3lyp_6-31+g(d).gjf (generated)

000952330.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952330.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952330.mol 000952330.PUBCHEM 000952330.mol (via Jmol)
000952336.b3lyp_6-31g(d).inp

000952336.b3lyp_6-31g(d).qchem.inp (generated)

000952336.b3lyp_6-31g(d).gjf (generated)

000952336.b3lyp_6-31g(d).firefly.inp (generated)

000952336.b3lyp_6-31g(d).smash.inp (generated)

000952336.b3lyp_6-31g(d).nwchem.inp (generated) 000952336.b3lyp_6-31g(d).log.xz 000952336.mol 000952336.PUBCHEM 000952336.mol (via Jmol)
000952389.b3lyp_6-31g(d).inp

000952389.b3lyp_6-31g(d).qchem.inp (generated)

000952389.b3lyp_6-31g(d).gjf (generated)

000952389.b3lyp_6-31g(d).firefly.inp (generated)

000952389.b3lyp_6-31g(d).smash.inp (generated)

000952389.b3lyp_6-31g(d).nwchem.inp (generated) 000952389.b3lyp_6-31g(d).log.xz 000952389.td-b3lyp_6-31g+(d).inp 000952389.td-b3lyp_6-31g+(d).log.xz

000952389.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952389.td-b3lyp_6-31+g(d).gjf (generated)

000952389.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952389.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952389.mol 000952389.PUBCHEM 000952389.mol (via Jmol)
000952390.b3lyp_6-31g(d).inp

000952390.b3lyp_6-31g(d).qchem.inp (generated)

000952390.b3lyp_6-31g(d).gjf (generated)

000952390.b3lyp_6-31g(d).firefly.inp (generated)

000952390.b3lyp_6-31g(d).smash.inp (generated)

000952390.b3lyp_6-31g(d).nwchem.inp (generated) 000952390.b3lyp_6-31g(d).log.xz 000952390.td-b3lyp_6-31g+(d).inp 000952390.td-b3lyp_6-31g+(d).log.xz

000952390.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952390.td-b3lyp_6-31+g(d).gjf (generated)

000952390.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952390.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952390.mol 000952390.PUBCHEM 000952390.mol (via Jmol)
000952393.b3lyp_6-31g(d).inp

000952393.b3lyp_6-31g(d).qchem.inp (generated)

000952393.b3lyp_6-31g(d).gjf (generated)

000952393.b3lyp_6-31g(d).firefly.inp (generated)

000952393.b3lyp_6-31g(d).smash.inp (generated)

000952393.b3lyp_6-31g(d).nwchem.inp (generated) 000952393.b3lyp_6-31g(d).log.xz 000952393.td-b3lyp_6-31g+(d).inp 000952393.td-b3lyp_6-31g+(d).log.xz

000952393.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952393.td-b3lyp_6-31+g(d).gjf (generated)

000952393.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952393.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952393.mol 000952393.PUBCHEM 000952393.mol (via Jmol)
000952394.b3lyp_6-31g(d).inp

000952394.b3lyp_6-31g(d).qchem.inp (generated)

000952394.b3lyp_6-31g(d).gjf (generated)

000952394.b3lyp_6-31g(d).firefly.inp (generated)

000952394.b3lyp_6-31g(d).smash.inp (generated)

000952394.b3lyp_6-31g(d).nwchem.inp (generated) 000952394.b3lyp_6-31g(d).log.xz 000952394.td-b3lyp_6-31g+(d).inp 000952394.td-b3lyp_6-31g+(d).log.xz

000952394.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952394.td-b3lyp_6-31+g(d).gjf (generated)

000952394.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952394.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952394.mol 000952394.PUBCHEM 000952394.mol (via Jmol)
000952395.b3lyp_6-31g(d).inp

000952395.b3lyp_6-31g(d).qchem.inp (generated)

000952395.b3lyp_6-31g(d).gjf (generated)

000952395.b3lyp_6-31g(d).firefly.inp (generated)

000952395.b3lyp_6-31g(d).smash.inp (generated)

000952395.b3lyp_6-31g(d).nwchem.inp (generated) 000952395.b3lyp_6-31g(d).log.xz 000952395.td-b3lyp_6-31g+(d).inp 000952395.td-b3lyp_6-31g+(d).log.xz

000952395.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952395.td-b3lyp_6-31+g(d).gjf (generated)

000952395.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952395.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952395.mol 000952395.PUBCHEM 000952395.mol (via Jmol)
000952396.b3lyp_6-31g(d).inp

000952396.b3lyp_6-31g(d).qchem.inp (generated)

000952396.b3lyp_6-31g(d).gjf (generated)

000952396.b3lyp_6-31g(d).firefly.inp (generated)

000952396.b3lyp_6-31g(d).smash.inp (generated)

000952396.b3lyp_6-31g(d).nwchem.inp (generated) 000952396.b3lyp_6-31g(d).log.xz 000952396.td-b3lyp_6-31g+(d).inp 000952396.td-b3lyp_6-31g+(d).log.xz

000952396.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952396.td-b3lyp_6-31+g(d).gjf (generated)

000952396.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952396.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952396.mol 000952396.PUBCHEM 000952396.mol (via Jmol)
000952397.b3lyp_6-31g(d).inp

000952397.b3lyp_6-31g(d).qchem.inp (generated)

000952397.b3lyp_6-31g(d).gjf (generated)

000952397.b3lyp_6-31g(d).firefly.inp (generated)

000952397.b3lyp_6-31g(d).smash.inp (generated)

000952397.b3lyp_6-31g(d).nwchem.inp (generated) 000952397.b3lyp_6-31g(d).log.xz 000952397.mol 000952397.PUBCHEM 000952397.mol (via Jmol)
000952400.b3lyp_6-31g(d).inp

000952400.b3lyp_6-31g(d).qchem.inp (generated)

000952400.b3lyp_6-31g(d).gjf (generated)

000952400.b3lyp_6-31g(d).firefly.inp (generated)

000952400.b3lyp_6-31g(d).smash.inp (generated)

000952400.b3lyp_6-31g(d).nwchem.inp (generated) 000952400.b3lyp_6-31g(d).log.xz 000952400.td-b3lyp_6-31g+(d).inp 000952400.td-b3lyp_6-31g+(d).log.xz

000952400.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952400.td-b3lyp_6-31+g(d).gjf (generated)

000952400.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952400.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952400.mol 000952400.PUBCHEM 000952400.mol (via Jmol)
000952402.b3lyp_6-31g(d).inp

000952402.b3lyp_6-31g(d).qchem.inp (generated)

000952402.b3lyp_6-31g(d).gjf (generated)

000952402.b3lyp_6-31g(d).firefly.inp (generated)

000952402.b3lyp_6-31g(d).smash.inp (generated)

000952402.b3lyp_6-31g(d).nwchem.inp (generated) 000952402.b3lyp_6-31g(d).log.xz 000952402.td-b3lyp_6-31g+(d).inp 000952402.td-b3lyp_6-31g+(d).log.xz

000952402.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952402.td-b3lyp_6-31+g(d).gjf (generated)

000952402.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952402.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952402.mol 000952402.PUBCHEM 000952402.mol (via Jmol)
000952460.b3lyp_6-31g(d).inp

000952460.b3lyp_6-31g(d).qchem.inp (generated)

000952460.b3lyp_6-31g(d).gjf (generated)

000952460.b3lyp_6-31g(d).firefly.inp (generated)

000952460.b3lyp_6-31g(d).smash.inp (generated)

000952460.b3lyp_6-31g(d).nwchem.inp (generated) 000952460.b3lyp_6-31g(d).log.xz 000952460.td-b3lyp_6-31g+(d).inp 000952460.td-b3lyp_6-31g+(d).log.xz

000952460.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952460.td-b3lyp_6-31+g(d).gjf (generated)

000952460.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952460.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952460.mol 000952460.PUBCHEM 000952460.mol (via Jmol)
000952463.b3lyp_6-31g(d).inp

000952463.b3lyp_6-31g(d).qchem.inp (generated)

000952463.b3lyp_6-31g(d).gjf (generated)

000952463.b3lyp_6-31g(d).firefly.inp (generated)

000952463.b3lyp_6-31g(d).smash.inp (generated)

000952463.b3lyp_6-31g(d).nwchem.inp (generated) 000952463.b3lyp_6-31g(d).log.xz 000952463.td-b3lyp_6-31g+(d).inp 000952463.td-b3lyp_6-31g+(d).log.xz

000952463.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952463.td-b3lyp_6-31+g(d).gjf (generated)

000952463.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952463.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952463.mol 000952463.PUBCHEM 000952463.mol (via Jmol)
000952691.b3lyp_6-31g(d).inp

000952691.b3lyp_6-31g(d).qchem.inp (generated)

000952691.b3lyp_6-31g(d).gjf (generated)

000952691.b3lyp_6-31g(d).firefly.inp (generated)

000952691.b3lyp_6-31g(d).smash.inp (generated)

000952691.b3lyp_6-31g(d).nwchem.inp (generated) 000952691.b3lyp_6-31g(d).log.xz 000952691.td-b3lyp_6-31g+(d).inp 000952691.td-b3lyp_6-31g+(d).log.xz

000952691.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952691.td-b3lyp_6-31+g(d).gjf (generated)

000952691.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952691.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952691.mol 000952691.PUBCHEM 000952691.mol (via Jmol)
000952692.b3lyp_6-31g(d).inp

000952692.b3lyp_6-31g(d).qchem.inp (generated)

000952692.b3lyp_6-31g(d).gjf (generated)

000952692.b3lyp_6-31g(d).firefly.inp (generated)

000952692.b3lyp_6-31g(d).smash.inp (generated)

000952692.b3lyp_6-31g(d).nwchem.inp (generated) 000952692.b3lyp_6-31g(d).log.xz 000952692.td-b3lyp_6-31g+(d).inp 000952692.td-b3lyp_6-31g+(d).log.xz

000952692.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952692.td-b3lyp_6-31+g(d).gjf (generated)

000952692.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952692.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952692.mol 000952692.PUBCHEM 000952692.mol (via Jmol)
000952712.b3lyp_6-31g(d).inp

000952712.b3lyp_6-31g(d).qchem.inp (generated)

000952712.b3lyp_6-31g(d).gjf (generated)

000952712.b3lyp_6-31g(d).firefly.inp (generated)

000952712.b3lyp_6-31g(d).smash.inp (generated)

000952712.b3lyp_6-31g(d).nwchem.inp (generated) 000952712.b3lyp_6-31g(d).log.xz 000952712.td-b3lyp_6-31g+(d).inp 000952712.td-b3lyp_6-31g+(d).log.xz

000952712.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952712.td-b3lyp_6-31+g(d).gjf (generated)

000952712.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952712.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952712.mol 000952712.PUBCHEM 000952712.mol (via Jmol)
000952713.b3lyp_6-31g(d).inp

000952713.b3lyp_6-31g(d).qchem.inp (generated)

000952713.b3lyp_6-31g(d).gjf (generated)

000952713.b3lyp_6-31g(d).firefly.inp (generated)

000952713.b3lyp_6-31g(d).smash.inp (generated)

000952713.b3lyp_6-31g(d).nwchem.inp (generated) 000952713.b3lyp_6-31g(d).log.xz 000952713.td-b3lyp_6-31g+(d).inp 000952713.td-b3lyp_6-31g+(d).log.xz

000952713.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952713.td-b3lyp_6-31+g(d).gjf (generated)

000952713.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952713.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952713.mol 000952713.PUBCHEM 000952713.mol (via Jmol)
000952763.b3lyp_6-31g(d).inp

000952763.b3lyp_6-31g(d).qchem.inp (generated)

000952763.b3lyp_6-31g(d).gjf (generated)

000952763.b3lyp_6-31g(d).firefly.inp (generated)

000952763.b3lyp_6-31g(d).smash.inp (generated)

000952763.b3lyp_6-31g(d).nwchem.inp (generated) 000952763.b3lyp_6-31g(d).log.xz 000952763.td-b3lyp_6-31g+(d).inp 000952763.td-b3lyp_6-31g+(d).log.xz

000952763.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952763.td-b3lyp_6-31+g(d).gjf (generated)

000952763.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952763.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952763.mol 000952763.PUBCHEM 000952763.mol (via Jmol)
000952794.b3lyp_6-31g(d).inp

000952794.b3lyp_6-31g(d).qchem.inp (generated)

000952794.b3lyp_6-31g(d).gjf (generated)

000952794.b3lyp_6-31g(d).firefly.inp (generated)

000952794.b3lyp_6-31g(d).smash.inp (generated)

000952794.b3lyp_6-31g(d).nwchem.inp (generated) 000952794.b3lyp_6-31g(d).log.xz 000952794.td-b3lyp_6-31g+(d).inp 000952794.td-b3lyp_6-31g+(d).log.xz

000952794.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952794.td-b3lyp_6-31+g(d).gjf (generated)

000952794.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952794.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952794.mol 000952794.PUBCHEM 000952794.mol (via Jmol)
000952797.b3lyp_6-31g(d).inp

000952797.b3lyp_6-31g(d).qchem.inp (generated)

000952797.b3lyp_6-31g(d).gjf (generated)

000952797.b3lyp_6-31g(d).firefly.inp (generated)

000952797.b3lyp_6-31g(d).smash.inp (generated)

000952797.b3lyp_6-31g(d).nwchem.inp (generated) 000952797.b3lyp_6-31g(d).log.xz 000952797.td-b3lyp_6-31g+(d).inp 000952797.td-b3lyp_6-31g+(d).log.xz

000952797.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952797.td-b3lyp_6-31+g(d).gjf (generated)

000952797.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952797.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952797.mol 000952797.PUBCHEM 000952797.mol (via Jmol)
000952938.b3lyp_6-31g(d).inp

000952938.b3lyp_6-31g(d).qchem.inp (generated)

000952938.b3lyp_6-31g(d).gjf (generated)

000952938.b3lyp_6-31g(d).firefly.inp (generated)

000952938.b3lyp_6-31g(d).smash.inp (generated)

000952938.b3lyp_6-31g(d).nwchem.inp (generated) 000952938.b3lyp_6-31g(d).log.xz 000952938.td-b3lyp_6-31g+(d).inp 000952938.td-b3lyp_6-31g+(d).log.xz

000952938.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952938.td-b3lyp_6-31+g(d).gjf (generated)

000952938.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952938.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952938.mol 000952938.PUBCHEM 000952938.mol (via Jmol)
000952949.b3lyp_6-31g(d).inp

000952949.b3lyp_6-31g(d).qchem.inp (generated)

000952949.b3lyp_6-31g(d).gjf (generated)

000952949.b3lyp_6-31g(d).firefly.inp (generated)

000952949.b3lyp_6-31g(d).smash.inp (generated)

000952949.b3lyp_6-31g(d).nwchem.inp (generated) 000952949.b3lyp_6-31g(d).log.xz 000952949.td-b3lyp_6-31g+(d).inp 000952949.td-b3lyp_6-31g+(d).log.xz

000952949.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952949.td-b3lyp_6-31+g(d).gjf (generated)

000952949.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952949.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952949.mol 000952949.PUBCHEM 000952949.mol (via Jmol)
000952958.b3lyp_6-31g(d).inp

000952958.b3lyp_6-31g(d).qchem.inp (generated)

000952958.b3lyp_6-31g(d).gjf (generated)

000952958.b3lyp_6-31g(d).firefly.inp (generated)

000952958.b3lyp_6-31g(d).smash.inp (generated)

000952958.b3lyp_6-31g(d).nwchem.inp (generated) 000952958.b3lyp_6-31g(d).log.xz 000952958.td-b3lyp_6-31g+(d).inp 000952958.td-b3lyp_6-31g+(d).log.xz

000952958.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952958.td-b3lyp_6-31+g(d).gjf (generated)

000952958.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952958.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952958.mol 000952958.PUBCHEM 000952958.mol (via Jmol)
000952968.b3lyp_6-31g(d).inp

000952968.b3lyp_6-31g(d).qchem.inp (generated)

000952968.b3lyp_6-31g(d).gjf (generated)

000952968.b3lyp_6-31g(d).firefly.inp (generated)

000952968.b3lyp_6-31g(d).smash.inp (generated)

000952968.b3lyp_6-31g(d).nwchem.inp (generated) 000952968.b3lyp_6-31g(d).log.xz 000952968.td-b3lyp_6-31g+(d).inp 000952968.td-b3lyp_6-31g+(d).log.xz

000952968.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952968.td-b3lyp_6-31+g(d).gjf (generated)

000952968.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952968.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952968.mol 000952968.PUBCHEM 000952968.mol (via Jmol)
000952986.b3lyp_6-31g(d).inp

000952986.b3lyp_6-31g(d).qchem.inp (generated)

000952986.b3lyp_6-31g(d).gjf (generated)

000952986.b3lyp_6-31g(d).firefly.inp (generated)

000952986.b3lyp_6-31g(d).smash.inp (generated)

000952986.b3lyp_6-31g(d).nwchem.inp (generated) 000952986.b3lyp_6-31g(d).log.xz 000952986.td-b3lyp_6-31g+(d).inp 000952986.td-b3lyp_6-31g+(d).log.xz

000952986.td-b3lyp_6-31+g(d).qchem.inp (generated)

000952986.td-b3lyp_6-31+g(d).gjf (generated)

000952986.td-b3lyp_6-31+g(d).firefly.inp (generated)

000952986.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000952986.mol 000952986.PUBCHEM 000952986.mol (via Jmol)
000953030.b3lyp_6-31g(d).inp

000953030.b3lyp_6-31g(d).qchem.inp (generated)

000953030.b3lyp_6-31g(d).gjf (generated)

000953030.b3lyp_6-31g(d).firefly.inp (generated)

000953030.b3lyp_6-31g(d).smash.inp (generated)

000953030.b3lyp_6-31g(d).nwchem.inp (generated) 000953030.b3lyp_6-31g(d).log.xz 000953030.td-b3lyp_6-31g+(d).inp 000953030.td-b3lyp_6-31g+(d).log.xz

000953030.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953030.td-b3lyp_6-31+g(d).gjf (generated)

000953030.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953030.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953030.mol 000953030.PUBCHEM 000953030.mol (via Jmol)
000953036.b3lyp_6-31g(d).inp

000953036.b3lyp_6-31g(d).qchem.inp (generated)

000953036.b3lyp_6-31g(d).gjf (generated)

000953036.b3lyp_6-31g(d).firefly.inp (generated)

000953036.b3lyp_6-31g(d).smash.inp (generated)

000953036.b3lyp_6-31g(d).nwchem.inp (generated) 000953036.b3lyp_6-31g(d).log.xz 000953036.td-b3lyp_6-31g+(d).inp 000953036.td-b3lyp_6-31g+(d).log.xz

000953036.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953036.td-b3lyp_6-31+g(d).gjf (generated)

000953036.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953036.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953036.mol 000953036.PUBCHEM 000953036.mol (via Jmol)
000953149.b3lyp_6-31g(d).inp

000953149.b3lyp_6-31g(d).qchem.inp (generated)

000953149.b3lyp_6-31g(d).gjf (generated)

000953149.b3lyp_6-31g(d).firefly.inp (generated)

000953149.b3lyp_6-31g(d).smash.inp (generated)

000953149.b3lyp_6-31g(d).nwchem.inp (generated) 000953149.b3lyp_6-31g(d).log.xz 000953149.td-b3lyp_6-31g+(d).inp 000953149.td-b3lyp_6-31g+(d).log.xz

000953149.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953149.td-b3lyp_6-31+g(d).gjf (generated)

000953149.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953149.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953149.mol 000953149.PUBCHEM 000953149.mol (via Jmol)
000953212.b3lyp_6-31g(d).inp

000953212.b3lyp_6-31g(d).qchem.inp (generated)

000953212.b3lyp_6-31g(d).gjf (generated)

000953212.b3lyp_6-31g(d).firefly.inp (generated)

000953212.b3lyp_6-31g(d).smash.inp (generated)

000953212.b3lyp_6-31g(d).nwchem.inp (generated) 000953212.b3lyp_6-31g(d).log.xz 000953212.td-b3lyp_6-31g+(d).inp 000953212.td-b3lyp_6-31g+(d).log.xz

000953212.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953212.td-b3lyp_6-31+g(d).gjf (generated)

000953212.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953212.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953212.mol 000953212.PUBCHEM 000953212.mol (via Jmol)
000953240.b3lyp_6-31g(d).inp

000953240.b3lyp_6-31g(d).qchem.inp (generated)

000953240.b3lyp_6-31g(d).gjf (generated)

000953240.b3lyp_6-31g(d).firefly.inp (generated)

000953240.b3lyp_6-31g(d).smash.inp (generated)

000953240.b3lyp_6-31g(d).nwchem.inp (generated) 000953240.b3lyp_6-31g(d).log.xz 000953240.td-b3lyp_6-31g+(d).inp 000953240.td-b3lyp_6-31g+(d).log.xz

000953240.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953240.td-b3lyp_6-31+g(d).gjf (generated)

000953240.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953240.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953240.mol 000953240.PUBCHEM 000953240.mol (via Jmol)
000953241.b3lyp_6-31g(d).inp

000953241.b3lyp_6-31g(d).qchem.inp (generated)

000953241.b3lyp_6-31g(d).gjf (generated)

000953241.b3lyp_6-31g(d).firefly.inp (generated)

000953241.b3lyp_6-31g(d).smash.inp (generated)

000953241.b3lyp_6-31g(d).nwchem.inp (generated) 000953241.b3lyp_6-31g(d).log.xz 000953241.td-b3lyp_6-31g+(d).inp 000953241.td-b3lyp_6-31g+(d).log.xz

000953241.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953241.td-b3lyp_6-31+g(d).gjf (generated)

000953241.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953241.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953241.mol 000953241.PUBCHEM 000953241.mol (via Jmol)
000953244.b3lyp_6-31g(d).inp

000953244.b3lyp_6-31g(d).qchem.inp (generated)

000953244.b3lyp_6-31g(d).gjf (generated)

000953244.b3lyp_6-31g(d).firefly.inp (generated)

000953244.b3lyp_6-31g(d).smash.inp (generated)

000953244.b3lyp_6-31g(d).nwchem.inp (generated) 000953244.b3lyp_6-31g(d).log.xz 000953244.td-b3lyp_6-31g+(d).inp 000953244.td-b3lyp_6-31g+(d).log.xz

000953244.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953244.td-b3lyp_6-31+g(d).gjf (generated)

000953244.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953244.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953244.mol 000953244.PUBCHEM 000953244.mol (via Jmol)
000953245.b3lyp_6-31g(d).inp

000953245.b3lyp_6-31g(d).qchem.inp (generated)

000953245.b3lyp_6-31g(d).gjf (generated)

000953245.b3lyp_6-31g(d).firefly.inp (generated)

000953245.b3lyp_6-31g(d).smash.inp (generated)

000953245.b3lyp_6-31g(d).nwchem.inp (generated) 000953245.b3lyp_6-31g(d).log.xz 000953245.mol 000953245.PUBCHEM 000953245.mol (via Jmol)
000953247.b3lyp_6-31g(d).inp

000953247.b3lyp_6-31g(d).qchem.inp (generated)

000953247.b3lyp_6-31g(d).gjf (generated)

000953247.b3lyp_6-31g(d).firefly.inp (generated)

000953247.b3lyp_6-31g(d).smash.inp (generated)

000953247.b3lyp_6-31g(d).nwchem.inp (generated) 000953247.b3lyp_6-31g(d).log.xz 000953247.td-b3lyp_6-31g+(d).inp 000953247.td-b3lyp_6-31g+(d).log.xz

000953247.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953247.td-b3lyp_6-31+g(d).gjf (generated)

000953247.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953247.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953247.mol 000953247.PUBCHEM 000953247.mol (via Jmol)
000953286.b3lyp_6-31g(d).inp

000953286.b3lyp_6-31g(d).qchem.inp (generated)

000953286.b3lyp_6-31g(d).gjf (generated)

000953286.b3lyp_6-31g(d).firefly.inp (generated)

000953286.b3lyp_6-31g(d).smash.inp (generated)

000953286.b3lyp_6-31g(d).nwchem.inp (generated) 000953286.b3lyp_6-31g(d).log.xz 000953286.mol 000953286.PUBCHEM 000953286.mol (via Jmol)
000953317.b3lyp_6-31g(d).inp

000953317.b3lyp_6-31g(d).qchem.inp (generated)

000953317.b3lyp_6-31g(d).gjf (generated)

000953317.b3lyp_6-31g(d).firefly.inp (generated)

000953317.b3lyp_6-31g(d).smash.inp (generated)

000953317.b3lyp_6-31g(d).nwchem.inp (generated) 000953317.b3lyp_6-31g(d).log.xz 000953317.td-b3lyp_6-31g+(d).inp 000953317.td-b3lyp_6-31g+(d).log.xz

000953317.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953317.td-b3lyp_6-31+g(d).gjf (generated)

000953317.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953317.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953317.mol 000953317.PUBCHEM 000953317.mol (via Jmol)
000953426.b3lyp_6-31g(d).inp

000953426.b3lyp_6-31g(d).qchem.inp (generated)

000953426.b3lyp_6-31g(d).gjf (generated)

000953426.b3lyp_6-31g(d).firefly.inp (generated)

000953426.b3lyp_6-31g(d).smash.inp (generated)

000953426.b3lyp_6-31g(d).nwchem.inp (generated) 000953426.b3lyp_6-31g(d).log.xz 000953426.td-b3lyp_6-31g+(d).inp 000953426.td-b3lyp_6-31g+(d).log.xz

000953426.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953426.td-b3lyp_6-31+g(d).gjf (generated)

000953426.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953426.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953426.mol 000953426.PUBCHEM 000953426.mol (via Jmol)
000953427.b3lyp_6-31g(d).inp

000953427.b3lyp_6-31g(d).qchem.inp (generated)

000953427.b3lyp_6-31g(d).gjf (generated)

000953427.b3lyp_6-31g(d).firefly.inp (generated)

000953427.b3lyp_6-31g(d).smash.inp (generated)

000953427.b3lyp_6-31g(d).nwchem.inp (generated) 000953427.b3lyp_6-31g(d).log.xz 000953427.td-b3lyp_6-31g+(d).inp 000953427.td-b3lyp_6-31g+(d).log.xz

000953427.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953427.td-b3lyp_6-31+g(d).gjf (generated)

000953427.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953427.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953427.mol 000953427.PUBCHEM 000953427.mol (via Jmol)
000953429.b3lyp_6-31g(d).inp

000953429.b3lyp_6-31g(d).qchem.inp (generated)

000953429.b3lyp_6-31g(d).gjf (generated)

000953429.b3lyp_6-31g(d).firefly.inp (generated)

000953429.b3lyp_6-31g(d).smash.inp (generated)

000953429.b3lyp_6-31g(d).nwchem.inp (generated) 000953429.b3lyp_6-31g(d).log.xz 000953429.td-b3lyp_6-31g+(d).inp 000953429.td-b3lyp_6-31g+(d).log.xz

000953429.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953429.td-b3lyp_6-31+g(d).gjf (generated)

000953429.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953429.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953429.mol 000953429.PUBCHEM 000953429.mol (via Jmol)
000953433.b3lyp_6-31g(d).inp

000953433.b3lyp_6-31g(d).qchem.inp (generated)

000953433.b3lyp_6-31g(d).gjf (generated)

000953433.b3lyp_6-31g(d).firefly.inp (generated)

000953433.b3lyp_6-31g(d).smash.inp (generated)

000953433.b3lyp_6-31g(d).nwchem.inp (generated) 000953433.b3lyp_6-31g(d).log.xz 000953433.td-b3lyp_6-31g+(d).inp 000953433.td-b3lyp_6-31g+(d).log.xz

000953433.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953433.td-b3lyp_6-31+g(d).gjf (generated)

000953433.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953433.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953433.mol 000953433.PUBCHEM 000953433.mol (via Jmol)
000953436.b3lyp_6-31g(d).inp

000953436.b3lyp_6-31g(d).qchem.inp (generated)

000953436.b3lyp_6-31g(d).gjf (generated)

000953436.b3lyp_6-31g(d).firefly.inp (generated)

000953436.b3lyp_6-31g(d).smash.inp (generated)

000953436.b3lyp_6-31g(d).nwchem.inp (generated) 000953436.b3lyp_6-31g(d).log.xz 000953436.td-b3lyp_6-31g+(d).inp 000953436.td-b3lyp_6-31g+(d).log.xz

000953436.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953436.td-b3lyp_6-31+g(d).gjf (generated)

000953436.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953436.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953436.mol 000953436.PUBCHEM 000953436.mol (via Jmol)
000953478.b3lyp_6-31g(d).inp

000953478.b3lyp_6-31g(d).qchem.inp (generated)

000953478.b3lyp_6-31g(d).gjf (generated)

000953478.b3lyp_6-31g(d).firefly.inp (generated)

000953478.b3lyp_6-31g(d).smash.inp (generated)

000953478.b3lyp_6-31g(d).nwchem.inp (generated) 000953478.b3lyp_6-31g(d).log.xz 000953478.td-b3lyp_6-31g+(d).inp 000953478.td-b3lyp_6-31g+(d).log.xz

000953478.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953478.td-b3lyp_6-31+g(d).gjf (generated)

000953478.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953478.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953478.mol 000953478.PUBCHEM 000953478.mol (via Jmol)
000953481.b3lyp_6-31g(d).inp

000953481.b3lyp_6-31g(d).qchem.inp (generated)

000953481.b3lyp_6-31g(d).gjf (generated)

000953481.b3lyp_6-31g(d).firefly.inp (generated)

000953481.b3lyp_6-31g(d).smash.inp (generated)

000953481.b3lyp_6-31g(d).nwchem.inp (generated) 000953481.b3lyp_6-31g(d).log.xz 000953481.td-b3lyp_6-31g+(d).inp 000953481.td-b3lyp_6-31g+(d).log.xz

000953481.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953481.td-b3lyp_6-31+g(d).gjf (generated)

000953481.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953481.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953481.mol 000953481.PUBCHEM 000953481.mol (via Jmol)
000953482.b3lyp_6-31g(d).inp

000953482.b3lyp_6-31g(d).qchem.inp (generated)

000953482.b3lyp_6-31g(d).gjf (generated)

000953482.b3lyp_6-31g(d).firefly.inp (generated)

000953482.b3lyp_6-31g(d).smash.inp (generated)

000953482.b3lyp_6-31g(d).nwchem.inp (generated) 000953482.b3lyp_6-31g(d).log.xz 000953482.mol 000953482.PUBCHEM 000953482.mol (via Jmol)
000953568.b3lyp_6-31g(d).inp

000953568.b3lyp_6-31g(d).qchem.inp (generated)

000953568.b3lyp_6-31g(d).gjf (generated)

000953568.b3lyp_6-31g(d).firefly.inp (generated)

000953568.b3lyp_6-31g(d).smash.inp (generated)

000953568.b3lyp_6-31g(d).nwchem.inp (generated) 000953568.b3lyp_6-31g(d).log.xz 000953568.td-b3lyp_6-31g+(d).inp 000953568.td-b3lyp_6-31g+(d).log.xz

000953568.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953568.td-b3lyp_6-31+g(d).gjf (generated)

000953568.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953568.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953568.mol 000953568.PUBCHEM 000953568.mol (via Jmol)
000953578.b3lyp_6-31g(d).inp

000953578.b3lyp_6-31g(d).qchem.inp (generated)

000953578.b3lyp_6-31g(d).gjf (generated)

000953578.b3lyp_6-31g(d).firefly.inp (generated)

000953578.b3lyp_6-31g(d).smash.inp (generated)

000953578.b3lyp_6-31g(d).nwchem.inp (generated) 000953578.b3lyp_6-31g(d).log.xz 000953578.td-b3lyp_6-31g+(d).inp 000953578.td-b3lyp_6-31g+(d).log.xz

000953578.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953578.td-b3lyp_6-31+g(d).gjf (generated)

000953578.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953578.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953578.mol 000953578.PUBCHEM 000953578.mol (via Jmol)
000953655.b3lyp_6-31g(d).inp

000953655.b3lyp_6-31g(d).qchem.inp (generated)

000953655.b3lyp_6-31g(d).gjf (generated)

000953655.b3lyp_6-31g(d).firefly.inp (generated)

000953655.b3lyp_6-31g(d).smash.inp (generated)

000953655.b3lyp_6-31g(d).nwchem.inp (generated) 000953655.b3lyp_6-31g(d).log.xz 000953655.td-b3lyp_6-31g+(d).inp 000953655.td-b3lyp_6-31g+(d).log.xz

000953655.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953655.td-b3lyp_6-31+g(d).gjf (generated)

000953655.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953655.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953655.mol 000953655.PUBCHEM 000953655.mol (via Jmol)
000953687.b3lyp_6-31g(d).inp

000953687.b3lyp_6-31g(d).qchem.inp (generated)

000953687.b3lyp_6-31g(d).gjf (generated)

000953687.b3lyp_6-31g(d).firefly.inp (generated)

000953687.b3lyp_6-31g(d).smash.inp (generated)

000953687.b3lyp_6-31g(d).nwchem.inp (generated) 000953687.b3lyp_6-31g(d).log.xz 000953687.td-b3lyp_6-31g+(d).inp 000953687.td-b3lyp_6-31g+(d).log.xz

000953687.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953687.td-b3lyp_6-31+g(d).gjf (generated)

000953687.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953687.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953687.mol 000953687.PUBCHEM 000953687.mol (via Jmol)
000953777.b3lyp_6-31g(d).inp

000953777.b3lyp_6-31g(d).qchem.inp (generated)

000953777.b3lyp_6-31g(d).gjf (generated)

000953777.b3lyp_6-31g(d).firefly.inp (generated)

000953777.b3lyp_6-31g(d).smash.inp (generated)

000953777.b3lyp_6-31g(d).nwchem.inp (generated) 000953777.b3lyp_6-31g(d).log.xz 000953777.td-b3lyp_6-31g+(d).inp 000953777.td-b3lyp_6-31g+(d).log.xz

000953777.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953777.td-b3lyp_6-31+g(d).gjf (generated)

000953777.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953777.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953777.mol 000953777.PUBCHEM 000953777.mol (via Jmol)
000953851.b3lyp_6-31g(d).inp

000953851.b3lyp_6-31g(d).qchem.inp (generated)

000953851.b3lyp_6-31g(d).gjf (generated)

000953851.b3lyp_6-31g(d).firefly.inp (generated)

000953851.b3lyp_6-31g(d).smash.inp (generated)

000953851.b3lyp_6-31g(d).nwchem.inp (generated) 000953851.b3lyp_6-31g(d).log.xz 000953851.td-b3lyp_6-31g+(d).inp 000953851.td-b3lyp_6-31g+(d).log.xz

000953851.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953851.td-b3lyp_6-31+g(d).gjf (generated)

000953851.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953851.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953851.mol 000953851.PUBCHEM 000953851.mol (via Jmol)
000953897.b3lyp_6-31g(d).inp

000953897.b3lyp_6-31g(d).qchem.inp (generated)

000953897.b3lyp_6-31g(d).gjf (generated)

000953897.b3lyp_6-31g(d).firefly.inp (generated)

000953897.b3lyp_6-31g(d).smash.inp (generated)

000953897.b3lyp_6-31g(d).nwchem.inp (generated) 000953897.b3lyp_6-31g(d).log.xz 000953897.td-b3lyp_6-31g+(d).inp 000953897.td-b3lyp_6-31g+(d).log.xz

000953897.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953897.td-b3lyp_6-31+g(d).gjf (generated)

000953897.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953897.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953897.mol 000953897.PUBCHEM 000953897.mol (via Jmol)
000953905.b3lyp_6-31g(d).inp

000953905.b3lyp_6-31g(d).qchem.inp (generated)

000953905.b3lyp_6-31g(d).gjf (generated)

000953905.b3lyp_6-31g(d).firefly.inp (generated)

000953905.b3lyp_6-31g(d).smash.inp (generated)

000953905.b3lyp_6-31g(d).nwchem.inp (generated) 000953905.b3lyp_6-31g(d).log.xz 000953905.mol 000953905.PUBCHEM 000953905.mol (via Jmol)
000953921.b3lyp_6-31g(d).inp

000953921.b3lyp_6-31g(d).qchem.inp (generated)

000953921.b3lyp_6-31g(d).gjf (generated)

000953921.b3lyp_6-31g(d).firefly.inp (generated)

000953921.b3lyp_6-31g(d).smash.inp (generated)

000953921.b3lyp_6-31g(d).nwchem.inp (generated) 000953921.b3lyp_6-31g(d).log.xz 000953921.td-b3lyp_6-31g+(d).inp 000953921.td-b3lyp_6-31g+(d).log.xz

000953921.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953921.td-b3lyp_6-31+g(d).gjf (generated)

000953921.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953921.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953921.mol 000953921.PUBCHEM 000953921.mol (via Jmol)
000953924.b3lyp_6-31g(d).inp

000953924.b3lyp_6-31g(d).qchem.inp (generated)

000953924.b3lyp_6-31g(d).gjf (generated)

000953924.b3lyp_6-31g(d).firefly.inp (generated)

000953924.b3lyp_6-31g(d).smash.inp (generated)

000953924.b3lyp_6-31g(d).nwchem.inp (generated) 000953924.b3lyp_6-31g(d).log.xz 000953924.td-b3lyp_6-31g+(d).inp 000953924.td-b3lyp_6-31g+(d).log.xz

000953924.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953924.td-b3lyp_6-31+g(d).gjf (generated)

000953924.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953924.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953924.mol 000953924.PUBCHEM 000953924.mol (via Jmol)
000953936.b3lyp_6-31g(d).inp

000953936.b3lyp_6-31g(d).qchem.inp (generated)

000953936.b3lyp_6-31g(d).gjf (generated)

000953936.b3lyp_6-31g(d).firefly.inp (generated)

000953936.b3lyp_6-31g(d).smash.inp (generated)

000953936.b3lyp_6-31g(d).nwchem.inp (generated) 000953936.b3lyp_6-31g(d).log.xz 000953936.td-b3lyp_6-31g+(d).inp 000953936.td-b3lyp_6-31g+(d).log.xz

000953936.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953936.td-b3lyp_6-31+g(d).gjf (generated)

000953936.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953936.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953936.mol 000953936.PUBCHEM 000953936.mol (via Jmol)
000953937.b3lyp_6-31g(d).inp

000953937.b3lyp_6-31g(d).qchem.inp (generated)

000953937.b3lyp_6-31g(d).gjf (generated)

000953937.b3lyp_6-31g(d).firefly.inp (generated)

000953937.b3lyp_6-31g(d).smash.inp (generated)

000953937.b3lyp_6-31g(d).nwchem.inp (generated) 000953937.b3lyp_6-31g(d).log.xz 000953937.td-b3lyp_6-31g+(d).inp 000953937.td-b3lyp_6-31g+(d).log.xz

000953937.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953937.td-b3lyp_6-31+g(d).gjf (generated)

000953937.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953937.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953937.mol 000953937.PUBCHEM 000953937.mol (via Jmol)
000953948.b3lyp_6-31g(d).inp

000953948.b3lyp_6-31g(d).qchem.inp (generated)

000953948.b3lyp_6-31g(d).gjf (generated)

000953948.b3lyp_6-31g(d).firefly.inp (generated)

000953948.b3lyp_6-31g(d).smash.inp (generated)

000953948.b3lyp_6-31g(d).nwchem.inp (generated) 000953948.b3lyp_6-31g(d).log.xz 000953948.td-b3lyp_6-31g+(d).inp 000953948.td-b3lyp_6-31g+(d).log.xz

000953948.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953948.td-b3lyp_6-31+g(d).gjf (generated)

000953948.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953948.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953948.mol 000953948.PUBCHEM 000953948.mol (via Jmol)
000953949.b3lyp_6-31g(d).inp

000953949.b3lyp_6-31g(d).qchem.inp (generated)

000953949.b3lyp_6-31g(d).gjf (generated)

000953949.b3lyp_6-31g(d).firefly.inp (generated)

000953949.b3lyp_6-31g(d).smash.inp (generated)

000953949.b3lyp_6-31g(d).nwchem.inp (generated) 000953949.b3lyp_6-31g(d).log.xz 000953949.td-b3lyp_6-31g+(d).inp 000953949.td-b3lyp_6-31g+(d).log.xz

000953949.td-b3lyp_6-31+g(d).qchem.inp (generated)

000953949.td-b3lyp_6-31+g(d).gjf (generated)

000953949.td-b3lyp_6-31+g(d).firefly.inp (generated)

000953949.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000953949.mol 000953949.PUBCHEM 000953949.mol (via Jmol)
000954051.b3lyp_6-31g(d).inp

000954051.b3lyp_6-31g(d).qchem.inp (generated)

000954051.b3lyp_6-31g(d).gjf (generated)

000954051.b3lyp_6-31g(d).firefly.inp (generated)

000954051.b3lyp_6-31g(d).smash.inp (generated)

000954051.b3lyp_6-31g(d).nwchem.inp (generated) 000954051.b3lyp_6-31g(d).log.xz 000954051.td-b3lyp_6-31g+(d).inp 000954051.td-b3lyp_6-31g+(d).log.xz

000954051.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954051.td-b3lyp_6-31+g(d).gjf (generated)

000954051.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954051.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954051.mol 000954051.PUBCHEM 000954051.mol (via Jmol)
000954052.b3lyp_6-31g(d).inp

000954052.b3lyp_6-31g(d).qchem.inp (generated)

000954052.b3lyp_6-31g(d).gjf (generated)

000954052.b3lyp_6-31g(d).firefly.inp (generated)

000954052.b3lyp_6-31g(d).smash.inp (generated)

000954052.b3lyp_6-31g(d).nwchem.inp (generated) 000954052.b3lyp_6-31g(d).log.xz 000954052.td-b3lyp_6-31g+(d).inp 000954052.td-b3lyp_6-31g+(d).log.xz

000954052.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954052.td-b3lyp_6-31+g(d).gjf (generated)

000954052.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954052.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954052.mol 000954052.PUBCHEM 000954052.mol (via Jmol)
000954078.b3lyp_6-31g(d).inp

000954078.b3lyp_6-31g(d).qchem.inp (generated)

000954078.b3lyp_6-31g(d).gjf (generated)

000954078.b3lyp_6-31g(d).firefly.inp (generated)

000954078.b3lyp_6-31g(d).smash.inp (generated)

000954078.b3lyp_6-31g(d).nwchem.inp (generated) 000954078.b3lyp_6-31g(d).log.xz 000954078.td-b3lyp_6-31g+(d).inp 000954078.td-b3lyp_6-31g+(d).log.xz

000954078.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954078.td-b3lyp_6-31+g(d).gjf (generated)

000954078.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954078.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954078.mol 000954078.PUBCHEM 000954078.mol (via Jmol)
000954114.b3lyp_6-31g(d).inp

000954114.b3lyp_6-31g(d).qchem.inp (generated)

000954114.b3lyp_6-31g(d).gjf (generated)

000954114.b3lyp_6-31g(d).firefly.inp (generated)

000954114.b3lyp_6-31g(d).smash.inp (generated)

000954114.b3lyp_6-31g(d).nwchem.inp (generated) 000954114.b3lyp_6-31g(d).log.xz 000954114.mol 000954114.PUBCHEM 000954114.mol (via Jmol)
000954131.b3lyp_6-31g(d).inp

000954131.b3lyp_6-31g(d).qchem.inp (generated)

000954131.b3lyp_6-31g(d).gjf (generated)

000954131.b3lyp_6-31g(d).firefly.inp (generated)

000954131.b3lyp_6-31g(d).smash.inp (generated)

000954131.b3lyp_6-31g(d).nwchem.inp (generated) 000954131.b3lyp_6-31g(d).log.xz 000954131.td-b3lyp_6-31g+(d).inp 000954131.td-b3lyp_6-31g+(d).log.xz

000954131.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954131.td-b3lyp_6-31+g(d).gjf (generated)

000954131.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954131.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954131.mol 000954131.PUBCHEM 000954131.mol (via Jmol)
000954132.b3lyp_6-31g(d).inp

000954132.b3lyp_6-31g(d).qchem.inp (generated)

000954132.b3lyp_6-31g(d).gjf (generated)

000954132.b3lyp_6-31g(d).firefly.inp (generated)

000954132.b3lyp_6-31g(d).smash.inp (generated)

000954132.b3lyp_6-31g(d).nwchem.inp (generated) 000954132.b3lyp_6-31g(d).log.xz 000954132.td-b3lyp_6-31g+(d).inp 000954132.td-b3lyp_6-31g+(d).log.xz

000954132.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954132.td-b3lyp_6-31+g(d).gjf (generated)

000954132.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954132.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954132.mol 000954132.PUBCHEM 000954132.mol (via Jmol)
000954134.b3lyp_6-31g(d).inp

000954134.b3lyp_6-31g(d).qchem.inp (generated)

000954134.b3lyp_6-31g(d).gjf (generated)

000954134.b3lyp_6-31g(d).firefly.inp (generated)

000954134.b3lyp_6-31g(d).smash.inp (generated)

000954134.b3lyp_6-31g(d).nwchem.inp (generated) 000954134.b3lyp_6-31g(d).log.xz 000954134.td-b3lyp_6-31g+(d).inp 000954134.td-b3lyp_6-31g+(d).log.xz

000954134.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954134.td-b3lyp_6-31+g(d).gjf (generated)

000954134.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954134.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954134.mol 000954134.PUBCHEM 000954134.mol (via Jmol)
000954136.b3lyp_6-31g(d).inp

000954136.b3lyp_6-31g(d).qchem.inp (generated)

000954136.b3lyp_6-31g(d).gjf (generated)

000954136.b3lyp_6-31g(d).firefly.inp (generated)

000954136.b3lyp_6-31g(d).smash.inp (generated)

000954136.b3lyp_6-31g(d).nwchem.inp (generated) 000954136.b3lyp_6-31g(d).log.xz 000954136.td-b3lyp_6-31g+(d).inp 000954136.td-b3lyp_6-31g+(d).log.xz

000954136.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954136.td-b3lyp_6-31+g(d).gjf (generated)

000954136.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954136.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954136.mol 000954136.PUBCHEM 000954136.mol (via Jmol)
000954164.b3lyp_6-31g(d).inp

000954164.b3lyp_6-31g(d).qchem.inp (generated)

000954164.b3lyp_6-31g(d).gjf (generated)

000954164.b3lyp_6-31g(d).firefly.inp (generated)

000954164.b3lyp_6-31g(d).smash.inp (generated)

000954164.b3lyp_6-31g(d).nwchem.inp (generated) 000954164.b3lyp_6-31g(d).log.xz 000954164.mol 000954164.PUBCHEM 000954164.mol (via Jmol)
000954169.b3lyp_6-31g(d).inp

000954169.b3lyp_6-31g(d).qchem.inp (generated)

000954169.b3lyp_6-31g(d).gjf (generated)

000954169.b3lyp_6-31g(d).firefly.inp (generated)

000954169.b3lyp_6-31g(d).smash.inp (generated)

000954169.b3lyp_6-31g(d).nwchem.inp (generated) 000954169.b3lyp_6-31g(d).log.xz 000954169.td-b3lyp_6-31g+(d).inp 000954169.td-b3lyp_6-31g+(d).log.xz

000954169.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954169.td-b3lyp_6-31+g(d).gjf (generated)

000954169.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954169.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954169.mol 000954169.PUBCHEM 000954169.mol (via Jmol)
000954249.b3lyp_6-31g(d).inp

000954249.b3lyp_6-31g(d).qchem.inp (generated)

000954249.b3lyp_6-31g(d).gjf (generated)

000954249.b3lyp_6-31g(d).firefly.inp (generated)

000954249.b3lyp_6-31g(d).smash.inp (generated)

000954249.b3lyp_6-31g(d).nwchem.inp (generated) 000954249.b3lyp_6-31g(d).log.xz 000954249.td-b3lyp_6-31g+(d).inp 000954249.td-b3lyp_6-31g+(d).log.xz

000954249.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954249.td-b3lyp_6-31+g(d).gjf (generated)

000954249.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954249.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954249.mol 000954249.PUBCHEM 000954249.mol (via Jmol)
000954252.b3lyp_6-31g(d).inp

000954252.b3lyp_6-31g(d).qchem.inp (generated)

000954252.b3lyp_6-31g(d).gjf (generated)

000954252.b3lyp_6-31g(d).firefly.inp (generated)

000954252.b3lyp_6-31g(d).smash.inp (generated)

000954252.b3lyp_6-31g(d).nwchem.inp (generated) 000954252.b3lyp_6-31g(d).log.xz 000954252.td-b3lyp_6-31g+(d).inp 000954252.td-b3lyp_6-31g+(d).log.xz

000954252.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954252.td-b3lyp_6-31+g(d).gjf (generated)

000954252.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954252.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954252.mol 000954252.PUBCHEM 000954252.mol (via Jmol)
000954260.b3lyp_6-31g(d).inp

000954260.b3lyp_6-31g(d).qchem.inp (generated)

000954260.b3lyp_6-31g(d).gjf (generated)

000954260.b3lyp_6-31g(d).firefly.inp (generated)

000954260.b3lyp_6-31g(d).smash.inp (generated)

000954260.b3lyp_6-31g(d).nwchem.inp (generated) 000954260.b3lyp_6-31g(d).log.xz 000954260.td-b3lyp_6-31g+(d).inp 000954260.td-b3lyp_6-31g+(d).log.xz

000954260.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954260.td-b3lyp_6-31+g(d).gjf (generated)

000954260.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954260.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954260.mol 000954260.PUBCHEM 000954260.mol (via Jmol)
000954263.b3lyp_6-31g(d).inp

000954263.b3lyp_6-31g(d).qchem.inp (generated)

000954263.b3lyp_6-31g(d).gjf (generated)

000954263.b3lyp_6-31g(d).firefly.inp (generated)

000954263.b3lyp_6-31g(d).smash.inp (generated)

000954263.b3lyp_6-31g(d).nwchem.inp (generated) 000954263.b3lyp_6-31g(d).log.xz 000954263.td-b3lyp_6-31g+(d).inp 000954263.td-b3lyp_6-31g+(d).log.xz

000954263.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954263.td-b3lyp_6-31+g(d).gjf (generated)

000954263.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954263.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954263.mol 000954263.PUBCHEM 000954263.mol (via Jmol)
000954283.b3lyp_6-31g(d).inp

000954283.b3lyp_6-31g(d).qchem.inp (generated)

000954283.b3lyp_6-31g(d).gjf (generated)

000954283.b3lyp_6-31g(d).firefly.inp (generated)

000954283.b3lyp_6-31g(d).smash.inp (generated)

000954283.b3lyp_6-31g(d).nwchem.inp (generated) 000954283.b3lyp_6-31g(d).log.xz 000954283.td-b3lyp_6-31g+(d).inp 000954283.td-b3lyp_6-31g+(d).log.xz

000954283.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954283.td-b3lyp_6-31+g(d).gjf (generated)

000954283.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954283.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954283.mol 000954283.PUBCHEM 000954283.mol (via Jmol)
000954313.b3lyp_6-31g(d).inp

000954313.b3lyp_6-31g(d).qchem.inp (generated)

000954313.b3lyp_6-31g(d).gjf (generated)

000954313.b3lyp_6-31g(d).firefly.inp (generated)

000954313.b3lyp_6-31g(d).smash.inp (generated)

000954313.b3lyp_6-31g(d).nwchem.inp (generated) 000954313.b3lyp_6-31g(d).log.xz 000954313.mol 000954313.PUBCHEM 000954313.mol (via Jmol)
000954416.b3lyp_6-31g(d).inp

000954416.b3lyp_6-31g(d).qchem.inp (generated)

000954416.b3lyp_6-31g(d).gjf (generated)

000954416.b3lyp_6-31g(d).firefly.inp (generated)

000954416.b3lyp_6-31g(d).smash.inp (generated)

000954416.b3lyp_6-31g(d).nwchem.inp (generated) 000954416.b3lyp_6-31g(d).log.xz 000954416.mol 000954416.PUBCHEM 000954416.mol (via Jmol)
000954419.b3lyp_6-31g(d).inp

000954419.b3lyp_6-31g(d).qchem.inp (generated)

000954419.b3lyp_6-31g(d).gjf (generated)

000954419.b3lyp_6-31g(d).firefly.inp (generated)

000954419.b3lyp_6-31g(d).smash.inp (generated)

000954419.b3lyp_6-31g(d).nwchem.inp (generated) 000954419.b3lyp_6-31g(d).log.xz 000954419.mol 000954419.PUBCHEM 000954419.mol (via Jmol)
000954421.b3lyp_6-31g(d).inp

000954421.b3lyp_6-31g(d).qchem.inp (generated)

000954421.b3lyp_6-31g(d).gjf (generated)

000954421.b3lyp_6-31g(d).firefly.inp (generated)

000954421.b3lyp_6-31g(d).smash.inp (generated)

000954421.b3lyp_6-31g(d).nwchem.inp (generated) 000954421.b3lyp_6-31g(d).log.xz 000954421.td-b3lyp_6-31g+(d).inp 000954421.td-b3lyp_6-31g+(d).log.xz

000954421.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954421.td-b3lyp_6-31+g(d).gjf (generated)

000954421.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954421.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954421.mol 000954421.PUBCHEM 000954421.mol (via Jmol)
000954457.b3lyp_6-31g(d).inp

000954457.b3lyp_6-31g(d).qchem.inp (generated)

000954457.b3lyp_6-31g(d).gjf (generated)

000954457.b3lyp_6-31g(d).firefly.inp (generated)

000954457.b3lyp_6-31g(d).smash.inp (generated)

000954457.b3lyp_6-31g(d).nwchem.inp (generated) 000954457.b3lyp_6-31g(d).log.xz 000954457.td-b3lyp_6-31g+(d).inp 000954457.td-b3lyp_6-31g+(d).log.xz

000954457.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954457.td-b3lyp_6-31+g(d).gjf (generated)

000954457.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954457.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954457.mol 000954457.PUBCHEM 000954457.mol (via Jmol)
000954465.b3lyp_6-31g(d).inp

000954465.b3lyp_6-31g(d).qchem.inp (generated)

000954465.b3lyp_6-31g(d).gjf (generated)

000954465.b3lyp_6-31g(d).firefly.inp (generated)

000954465.b3lyp_6-31g(d).smash.inp (generated)

000954465.b3lyp_6-31g(d).nwchem.inp (generated) 000954465.b3lyp_6-31g(d).log.xz 000954465.td-b3lyp_6-31g+(d).inp 000954465.td-b3lyp_6-31g+(d).log.xz

000954465.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954465.td-b3lyp_6-31+g(d).gjf (generated)

000954465.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954465.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954465.mol 000954465.PUBCHEM 000954465.mol (via Jmol)
000954467.b3lyp_6-31g(d).inp

000954467.b3lyp_6-31g(d).qchem.inp (generated)

000954467.b3lyp_6-31g(d).gjf (generated)

000954467.b3lyp_6-31g(d).firefly.inp (generated)

000954467.b3lyp_6-31g(d).smash.inp (generated)

000954467.b3lyp_6-31g(d).nwchem.inp (generated) 000954467.b3lyp_6-31g(d).log.xz 000954467.td-b3lyp_6-31g+(d).inp 000954467.td-b3lyp_6-31g+(d).log.xz

000954467.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954467.td-b3lyp_6-31+g(d).gjf (generated)

000954467.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954467.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954467.mol 000954467.PUBCHEM 000954467.mol (via Jmol)
000954470.b3lyp_6-31g(d).inp

000954470.b3lyp_6-31g(d).qchem.inp (generated)

000954470.b3lyp_6-31g(d).gjf (generated)

000954470.b3lyp_6-31g(d).firefly.inp (generated)

000954470.b3lyp_6-31g(d).smash.inp (generated)

000954470.b3lyp_6-31g(d).nwchem.inp (generated) 000954470.b3lyp_6-31g(d).log.xz 000954470.td-b3lyp_6-31g+(d).inp 000954470.td-b3lyp_6-31g+(d).log.xz

000954470.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954470.td-b3lyp_6-31+g(d).gjf (generated)

000954470.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954470.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954470.mol 000954470.PUBCHEM 000954470.mol (via Jmol)
000954471.b3lyp_6-31g(d).inp

000954471.b3lyp_6-31g(d).qchem.inp (generated)

000954471.b3lyp_6-31g(d).gjf (generated)

000954471.b3lyp_6-31g(d).firefly.inp (generated)

000954471.b3lyp_6-31g(d).smash.inp (generated)

000954471.b3lyp_6-31g(d).nwchem.inp (generated) 000954471.b3lyp_6-31g(d).log.xz 000954471.td-b3lyp_6-31g+(d).inp 000954471.td-b3lyp_6-31g+(d).log.xz

000954471.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954471.td-b3lyp_6-31+g(d).gjf (generated)

000954471.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954471.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954471.mol 000954471.PUBCHEM 000954471.mol (via Jmol)
000954515.b3lyp_6-31g(d).inp

000954515.b3lyp_6-31g(d).qchem.inp (generated)

000954515.b3lyp_6-31g(d).gjf (generated)

000954515.b3lyp_6-31g(d).firefly.inp (generated)

000954515.b3lyp_6-31g(d).smash.inp (generated)

000954515.b3lyp_6-31g(d).nwchem.inp (generated) 000954515.b3lyp_6-31g(d).log.xz 000954515.td-b3lyp_6-31g+(d).inp 000954515.td-b3lyp_6-31g+(d).log.xz

000954515.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954515.td-b3lyp_6-31+g(d).gjf (generated)

000954515.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954515.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954515.mol 000954515.PUBCHEM 000954515.mol (via Jmol)
000954619.b3lyp_6-31g(d).inp

000954619.b3lyp_6-31g(d).qchem.inp (generated)

000954619.b3lyp_6-31g(d).gjf (generated)

000954619.b3lyp_6-31g(d).firefly.inp (generated)

000954619.b3lyp_6-31g(d).smash.inp (generated)

000954619.b3lyp_6-31g(d).nwchem.inp (generated) 000954619.b3lyp_6-31g(d).log.xz 000954619.td-b3lyp_6-31g+(d).inp 000954619.td-b3lyp_6-31g+(d).log.xz

000954619.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954619.td-b3lyp_6-31+g(d).gjf (generated)

000954619.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954619.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954619.mol 000954619.PUBCHEM 000954619.mol (via Jmol)
000954642.b3lyp_6-31g(d).inp

000954642.b3lyp_6-31g(d).qchem.inp (generated)

000954642.b3lyp_6-31g(d).gjf (generated)

000954642.b3lyp_6-31g(d).firefly.inp (generated)

000954642.b3lyp_6-31g(d).smash.inp (generated)

000954642.b3lyp_6-31g(d).nwchem.inp (generated) 000954642.b3lyp_6-31g(d).log.xz 000954642.td-b3lyp_6-31g+(d).inp 000954642.td-b3lyp_6-31g+(d).log.xz

000954642.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954642.td-b3lyp_6-31+g(d).gjf (generated)

000954642.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954642.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954642.mol 000954642.PUBCHEM 000954642.mol (via Jmol)
000954716.b3lyp_6-31g(d).inp

000954716.b3lyp_6-31g(d).qchem.inp (generated)

000954716.b3lyp_6-31g(d).gjf (generated)

000954716.b3lyp_6-31g(d).firefly.inp (generated)

000954716.b3lyp_6-31g(d).smash.inp (generated)

000954716.b3lyp_6-31g(d).nwchem.inp (generated) 000954716.b3lyp_6-31g(d).log.xz 000954716.td-b3lyp_6-31g+(d).inp 000954716.td-b3lyp_6-31g+(d).log.xz

000954716.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954716.td-b3lyp_6-31+g(d).gjf (generated)

000954716.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954716.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954716.mol 000954716.PUBCHEM 000954716.mol (via Jmol)
000954735.b3lyp_6-31g(d).inp

000954735.b3lyp_6-31g(d).qchem.inp (generated)

000954735.b3lyp_6-31g(d).gjf (generated)

000954735.b3lyp_6-31g(d).firefly.inp (generated)

000954735.b3lyp_6-31g(d).smash.inp (generated)

000954735.b3lyp_6-31g(d).nwchem.inp (generated) 000954735.b3lyp_6-31g(d).log.xz 000954735.td-b3lyp_6-31g+(d).inp 000954735.td-b3lyp_6-31g+(d).log.xz

000954735.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954735.td-b3lyp_6-31+g(d).gjf (generated)

000954735.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954735.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954735.mol 000954735.PUBCHEM 000954735.mol (via Jmol)
000954770.b3lyp_6-31g(d).inp

000954770.b3lyp_6-31g(d).qchem.inp (generated)

000954770.b3lyp_6-31g(d).gjf (generated)

000954770.b3lyp_6-31g(d).firefly.inp (generated)

000954770.b3lyp_6-31g(d).smash.inp (generated)

000954770.b3lyp_6-31g(d).nwchem.inp (generated) 000954770.b3lyp_6-31g(d).log.xz 000954770.mol 000954770.PUBCHEM 000954770.mol (via Jmol)
000954804.b3lyp_6-31g(d).inp

000954804.b3lyp_6-31g(d).qchem.inp (generated)

000954804.b3lyp_6-31g(d).gjf (generated)

000954804.b3lyp_6-31g(d).firefly.inp (generated)

000954804.b3lyp_6-31g(d).smash.inp (generated)

000954804.b3lyp_6-31g(d).nwchem.inp (generated) 000954804.b3lyp_6-31g(d).log.xz 000954804.mol 000954804.PUBCHEM 000954804.mol (via Jmol)
000954839.b3lyp_6-31g(d).inp

000954839.b3lyp_6-31g(d).qchem.inp (generated)

000954839.b3lyp_6-31g(d).gjf (generated)

000954839.b3lyp_6-31g(d).firefly.inp (generated)

000954839.b3lyp_6-31g(d).smash.inp (generated)

000954839.b3lyp_6-31g(d).nwchem.inp (generated) 000954839.b3lyp_6-31g(d).log.xz 000954839.td-b3lyp_6-31g+(d).inp 000954839.td-b3lyp_6-31g+(d).log.xz

000954839.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954839.td-b3lyp_6-31+g(d).gjf (generated)

000954839.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954839.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954839.mol 000954839.PUBCHEM 000954839.mol (via Jmol)
000954851.b3lyp_6-31g(d).inp

000954851.b3lyp_6-31g(d).qchem.inp (generated)

000954851.b3lyp_6-31g(d).gjf (generated)

000954851.b3lyp_6-31g(d).firefly.inp (generated)

000954851.b3lyp_6-31g(d).smash.inp (generated)

000954851.b3lyp_6-31g(d).nwchem.inp (generated) 000954851.b3lyp_6-31g(d).log.xz 000954851.td-b3lyp_6-31g+(d).inp 000954851.td-b3lyp_6-31g+(d).log.xz

000954851.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954851.td-b3lyp_6-31+g(d).gjf (generated)

000954851.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954851.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954851.mol 000954851.PUBCHEM 000954851.mol (via Jmol)
000954852.b3lyp_6-31g(d).inp

000954852.b3lyp_6-31g(d).qchem.inp (generated)

000954852.b3lyp_6-31g(d).gjf (generated)

000954852.b3lyp_6-31g(d).firefly.inp (generated)

000954852.b3lyp_6-31g(d).smash.inp (generated)

000954852.b3lyp_6-31g(d).nwchem.inp (generated) 000954852.b3lyp_6-31g(d).log.xz 000954852.td-b3lyp_6-31g+(d).inp 000954852.td-b3lyp_6-31g+(d).log.xz

000954852.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954852.td-b3lyp_6-31+g(d).gjf (generated)

000954852.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954852.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954852.mol 000954852.PUBCHEM 000954852.mol (via Jmol)
000954889.b3lyp_6-31g(d).inp

000954889.b3lyp_6-31g(d).qchem.inp (generated)

000954889.b3lyp_6-31g(d).gjf (generated)

000954889.b3lyp_6-31g(d).firefly.inp (generated)

000954889.b3lyp_6-31g(d).smash.inp (generated)

000954889.b3lyp_6-31g(d).nwchem.inp (generated) 000954889.b3lyp_6-31g(d).log.xz 000954889.mol 000954889.PUBCHEM 000954889.mol (via Jmol)
000954890.b3lyp_6-31g(d).inp

000954890.b3lyp_6-31g(d).qchem.inp (generated)

000954890.b3lyp_6-31g(d).gjf (generated)

000954890.b3lyp_6-31g(d).firefly.inp (generated)

000954890.b3lyp_6-31g(d).smash.inp (generated)

000954890.b3lyp_6-31g(d).nwchem.inp (generated) 000954890.b3lyp_6-31g(d).log.xz 000954890.mol 000954890.PUBCHEM 000954890.mol (via Jmol)
000954897.b3lyp_6-31g(d).inp

000954897.b3lyp_6-31g(d).qchem.inp (generated)

000954897.b3lyp_6-31g(d).gjf (generated)

000954897.b3lyp_6-31g(d).firefly.inp (generated)

000954897.b3lyp_6-31g(d).smash.inp (generated)

000954897.b3lyp_6-31g(d).nwchem.inp (generated) 000954897.b3lyp_6-31g(d).log.xz 000954897.td-b3lyp_6-31g+(d).inp 000954897.td-b3lyp_6-31g+(d).log.xz

000954897.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954897.td-b3lyp_6-31+g(d).gjf (generated)

000954897.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954897.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954897.mol 000954897.PUBCHEM 000954897.mol (via Jmol)
000954911.b3lyp_6-31g(d).inp

000954911.b3lyp_6-31g(d).qchem.inp (generated)

000954911.b3lyp_6-31g(d).gjf (generated)

000954911.b3lyp_6-31g(d).firefly.inp (generated)

000954911.b3lyp_6-31g(d).smash.inp (generated)

000954911.b3lyp_6-31g(d).nwchem.inp (generated) 000954911.b3lyp_6-31g(d).log.xz 000954911.td-b3lyp_6-31g+(d).inp 000954911.td-b3lyp_6-31g+(d).log.xz

000954911.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954911.td-b3lyp_6-31+g(d).gjf (generated)

000954911.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954911.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954911.mol 000954911.PUBCHEM 000954911.mol (via Jmol)
000954912.b3lyp_6-31g(d).inp

000954912.b3lyp_6-31g(d).qchem.inp (generated)

000954912.b3lyp_6-31g(d).gjf (generated)

000954912.b3lyp_6-31g(d).firefly.inp (generated)

000954912.b3lyp_6-31g(d).smash.inp (generated)

000954912.b3lyp_6-31g(d).nwchem.inp (generated) 000954912.b3lyp_6-31g(d).log.xz 000954912.td-b3lyp_6-31g+(d).inp 000954912.td-b3lyp_6-31g+(d).log.xz

000954912.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954912.td-b3lyp_6-31+g(d).gjf (generated)

000954912.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954912.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954912.mol 000954912.PUBCHEM 000954912.mol (via Jmol)
000954953.b3lyp_6-31g(d).inp

000954953.b3lyp_6-31g(d).qchem.inp (generated)

000954953.b3lyp_6-31g(d).gjf (generated)

000954953.b3lyp_6-31g(d).firefly.inp (generated)

000954953.b3lyp_6-31g(d).smash.inp (generated)

000954953.b3lyp_6-31g(d).nwchem.inp (generated) 000954953.b3lyp_6-31g(d).log.xz 000954953.td-b3lyp_6-31g+(d).inp 000954953.td-b3lyp_6-31g+(d).log.xz

000954953.td-b3lyp_6-31+g(d).qchem.inp (generated)

000954953.td-b3lyp_6-31+g(d).gjf (generated)

000954953.td-b3lyp_6-31+g(d).firefly.inp (generated)

000954953.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000954953.mol 000954953.PUBCHEM 000954953.mol (via Jmol)
000955021.b3lyp_6-31g(d).inp

000955021.b3lyp_6-31g(d).qchem.inp (generated)

000955021.b3lyp_6-31g(d).gjf (generated)

000955021.b3lyp_6-31g(d).firefly.inp (generated)

000955021.b3lyp_6-31g(d).smash.inp (generated)

000955021.b3lyp_6-31g(d).nwchem.inp (generated) 000955021.b3lyp_6-31g(d).log.xz 000955021.td-b3lyp_6-31g+(d).inp 000955021.td-b3lyp_6-31g+(d).log.xz

000955021.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955021.td-b3lyp_6-31+g(d).gjf (generated)

000955021.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955021.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955021.mol 000955021.PUBCHEM 000955021.mol (via Jmol)
000955144.b3lyp_6-31g(d).inp

000955144.b3lyp_6-31g(d).qchem.inp (generated)

000955144.b3lyp_6-31g(d).gjf (generated)

000955144.b3lyp_6-31g(d).firefly.inp (generated)

000955144.b3lyp_6-31g(d).smash.inp (generated)

000955144.b3lyp_6-31g(d).nwchem.inp (generated) 000955144.b3lyp_6-31g(d).log.xz 000955144.td-b3lyp_6-31g+(d).inp 000955144.td-b3lyp_6-31g+(d).log.xz

000955144.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955144.td-b3lyp_6-31+g(d).gjf (generated)

000955144.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955144.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955144.mol 000955144.PUBCHEM 000955144.mol (via Jmol)
000955146.b3lyp_6-31g(d).inp

000955146.b3lyp_6-31g(d).qchem.inp (generated)

000955146.b3lyp_6-31g(d).gjf (generated)

000955146.b3lyp_6-31g(d).firefly.inp (generated)

000955146.b3lyp_6-31g(d).smash.inp (generated)

000955146.b3lyp_6-31g(d).nwchem.inp (generated) 000955146.b3lyp_6-31g(d).log.xz 000955146.td-b3lyp_6-31g+(d).inp 000955146.td-b3lyp_6-31g+(d).log.xz

000955146.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955146.td-b3lyp_6-31+g(d).gjf (generated)

000955146.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955146.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955146.mol 000955146.PUBCHEM 000955146.mol (via Jmol)
000955162.b3lyp_6-31g(d).inp

000955162.b3lyp_6-31g(d).qchem.inp (generated)

000955162.b3lyp_6-31g(d).gjf (generated)

000955162.b3lyp_6-31g(d).firefly.inp (generated)

000955162.b3lyp_6-31g(d).smash.inp (generated)

000955162.b3lyp_6-31g(d).nwchem.inp (generated) 000955162.b3lyp_6-31g(d).log.xz 000955162.td-b3lyp_6-31g+(d).inp 000955162.td-b3lyp_6-31g+(d).log.xz

000955162.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955162.td-b3lyp_6-31+g(d).gjf (generated)

000955162.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955162.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955162.mol 000955162.PUBCHEM 000955162.mol (via Jmol)
000955172.b3lyp_6-31g(d).inp

000955172.b3lyp_6-31g(d).qchem.inp (generated)

000955172.b3lyp_6-31g(d).gjf (generated)

000955172.b3lyp_6-31g(d).firefly.inp (generated)

000955172.b3lyp_6-31g(d).smash.inp (generated)

000955172.b3lyp_6-31g(d).nwchem.inp (generated) 000955172.b3lyp_6-31g(d).log.xz 000955172.td-b3lyp_6-31g+(d).inp 000955172.td-b3lyp_6-31g+(d).log.xz

000955172.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955172.td-b3lyp_6-31+g(d).gjf (generated)

000955172.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955172.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955172.mol 000955172.PUBCHEM 000955172.mol (via Jmol)
000955306.b3lyp_6-31g(d).inp

000955306.b3lyp_6-31g(d).qchem.inp (generated)

000955306.b3lyp_6-31g(d).gjf (generated)

000955306.b3lyp_6-31g(d).firefly.inp (generated)

000955306.b3lyp_6-31g(d).smash.inp (generated)

000955306.b3lyp_6-31g(d).nwchem.inp (generated) 000955306.b3lyp_6-31g(d).log.xz 000955306.td-b3lyp_6-31g+(d).inp 000955306.td-b3lyp_6-31g+(d).log.xz

000955306.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955306.td-b3lyp_6-31+g(d).gjf (generated)

000955306.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955306.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955306.mol 000955306.PUBCHEM 000955306.mol (via Jmol)
000955343.b3lyp_6-31g(d).inp

000955343.b3lyp_6-31g(d).qchem.inp (generated)

000955343.b3lyp_6-31g(d).gjf (generated)

000955343.b3lyp_6-31g(d).firefly.inp (generated)

000955343.b3lyp_6-31g(d).smash.inp (generated)

000955343.b3lyp_6-31g(d).nwchem.inp (generated) 000955343.b3lyp_6-31g(d).log.xz 000955343.mol 000955343.PUBCHEM 000955343.mol (via Jmol)
000955410.b3lyp_6-31g(d).inp

000955410.b3lyp_6-31g(d).qchem.inp (generated)

000955410.b3lyp_6-31g(d).gjf (generated)

000955410.b3lyp_6-31g(d).firefly.inp (generated)

000955410.b3lyp_6-31g(d).smash.inp (generated)

000955410.b3lyp_6-31g(d).nwchem.inp (generated) 000955410.b3lyp_6-31g(d).log.xz 000955410.mol 000955410.PUBCHEM 000955410.mol (via Jmol)
000955413.b3lyp_6-31g(d).inp

000955413.b3lyp_6-31g(d).qchem.inp (generated)

000955413.b3lyp_6-31g(d).gjf (generated)

000955413.b3lyp_6-31g(d).firefly.inp (generated)

000955413.b3lyp_6-31g(d).smash.inp (generated)

000955413.b3lyp_6-31g(d).nwchem.inp (generated) 000955413.b3lyp_6-31g(d).log.xz 000955413.td-b3lyp_6-31g+(d).inp 000955413.td-b3lyp_6-31g+(d).log.xz

000955413.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955413.td-b3lyp_6-31+g(d).gjf (generated)

000955413.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955413.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955413.mol 000955413.PUBCHEM 000955413.mol (via Jmol)
000955436.b3lyp_6-31g(d).inp

000955436.b3lyp_6-31g(d).qchem.inp (generated)

000955436.b3lyp_6-31g(d).gjf (generated)

000955436.b3lyp_6-31g(d).firefly.inp (generated)

000955436.b3lyp_6-31g(d).smash.inp (generated)

000955436.b3lyp_6-31g(d).nwchem.inp (generated) 000955436.b3lyp_6-31g(d).log.xz 000955436.td-b3lyp_6-31g+(d).inp 000955436.td-b3lyp_6-31g+(d).log.xz

000955436.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955436.td-b3lyp_6-31+g(d).gjf (generated)

000955436.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955436.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955436.mol 000955436.PUBCHEM 000955436.mol (via Jmol)
000955459.b3lyp_6-31g(d).inp

000955459.b3lyp_6-31g(d).qchem.inp (generated)

000955459.b3lyp_6-31g(d).gjf (generated)

000955459.b3lyp_6-31g(d).firefly.inp (generated)

000955459.b3lyp_6-31g(d).smash.inp (generated)

000955459.b3lyp_6-31g(d).nwchem.inp (generated) 000955459.b3lyp_6-31g(d).log.xz 000955459.td-b3lyp_6-31g+(d).inp 000955459.td-b3lyp_6-31g+(d).log.xz

000955459.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955459.td-b3lyp_6-31+g(d).gjf (generated)

000955459.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955459.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955459.mol 000955459.PUBCHEM 000955459.mol (via Jmol)
000955486.b3lyp_6-31g(d).inp

000955486.b3lyp_6-31g(d).qchem.inp (generated)

000955486.b3lyp_6-31g(d).gjf (generated)

000955486.b3lyp_6-31g(d).firefly.inp (generated)

000955486.b3lyp_6-31g(d).smash.inp (generated)

000955486.b3lyp_6-31g(d).nwchem.inp (generated) 000955486.b3lyp_6-31g(d).log.xz 000955486.td-b3lyp_6-31g+(d).inp 000955486.td-b3lyp_6-31g+(d).log.xz

000955486.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955486.td-b3lyp_6-31+g(d).gjf (generated)

000955486.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955486.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955486.mol 000955486.PUBCHEM 000955486.mol (via Jmol)
000955487.b3lyp_6-31g(d).inp

000955487.b3lyp_6-31g(d).qchem.inp (generated)

000955487.b3lyp_6-31g(d).gjf (generated)

000955487.b3lyp_6-31g(d).firefly.inp (generated)

000955487.b3lyp_6-31g(d).smash.inp (generated)

000955487.b3lyp_6-31g(d).nwchem.inp (generated) 000955487.b3lyp_6-31g(d).log.xz 000955487.td-b3lyp_6-31g+(d).inp 000955487.td-b3lyp_6-31g+(d).log.xz

000955487.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955487.td-b3lyp_6-31+g(d).gjf (generated)

000955487.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955487.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955487.mol 000955487.PUBCHEM 000955487.mol (via Jmol)
000955518.b3lyp_6-31g(d).inp

000955518.b3lyp_6-31g(d).qchem.inp (generated)

000955518.b3lyp_6-31g(d).gjf (generated)

000955518.b3lyp_6-31g(d).firefly.inp (generated)

000955518.b3lyp_6-31g(d).smash.inp (generated)

000955518.b3lyp_6-31g(d).nwchem.inp (generated) 000955518.b3lyp_6-31g(d).log.xz 000955518.mol 000955518.PUBCHEM 000955518.mol (via Jmol)
000955556.b3lyp_6-31g(d).inp

000955556.b3lyp_6-31g(d).qchem.inp (generated)

000955556.b3lyp_6-31g(d).gjf (generated)

000955556.b3lyp_6-31g(d).firefly.inp (generated)

000955556.b3lyp_6-31g(d).smash.inp (generated)

000955556.b3lyp_6-31g(d).nwchem.inp (generated) 000955556.b3lyp_6-31g(d).log.xz 000955556.td-b3lyp_6-31g+(d).inp 000955556.td-b3lyp_6-31g+(d).log.xz

000955556.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955556.td-b3lyp_6-31+g(d).gjf (generated)

000955556.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955556.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955556.mol 000955556.PUBCHEM 000955556.mol (via Jmol)
000955611.b3lyp_6-31g(d).inp

000955611.b3lyp_6-31g(d).qchem.inp (generated)

000955611.b3lyp_6-31g(d).gjf (generated)

000955611.b3lyp_6-31g(d).firefly.inp (generated)

000955611.b3lyp_6-31g(d).smash.inp (generated)

000955611.b3lyp_6-31g(d).nwchem.inp (generated) 000955611.b3lyp_6-31g(d).log.xz 000955611.td-b3lyp_6-31g+(d).inp 000955611.td-b3lyp_6-31g+(d).log.xz

000955611.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955611.td-b3lyp_6-31+g(d).gjf (generated)

000955611.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955611.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955611.mol 000955611.PUBCHEM 000955611.mol (via Jmol)
000955618.b3lyp_6-31g(d).inp

000955618.b3lyp_6-31g(d).qchem.inp (generated)

000955618.b3lyp_6-31g(d).gjf (generated)

000955618.b3lyp_6-31g(d).firefly.inp (generated)

000955618.b3lyp_6-31g(d).smash.inp (generated)

000955618.b3lyp_6-31g(d).nwchem.inp (generated) 000955618.b3lyp_6-31g(d).log.xz 000955618.td-b3lyp_6-31g+(d).inp 000955618.td-b3lyp_6-31g+(d).log.xz

000955618.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955618.td-b3lyp_6-31+g(d).gjf (generated)

000955618.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955618.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955618.mol 000955618.PUBCHEM 000955618.mol (via Jmol)
000955620.b3lyp_6-31g(d).inp

000955620.b3lyp_6-31g(d).qchem.inp (generated)

000955620.b3lyp_6-31g(d).gjf (generated)

000955620.b3lyp_6-31g(d).firefly.inp (generated)

000955620.b3lyp_6-31g(d).smash.inp (generated)

000955620.b3lyp_6-31g(d).nwchem.inp (generated) 000955620.b3lyp_6-31g(d).log.xz 000955620.td-b3lyp_6-31g+(d).inp 000955620.td-b3lyp_6-31g+(d).log.xz

000955620.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955620.td-b3lyp_6-31+g(d).gjf (generated)

000955620.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955620.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955620.mol 000955620.PUBCHEM 000955620.mol (via Jmol)
000955621.b3lyp_6-31g(d).inp

000955621.b3lyp_6-31g(d).qchem.inp (generated)

000955621.b3lyp_6-31g(d).gjf (generated)

000955621.b3lyp_6-31g(d).firefly.inp (generated)

000955621.b3lyp_6-31g(d).smash.inp (generated)

000955621.b3lyp_6-31g(d).nwchem.inp (generated) 000955621.b3lyp_6-31g(d).log.xz 000955621.mol 000955621.PUBCHEM 000955621.mol (via Jmol)
000955636.b3lyp_6-31g(d).inp

000955636.b3lyp_6-31g(d).qchem.inp (generated)

000955636.b3lyp_6-31g(d).gjf (generated)

000955636.b3lyp_6-31g(d).firefly.inp (generated)

000955636.b3lyp_6-31g(d).smash.inp (generated)

000955636.b3lyp_6-31g(d).nwchem.inp (generated) 000955636.b3lyp_6-31g(d).log.xz 000955636.td-b3lyp_6-31g+(d).inp 000955636.td-b3lyp_6-31g+(d).log.xz

000955636.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955636.td-b3lyp_6-31+g(d).gjf (generated)

000955636.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955636.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955636.mol 000955636.PUBCHEM 000955636.mol (via Jmol)
000955649.b3lyp_6-31g(d).inp

000955649.b3lyp_6-31g(d).qchem.inp (generated)

000955649.b3lyp_6-31g(d).gjf (generated)

000955649.b3lyp_6-31g(d).firefly.inp (generated)

000955649.b3lyp_6-31g(d).smash.inp (generated)

000955649.b3lyp_6-31g(d).nwchem.inp (generated) 000955649.b3lyp_6-31g(d).log.xz 000955649.td-b3lyp_6-31g+(d).inp 000955649.td-b3lyp_6-31g+(d).log.xz

000955649.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955649.td-b3lyp_6-31+g(d).gjf (generated)

000955649.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955649.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955649.mol 000955649.PUBCHEM 000955649.mol (via Jmol)
000955650.b3lyp_6-31g(d).inp

000955650.b3lyp_6-31g(d).qchem.inp (generated)

000955650.b3lyp_6-31g(d).gjf (generated)

000955650.b3lyp_6-31g(d).firefly.inp (generated)

000955650.b3lyp_6-31g(d).smash.inp (generated)

000955650.b3lyp_6-31g(d).nwchem.inp (generated) 000955650.b3lyp_6-31g(d).log.xz 000955650.td-b3lyp_6-31g+(d).inp 000955650.td-b3lyp_6-31g+(d).log.xz

000955650.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955650.td-b3lyp_6-31+g(d).gjf (generated)

000955650.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955650.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955650.mol 000955650.PUBCHEM 000955650.mol (via Jmol)
000955652.b3lyp_6-31g(d).inp

000955652.b3lyp_6-31g(d).qchem.inp (generated)

000955652.b3lyp_6-31g(d).gjf (generated)

000955652.b3lyp_6-31g(d).firefly.inp (generated)

000955652.b3lyp_6-31g(d).smash.inp (generated)

000955652.b3lyp_6-31g(d).nwchem.inp (generated) 000955652.b3lyp_6-31g(d).log.xz 000955652.td-b3lyp_6-31g+(d).inp 000955652.td-b3lyp_6-31g+(d).log.xz

000955652.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955652.td-b3lyp_6-31+g(d).gjf (generated)

000955652.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955652.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955652.mol 000955652.PUBCHEM 000955652.mol (via Jmol)
000955660.b3lyp_6-31g(d).inp

000955660.b3lyp_6-31g(d).qchem.inp (generated)

000955660.b3lyp_6-31g(d).gjf (generated)

000955660.b3lyp_6-31g(d).firefly.inp (generated)

000955660.b3lyp_6-31g(d).smash.inp (generated)

000955660.b3lyp_6-31g(d).nwchem.inp (generated) 000955660.b3lyp_6-31g(d).log.xz 000955660.td-b3lyp_6-31g+(d).inp 000955660.td-b3lyp_6-31g+(d).log.xz

000955660.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955660.td-b3lyp_6-31+g(d).gjf (generated)

000955660.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955660.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955660.mol 000955660.PUBCHEM 000955660.mol (via Jmol)
000955662.b3lyp_6-31g(d).inp

000955662.b3lyp_6-31g(d).qchem.inp (generated)

000955662.b3lyp_6-31g(d).gjf (generated)

000955662.b3lyp_6-31g(d).firefly.inp (generated)

000955662.b3lyp_6-31g(d).smash.inp (generated)

000955662.b3lyp_6-31g(d).nwchem.inp (generated) 000955662.b3lyp_6-31g(d).log.xz 000955662.td-b3lyp_6-31g+(d).inp 000955662.td-b3lyp_6-31g+(d).log.xz

000955662.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955662.td-b3lyp_6-31+g(d).gjf (generated)

000955662.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955662.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955662.mol 000955662.PUBCHEM 000955662.mol (via Jmol)
000955666.b3lyp_6-31g(d).inp

000955666.b3lyp_6-31g(d).qchem.inp (generated)

000955666.b3lyp_6-31g(d).gjf (generated)

000955666.b3lyp_6-31g(d).firefly.inp (generated)

000955666.b3lyp_6-31g(d).smash.inp (generated)

000955666.b3lyp_6-31g(d).nwchem.inp (generated) 000955666.b3lyp_6-31g(d).log.xz 000955666.td-b3lyp_6-31g+(d).inp 000955666.td-b3lyp_6-31g+(d).log.xz

000955666.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955666.td-b3lyp_6-31+g(d).gjf (generated)

000955666.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955666.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955666.mol 000955666.PUBCHEM 000955666.mol (via Jmol)
000955797.b3lyp_6-31g(d).inp

000955797.b3lyp_6-31g(d).qchem.inp (generated)

000955797.b3lyp_6-31g(d).gjf (generated)

000955797.b3lyp_6-31g(d).firefly.inp (generated)

000955797.b3lyp_6-31g(d).smash.inp (generated)

000955797.b3lyp_6-31g(d).nwchem.inp (generated) 000955797.b3lyp_6-31g(d).log.xz 000955797.mol 000955797.PUBCHEM 000955797.mol (via Jmol)
000955842.b3lyp_6-31g(d).inp

000955842.b3lyp_6-31g(d).qchem.inp (generated)

000955842.b3lyp_6-31g(d).gjf (generated)

000955842.b3lyp_6-31g(d).firefly.inp (generated)

000955842.b3lyp_6-31g(d).smash.inp (generated)

000955842.b3lyp_6-31g(d).nwchem.inp (generated) 000955842.b3lyp_6-31g(d).log.xz 000955842.td-b3lyp_6-31g+(d).inp 000955842.td-b3lyp_6-31g+(d).log.xz

000955842.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955842.td-b3lyp_6-31+g(d).gjf (generated)

000955842.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955842.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955842.mol 000955842.PUBCHEM 000955842.mol (via Jmol)
000955870.b3lyp_6-31g(d).inp

000955870.b3lyp_6-31g(d).qchem.inp (generated)

000955870.b3lyp_6-31g(d).gjf (generated)

000955870.b3lyp_6-31g(d).firefly.inp (generated)

000955870.b3lyp_6-31g(d).smash.inp (generated)

000955870.b3lyp_6-31g(d).nwchem.inp (generated) 000955870.b3lyp_6-31g(d).log.xz 000955870.td-b3lyp_6-31g+(d).inp 000955870.td-b3lyp_6-31g+(d).log.xz

000955870.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955870.td-b3lyp_6-31+g(d).gjf (generated)

000955870.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955870.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955870.mol 000955870.PUBCHEM 000955870.mol (via Jmol)
000955881.b3lyp_6-31g(d).inp

000955881.b3lyp_6-31g(d).qchem.inp (generated)

000955881.b3lyp_6-31g(d).gjf (generated)

000955881.b3lyp_6-31g(d).firefly.inp (generated)

000955881.b3lyp_6-31g(d).smash.inp (generated)

000955881.b3lyp_6-31g(d).nwchem.inp (generated) 000955881.b3lyp_6-31g(d).log.xz 000955881.td-b3lyp_6-31g+(d).inp 000955881.td-b3lyp_6-31g+(d).log.xz

000955881.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955881.td-b3lyp_6-31+g(d).gjf (generated)

000955881.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955881.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955881.mol 000955881.PUBCHEM 000955881.mol (via Jmol)
000955911.b3lyp_6-31g(d).inp

000955911.b3lyp_6-31g(d).qchem.inp (generated)

000955911.b3lyp_6-31g(d).gjf (generated)

000955911.b3lyp_6-31g(d).firefly.inp (generated)

000955911.b3lyp_6-31g(d).smash.inp (generated)

000955911.b3lyp_6-31g(d).nwchem.inp (generated) 000955911.b3lyp_6-31g(d).log.xz 000955911.td-b3lyp_6-31g+(d).inp 000955911.td-b3lyp_6-31g+(d).log.xz

000955911.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955911.td-b3lyp_6-31+g(d).gjf (generated)

000955911.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955911.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955911.mol 000955911.PUBCHEM 000955911.mol (via Jmol)
000955925.b3lyp_6-31g(d).inp

000955925.b3lyp_6-31g(d).qchem.inp (generated)

000955925.b3lyp_6-31g(d).gjf (generated)

000955925.b3lyp_6-31g(d).firefly.inp (generated)

000955925.b3lyp_6-31g(d).smash.inp (generated)

000955925.b3lyp_6-31g(d).nwchem.inp (generated) 000955925.b3lyp_6-31g(d).log.xz 000955925.mol 000955925.PUBCHEM 000955925.mol (via Jmol)
000955937.b3lyp_6-31g(d).inp

000955937.b3lyp_6-31g(d).qchem.inp (generated)

000955937.b3lyp_6-31g(d).gjf (generated)

000955937.b3lyp_6-31g(d).firefly.inp (generated)

000955937.b3lyp_6-31g(d).smash.inp (generated)

000955937.b3lyp_6-31g(d).nwchem.inp (generated) 000955937.b3lyp_6-31g(d).log.xz 000955937.td-b3lyp_6-31g+(d).inp 000955937.td-b3lyp_6-31g+(d).log.xz

000955937.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955937.td-b3lyp_6-31+g(d).gjf (generated)

000955937.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955937.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955937.mol 000955937.PUBCHEM 000955937.mol (via Jmol)
000955939.b3lyp_6-31g(d).inp

000955939.b3lyp_6-31g(d).qchem.inp (generated)

000955939.b3lyp_6-31g(d).gjf (generated)

000955939.b3lyp_6-31g(d).firefly.inp (generated)

000955939.b3lyp_6-31g(d).smash.inp (generated)

000955939.b3lyp_6-31g(d).nwchem.inp (generated) 000955939.b3lyp_6-31g(d).log.xz 000955939.td-b3lyp_6-31g+(d).inp 000955939.td-b3lyp_6-31g+(d).log.xz

000955939.td-b3lyp_6-31+g(d).qchem.inp (generated)

000955939.td-b3lyp_6-31+g(d).gjf (generated)

000955939.td-b3lyp_6-31+g(d).firefly.inp (generated)

000955939.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000955939.mol 000955939.PUBCHEM 000955939.mol (via Jmol)
000956000.b3lyp_6-31g(d).inp

000956000.b3lyp_6-31g(d).qchem.inp (generated)

000956000.b3lyp_6-31g(d).gjf (generated)

000956000.b3lyp_6-31g(d).firefly.inp (generated)

000956000.b3lyp_6-31g(d).smash.inp (generated)

000956000.b3lyp_6-31g(d).nwchem.inp (generated) 000956000.b3lyp_6-31g(d).log.xz 000956000.td-b3lyp_6-31g+(d).inp 000956000.td-b3lyp_6-31g+(d).log.xz

000956000.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956000.td-b3lyp_6-31+g(d).gjf (generated)

000956000.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956000.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956000.mol 000956000.PUBCHEM 000956000.mol (via Jmol)
000956037.b3lyp_6-31g(d).inp

000956037.b3lyp_6-31g(d).qchem.inp (generated)

000956037.b3lyp_6-31g(d).gjf (generated)

000956037.b3lyp_6-31g(d).firefly.inp (generated)

000956037.b3lyp_6-31g(d).smash.inp (generated)

000956037.b3lyp_6-31g(d).nwchem.inp (generated) 000956037.b3lyp_6-31g(d).log.xz 000956037.td-b3lyp_6-31g+(d).inp 000956037.td-b3lyp_6-31g+(d).log.xz

000956037.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956037.td-b3lyp_6-31+g(d).gjf (generated)

000956037.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956037.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956037.mol 000956037.PUBCHEM 000956037.mol (via Jmol)
000956041.b3lyp_6-31g(d).inp

000956041.b3lyp_6-31g(d).qchem.inp (generated)

000956041.b3lyp_6-31g(d).gjf (generated)

000956041.b3lyp_6-31g(d).firefly.inp (generated)

000956041.b3lyp_6-31g(d).smash.inp (generated)

000956041.b3lyp_6-31g(d).nwchem.inp (generated) 000956041.b3lyp_6-31g(d).log.xz 000956041.td-b3lyp_6-31g+(d).inp 000956041.td-b3lyp_6-31g+(d).log.xz

000956041.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956041.td-b3lyp_6-31+g(d).gjf (generated)

000956041.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956041.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956041.mol 000956041.PUBCHEM 000956041.mol (via Jmol)
000956051.b3lyp_6-31g(d).inp

000956051.b3lyp_6-31g(d).qchem.inp (generated)

000956051.b3lyp_6-31g(d).gjf (generated)

000956051.b3lyp_6-31g(d).firefly.inp (generated)

000956051.b3lyp_6-31g(d).smash.inp (generated)

000956051.b3lyp_6-31g(d).nwchem.inp (generated) 000956051.b3lyp_6-31g(d).log.xz 000956051.td-b3lyp_6-31g+(d).inp 000956051.td-b3lyp_6-31g+(d).log.xz

000956051.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956051.td-b3lyp_6-31+g(d).gjf (generated)

000956051.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956051.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956051.mol 000956051.PUBCHEM 000956051.mol (via Jmol)
000956056.b3lyp_6-31g(d).inp

000956056.b3lyp_6-31g(d).qchem.inp (generated)

000956056.b3lyp_6-31g(d).gjf (generated)

000956056.b3lyp_6-31g(d).firefly.inp (generated)

000956056.b3lyp_6-31g(d).smash.inp (generated)

000956056.b3lyp_6-31g(d).nwchem.inp (generated) 000956056.b3lyp_6-31g(d).log.xz 000956056.mol 000956056.PUBCHEM 000956056.mol (via Jmol)
000956107.b3lyp_6-31g(d).inp

000956107.b3lyp_6-31g(d).qchem.inp (generated)

000956107.b3lyp_6-31g(d).gjf (generated)

000956107.b3lyp_6-31g(d).firefly.inp (generated)

000956107.b3lyp_6-31g(d).smash.inp (generated)

000956107.b3lyp_6-31g(d).nwchem.inp (generated) 000956107.b3lyp_6-31g(d).log.xz 000956107.td-b3lyp_6-31g+(d).inp 000956107.td-b3lyp_6-31g+(d).log.xz

000956107.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956107.td-b3lyp_6-31+g(d).gjf (generated)

000956107.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956107.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956107.mol 000956107.PUBCHEM 000956107.mol (via Jmol)
000956116.b3lyp_6-31g(d).inp

000956116.b3lyp_6-31g(d).qchem.inp (generated)

000956116.b3lyp_6-31g(d).gjf (generated)

000956116.b3lyp_6-31g(d).firefly.inp (generated)

000956116.b3lyp_6-31g(d).smash.inp (generated)

000956116.b3lyp_6-31g(d).nwchem.inp (generated) 000956116.b3lyp_6-31g(d).log.xz 000956116.td-b3lyp_6-31g+(d).inp 000956116.td-b3lyp_6-31g+(d).log.xz

000956116.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956116.td-b3lyp_6-31+g(d).gjf (generated)

000956116.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956116.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956116.mol 000956116.PUBCHEM 000956116.mol (via Jmol)
000956120.b3lyp_6-31g(d).inp

000956120.b3lyp_6-31g(d).qchem.inp (generated)

000956120.b3lyp_6-31g(d).gjf (generated)

000956120.b3lyp_6-31g(d).firefly.inp (generated)

000956120.b3lyp_6-31g(d).smash.inp (generated)

000956120.b3lyp_6-31g(d).nwchem.inp (generated) 000956120.b3lyp_6-31g(d).log.xz 000956120.td-b3lyp_6-31g+(d).inp 000956120.td-b3lyp_6-31g+(d).log.xz

000956120.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956120.td-b3lyp_6-31+g(d).gjf (generated)

000956120.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956120.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956120.mol 000956120.PUBCHEM 000956120.mol (via Jmol)
000956128.b3lyp_6-31g(d).inp

000956128.b3lyp_6-31g(d).qchem.inp (generated)

000956128.b3lyp_6-31g(d).gjf (generated)

000956128.b3lyp_6-31g(d).firefly.inp (generated)

000956128.b3lyp_6-31g(d).smash.inp (generated)

000956128.b3lyp_6-31g(d).nwchem.inp (generated) 000956128.b3lyp_6-31g(d).log.xz 000956128.td-b3lyp_6-31g+(d).inp 000956128.td-b3lyp_6-31g+(d).log.xz

000956128.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956128.td-b3lyp_6-31+g(d).gjf (generated)

000956128.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956128.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956128.mol 000956128.PUBCHEM 000956128.mol (via Jmol)
000956135.b3lyp_6-31g(d).inp

000956135.b3lyp_6-31g(d).qchem.inp (generated)

000956135.b3lyp_6-31g(d).gjf (generated)

000956135.b3lyp_6-31g(d).firefly.inp (generated)

000956135.b3lyp_6-31g(d).smash.inp (generated)

000956135.b3lyp_6-31g(d).nwchem.inp (generated) 000956135.b3lyp_6-31g(d).log.xz 000956135.td-b3lyp_6-31g+(d).inp 000956135.td-b3lyp_6-31g+(d).log.xz

000956135.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956135.td-b3lyp_6-31+g(d).gjf (generated)

000956135.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956135.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956135.mol 000956135.PUBCHEM 000956135.mol (via Jmol)
000956143.b3lyp_6-31g(d).inp

000956143.b3lyp_6-31g(d).qchem.inp (generated)

000956143.b3lyp_6-31g(d).gjf (generated)

000956143.b3lyp_6-31g(d).firefly.inp (generated)

000956143.b3lyp_6-31g(d).smash.inp (generated)

000956143.b3lyp_6-31g(d).nwchem.inp (generated) 000956143.b3lyp_6-31g(d).log.xz 000956143.td-b3lyp_6-31g+(d).inp 000956143.td-b3lyp_6-31g+(d).log.xz

000956143.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956143.td-b3lyp_6-31+g(d).gjf (generated)

000956143.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956143.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956143.mol 000956143.PUBCHEM 000956143.mol (via Jmol)
000956155.b3lyp_6-31g(d).inp

000956155.b3lyp_6-31g(d).qchem.inp (generated)

000956155.b3lyp_6-31g(d).gjf (generated)

000956155.b3lyp_6-31g(d).firefly.inp (generated)

000956155.b3lyp_6-31g(d).smash.inp (generated)

000956155.b3lyp_6-31g(d).nwchem.inp (generated) 000956155.b3lyp_6-31g(d).log.xz 000956155.td-b3lyp_6-31g+(d).inp 000956155.td-b3lyp_6-31g+(d).log.xz

000956155.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956155.td-b3lyp_6-31+g(d).gjf (generated)

000956155.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956155.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956155.mol 000956155.PUBCHEM 000956155.mol (via Jmol)
000956160.b3lyp_6-31g(d).inp

000956160.b3lyp_6-31g(d).qchem.inp (generated)

000956160.b3lyp_6-31g(d).gjf (generated)

000956160.b3lyp_6-31g(d).firefly.inp (generated)

000956160.b3lyp_6-31g(d).smash.inp (generated)

000956160.b3lyp_6-31g(d).nwchem.inp (generated) 000956160.b3lyp_6-31g(d).log.xz 000956160.td-b3lyp_6-31g+(d).inp 000956160.td-b3lyp_6-31g+(d).log.xz

000956160.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956160.td-b3lyp_6-31+g(d).gjf (generated)

000956160.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956160.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956160.mol 000956160.PUBCHEM 000956160.mol (via Jmol)
000956215.b3lyp_6-31g(d).inp

000956215.b3lyp_6-31g(d).qchem.inp (generated)

000956215.b3lyp_6-31g(d).gjf (generated)

000956215.b3lyp_6-31g(d).firefly.inp (generated)

000956215.b3lyp_6-31g(d).smash.inp (generated)

000956215.b3lyp_6-31g(d).nwchem.inp (generated) 000956215.b3lyp_6-31g(d).log.xz 000956215.td-b3lyp_6-31g+(d).inp 000956215.td-b3lyp_6-31g+(d).log.xz

000956215.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956215.td-b3lyp_6-31+g(d).gjf (generated)

000956215.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956215.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956215.mol 000956215.PUBCHEM 000956215.mol (via Jmol)
000956217.b3lyp_6-31g(d).inp

000956217.b3lyp_6-31g(d).qchem.inp (generated)

000956217.b3lyp_6-31g(d).gjf (generated)

000956217.b3lyp_6-31g(d).firefly.inp (generated)

000956217.b3lyp_6-31g(d).smash.inp (generated)

000956217.b3lyp_6-31g(d).nwchem.inp (generated) 000956217.b3lyp_6-31g(d).log.xz 000956217.td-b3lyp_6-31g+(d).inp 000956217.td-b3lyp_6-31g+(d).log.xz

000956217.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956217.td-b3lyp_6-31+g(d).gjf (generated)

000956217.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956217.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956217.mol 000956217.PUBCHEM 000956217.mol (via Jmol)
000956221.b3lyp_6-31g(d).inp

000956221.b3lyp_6-31g(d).qchem.inp (generated)

000956221.b3lyp_6-31g(d).gjf (generated)

000956221.b3lyp_6-31g(d).firefly.inp (generated)

000956221.b3lyp_6-31g(d).smash.inp (generated)

000956221.b3lyp_6-31g(d).nwchem.inp (generated) 000956221.b3lyp_6-31g(d).log.xz 000956221.mol 000956221.PUBCHEM 000956221.mol (via Jmol)
000956226.b3lyp_6-31g(d).inp

000956226.b3lyp_6-31g(d).qchem.inp (generated)

000956226.b3lyp_6-31g(d).gjf (generated)

000956226.b3lyp_6-31g(d).firefly.inp (generated)

000956226.b3lyp_6-31g(d).smash.inp (generated)

000956226.b3lyp_6-31g(d).nwchem.inp (generated) 000956226.b3lyp_6-31g(d).log.xz 000956226.td-b3lyp_6-31g+(d).inp 000956226.td-b3lyp_6-31g+(d).log.xz

000956226.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956226.td-b3lyp_6-31+g(d).gjf (generated)

000956226.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956226.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956226.mol 000956226.PUBCHEM 000956226.mol (via Jmol)
000956244.b3lyp_6-31g(d).inp

000956244.b3lyp_6-31g(d).qchem.inp (generated)

000956244.b3lyp_6-31g(d).gjf (generated)

000956244.b3lyp_6-31g(d).firefly.inp (generated)

000956244.b3lyp_6-31g(d).smash.inp (generated)

000956244.b3lyp_6-31g(d).nwchem.inp (generated) 000956244.b3lyp_6-31g(d).log.xz 000956244.td-b3lyp_6-31g+(d).inp 000956244.td-b3lyp_6-31g+(d).log.xz

000956244.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956244.td-b3lyp_6-31+g(d).gjf (generated)

000956244.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956244.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956244.mol 000956244.PUBCHEM 000956244.mol (via Jmol)
000956250.b3lyp_6-31g(d).inp

000956250.b3lyp_6-31g(d).qchem.inp (generated)

000956250.b3lyp_6-31g(d).gjf (generated)

000956250.b3lyp_6-31g(d).firefly.inp (generated)

000956250.b3lyp_6-31g(d).smash.inp (generated)

000956250.b3lyp_6-31g(d).nwchem.inp (generated) 000956250.b3lyp_6-31g(d).log.xz 000956250.td-b3lyp_6-31g+(d).inp 000956250.td-b3lyp_6-31g+(d).log.xz

000956250.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956250.td-b3lyp_6-31+g(d).gjf (generated)

000956250.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956250.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956250.mol 000956250.PUBCHEM 000956250.mol (via Jmol)
000956356.b3lyp_6-31g(d).inp

000956356.b3lyp_6-31g(d).qchem.inp (generated)

000956356.b3lyp_6-31g(d).gjf (generated)

000956356.b3lyp_6-31g(d).firefly.inp (generated)

000956356.b3lyp_6-31g(d).smash.inp (generated)

000956356.b3lyp_6-31g(d).nwchem.inp (generated) 000956356.b3lyp_6-31g(d).log.xz 000956356.mol 000956356.PUBCHEM 000956356.mol (via Jmol)
000956378.b3lyp_6-31g(d).inp

000956378.b3lyp_6-31g(d).qchem.inp (generated)

000956378.b3lyp_6-31g(d).gjf (generated)

000956378.b3lyp_6-31g(d).firefly.inp (generated)

000956378.b3lyp_6-31g(d).smash.inp (generated)

000956378.b3lyp_6-31g(d).nwchem.inp (generated) 000956378.b3lyp_6-31g(d).log.xz 000956378.td-b3lyp_6-31g+(d).inp 000956378.td-b3lyp_6-31g+(d).log.xz

000956378.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956378.td-b3lyp_6-31+g(d).gjf (generated)

000956378.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956378.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956378.mol 000956378.PUBCHEM 000956378.mol (via Jmol)
000956405.b3lyp_6-31g(d).inp

000956405.b3lyp_6-31g(d).qchem.inp (generated)

000956405.b3lyp_6-31g(d).gjf (generated)

000956405.b3lyp_6-31g(d).firefly.inp (generated)

000956405.b3lyp_6-31g(d).smash.inp (generated)

000956405.b3lyp_6-31g(d).nwchem.inp (generated) 000956405.b3lyp_6-31g(d).log.xz 000956405.td-b3lyp_6-31g+(d).inp 000956405.td-b3lyp_6-31g+(d).log.xz

000956405.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956405.td-b3lyp_6-31+g(d).gjf (generated)

000956405.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956405.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956405.mol 000956405.PUBCHEM 000956405.mol (via Jmol)
000956407.b3lyp_6-31g(d).inp

000956407.b3lyp_6-31g(d).qchem.inp (generated)

000956407.b3lyp_6-31g(d).gjf (generated)

000956407.b3lyp_6-31g(d).firefly.inp (generated)

000956407.b3lyp_6-31g(d).smash.inp (generated)

000956407.b3lyp_6-31g(d).nwchem.inp (generated) 000956407.b3lyp_6-31g(d).log.xz 000956407.td-b3lyp_6-31g+(d).inp 000956407.td-b3lyp_6-31g+(d).log.xz

000956407.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956407.td-b3lyp_6-31+g(d).gjf (generated)

000956407.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956407.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956407.mol 000956407.PUBCHEM 000956407.mol (via Jmol)
000956411.b3lyp_6-31g(d).inp

000956411.b3lyp_6-31g(d).qchem.inp (generated)

000956411.b3lyp_6-31g(d).gjf (generated)

000956411.b3lyp_6-31g(d).firefly.inp (generated)

000956411.b3lyp_6-31g(d).smash.inp (generated)

000956411.b3lyp_6-31g(d).nwchem.inp (generated) 000956411.b3lyp_6-31g(d).log.xz 000956411.mol 000956411.PUBCHEM 000956411.mol (via Jmol)
000956414.b3lyp_6-31g(d).inp

000956414.b3lyp_6-31g(d).qchem.inp (generated)

000956414.b3lyp_6-31g(d).gjf (generated)

000956414.b3lyp_6-31g(d).firefly.inp (generated)

000956414.b3lyp_6-31g(d).smash.inp (generated)

000956414.b3lyp_6-31g(d).nwchem.inp (generated) 000956414.b3lyp_6-31g(d).log.xz 000956414.mol 000956414.PUBCHEM 000956414.mol (via Jmol)
000956416.b3lyp_6-31g(d).inp

000956416.b3lyp_6-31g(d).qchem.inp (generated)

000956416.b3lyp_6-31g(d).gjf (generated)

000956416.b3lyp_6-31g(d).firefly.inp (generated)

000956416.b3lyp_6-31g(d).smash.inp (generated)

000956416.b3lyp_6-31g(d).nwchem.inp (generated) 000956416.b3lyp_6-31g(d).log.xz 000956416.mol 000956416.PUBCHEM 000956416.mol (via Jmol)
000956442.b3lyp_6-31g(d).inp

000956442.b3lyp_6-31g(d).qchem.inp (generated)

000956442.b3lyp_6-31g(d).gjf (generated)

000956442.b3lyp_6-31g(d).firefly.inp (generated)

000956442.b3lyp_6-31g(d).smash.inp (generated)

000956442.b3lyp_6-31g(d).nwchem.inp (generated) 000956442.b3lyp_6-31g(d).log.xz 000956442.td-b3lyp_6-31g+(d).inp 000956442.td-b3lyp_6-31g+(d).log.xz

000956442.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956442.td-b3lyp_6-31+g(d).gjf (generated)

000956442.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956442.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956442.mol 000956442.PUBCHEM 000956442.mol (via Jmol)
000956457.b3lyp_6-31g(d).inp

000956457.b3lyp_6-31g(d).qchem.inp (generated)

000956457.b3lyp_6-31g(d).gjf (generated)

000956457.b3lyp_6-31g(d).firefly.inp (generated)

000956457.b3lyp_6-31g(d).smash.inp (generated)

000956457.b3lyp_6-31g(d).nwchem.inp (generated) 000956457.b3lyp_6-31g(d).log.xz 000956457.td-b3lyp_6-31g+(d).inp 000956457.td-b3lyp_6-31g+(d).log.xz

000956457.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956457.td-b3lyp_6-31+g(d).gjf (generated)

000956457.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956457.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956457.mol 000956457.PUBCHEM 000956457.mol (via Jmol)
000956458.b3lyp_6-31g(d).inp

000956458.b3lyp_6-31g(d).qchem.inp (generated)

000956458.b3lyp_6-31g(d).gjf (generated)

000956458.b3lyp_6-31g(d).firefly.inp (generated)

000956458.b3lyp_6-31g(d).smash.inp (generated)

000956458.b3lyp_6-31g(d).nwchem.inp (generated) 000956458.b3lyp_6-31g(d).log.xz 000956458.td-b3lyp_6-31g+(d).inp 000956458.td-b3lyp_6-31g+(d).log.xz

000956458.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956458.td-b3lyp_6-31+g(d).gjf (generated)

000956458.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956458.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956458.mol 000956458.PUBCHEM 000956458.mol (via Jmol)
000956461.b3lyp_6-31g(d).inp

000956461.b3lyp_6-31g(d).qchem.inp (generated)

000956461.b3lyp_6-31g(d).gjf (generated)

000956461.b3lyp_6-31g(d).firefly.inp (generated)

000956461.b3lyp_6-31g(d).smash.inp (generated)

000956461.b3lyp_6-31g(d).nwchem.inp (generated) 000956461.b3lyp_6-31g(d).log.xz 000956461.td-b3lyp_6-31g+(d).inp 000956461.td-b3lyp_6-31g+(d).log.xz

000956461.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956461.td-b3lyp_6-31+g(d).gjf (generated)

000956461.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956461.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956461.mol 000956461.PUBCHEM 000956461.mol (via Jmol)
000956504.b3lyp_6-31g(d).inp

000956504.b3lyp_6-31g(d).qchem.inp (generated)

000956504.b3lyp_6-31g(d).gjf (generated)

000956504.b3lyp_6-31g(d).firefly.inp (generated)

000956504.b3lyp_6-31g(d).smash.inp (generated)

000956504.b3lyp_6-31g(d).nwchem.inp (generated) 000956504.b3lyp_6-31g(d).log.xz 000956504.mol 000956504.PUBCHEM 000956504.mol (via Jmol)
000956505.b3lyp_6-31g(d).inp

000956505.b3lyp_6-31g(d).qchem.inp (generated)

000956505.b3lyp_6-31g(d).gjf (generated)

000956505.b3lyp_6-31g(d).firefly.inp (generated)

000956505.b3lyp_6-31g(d).smash.inp (generated)

000956505.b3lyp_6-31g(d).nwchem.inp (generated) 000956505.b3lyp_6-31g(d).log.xz 000956505.mol 000956505.PUBCHEM 000956505.mol (via Jmol)
000956584.b3lyp_6-31g(d).inp

000956584.b3lyp_6-31g(d).qchem.inp (generated)

000956584.b3lyp_6-31g(d).gjf (generated)

000956584.b3lyp_6-31g(d).firefly.inp (generated)

000956584.b3lyp_6-31g(d).smash.inp (generated)

000956584.b3lyp_6-31g(d).nwchem.inp (generated) 000956584.b3lyp_6-31g(d).log.xz 000956584.td-b3lyp_6-31g+(d).inp 000956584.td-b3lyp_6-31g+(d).log.xz

000956584.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956584.td-b3lyp_6-31+g(d).gjf (generated)

000956584.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956584.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956584.mol 000956584.PUBCHEM 000956584.mol (via Jmol)
000956653.b3lyp_6-31g(d).inp

000956653.b3lyp_6-31g(d).qchem.inp (generated)

000956653.b3lyp_6-31g(d).gjf (generated)

000956653.b3lyp_6-31g(d).firefly.inp (generated)

000956653.b3lyp_6-31g(d).smash.inp (generated)

000956653.b3lyp_6-31g(d).nwchem.inp (generated) 000956653.b3lyp_6-31g(d).log.xz 000956653.mol 000956653.PUBCHEM 000956653.mol (via Jmol)
000956680.b3lyp_6-31g(d).inp

000956680.b3lyp_6-31g(d).qchem.inp (generated)

000956680.b3lyp_6-31g(d).gjf (generated)

000956680.b3lyp_6-31g(d).firefly.inp (generated)

000956680.b3lyp_6-31g(d).smash.inp (generated)

000956680.b3lyp_6-31g(d).nwchem.inp (generated) 000956680.b3lyp_6-31g(d).log.xz 000956680.td-b3lyp_6-31g+(d).inp 000956680.td-b3lyp_6-31g+(d).log.xz

000956680.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956680.td-b3lyp_6-31+g(d).gjf (generated)

000956680.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956680.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956680.mol 000956680.PUBCHEM 000956680.mol (via Jmol)
000956681.b3lyp_6-31g(d).inp

000956681.b3lyp_6-31g(d).qchem.inp (generated)

000956681.b3lyp_6-31g(d).gjf (generated)

000956681.b3lyp_6-31g(d).firefly.inp (generated)

000956681.b3lyp_6-31g(d).smash.inp (generated)

000956681.b3lyp_6-31g(d).nwchem.inp (generated) 000956681.b3lyp_6-31g(d).log.xz 000956681.td-b3lyp_6-31g+(d).inp 000956681.td-b3lyp_6-31g+(d).log.xz

000956681.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956681.td-b3lyp_6-31+g(d).gjf (generated)

000956681.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956681.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956681.mol 000956681.PUBCHEM 000956681.mol (via Jmol)
000956682.b3lyp_6-31g(d).inp

000956682.b3lyp_6-31g(d).qchem.inp (generated)

000956682.b3lyp_6-31g(d).gjf (generated)

000956682.b3lyp_6-31g(d).firefly.inp (generated)

000956682.b3lyp_6-31g(d).smash.inp (generated)

000956682.b3lyp_6-31g(d).nwchem.inp (generated) 000956682.b3lyp_6-31g(d).log.xz 000956682.td-b3lyp_6-31g+(d).inp 000956682.td-b3lyp_6-31g+(d).log.xz

000956682.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956682.td-b3lyp_6-31+g(d).gjf (generated)

000956682.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956682.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956682.mol 000956682.PUBCHEM 000956682.mol (via Jmol)
000956683.b3lyp_6-31g(d).inp

000956683.b3lyp_6-31g(d).qchem.inp (generated)

000956683.b3lyp_6-31g(d).gjf (generated)

000956683.b3lyp_6-31g(d).firefly.inp (generated)

000956683.b3lyp_6-31g(d).smash.inp (generated)

000956683.b3lyp_6-31g(d).nwchem.inp (generated) 000956683.b3lyp_6-31g(d).log.xz 000956683.td-b3lyp_6-31g+(d).inp 000956683.td-b3lyp_6-31g+(d).log.xz

000956683.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956683.td-b3lyp_6-31+g(d).gjf (generated)

000956683.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956683.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956683.mol 000956683.PUBCHEM 000956683.mol (via Jmol)
000956684.b3lyp_6-31g(d).inp

000956684.b3lyp_6-31g(d).qchem.inp (generated)

000956684.b3lyp_6-31g(d).gjf (generated)

000956684.b3lyp_6-31g(d).firefly.inp (generated)

000956684.b3lyp_6-31g(d).smash.inp (generated)

000956684.b3lyp_6-31g(d).nwchem.inp (generated) 000956684.b3lyp_6-31g(d).log.xz 000956684.td-b3lyp_6-31g+(d).inp 000956684.td-b3lyp_6-31g+(d).log.xz

000956684.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956684.td-b3lyp_6-31+g(d).gjf (generated)

000956684.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956684.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956684.mol 000956684.PUBCHEM 000956684.mol (via Jmol)
000956695.b3lyp_6-31g(d).inp

000956695.b3lyp_6-31g(d).qchem.inp (generated)

000956695.b3lyp_6-31g(d).gjf (generated)

000956695.b3lyp_6-31g(d).firefly.inp (generated)

000956695.b3lyp_6-31g(d).smash.inp (generated)

000956695.b3lyp_6-31g(d).nwchem.inp (generated) 000956695.b3lyp_6-31g(d).log.xz 000956695.mol 000956695.PUBCHEM 000956695.mol (via Jmol)
000956739.b3lyp_6-31g(d).inp

000956739.b3lyp_6-31g(d).qchem.inp (generated)

000956739.b3lyp_6-31g(d).gjf (generated)

000956739.b3lyp_6-31g(d).firefly.inp (generated)

000956739.b3lyp_6-31g(d).smash.inp (generated)

000956739.b3lyp_6-31g(d).nwchem.inp (generated) 000956739.b3lyp_6-31g(d).log.xz 000956739.td-b3lyp_6-31g+(d).inp 000956739.td-b3lyp_6-31g+(d).log.xz

000956739.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956739.td-b3lyp_6-31+g(d).gjf (generated)

000956739.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956739.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956739.mol 000956739.PUBCHEM 000956739.mol (via Jmol)
000956778.b3lyp_6-31g(d).inp

000956778.b3lyp_6-31g(d).qchem.inp (generated)

000956778.b3lyp_6-31g(d).gjf (generated)

000956778.b3lyp_6-31g(d).firefly.inp (generated)

000956778.b3lyp_6-31g(d).smash.inp (generated)

000956778.b3lyp_6-31g(d).nwchem.inp (generated) 000956778.b3lyp_6-31g(d).log.xz 000956778.td-b3lyp_6-31g+(d).inp 000956778.td-b3lyp_6-31g+(d).log.xz

000956778.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956778.td-b3lyp_6-31+g(d).gjf (generated)

000956778.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956778.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956778.mol 000956778.PUBCHEM 000956778.mol (via Jmol)
000956811.b3lyp_6-31g(d).inp

000956811.b3lyp_6-31g(d).qchem.inp (generated)

000956811.b3lyp_6-31g(d).gjf (generated)

000956811.b3lyp_6-31g(d).firefly.inp (generated)

000956811.b3lyp_6-31g(d).smash.inp (generated)

000956811.b3lyp_6-31g(d).nwchem.inp (generated) 000956811.b3lyp_6-31g(d).log.xz 000956811.td-b3lyp_6-31g+(d).inp 000956811.td-b3lyp_6-31g+(d).log.xz

000956811.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956811.td-b3lyp_6-31+g(d).gjf (generated)

000956811.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956811.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956811.mol 000956811.PUBCHEM 000956811.mol (via Jmol)
000956848.b3lyp_6-31g(d).inp

000956848.b3lyp_6-31g(d).qchem.inp (generated)

000956848.b3lyp_6-31g(d).gjf (generated)

000956848.b3lyp_6-31g(d).firefly.inp (generated)

000956848.b3lyp_6-31g(d).smash.inp (generated)

000956848.b3lyp_6-31g(d).nwchem.inp (generated) 000956848.b3lyp_6-31g(d).log.xz 000956848.mol 000956848.PUBCHEM 000956848.mol (via Jmol)
000956876.b3lyp_6-31g(d).inp

000956876.b3lyp_6-31g(d).qchem.inp (generated)

000956876.b3lyp_6-31g(d).gjf (generated)

000956876.b3lyp_6-31g(d).firefly.inp (generated)

000956876.b3lyp_6-31g(d).smash.inp (generated)

000956876.b3lyp_6-31g(d).nwchem.inp (generated) 000956876.b3lyp_6-31g(d).log.xz 000956876.mol 000956876.PUBCHEM 000956876.mol (via Jmol)
000956878.b3lyp_6-31g(d).inp

000956878.b3lyp_6-31g(d).qchem.inp (generated)

000956878.b3lyp_6-31g(d).gjf (generated)

000956878.b3lyp_6-31g(d).firefly.inp (generated)

000956878.b3lyp_6-31g(d).smash.inp (generated)

000956878.b3lyp_6-31g(d).nwchem.inp (generated) 000956878.b3lyp_6-31g(d).log.xz 000956878.td-b3lyp_6-31g+(d).inp 000956878.td-b3lyp_6-31g+(d).log.xz

000956878.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956878.td-b3lyp_6-31+g(d).gjf (generated)

000956878.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956878.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956878.mol 000956878.PUBCHEM 000956878.mol (via Jmol)
000956881.b3lyp_6-31g(d).inp

000956881.b3lyp_6-31g(d).qchem.inp (generated)

000956881.b3lyp_6-31g(d).gjf (generated)

000956881.b3lyp_6-31g(d).firefly.inp (generated)

000956881.b3lyp_6-31g(d).smash.inp (generated)

000956881.b3lyp_6-31g(d).nwchem.inp (generated) 000956881.b3lyp_6-31g(d).log.xz 000956881.td-b3lyp_6-31g+(d).inp 000956881.td-b3lyp_6-31g+(d).log.xz

000956881.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956881.td-b3lyp_6-31+g(d).gjf (generated)

000956881.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956881.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956881.mol 000956881.PUBCHEM 000956881.mol (via Jmol)
000956886.b3lyp_6-31g(d).inp

000956886.b3lyp_6-31g(d).qchem.inp (generated)

000956886.b3lyp_6-31g(d).gjf (generated)

000956886.b3lyp_6-31g(d).firefly.inp (generated)

000956886.b3lyp_6-31g(d).smash.inp (generated)

000956886.b3lyp_6-31g(d).nwchem.inp (generated) 000956886.b3lyp_6-31g(d).log.xz 000956886.td-b3lyp_6-31g+(d).inp 000956886.td-b3lyp_6-31g+(d).log.xz

000956886.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956886.td-b3lyp_6-31+g(d).gjf (generated)

000956886.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956886.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956886.mol 000956886.PUBCHEM 000956886.mol (via Jmol)
000956901.b3lyp_6-31g(d).inp

000956901.b3lyp_6-31g(d).qchem.inp (generated)

000956901.b3lyp_6-31g(d).gjf (generated)

000956901.b3lyp_6-31g(d).firefly.inp (generated)

000956901.b3lyp_6-31g(d).smash.inp (generated)

000956901.b3lyp_6-31g(d).nwchem.inp (generated) 000956901.b3lyp_6-31g(d).log.xz 000956901.td-b3lyp_6-31g+(d).inp 000956901.td-b3lyp_6-31g+(d).log.xz

000956901.td-b3lyp_6-31+g(d).qchem.inp (generated)

000956901.td-b3lyp_6-31+g(d).gjf (generated)

000956901.td-b3lyp_6-31+g(d).firefly.inp (generated)

000956901.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000956901.mol 000956901.PUBCHEM 000956901.mol (via Jmol)
000957007.b3lyp_6-31g(d).inp

000957007.b3lyp_6-31g(d).qchem.inp (generated)

000957007.b3lyp_6-31g(d).gjf (generated)

000957007.b3lyp_6-31g(d).firefly.inp (generated)

000957007.b3lyp_6-31g(d).smash.inp (generated)

000957007.b3lyp_6-31g(d).nwchem.inp (generated) 000957007.b3lyp_6-31g(d).log.xz 000957007.td-b3lyp_6-31g+(d).inp 000957007.td-b3lyp_6-31g+(d).log.xz

000957007.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957007.td-b3lyp_6-31+g(d).gjf (generated)

000957007.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957007.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957007.mol 000957007.PUBCHEM 000957007.mol (via Jmol)
000957067.b3lyp_6-31g(d).inp

000957067.b3lyp_6-31g(d).qchem.inp (generated)

000957067.b3lyp_6-31g(d).gjf (generated)

000957067.b3lyp_6-31g(d).firefly.inp (generated)

000957067.b3lyp_6-31g(d).smash.inp (generated)

000957067.b3lyp_6-31g(d).nwchem.inp (generated) 000957067.b3lyp_6-31g(d).log.xz 000957067.mol 000957067.PUBCHEM 000957067.mol (via Jmol)
000957070.b3lyp_6-31g(d).inp

000957070.b3lyp_6-31g(d).qchem.inp (generated)

000957070.b3lyp_6-31g(d).gjf (generated)

000957070.b3lyp_6-31g(d).firefly.inp (generated)

000957070.b3lyp_6-31g(d).smash.inp (generated)

000957070.b3lyp_6-31g(d).nwchem.inp (generated) 000957070.b3lyp_6-31g(d).log.xz 000957070.td-b3lyp_6-31g+(d).inp 000957070.td-b3lyp_6-31g+(d).log.xz

000957070.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957070.td-b3lyp_6-31+g(d).gjf (generated)

000957070.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957070.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957070.mol 000957070.PUBCHEM 000957070.mol (via Jmol)
000957123.b3lyp_6-31g(d).inp

000957123.b3lyp_6-31g(d).qchem.inp (generated)

000957123.b3lyp_6-31g(d).gjf (generated)

000957123.b3lyp_6-31g(d).firefly.inp (generated)

000957123.b3lyp_6-31g(d).smash.inp (generated)

000957123.b3lyp_6-31g(d).nwchem.inp (generated) 000957123.b3lyp_6-31g(d).log.xz 000957123.mol 000957123.PUBCHEM 000957123.mol (via Jmol)
000957139.b3lyp_6-31g(d).inp

000957139.b3lyp_6-31g(d).qchem.inp (generated)

000957139.b3lyp_6-31g(d).gjf (generated)

000957139.b3lyp_6-31g(d).firefly.inp (generated)

000957139.b3lyp_6-31g(d).smash.inp (generated)

000957139.b3lyp_6-31g(d).nwchem.inp (generated) 000957139.b3lyp_6-31g(d).log.xz 000957139.mol 000957139.PUBCHEM 000957139.mol (via Jmol)
000957140.b3lyp_6-31g(d).inp

000957140.b3lyp_6-31g(d).qchem.inp (generated)

000957140.b3lyp_6-31g(d).gjf (generated)

000957140.b3lyp_6-31g(d).firefly.inp (generated)

000957140.b3lyp_6-31g(d).smash.inp (generated)

000957140.b3lyp_6-31g(d).nwchem.inp (generated) 000957140.b3lyp_6-31g(d).log.xz 000957140.td-b3lyp_6-31g+(d).inp 000957140.td-b3lyp_6-31g+(d).log.xz

000957140.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957140.td-b3lyp_6-31+g(d).gjf (generated)

000957140.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957140.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957140.mol 000957140.PUBCHEM 000957140.mol (via Jmol)
000957224.b3lyp_6-31g(d).inp

000957224.b3lyp_6-31g(d).qchem.inp (generated)

000957224.b3lyp_6-31g(d).gjf (generated)

000957224.b3lyp_6-31g(d).firefly.inp (generated)

000957224.b3lyp_6-31g(d).smash.inp (generated)

000957224.b3lyp_6-31g(d).nwchem.inp (generated) 000957224.b3lyp_6-31g(d).log.xz 000957224.mol 000957224.PUBCHEM 000957224.mol (via Jmol)
000957257.b3lyp_6-31g(d).inp

000957257.b3lyp_6-31g(d).qchem.inp (generated)

000957257.b3lyp_6-31g(d).gjf (generated)

000957257.b3lyp_6-31g(d).firefly.inp (generated)

000957257.b3lyp_6-31g(d).smash.inp (generated)

000957257.b3lyp_6-31g(d).nwchem.inp (generated) 000957257.b3lyp_6-31g(d).log.xz 000957257.td-b3lyp_6-31g+(d).inp 000957257.td-b3lyp_6-31g+(d).log.xz

000957257.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957257.td-b3lyp_6-31+g(d).gjf (generated)

000957257.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957257.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957257.mol 000957257.PUBCHEM 000957257.mol (via Jmol)
000957261.b3lyp_6-31g(d).inp

000957261.b3lyp_6-31g(d).qchem.inp (generated)

000957261.b3lyp_6-31g(d).gjf (generated)

000957261.b3lyp_6-31g(d).firefly.inp (generated)

000957261.b3lyp_6-31g(d).smash.inp (generated)

000957261.b3lyp_6-31g(d).nwchem.inp (generated) 000957261.b3lyp_6-31g(d).log.xz 000957261.mol 000957261.PUBCHEM 000957261.mol (via Jmol)
000957268.b3lyp_6-31g(d).inp

000957268.b3lyp_6-31g(d).qchem.inp (generated)

000957268.b3lyp_6-31g(d).gjf (generated)

000957268.b3lyp_6-31g(d).firefly.inp (generated)

000957268.b3lyp_6-31g(d).smash.inp (generated)

000957268.b3lyp_6-31g(d).nwchem.inp (generated) 000957268.b3lyp_6-31g(d).log.xz 000957268.mol 000957268.PUBCHEM 000957268.mol (via Jmol)
000957305.b3lyp_6-31g(d).inp

000957305.b3lyp_6-31g(d).qchem.inp (generated)

000957305.b3lyp_6-31g(d).gjf (generated)

000957305.b3lyp_6-31g(d).firefly.inp (generated)

000957305.b3lyp_6-31g(d).smash.inp (generated)

000957305.b3lyp_6-31g(d).nwchem.inp (generated) 000957305.b3lyp_6-31g(d).log.xz 000957305.td-b3lyp_6-31g+(d).inp 000957305.td-b3lyp_6-31g+(d).log.xz

000957305.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957305.td-b3lyp_6-31+g(d).gjf (generated)

000957305.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957305.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957305.mol 000957305.PUBCHEM 000957305.mol (via Jmol)
000957324.b3lyp_6-31g(d).inp

000957324.b3lyp_6-31g(d).qchem.inp (generated)

000957324.b3lyp_6-31g(d).gjf (generated)

000957324.b3lyp_6-31g(d).firefly.inp (generated)

000957324.b3lyp_6-31g(d).smash.inp (generated)

000957324.b3lyp_6-31g(d).nwchem.inp (generated) 000957324.b3lyp_6-31g(d).log.xz 000957324.td-b3lyp_6-31g+(d).inp 000957324.td-b3lyp_6-31g+(d).log.xz

000957324.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957324.td-b3lyp_6-31+g(d).gjf (generated)

000957324.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957324.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957324.mol 000957324.PUBCHEM 000957324.mol (via Jmol)
000957328.b3lyp_6-31g(d).inp

000957328.b3lyp_6-31g(d).qchem.inp (generated)

000957328.b3lyp_6-31g(d).gjf (generated)

000957328.b3lyp_6-31g(d).firefly.inp (generated)

000957328.b3lyp_6-31g(d).smash.inp (generated)

000957328.b3lyp_6-31g(d).nwchem.inp (generated) 000957328.b3lyp_6-31g(d).log.xz 000957328.td-b3lyp_6-31g+(d).inp 000957328.td-b3lyp_6-31g+(d).log.xz

000957328.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957328.td-b3lyp_6-31+g(d).gjf (generated)

000957328.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957328.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957328.mol 000957328.PUBCHEM 000957328.mol (via Jmol)
000957332.b3lyp_6-31g(d).inp

000957332.b3lyp_6-31g(d).qchem.inp (generated)

000957332.b3lyp_6-31g(d).gjf (generated)

000957332.b3lyp_6-31g(d).firefly.inp (generated)

000957332.b3lyp_6-31g(d).smash.inp (generated)

000957332.b3lyp_6-31g(d).nwchem.inp (generated) 000957332.b3lyp_6-31g(d).log.xz 000957332.td-b3lyp_6-31g+(d).inp 000957332.td-b3lyp_6-31g+(d).log.xz

000957332.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957332.td-b3lyp_6-31+g(d).gjf (generated)

000957332.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957332.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957332.mol 000957332.PUBCHEM 000957332.mol (via Jmol)
000957364.b3lyp_6-31g(d).inp

000957364.b3lyp_6-31g(d).qchem.inp (generated)

000957364.b3lyp_6-31g(d).gjf (generated)

000957364.b3lyp_6-31g(d).firefly.inp (generated)

000957364.b3lyp_6-31g(d).smash.inp (generated)

000957364.b3lyp_6-31g(d).nwchem.inp (generated) 000957364.b3lyp_6-31g(d).log.xz 000957364.mol 000957364.PUBCHEM 000957364.mol (via Jmol)
000957365.b3lyp_6-31g(d).inp

000957365.b3lyp_6-31g(d).qchem.inp (generated)

000957365.b3lyp_6-31g(d).gjf (generated)

000957365.b3lyp_6-31g(d).firefly.inp (generated)

000957365.b3lyp_6-31g(d).smash.inp (generated)

000957365.b3lyp_6-31g(d).nwchem.inp (generated) 000957365.b3lyp_6-31g(d).log.xz 000957365.mol 000957365.PUBCHEM 000957365.mol (via Jmol)
000957404.b3lyp_6-31g(d).inp

000957404.b3lyp_6-31g(d).qchem.inp (generated)

000957404.b3lyp_6-31g(d).gjf (generated)

000957404.b3lyp_6-31g(d).firefly.inp (generated)

000957404.b3lyp_6-31g(d).smash.inp (generated)

000957404.b3lyp_6-31g(d).nwchem.inp (generated) 000957404.b3lyp_6-31g(d).log.xz 000957404.mol 000957404.PUBCHEM 000957404.mol (via Jmol)
000957447.b3lyp_6-31g(d).inp

000957447.b3lyp_6-31g(d).qchem.inp (generated)

000957447.b3lyp_6-31g(d).gjf (generated)

000957447.b3lyp_6-31g(d).firefly.inp (generated)

000957447.b3lyp_6-31g(d).smash.inp (generated)

000957447.b3lyp_6-31g(d).nwchem.inp (generated) 000957447.b3lyp_6-31g(d).log.xz 000957447.td-b3lyp_6-31g+(d).inp 000957447.td-b3lyp_6-31g+(d).log.xz

000957447.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957447.td-b3lyp_6-31+g(d).gjf (generated)

000957447.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957447.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957447.mol 000957447.PUBCHEM 000957447.mol (via Jmol)
000957472.b3lyp_6-31g(d).inp

000957472.b3lyp_6-31g(d).qchem.inp (generated)

000957472.b3lyp_6-31g(d).gjf (generated)

000957472.b3lyp_6-31g(d).firefly.inp (generated)

000957472.b3lyp_6-31g(d).smash.inp (generated)

000957472.b3lyp_6-31g(d).nwchem.inp (generated) 000957472.b3lyp_6-31g(d).log.xz 000957472.mol 000957472.PUBCHEM 000957472.mol (via Jmol)
000957474.b3lyp_6-31g(d).inp

000957474.b3lyp_6-31g(d).qchem.inp (generated)

000957474.b3lyp_6-31g(d).gjf (generated)

000957474.b3lyp_6-31g(d).firefly.inp (generated)

000957474.b3lyp_6-31g(d).smash.inp (generated)

000957474.b3lyp_6-31g(d).nwchem.inp (generated) 000957474.b3lyp_6-31g(d).log.xz 000957474.mol 000957474.PUBCHEM 000957474.mol (via Jmol)
000957495.b3lyp_6-31g(d).inp

000957495.b3lyp_6-31g(d).qchem.inp (generated)

000957495.b3lyp_6-31g(d).gjf (generated)

000957495.b3lyp_6-31g(d).firefly.inp (generated)

000957495.b3lyp_6-31g(d).smash.inp (generated)

000957495.b3lyp_6-31g(d).nwchem.inp (generated) 000957495.b3lyp_6-31g(d).log.xz 000957495.td-b3lyp_6-31g+(d).inp 000957495.td-b3lyp_6-31g+(d).log.xz

000957495.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957495.td-b3lyp_6-31+g(d).gjf (generated)

000957495.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957495.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957495.mol 000957495.PUBCHEM 000957495.mol (via Jmol)
000957498.b3lyp_6-31g(d).inp

000957498.b3lyp_6-31g(d).qchem.inp (generated)

000957498.b3lyp_6-31g(d).gjf (generated)

000957498.b3lyp_6-31g(d).firefly.inp (generated)

000957498.b3lyp_6-31g(d).smash.inp (generated)

000957498.b3lyp_6-31g(d).nwchem.inp (generated) 000957498.b3lyp_6-31g(d).log.xz 000957498.td-b3lyp_6-31g+(d).inp 000957498.td-b3lyp_6-31g+(d).log.xz

000957498.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957498.td-b3lyp_6-31+g(d).gjf (generated)

000957498.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957498.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957498.mol 000957498.PUBCHEM 000957498.mol (via Jmol)
000957507.b3lyp_6-31g(d).inp

000957507.b3lyp_6-31g(d).qchem.inp (generated)

000957507.b3lyp_6-31g(d).gjf (generated)

000957507.b3lyp_6-31g(d).firefly.inp (generated)

000957507.b3lyp_6-31g(d).smash.inp (generated)

000957507.b3lyp_6-31g(d).nwchem.inp (generated) 000957507.b3lyp_6-31g(d).log.xz 000957507.mol 000957507.PUBCHEM 000957507.mol (via Jmol)
000957550.b3lyp_6-31g(d).inp

000957550.b3lyp_6-31g(d).qchem.inp (generated)

000957550.b3lyp_6-31g(d).gjf (generated)

000957550.b3lyp_6-31g(d).firefly.inp (generated)

000957550.b3lyp_6-31g(d).smash.inp (generated)

000957550.b3lyp_6-31g(d).nwchem.inp (generated) 000957550.b3lyp_6-31g(d).log.xz 000957550.td-b3lyp_6-31g+(d).inp 000957550.td-b3lyp_6-31g+(d).log.xz

000957550.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957550.td-b3lyp_6-31+g(d).gjf (generated)

000957550.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957550.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957550.mol 000957550.PUBCHEM 000957550.mol (via Jmol)
000957552.b3lyp_6-31g(d).inp

000957552.b3lyp_6-31g(d).qchem.inp (generated)

000957552.b3lyp_6-31g(d).gjf (generated)

000957552.b3lyp_6-31g(d).firefly.inp (generated)

000957552.b3lyp_6-31g(d).smash.inp (generated)

000957552.b3lyp_6-31g(d).nwchem.inp (generated) 000957552.b3lyp_6-31g(d).log.xz 000957552.td-b3lyp_6-31g+(d).inp 000957552.td-b3lyp_6-31g+(d).log.xz

000957552.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957552.td-b3lyp_6-31+g(d).gjf (generated)

000957552.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957552.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957552.mol 000957552.PUBCHEM 000957552.mol (via Jmol)
000957557.b3lyp_6-31g(d).inp

000957557.b3lyp_6-31g(d).qchem.inp (generated)

000957557.b3lyp_6-31g(d).gjf (generated)

000957557.b3lyp_6-31g(d).firefly.inp (generated)

000957557.b3lyp_6-31g(d).smash.inp (generated)

000957557.b3lyp_6-31g(d).nwchem.inp (generated) 000957557.b3lyp_6-31g(d).log.xz 000957557.mol 000957557.PUBCHEM 000957557.mol (via Jmol)
000957562.b3lyp_6-31g(d).inp

000957562.b3lyp_6-31g(d).qchem.inp (generated)

000957562.b3lyp_6-31g(d).gjf (generated)

000957562.b3lyp_6-31g(d).firefly.inp (generated)

000957562.b3lyp_6-31g(d).smash.inp (generated)

000957562.b3lyp_6-31g(d).nwchem.inp (generated) 000957562.b3lyp_6-31g(d).log.xz 000957562.td-b3lyp_6-31g+(d).inp 000957562.td-b3lyp_6-31g+(d).log.xz

000957562.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957562.td-b3lyp_6-31+g(d).gjf (generated)

000957562.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957562.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957562.mol 000957562.PUBCHEM 000957562.mol (via Jmol)
000957577.b3lyp_6-31g(d).inp

000957577.b3lyp_6-31g(d).qchem.inp (generated)

000957577.b3lyp_6-31g(d).gjf (generated)

000957577.b3lyp_6-31g(d).firefly.inp (generated)

000957577.b3lyp_6-31g(d).smash.inp (generated)

000957577.b3lyp_6-31g(d).nwchem.inp (generated) 000957577.b3lyp_6-31g(d).log.xz 000957577.mol 000957577.PUBCHEM 000957577.mol (via Jmol)
000957590.b3lyp_6-31g(d).inp

000957590.b3lyp_6-31g(d).qchem.inp (generated)

000957590.b3lyp_6-31g(d).gjf (generated)

000957590.b3lyp_6-31g(d).firefly.inp (generated)

000957590.b3lyp_6-31g(d).smash.inp (generated)

000957590.b3lyp_6-31g(d).nwchem.inp (generated) 000957590.b3lyp_6-31g(d).log.xz 000957590.mol 000957590.PUBCHEM 000957590.mol (via Jmol)
000957604.b3lyp_6-31g(d).inp

000957604.b3lyp_6-31g(d).qchem.inp (generated)

000957604.b3lyp_6-31g(d).gjf (generated)

000957604.b3lyp_6-31g(d).firefly.inp (generated)

000957604.b3lyp_6-31g(d).smash.inp (generated)

000957604.b3lyp_6-31g(d).nwchem.inp (generated) 000957604.b3lyp_6-31g(d).log.xz 000957604.td-b3lyp_6-31g+(d).inp 000957604.td-b3lyp_6-31g+(d).log.xz

000957604.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957604.td-b3lyp_6-31+g(d).gjf (generated)

000957604.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957604.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957604.mol 000957604.PUBCHEM 000957604.mol (via Jmol)
000957611.b3lyp_6-31g(d).inp

000957611.b3lyp_6-31g(d).qchem.inp (generated)

000957611.b3lyp_6-31g(d).gjf (generated)

000957611.b3lyp_6-31g(d).firefly.inp (generated)

000957611.b3lyp_6-31g(d).smash.inp (generated)

000957611.b3lyp_6-31g(d).nwchem.inp (generated) 000957611.b3lyp_6-31g(d).log.xz 000957611.td-b3lyp_6-31g+(d).inp 000957611.td-b3lyp_6-31g+(d).log.xz

000957611.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957611.td-b3lyp_6-31+g(d).gjf (generated)

000957611.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957611.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957611.mol 000957611.PUBCHEM 000957611.mol (via Jmol)
000957612.b3lyp_6-31g(d).inp

000957612.b3lyp_6-31g(d).qchem.inp (generated)

000957612.b3lyp_6-31g(d).gjf (generated)

000957612.b3lyp_6-31g(d).firefly.inp (generated)

000957612.b3lyp_6-31g(d).smash.inp (generated)

000957612.b3lyp_6-31g(d).nwchem.inp (generated) 000957612.b3lyp_6-31g(d).log.xz 000957612.td-b3lyp_6-31g+(d).inp 000957612.td-b3lyp_6-31g+(d).log.xz

000957612.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957612.td-b3lyp_6-31+g(d).gjf (generated)

000957612.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957612.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957612.mol 000957612.PUBCHEM 000957612.mol (via Jmol)
000957614.b3lyp_6-31g(d).inp

000957614.b3lyp_6-31g(d).qchem.inp (generated)

000957614.b3lyp_6-31g(d).gjf (generated)

000957614.b3lyp_6-31g(d).firefly.inp (generated)

000957614.b3lyp_6-31g(d).smash.inp (generated)

000957614.b3lyp_6-31g(d).nwchem.inp (generated) 000957614.b3lyp_6-31g(d).log.xz 000957614.td-b3lyp_6-31g+(d).inp 000957614.td-b3lyp_6-31g+(d).log.xz

000957614.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957614.td-b3lyp_6-31+g(d).gjf (generated)

000957614.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957614.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957614.mol 000957614.PUBCHEM 000957614.mol (via Jmol)
000957615.b3lyp_6-31g(d).inp

000957615.b3lyp_6-31g(d).qchem.inp (generated)

000957615.b3lyp_6-31g(d).gjf (generated)

000957615.b3lyp_6-31g(d).firefly.inp (generated)

000957615.b3lyp_6-31g(d).smash.inp (generated)

000957615.b3lyp_6-31g(d).nwchem.inp (generated) 000957615.b3lyp_6-31g(d).log.xz 000957615.td-b3lyp_6-31g+(d).inp 000957615.td-b3lyp_6-31g+(d).log.xz

000957615.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957615.td-b3lyp_6-31+g(d).gjf (generated)

000957615.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957615.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957615.mol 000957615.PUBCHEM 000957615.mol (via Jmol)
000957618.b3lyp_6-31g(d).inp

000957618.b3lyp_6-31g(d).qchem.inp (generated)

000957618.b3lyp_6-31g(d).gjf (generated)

000957618.b3lyp_6-31g(d).firefly.inp (generated)

000957618.b3lyp_6-31g(d).smash.inp (generated)

000957618.b3lyp_6-31g(d).nwchem.inp (generated) 000957618.b3lyp_6-31g(d).log.xz 000957618.td-b3lyp_6-31g+(d).inp 000957618.td-b3lyp_6-31g+(d).log.xz

000957618.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957618.td-b3lyp_6-31+g(d).gjf (generated)

000957618.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957618.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957618.mol 000957618.PUBCHEM 000957618.mol (via Jmol)
000957653.b3lyp_6-31g(d).inp

000957653.b3lyp_6-31g(d).qchem.inp (generated)

000957653.b3lyp_6-31g(d).gjf (generated)

000957653.b3lyp_6-31g(d).firefly.inp (generated)

000957653.b3lyp_6-31g(d).smash.inp (generated)

000957653.b3lyp_6-31g(d).nwchem.inp (generated) 000957653.b3lyp_6-31g(d).log.xz 000957653.mol 000957653.PUBCHEM 000957653.mol (via Jmol)
000957655.b3lyp_6-31g(d).inp

000957655.b3lyp_6-31g(d).qchem.inp (generated)

000957655.b3lyp_6-31g(d).gjf (generated)

000957655.b3lyp_6-31g(d).firefly.inp (generated)

000957655.b3lyp_6-31g(d).smash.inp (generated)

000957655.b3lyp_6-31g(d).nwchem.inp (generated) 000957655.b3lyp_6-31g(d).log.xz 000957655.td-b3lyp_6-31g+(d).inp 000957655.td-b3lyp_6-31g+(d).log.xz

000957655.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957655.td-b3lyp_6-31+g(d).gjf (generated)

000957655.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957655.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957655.mol 000957655.PUBCHEM 000957655.mol (via Jmol)
000957700.b3lyp_6-31g(d).inp

000957700.b3lyp_6-31g(d).qchem.inp (generated)

000957700.b3lyp_6-31g(d).gjf (generated)

000957700.b3lyp_6-31g(d).firefly.inp (generated)

000957700.b3lyp_6-31g(d).smash.inp (generated)

000957700.b3lyp_6-31g(d).nwchem.inp (generated) 000957700.b3lyp_6-31g(d).log.xz 000957700.mol 000957700.PUBCHEM 000957700.mol (via Jmol)
000957702.b3lyp_6-31g(d).inp

000957702.b3lyp_6-31g(d).qchem.inp (generated)

000957702.b3lyp_6-31g(d).gjf (generated)

000957702.b3lyp_6-31g(d).firefly.inp (generated)

000957702.b3lyp_6-31g(d).smash.inp (generated)

000957702.b3lyp_6-31g(d).nwchem.inp (generated) 000957702.b3lyp_6-31g(d).log.xz 000957702.td-b3lyp_6-31g+(d).inp 000957702.td-b3lyp_6-31g+(d).log.xz

000957702.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957702.td-b3lyp_6-31+g(d).gjf (generated)

000957702.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957702.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957702.mol 000957702.PUBCHEM 000957702.mol (via Jmol)
000957795.b3lyp_6-31g(d).inp

000957795.b3lyp_6-31g(d).qchem.inp (generated)

000957795.b3lyp_6-31g(d).gjf (generated)

000957795.b3lyp_6-31g(d).firefly.inp (generated)

000957795.b3lyp_6-31g(d).smash.inp (generated)

000957795.b3lyp_6-31g(d).nwchem.inp (generated) 000957795.b3lyp_6-31g(d).log.xz 000957795.td-b3lyp_6-31g+(d).inp 000957795.td-b3lyp_6-31g+(d).log.xz

000957795.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957795.td-b3lyp_6-31+g(d).gjf (generated)

000957795.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957795.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957795.mol 000957795.PUBCHEM 000957795.mol (via Jmol)
000957796.b3lyp_6-31g(d).inp

000957796.b3lyp_6-31g(d).qchem.inp (generated)

000957796.b3lyp_6-31g(d).gjf (generated)

000957796.b3lyp_6-31g(d).firefly.inp (generated)

000957796.b3lyp_6-31g(d).smash.inp (generated)

000957796.b3lyp_6-31g(d).nwchem.inp (generated) 000957796.b3lyp_6-31g(d).log.xz 000957796.td-b3lyp_6-31g+(d).inp 000957796.td-b3lyp_6-31g+(d).log.xz

000957796.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957796.td-b3lyp_6-31+g(d).gjf (generated)

000957796.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957796.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957796.mol 000957796.PUBCHEM 000957796.mol (via Jmol)
000957798.b3lyp_6-31g(d).inp

000957798.b3lyp_6-31g(d).qchem.inp (generated)

000957798.b3lyp_6-31g(d).gjf (generated)

000957798.b3lyp_6-31g(d).firefly.inp (generated)

000957798.b3lyp_6-31g(d).smash.inp (generated)

000957798.b3lyp_6-31g(d).nwchem.inp (generated) 000957798.b3lyp_6-31g(d).log.xz 000957798.td-b3lyp_6-31g+(d).inp 000957798.td-b3lyp_6-31g+(d).log.xz

000957798.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957798.td-b3lyp_6-31+g(d).gjf (generated)

000957798.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957798.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957798.mol 000957798.PUBCHEM 000957798.mol (via Jmol)
000957799.b3lyp_6-31g(d).inp

000957799.b3lyp_6-31g(d).qchem.inp (generated)

000957799.b3lyp_6-31g(d).gjf (generated)

000957799.b3lyp_6-31g(d).firefly.inp (generated)

000957799.b3lyp_6-31g(d).smash.inp (generated)

000957799.b3lyp_6-31g(d).nwchem.inp (generated) 000957799.b3lyp_6-31g(d).log.xz 000957799.td-b3lyp_6-31g+(d).inp 000957799.td-b3lyp_6-31g+(d).log.xz

000957799.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957799.td-b3lyp_6-31+g(d).gjf (generated)

000957799.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957799.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957799.mol 000957799.PUBCHEM 000957799.mol (via Jmol)
000957801.b3lyp_6-31g(d).inp

000957801.b3lyp_6-31g(d).qchem.inp (generated)

000957801.b3lyp_6-31g(d).gjf (generated)

000957801.b3lyp_6-31g(d).firefly.inp (generated)

000957801.b3lyp_6-31g(d).smash.inp (generated)

000957801.b3lyp_6-31g(d).nwchem.inp (generated) 000957801.b3lyp_6-31g(d).log.xz 000957801.td-b3lyp_6-31g+(d).inp 000957801.td-b3lyp_6-31g+(d).log.xz

000957801.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957801.td-b3lyp_6-31+g(d).gjf (generated)

000957801.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957801.mol 000957801.PUBCHEM 000957801.mol (via Jmol)
000957853.b3lyp_6-31g(d).inp

000957853.b3lyp_6-31g(d).qchem.inp (generated)

000957853.b3lyp_6-31g(d).gjf (generated)

000957853.b3lyp_6-31g(d).firefly.inp (generated)

000957853.b3lyp_6-31g(d).smash.inp (generated)

000957853.b3lyp_6-31g(d).nwchem.inp (generated) 000957853.b3lyp_6-31g(d).log.xz 000957853.td-b3lyp_6-31g+(d).inp 000957853.td-b3lyp_6-31g+(d).log.xz

000957853.td-b3lyp_6-31+g(d).qchem.inp (generated)

000957853.td-b3lyp_6-31+g(d).gjf (generated)

000957853.td-b3lyp_6-31+g(d).firefly.inp (generated)

000957853.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000957853.mol 000957853.PUBCHEM 000957853.mol (via Jmol)
000958055.b3lyp_6-31g(d).inp

000958055.b3lyp_6-31g(d).qchem.inp (generated)

000958055.b3lyp_6-31g(d).gjf (generated)

000958055.b3lyp_6-31g(d).firefly.inp (generated)

000958055.b3lyp_6-31g(d).smash.inp (generated)

000958055.b3lyp_6-31g(d).nwchem.inp (generated) 000958055.b3lyp_6-31g(d).log.xz 000958055.td-b3lyp_6-31g+(d).inp 000958055.td-b3lyp_6-31g+(d).log.xz

000958055.td-b3lyp_6-31+g(d).qchem.inp (generated)

000958055.td-b3lyp_6-31+g(d).gjf (generated)

000958055.td-b3lyp_6-31+g(d).firefly.inp (generated)

000958055.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000958055.mol 000958055.PUBCHEM 000958055.mol (via Jmol)
000958072.b3lyp_6-31g(d).inp

000958072.b3lyp_6-31g(d).qchem.inp (generated)

000958072.b3lyp_6-31g(d).gjf (generated)

000958072.b3lyp_6-31g(d).firefly.inp (generated)

000958072.b3lyp_6-31g(d).smash.inp (generated)

000958072.b3lyp_6-31g(d).nwchem.inp (generated) 000958072.b3lyp_6-31g(d).log.xz 000958072.td-b3lyp_6-31g+(d).inp 000958072.td-b3lyp_6-31g+(d).log.xz

000958072.td-b3lyp_6-31+g(d).qchem.inp (generated)

000958072.td-b3lyp_6-31+g(d).gjf (generated)

000958072.td-b3lyp_6-31+g(d).firefly.inp (generated)

000958072.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000958072.mol 000958072.PUBCHEM 000958072.mol (via Jmol)
000958144.b3lyp_6-31g(d).inp

000958144.b3lyp_6-31g(d).qchem.inp (generated)

000958144.b3lyp_6-31g(d).gjf (generated)

000958144.b3lyp_6-31g(d).firefly.inp (generated)

000958144.b3lyp_6-31g(d).smash.inp (generated)

000958144.b3lyp_6-31g(d).nwchem.inp (generated) 000958144.b3lyp_6-31g(d).log.xz 000958144.td-b3lyp_6-31g+(d).inp 000958144.td-b3lyp_6-31g+(d).log.xz

000958144.td-b3lyp_6-31+g(d).qchem.inp (generated)

000958144.td-b3lyp_6-31+g(d).gjf (generated)

000958144.td-b3lyp_6-31+g(d).firefly.inp (generated)

000958144.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000958144.mol 000958144.PUBCHEM 000958144.mol (via Jmol)
000958215.b3lyp_6-31g(d).inp

000958215.b3lyp_6-31g(d).qchem.inp (generated)

000958215.b3lyp_6-31g(d).gjf (generated)

000958215.b3lyp_6-31g(d).firefly.inp (generated)

000958215.b3lyp_6-31g(d).smash.inp (generated)

000958215.b3lyp_6-31g(d).nwchem.inp (generated) 000958215.b3lyp_6-31g(d).log.xz 000958215.mol 000958215.PUBCHEM 000958215.mol (via Jmol)
000958334.b3lyp_6-31g(d).inp

000958334.b3lyp_6-31g(d).qchem.inp (generated)

000958334.b3lyp_6-31g(d).gjf (generated)

000958334.b3lyp_6-31g(d).firefly.inp (generated)

000958334.b3lyp_6-31g(d).smash.inp (generated)

000958334.b3lyp_6-31g(d).nwchem.inp (generated) 000958334.b3lyp_6-31g(d).log.xz 000958334.td-b3lyp_6-31g+(d).inp 000958334.td-b3lyp_6-31g+(d).log.xz

000958334.td-b3lyp_6-31+g(d).qchem.inp (generated)

000958334.td-b3lyp_6-31+g(d).gjf (generated)

000958334.td-b3lyp_6-31+g(d).firefly.inp (generated)

000958334.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000958334.mol 000958334.PUBCHEM 000958334.mol (via Jmol)
000958450.b3lyp_6-31g(d).inp

000958450.b3lyp_6-31g(d).qchem.inp (generated)

000958450.b3lyp_6-31g(d).gjf (generated)

000958450.b3lyp_6-31g(d).firefly.inp (generated)

000958450.b3lyp_6-31g(d).smash.inp (generated)

000958450.b3lyp_6-31g(d).nwchem.inp (generated) 000958450.b3lyp_6-31g(d).log.xz 000958450.td-b3lyp_6-31g+(d).inp 000958450.td-b3lyp_6-31g+(d).log.xz

000958450.td-b3lyp_6-31+g(d).qchem.inp (generated)

000958450.td-b3lyp_6-31+g(d).gjf (generated)

000958450.td-b3lyp_6-31+g(d).firefly.inp (generated)

000958450.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000958450.mol 000958450.PUBCHEM 000958450.mol (via Jmol)
000958468.b3lyp_6-31g(d).inp

000958468.b3lyp_6-31g(d).qchem.inp (generated)

000958468.b3lyp_6-31g(d).gjf (generated)

000958468.b3lyp_6-31g(d).firefly.inp (generated)

000958468.b3lyp_6-31g(d).smash.inp (generated)

000958468.b3lyp_6-31g(d).nwchem.inp (generated) 000958468.b3lyp_6-31g(d).log.xz 000958468.td-b3lyp_6-31g+(d).inp 000958468.td-b3lyp_6-31g+(d).log.xz

000958468.td-b3lyp_6-31+g(d).qchem.inp (generated)

000958468.td-b3lyp_6-31+g(d).gjf (generated)

000958468.td-b3lyp_6-31+g(d).firefly.inp (generated)

000958468.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000958468.mol 000958468.PUBCHEM 000958468.mol (via Jmol)
000958473.b3lyp_6-31g(d).inp

000958473.b3lyp_6-31g(d).qchem.inp (generated)

000958473.b3lyp_6-31g(d).gjf (generated)

000958473.b3lyp_6-31g(d).firefly.inp (generated)

000958473.b3lyp_6-31g(d).smash.inp (generated)

000958473.b3lyp_6-31g(d).nwchem.inp (generated) 000958473.b3lyp_6-31g(d).log.xz 000958473.td-b3lyp_6-31g+(d).inp 000958473.td-b3lyp_6-31g+(d).log.xz

000958473.td-b3lyp_6-31+g(d).qchem.inp (generated)

000958473.td-b3lyp_6-31+g(d).gjf (generated)

000958473.td-b3lyp_6-31+g(d).firefly.inp (generated)

000958473.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000958473.mol 000958473.PUBCHEM 000958473.mol (via Jmol)
000958484.b3lyp_6-31g(d).inp

000958484.b3lyp_6-31g(d).qchem.inp (generated)

000958484.b3lyp_6-31g(d).gjf (generated)

000958484.b3lyp_6-31g(d).firefly.inp (generated)

000958484.b3lyp_6-31g(d).smash.inp (generated)

000958484.b3lyp_6-31g(d).nwchem.inp (generated) 000958484.b3lyp_6-31g(d).log.xz 000958484.td-b3lyp_6-31g+(d).inp 000958484.td-b3lyp_6-31g+(d).log.xz

000958484.td-b3lyp_6-31+g(d).qchem.inp (generated)

000958484.td-b3lyp_6-31+g(d).gjf (generated)

000958484.td-b3lyp_6-31+g(d).firefly.inp (generated)

000958484.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000958484.mol 000958484.PUBCHEM 000958484.mol (via Jmol)
000958519.b3lyp_6-31g(d).inp

000958519.b3lyp_6-31g(d).qchem.inp (generated)

000958519.b3lyp_6-31g(d).gjf (generated)

000958519.b3lyp_6-31g(d).firefly.inp (generated)

000958519.b3lyp_6-31g(d).smash.inp (generated)

000958519.b3lyp_6-31g(d).nwchem.inp (generated) 000958519.b3lyp_6-31g(d).log.xz 000958519.td-b3lyp_6-31g+(d).inp 000958519.td-b3lyp_6-31g+(d).log.xz

000958519.td-b3lyp_6-31+g(d).qchem.inp (generated)

000958519.td-b3lyp_6-31+g(d).gjf (generated)

000958519.td-b3lyp_6-31+g(d).firefly.inp (generated)

000958519.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000958519.mol 000958519.PUBCHEM 000958519.mol (via Jmol)
000958542.b3lyp_6-31g(d).inp

000958542.b3lyp_6-31g(d).qchem.inp (generated)

000958542.b3lyp_6-31g(d).gjf (generated)

000958542.b3lyp_6-31g(d).firefly.inp (generated)

000958542.b3lyp_6-31g(d).smash.inp (generated)

000958542.b3lyp_6-31g(d).nwchem.inp (generated) 000958542.b3lyp_6-31g(d).log.xz 000958542.td-b3lyp_6-31g+(d).inp 000958542.td-b3lyp_6-31g+(d).log.xz

000958542.td-b3lyp_6-31+g(d).qchem.inp (generated)

000958542.td-b3lyp_6-31+g(d).gjf (generated)

000958542.td-b3lyp_6-31+g(d).firefly.inp (generated)

000958542.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000958542.mol 000958542.PUBCHEM 000958542.mol (via Jmol)
000958553.b3lyp_6-31g(d).inp

000958553.b3lyp_6-31g(d).qchem.inp (generated)

000958553.b3lyp_6-31g(d).gjf (generated)

000958553.b3lyp_6-31g(d).firefly.inp (generated)

000958553.b3lyp_6-31g(d).smash.inp (generated)

000958553.b3lyp_6-31g(d).nwchem.inp (generated) 000958553.b3lyp_6-31g(d).log.xz 000958553.mol 000958553.PUBCHEM 000958553.mol (via Jmol)
000958555.b3lyp_6-31g(d).inp

000958555.b3lyp_6-31g(d).qchem.inp (generated)

000958555.b3lyp_6-31g(d).gjf (generated)

000958555.b3lyp_6-31g(d).firefly.inp (generated)

000958555.b3lyp_6-31g(d).smash.inp (generated)

000958555.b3lyp_6-31g(d).nwchem.inp (generated) 000958555.b3lyp_6-31g(d).log.xz 000958555.mol 000958555.PUBCHEM 000958555.mol (via Jmol)
000958611.b3lyp_6-31g(d).inp

000958611.b3lyp_6-31g(d).qchem.inp (generated)

000958611.b3lyp_6-31g(d).gjf (generated)

000958611.b3lyp_6-31g(d).firefly.inp (generated)

000958611.b3lyp_6-31g(d).smash.inp (generated)

000958611.b3lyp_6-31g(d).nwchem.inp (generated) 000958611.b3lyp_6-31g(d).log.xz 000958611.td-b3lyp_6-31g+(d).inp 000958611.td-b3lyp_6-31g+(d).log.xz

000958611.td-b3lyp_6-31+g(d).qchem.inp (generated)

000958611.td-b3lyp_6-31+g(d).gjf (generated)

000958611.td-b3lyp_6-31+g(d).firefly.inp (generated)

000958611.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000958611.mol 000958611.PUBCHEM 000958611.mol (via Jmol)
000958659.b3lyp_6-31g(d).inp

000958659.b3lyp_6-31g(d).qchem.inp (generated)

000958659.b3lyp_6-31g(d).gjf (generated)

000958659.b3lyp_6-31g(d).firefly.inp (generated)

000958659.b3lyp_6-31g(d).smash.inp (generated)

000958659.b3lyp_6-31g(d).nwchem.inp (generated) 000958659.b3lyp_6-31g(d).log.xz 000958659.td-b3lyp_6-31g+(d).inp 000958659.td-b3lyp_6-31g+(d).log.xz

000958659.td-b3lyp_6-31+g(d).qchem.inp (generated)

000958659.td-b3lyp_6-31+g(d).gjf (generated)

000958659.td-b3lyp_6-31+g(d).firefly.inp (generated)

000958659.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000958659.mol 000958659.PUBCHEM 000958659.mol (via Jmol)
000958660.b3lyp_6-31g(d).inp

000958660.b3lyp_6-31g(d).qchem.inp (generated)

000958660.b3lyp_6-31g(d).gjf (generated)

000958660.b3lyp_6-31g(d).firefly.inp (generated)

000958660.b3lyp_6-31g(d).smash.inp (generated)

000958660.b3lyp_6-31g(d).nwchem.inp (generated) 000958660.b3lyp_6-31g(d).log.xz 000958660.td-b3lyp_6-31g+(d).inp 000958660.td-b3lyp_6-31g+(d).log.xz

000958660.td-b3lyp_6-31+g(d).qchem.inp (generated)

000958660.td-b3lyp_6-31+g(d).gjf (generated)

000958660.td-b3lyp_6-31+g(d).firefly.inp (generated)

000958660.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000958660.mol 000958660.PUBCHEM 000958660.mol (via Jmol)
000958708.b3lyp_6-31g(d).inp

000958708.b3lyp_6-31g(d).qchem.inp (generated)

000958708.b3lyp_6-31g(d).gjf (generated)

000958708.b3lyp_6-31g(d).firefly.inp (generated)

000958708.b3lyp_6-31g(d).smash.inp (generated)

000958708.b3lyp_6-31g(d).nwchem.inp (generated) 000958708.b3lyp_6-31g(d).log.xz 000958708.mol 000958708.PUBCHEM 000958708.mol (via Jmol)
000958750.b3lyp_6-31g(d).inp

000958750.b3lyp_6-31g(d).qchem.inp (generated)

000958750.b3lyp_6-31g(d).gjf (generated)

000958750.b3lyp_6-31g(d).firefly.inp (generated)

000958750.b3lyp_6-31g(d).smash.inp (generated)

000958750.b3lyp_6-31g(d).nwchem.inp (generated) 000958750.b3lyp_6-31g(d).log.xz 000958750.td-b3lyp_6-31g+(d).inp 000958750.td-b3lyp_6-31g+(d).log.xz

000958750.td-b3lyp_6-31+g(d).qchem.inp (generated)

000958750.td-b3lyp_6-31+g(d).gjf (generated)

000958750.td-b3lyp_6-31+g(d).firefly.inp (generated)

000958750.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000958750.mol 000958750.PUBCHEM 000958750.mol (via Jmol)
000958774.b3lyp_6-31g(d).inp

000958774.b3lyp_6-31g(d).qchem.inp (generated)

000958774.b3lyp_6-31g(d).gjf (generated)

000958774.b3lyp_6-31g(d).firefly.inp (generated)

000958774.b3lyp_6-31g(d).smash.inp (generated)

000958774.b3lyp_6-31g(d).nwchem.inp (generated) 000958774.b3lyp_6-31g(d).log.xz 000958774.td-b3lyp_6-31g+(d).inp 000958774.td-b3lyp_6-31g+(d).log.xz

000958774.td-b3lyp_6-31+g(d).qchem.inp (generated)

000958774.td-b3lyp_6-31+g(d).gjf (generated)

000958774.td-b3lyp_6-31+g(d).firefly.inp (generated)

000958774.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000958774.mol 000958774.PUBCHEM 000958774.mol (via Jmol)
000958795.b3lyp_6-31g(d).inp

000958795.b3lyp_6-31g(d).qchem.inp (generated)

000958795.b3lyp_6-31g(d).gjf (generated)

000958795.b3lyp_6-31g(d).firefly.inp (generated)

000958795.b3lyp_6-31g(d).smash.inp (generated)

000958795.b3lyp_6-31g(d).nwchem.inp (generated) 000958795.b3lyp_6-31g(d).log.xz 000958795.td-b3lyp_6-31g+(d).inp 000958795.td-b3lyp_6-31g+(d).log.xz

000958795.td-b3lyp_6-31+g(d).qchem.inp (generated)

000958795.td-b3lyp_6-31+g(d).gjf (generated)

000958795.td-b3lyp_6-31+g(d).firefly.inp (generated)

000958795.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000958795.mol 000958795.PUBCHEM 000958795.mol (via Jmol)
000958810.b3lyp_6-31g(d).inp

000958810.b3lyp_6-31g(d).qchem.inp (generated)

000958810.b3lyp_6-31g(d).gjf (generated)

000958810.b3lyp_6-31g(d).firefly.inp (generated)

000958810.b3lyp_6-31g(d).smash.inp (generated)

000958810.b3lyp_6-31g(d).nwchem.inp (generated) 000958810.b3lyp_6-31g(d).log.xz 000958810.td-b3lyp_6-31g+(d).inp 000958810.td-b3lyp_6-31g+(d).log.xz

000958810.td-b3lyp_6-31+g(d).qchem.inp (generated)

000958810.td-b3lyp_6-31+g(d).gjf (generated)

000958810.td-b3lyp_6-31+g(d).firefly.inp (generated)

000958810.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000958810.mol 000958810.PUBCHEM 000958810.mol (via Jmol)
000958828.b3lyp_6-31g(d).inp

000958828.b3lyp_6-31g(d).qchem.inp (generated)

000958828.b3lyp_6-31g(d).gjf (generated)

000958828.b3lyp_6-31g(d).firefly.inp (generated)

000958828.b3lyp_6-31g(d).smash.inp (generated)

000958828.b3lyp_6-31g(d).nwchem.inp (generated) 000958828.b3lyp_6-31g(d).log.xz 000958828.td-b3lyp_6-31g+(d).inp 000958828.td-b3lyp_6-31g+(d).log.xz

000958828.td-b3lyp_6-31+g(d).qchem.inp (generated)

000958828.td-b3lyp_6-31+g(d).gjf (generated)

000958828.td-b3lyp_6-31+g(d).firefly.inp (generated)

000958828.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000958828.mol 000958828.PUBCHEM 000958828.mol (via Jmol)
000958834.b3lyp_6-31g(d).inp

000958834.b3lyp_6-31g(d).qchem.inp (generated)

000958834.b3lyp_6-31g(d).gjf (generated)

000958834.b3lyp_6-31g(d).firefly.inp (generated)

000958834.b3lyp_6-31g(d).smash.inp (generated)

000958834.b3lyp_6-31g(d).nwchem.inp (generated) 000958834.b3lyp_6-31g(d).log.xz 000958834.td-b3lyp_6-31g+(d).inp 000958834.td-b3lyp_6-31g+(d).log.xz

000958834.td-b3lyp_6-31+g(d).qchem.inp (generated)

000958834.td-b3lyp_6-31+g(d).gjf (generated)

000958834.td-b3lyp_6-31+g(d).firefly.inp (generated)

000958834.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000958834.mol 000958834.PUBCHEM 000958834.mol (via Jmol)
000958976.b3lyp_6-31g(d).inp

000958976.b3lyp_6-31g(d).qchem.inp (generated)

000958976.b3lyp_6-31g(d).gjf (generated)

000958976.b3lyp_6-31g(d).firefly.inp (generated)

000958976.b3lyp_6-31g(d).smash.inp (generated)

000958976.b3lyp_6-31g(d).nwchem.inp (generated) 000958976.b3lyp_6-31g(d).log.xz 000958976.td-b3lyp_6-31g+(d).inp 000958976.td-b3lyp_6-31g+(d).log.xz

000958976.td-b3lyp_6-31+g(d).qchem.inp (generated)

000958976.td-b3lyp_6-31+g(d).gjf (generated)

000958976.td-b3lyp_6-31+g(d).firefly.inp (generated)

000958976.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000958976.mol 000958976.PUBCHEM 000958976.mol (via Jmol)
000959133.b3lyp_6-31g(d).inp

000959133.b3lyp_6-31g(d).qchem.inp (generated)

000959133.b3lyp_6-31g(d).gjf (generated)

000959133.b3lyp_6-31g(d).firefly.inp (generated)

000959133.b3lyp_6-31g(d).smash.inp (generated)

000959133.b3lyp_6-31g(d).nwchem.inp (generated) 000959133.b3lyp_6-31g(d).log.xz 000959133.td-b3lyp_6-31g+(d).inp 000959133.td-b3lyp_6-31g+(d).log.xz

000959133.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959133.td-b3lyp_6-31+g(d).gjf (generated)

000959133.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959133.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959133.mol 000959133.PUBCHEM 000959133.mol (via Jmol)
000959139.b3lyp_6-31g(d).inp

000959139.b3lyp_6-31g(d).qchem.inp (generated)

000959139.b3lyp_6-31g(d).gjf (generated)

000959139.b3lyp_6-31g(d).firefly.inp (generated)

000959139.b3lyp_6-31g(d).smash.inp (generated)

000959139.b3lyp_6-31g(d).nwchem.inp (generated) 000959139.b3lyp_6-31g(d).log.xz 000959139.td-b3lyp_6-31g+(d).inp 000959139.td-b3lyp_6-31g+(d).log.xz

000959139.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959139.td-b3lyp_6-31+g(d).gjf (generated)

000959139.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959139.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959139.mol 000959139.PUBCHEM 000959139.mol (via Jmol)
000959140.b3lyp_6-31g(d).inp

000959140.b3lyp_6-31g(d).qchem.inp (generated)

000959140.b3lyp_6-31g(d).gjf (generated)

000959140.b3lyp_6-31g(d).firefly.inp (generated)

000959140.b3lyp_6-31g(d).smash.inp (generated)

000959140.b3lyp_6-31g(d).nwchem.inp (generated) 000959140.b3lyp_6-31g(d).log.xz 000959140.td-b3lyp_6-31g+(d).inp 000959140.td-b3lyp_6-31g+(d).log.xz

000959140.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959140.td-b3lyp_6-31+g(d).gjf (generated)

000959140.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959140.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959140.mol 000959140.PUBCHEM 000959140.mol (via Jmol)
000959147.b3lyp_6-31g(d).inp

000959147.b3lyp_6-31g(d).qchem.inp (generated)

000959147.b3lyp_6-31g(d).gjf (generated)

000959147.b3lyp_6-31g(d).firefly.inp (generated)

000959147.b3lyp_6-31g(d).smash.inp (generated)

000959147.b3lyp_6-31g(d).nwchem.inp (generated) 000959147.b3lyp_6-31g(d).log.xz 000959147.mol 000959147.PUBCHEM 000959147.mol (via Jmol)
000959163.b3lyp_6-31g(d).inp

000959163.b3lyp_6-31g(d).qchem.inp (generated)

000959163.b3lyp_6-31g(d).gjf (generated)

000959163.b3lyp_6-31g(d).firefly.inp (generated)

000959163.b3lyp_6-31g(d).smash.inp (generated)

000959163.b3lyp_6-31g(d).nwchem.inp (generated) 000959163.b3lyp_6-31g(d).log.xz 000959163.td-b3lyp_6-31g+(d).inp 000959163.td-b3lyp_6-31g+(d).log.xz

000959163.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959163.td-b3lyp_6-31+g(d).gjf (generated)

000959163.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959163.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959163.mol 000959163.PUBCHEM 000959163.mol (via Jmol)
000959164.b3lyp_6-31g(d).inp

000959164.b3lyp_6-31g(d).qchem.inp (generated)

000959164.b3lyp_6-31g(d).gjf (generated)

000959164.b3lyp_6-31g(d).firefly.inp (generated)

000959164.b3lyp_6-31g(d).smash.inp (generated)

000959164.b3lyp_6-31g(d).nwchem.inp (generated) 000959164.b3lyp_6-31g(d).log.xz 000959164.td-b3lyp_6-31g+(d).inp 000959164.td-b3lyp_6-31g+(d).log.xz

000959164.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959164.td-b3lyp_6-31+g(d).gjf (generated)

000959164.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959164.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959164.mol 000959164.PUBCHEM 000959164.mol (via Jmol)
000959169.b3lyp_6-31g(d).inp

000959169.b3lyp_6-31g(d).qchem.inp (generated)

000959169.b3lyp_6-31g(d).gjf (generated)

000959169.b3lyp_6-31g(d).firefly.inp (generated)

000959169.b3lyp_6-31g(d).smash.inp (generated)

000959169.b3lyp_6-31g(d).nwchem.inp (generated) 000959169.b3lyp_6-31g(d).log.xz 000959169.td-b3lyp_6-31g+(d).inp 000959169.td-b3lyp_6-31g+(d).log.xz

000959169.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959169.td-b3lyp_6-31+g(d).gjf (generated)

000959169.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959169.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959169.mol 000959169.PUBCHEM 000959169.mol (via Jmol)
000959171.b3lyp_6-31g(d).inp

000959171.b3lyp_6-31g(d).qchem.inp (generated)

000959171.b3lyp_6-31g(d).gjf (generated)

000959171.b3lyp_6-31g(d).firefly.inp (generated)

000959171.b3lyp_6-31g(d).smash.inp (generated)

000959171.b3lyp_6-31g(d).nwchem.inp (generated) 000959171.b3lyp_6-31g(d).log.xz 000959171.td-b3lyp_6-31g+(d).inp 000959171.td-b3lyp_6-31g+(d).log.xz

000959171.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959171.td-b3lyp_6-31+g(d).gjf (generated)

000959171.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959171.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959171.mol 000959171.PUBCHEM 000959171.mol (via Jmol)
000959189.b3lyp_6-31g(d).inp

000959189.b3lyp_6-31g(d).qchem.inp (generated)

000959189.b3lyp_6-31g(d).gjf (generated)

000959189.b3lyp_6-31g(d).firefly.inp (generated)

000959189.b3lyp_6-31g(d).smash.inp (generated)

000959189.b3lyp_6-31g(d).nwchem.inp (generated) 000959189.b3lyp_6-31g(d).log.xz 000959189.td-b3lyp_6-31g+(d).inp 000959189.td-b3lyp_6-31g+(d).log.xz

000959189.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959189.td-b3lyp_6-31+g(d).gjf (generated)

000959189.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959189.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959189.mol 000959189.PUBCHEM 000959189.mol (via Jmol)
000959192.b3lyp_6-31g(d).inp

000959192.b3lyp_6-31g(d).qchem.inp (generated)

000959192.b3lyp_6-31g(d).gjf (generated)

000959192.b3lyp_6-31g(d).firefly.inp (generated)

000959192.b3lyp_6-31g(d).smash.inp (generated)

000959192.b3lyp_6-31g(d).nwchem.inp (generated) 000959192.b3lyp_6-31g(d).log.xz 000959192.td-b3lyp_6-31g+(d).inp 000959192.td-b3lyp_6-31g+(d).log.xz

000959192.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959192.td-b3lyp_6-31+g(d).gjf (generated)

000959192.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959192.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959192.mol 000959192.PUBCHEM 000959192.mol (via Jmol)
000959195.b3lyp_6-31g(d).inp

000959195.b3lyp_6-31g(d).qchem.inp (generated)

000959195.b3lyp_6-31g(d).gjf (generated)

000959195.b3lyp_6-31g(d).firefly.inp (generated)

000959195.b3lyp_6-31g(d).smash.inp (generated)

000959195.b3lyp_6-31g(d).nwchem.inp (generated) 000959195.b3lyp_6-31g(d).log.xz 000959195.td-b3lyp_6-31g+(d).inp 000959195.td-b3lyp_6-31g+(d).log.xz

000959195.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959195.td-b3lyp_6-31+g(d).gjf (generated)

000959195.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959195.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959195.mol 000959195.PUBCHEM 000959195.mol (via Jmol)
000959196.b3lyp_6-31g(d).inp

000959196.b3lyp_6-31g(d).qchem.inp (generated)

000959196.b3lyp_6-31g(d).gjf (generated)

000959196.b3lyp_6-31g(d).firefly.inp (generated)

000959196.b3lyp_6-31g(d).smash.inp (generated)

000959196.b3lyp_6-31g(d).nwchem.inp (generated) 000959196.b3lyp_6-31g(d).log.xz 000959196.td-b3lyp_6-31g+(d).inp 000959196.td-b3lyp_6-31g+(d).log.xz

000959196.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959196.td-b3lyp_6-31+g(d).gjf (generated)

000959196.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959196.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959196.mol 000959196.PUBCHEM 000959196.mol (via Jmol)
000959200.b3lyp_6-31g(d).inp

000959200.b3lyp_6-31g(d).qchem.inp (generated)

000959200.b3lyp_6-31g(d).gjf (generated)

000959200.b3lyp_6-31g(d).firefly.inp (generated)

000959200.b3lyp_6-31g(d).smash.inp (generated)

000959200.b3lyp_6-31g(d).nwchem.inp (generated) 000959200.b3lyp_6-31g(d).log.xz 000959200.td-b3lyp_6-31g+(d).inp 000959200.td-b3lyp_6-31g+(d).log.xz

000959200.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959200.td-b3lyp_6-31+g(d).gjf (generated)

000959200.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959200.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959200.mol 000959200.PUBCHEM 000959200.mol (via Jmol)
000959206.b3lyp_6-31g(d).inp

000959206.b3lyp_6-31g(d).qchem.inp (generated)

000959206.b3lyp_6-31g(d).gjf (generated)

000959206.b3lyp_6-31g(d).firefly.inp (generated)

000959206.b3lyp_6-31g(d).smash.inp (generated)

000959206.b3lyp_6-31g(d).nwchem.inp (generated) 000959206.b3lyp_6-31g(d).log.xz 000959206.mol 000959206.PUBCHEM 000959206.mol (via Jmol)
000959207.b3lyp_6-31g(d).inp

000959207.b3lyp_6-31g(d).qchem.inp (generated)

000959207.b3lyp_6-31g(d).gjf (generated)

000959207.b3lyp_6-31g(d).firefly.inp (generated)

000959207.b3lyp_6-31g(d).smash.inp (generated)

000959207.b3lyp_6-31g(d).nwchem.inp (generated) 000959207.b3lyp_6-31g(d).log.xz 000959207.mol 000959207.PUBCHEM 000959207.mol (via Jmol)
000959208.b3lyp_6-31g(d).inp

000959208.b3lyp_6-31g(d).qchem.inp (generated)

000959208.b3lyp_6-31g(d).gjf (generated)

000959208.b3lyp_6-31g(d).firefly.inp (generated)

000959208.b3lyp_6-31g(d).smash.inp (generated)

000959208.b3lyp_6-31g(d).nwchem.inp (generated) 000959208.b3lyp_6-31g(d).log.xz 000959208.mol 000959208.PUBCHEM 000959208.mol (via Jmol)
000959213.b3lyp_6-31g(d).inp

000959213.b3lyp_6-31g(d).qchem.inp (generated)

000959213.b3lyp_6-31g(d).gjf (generated)

000959213.b3lyp_6-31g(d).firefly.inp (generated)

000959213.b3lyp_6-31g(d).smash.inp (generated)

000959213.b3lyp_6-31g(d).nwchem.inp (generated) 000959213.b3lyp_6-31g(d).log.xz 000959213.td-b3lyp_6-31g+(d).inp 000959213.td-b3lyp_6-31g+(d).log.xz

000959213.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959213.td-b3lyp_6-31+g(d).gjf (generated)

000959213.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959213.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959213.mol 000959213.PUBCHEM 000959213.mol (via Jmol)
000959250.b3lyp_6-31g(d).inp

000959250.b3lyp_6-31g(d).qchem.inp (generated)

000959250.b3lyp_6-31g(d).gjf (generated)

000959250.b3lyp_6-31g(d).firefly.inp (generated)

000959250.b3lyp_6-31g(d).smash.inp (generated)

000959250.b3lyp_6-31g(d).nwchem.inp (generated) 000959250.b3lyp_6-31g(d).log.xz 000959250.td-b3lyp_6-31g+(d).inp 000959250.td-b3lyp_6-31g+(d).log.xz

000959250.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959250.td-b3lyp_6-31+g(d).gjf (generated)

000959250.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959250.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959250.mol 000959250.PUBCHEM 000959250.mol (via Jmol)
000959252.b3lyp_6-31g(d).inp

000959252.b3lyp_6-31g(d).qchem.inp (generated)

000959252.b3lyp_6-31g(d).gjf (generated)

000959252.b3lyp_6-31g(d).firefly.inp (generated)

000959252.b3lyp_6-31g(d).smash.inp (generated)

000959252.b3lyp_6-31g(d).nwchem.inp (generated) 000959252.b3lyp_6-31g(d).log.xz 000959252.td-b3lyp_6-31g+(d).inp 000959252.td-b3lyp_6-31g+(d).log.xz

000959252.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959252.td-b3lyp_6-31+g(d).gjf (generated)

000959252.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959252.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959252.mol 000959252.PUBCHEM 000959252.mol (via Jmol)
000959253.b3lyp_6-31g(d).inp

000959253.b3lyp_6-31g(d).qchem.inp (generated)

000959253.b3lyp_6-31g(d).gjf (generated)

000959253.b3lyp_6-31g(d).firefly.inp (generated)

000959253.b3lyp_6-31g(d).smash.inp (generated)

000959253.b3lyp_6-31g(d).nwchem.inp (generated) 000959253.b3lyp_6-31g(d).log.xz 000959253.td-b3lyp_6-31g+(d).inp 000959253.td-b3lyp_6-31g+(d).log.xz

000959253.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959253.td-b3lyp_6-31+g(d).gjf (generated)

000959253.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959253.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959253.mol 000959253.PUBCHEM 000959253.mol (via Jmol)
000959491.b3lyp_6-31g(d).inp

000959491.b3lyp_6-31g(d).qchem.inp (generated)

000959491.b3lyp_6-31g(d).gjf (generated)

000959491.b3lyp_6-31g(d).firefly.inp (generated)

000959491.b3lyp_6-31g(d).smash.inp (generated)

000959491.b3lyp_6-31g(d).nwchem.inp (generated) 000959491.b3lyp_6-31g(d).log.xz 000959491.td-b3lyp_6-31g+(d).inp 000959491.td-b3lyp_6-31g+(d).log.xz

000959491.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959491.td-b3lyp_6-31+g(d).gjf (generated)

000959491.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959491.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959491.mol 000959491.PUBCHEM 000959491.mol (via Jmol)
000959492.b3lyp_6-31g(d).inp

000959492.b3lyp_6-31g(d).qchem.inp (generated)

000959492.b3lyp_6-31g(d).gjf (generated)

000959492.b3lyp_6-31g(d).firefly.inp (generated)

000959492.b3lyp_6-31g(d).smash.inp (generated)

000959492.b3lyp_6-31g(d).nwchem.inp (generated) 000959492.b3lyp_6-31g(d).log.xz 000959492.td-b3lyp_6-31g+(d).inp 000959492.td-b3lyp_6-31g+(d).log.xz

000959492.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959492.td-b3lyp_6-31+g(d).gjf (generated)

000959492.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959492.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959492.mol 000959492.PUBCHEM 000959492.mol (via Jmol)
000959499.b3lyp_6-31g(d).inp

000959499.b3lyp_6-31g(d).qchem.inp (generated)

000959499.b3lyp_6-31g(d).gjf (generated)

000959499.b3lyp_6-31g(d).firefly.inp (generated)

000959499.b3lyp_6-31g(d).smash.inp (generated)

000959499.b3lyp_6-31g(d).nwchem.inp (generated) 000959499.b3lyp_6-31g(d).log.xz 000959499.td-b3lyp_6-31g+(d).inp 000959499.td-b3lyp_6-31g+(d).log.xz

000959499.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959499.td-b3lyp_6-31+g(d).gjf (generated)

000959499.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959499.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959499.mol 000959499.PUBCHEM 000959499.mol (via Jmol)
000959502.b3lyp_6-31g(d).inp

000959502.b3lyp_6-31g(d).qchem.inp (generated)

000959502.b3lyp_6-31g(d).gjf (generated)

000959502.b3lyp_6-31g(d).firefly.inp (generated)

000959502.b3lyp_6-31g(d).smash.inp (generated)

000959502.b3lyp_6-31g(d).nwchem.inp (generated) 000959502.b3lyp_6-31g(d).log.xz 000959502.mol 000959502.PUBCHEM 000959502.mol (via Jmol)
000959506.b3lyp_6-31g(d).inp

000959506.b3lyp_6-31g(d).qchem.inp (generated)

000959506.b3lyp_6-31g(d).gjf (generated)

000959506.b3lyp_6-31g(d).firefly.inp (generated)

000959506.b3lyp_6-31g(d).smash.inp (generated)

000959506.b3lyp_6-31g(d).nwchem.inp (generated) 000959506.b3lyp_6-31g(d).log.xz 000959506.td-b3lyp_6-31g+(d).inp 000959506.td-b3lyp_6-31g+(d).log.xz

000959506.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959506.td-b3lyp_6-31+g(d).gjf (generated)

000959506.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959506.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959506.mol 000959506.PUBCHEM 000959506.mol (via Jmol)
000959514.b3lyp_6-31g(d).inp

000959514.b3lyp_6-31g(d).qchem.inp (generated)

000959514.b3lyp_6-31g(d).gjf (generated)

000959514.b3lyp_6-31g(d).firefly.inp (generated)

000959514.b3lyp_6-31g(d).smash.inp (generated)

000959514.b3lyp_6-31g(d).nwchem.inp (generated) 000959514.b3lyp_6-31g(d).log.xz 000959514.td-b3lyp_6-31g+(d).inp 000959514.td-b3lyp_6-31g+(d).log.xz

000959514.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959514.td-b3lyp_6-31+g(d).gjf (generated)

000959514.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959514.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959514.mol 000959514.PUBCHEM 000959514.mol (via Jmol)
000959529.b3lyp_6-31g(d).inp

000959529.b3lyp_6-31g(d).qchem.inp (generated)

000959529.b3lyp_6-31g(d).gjf (generated)

000959529.b3lyp_6-31g(d).firefly.inp (generated)

000959529.b3lyp_6-31g(d).smash.inp (generated)

000959529.b3lyp_6-31g(d).nwchem.inp (generated) 000959529.b3lyp_6-31g(d).log.xz 000959529.td-b3lyp_6-31g+(d).inp 000959529.td-b3lyp_6-31g+(d).log.xz

000959529.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959529.td-b3lyp_6-31+g(d).gjf (generated)

000959529.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959529.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959529.mol 000959529.PUBCHEM 000959529.mol (via Jmol)
000959531.b3lyp_6-31g(d).inp

000959531.b3lyp_6-31g(d).qchem.inp (generated)

000959531.b3lyp_6-31g(d).gjf (generated)

000959531.b3lyp_6-31g(d).firefly.inp (generated)

000959531.b3lyp_6-31g(d).smash.inp (generated)

000959531.b3lyp_6-31g(d).nwchem.inp (generated) 000959531.b3lyp_6-31g(d).log.xz 000959531.td-b3lyp_6-31g+(d).inp 000959531.td-b3lyp_6-31g+(d).log.xz

000959531.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959531.td-b3lyp_6-31+g(d).gjf (generated)

000959531.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959531.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959531.mol 000959531.PUBCHEM 000959531.mol (via Jmol)
000959532.b3lyp_6-31g(d).inp

000959532.b3lyp_6-31g(d).qchem.inp (generated)

000959532.b3lyp_6-31g(d).gjf (generated)

000959532.b3lyp_6-31g(d).firefly.inp (generated)

000959532.b3lyp_6-31g(d).smash.inp (generated)

000959532.b3lyp_6-31g(d).nwchem.inp (generated) 000959532.b3lyp_6-31g(d).log.xz 000959532.td-b3lyp_6-31g+(d).inp 000959532.td-b3lyp_6-31g+(d).log.xz

000959532.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959532.td-b3lyp_6-31+g(d).gjf (generated)

000959532.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959532.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959532.mol 000959532.PUBCHEM 000959532.mol (via Jmol)
000959596.b3lyp_6-31g(d).inp

000959596.b3lyp_6-31g(d).qchem.inp (generated)

000959596.b3lyp_6-31g(d).gjf (generated)

000959596.b3lyp_6-31g(d).firefly.inp (generated)

000959596.b3lyp_6-31g(d).smash.inp (generated)

000959596.b3lyp_6-31g(d).nwchem.inp (generated) 000959596.b3lyp_6-31g(d).log.xz 000959596.td-b3lyp_6-31g+(d).inp 000959596.td-b3lyp_6-31g+(d).log.xz

000959596.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959596.td-b3lyp_6-31+g(d).gjf (generated)

000959596.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959596.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959596.mol 000959596.PUBCHEM 000959596.mol (via Jmol)
000959605.b3lyp_6-31g(d).inp

000959605.b3lyp_6-31g(d).qchem.inp (generated)

000959605.b3lyp_6-31g(d).gjf (generated)

000959605.b3lyp_6-31g(d).firefly.inp (generated)

000959605.b3lyp_6-31g(d).smash.inp (generated)

000959605.b3lyp_6-31g(d).nwchem.inp (generated) 000959605.b3lyp_6-31g(d).log.xz 000959605.td-b3lyp_6-31g+(d).inp 000959605.td-b3lyp_6-31g+(d).log.xz

000959605.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959605.td-b3lyp_6-31+g(d).gjf (generated)

000959605.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959605.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959605.mol 000959605.PUBCHEM 000959605.mol (via Jmol)
000959606.b3lyp_6-31g(d).inp

000959606.b3lyp_6-31g(d).qchem.inp (generated)

000959606.b3lyp_6-31g(d).gjf (generated)

000959606.b3lyp_6-31g(d).firefly.inp (generated)

000959606.b3lyp_6-31g(d).smash.inp (generated)

000959606.b3lyp_6-31g(d).nwchem.inp (generated) 000959606.b3lyp_6-31g(d).log.xz 000959606.td-b3lyp_6-31g+(d).inp 000959606.td-b3lyp_6-31g+(d).log.xz

000959606.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959606.td-b3lyp_6-31+g(d).gjf (generated)

000959606.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959606.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959606.mol 000959606.PUBCHEM 000959606.mol (via Jmol)
000959614.b3lyp_6-31g(d).inp

000959614.b3lyp_6-31g(d).qchem.inp (generated)

000959614.b3lyp_6-31g(d).gjf (generated)

000959614.b3lyp_6-31g(d).firefly.inp (generated)

000959614.b3lyp_6-31g(d).smash.inp (generated)

000959614.b3lyp_6-31g(d).nwchem.inp (generated) 000959614.b3lyp_6-31g(d).log.xz 000959614.td-b3lyp_6-31g+(d).inp 000959614.td-b3lyp_6-31g+(d).log.xz

000959614.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959614.td-b3lyp_6-31+g(d).gjf (generated)

000959614.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959614.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959614.mol 000959614.PUBCHEM 000959614.mol (via Jmol)
000959615.b3lyp_6-31g(d).inp

000959615.b3lyp_6-31g(d).qchem.inp (generated)

000959615.b3lyp_6-31g(d).gjf (generated)

000959615.b3lyp_6-31g(d).firefly.inp (generated)

000959615.b3lyp_6-31g(d).smash.inp (generated)

000959615.b3lyp_6-31g(d).nwchem.inp (generated) 000959615.b3lyp_6-31g(d).log.xz 000959615.td-b3lyp_6-31g+(d).inp 000959615.td-b3lyp_6-31g+(d).log.xz

000959615.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959615.td-b3lyp_6-31+g(d).gjf (generated)

000959615.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959615.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959615.mol 000959615.PUBCHEM 000959615.mol (via Jmol)
000959638.b3lyp_6-31g(d).inp

000959638.b3lyp_6-31g(d).qchem.inp (generated)

000959638.b3lyp_6-31g(d).gjf (generated)

000959638.b3lyp_6-31g(d).firefly.inp (generated)

000959638.b3lyp_6-31g(d).smash.inp (generated)

000959638.b3lyp_6-31g(d).nwchem.inp (generated) 000959638.b3lyp_6-31g(d).log.xz 000959638.td-b3lyp_6-31g+(d).inp 000959638.td-b3lyp_6-31g+(d).log.xz

000959638.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959638.td-b3lyp_6-31+g(d).gjf (generated)

000959638.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959638.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959638.mol 000959638.PUBCHEM 000959638.mol (via Jmol)
000959717.b3lyp_6-31g(d).inp

000959717.b3lyp_6-31g(d).qchem.inp (generated)

000959717.b3lyp_6-31g(d).gjf (generated)

000959717.b3lyp_6-31g(d).firefly.inp (generated)

000959717.b3lyp_6-31g(d).smash.inp (generated)

000959717.b3lyp_6-31g(d).nwchem.inp (generated) 000959717.b3lyp_6-31g(d).log.xz 000959717.mol 000959717.PUBCHEM 000959717.mol (via Jmol)
000959718.b3lyp_6-31g(d).inp

000959718.b3lyp_6-31g(d).qchem.inp (generated)

000959718.b3lyp_6-31g(d).gjf (generated)

000959718.b3lyp_6-31g(d).firefly.inp (generated)

000959718.b3lyp_6-31g(d).smash.inp (generated)

000959718.b3lyp_6-31g(d).nwchem.inp (generated) 000959718.b3lyp_6-31g(d).log.xz 000959718.mol 000959718.PUBCHEM 000959718.mol (via Jmol)
000959729.b3lyp_6-31g(d).inp

000959729.b3lyp_6-31g(d).qchem.inp (generated)

000959729.b3lyp_6-31g(d).gjf (generated)

000959729.b3lyp_6-31g(d).firefly.inp (generated)

000959729.b3lyp_6-31g(d).smash.inp (generated)

000959729.b3lyp_6-31g(d).nwchem.inp (generated) 000959729.b3lyp_6-31g(d).log.xz 000959729.td-b3lyp_6-31g+(d).inp 000959729.td-b3lyp_6-31g+(d).log.xz

000959729.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959729.td-b3lyp_6-31+g(d).gjf (generated)

000959729.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959729.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959729.mol 000959729.PUBCHEM 000959729.mol (via Jmol)
000959785.b3lyp_6-31g(d).inp

000959785.b3lyp_6-31g(d).qchem.inp (generated)

000959785.b3lyp_6-31g(d).gjf (generated)

000959785.b3lyp_6-31g(d).firefly.inp (generated)

000959785.b3lyp_6-31g(d).smash.inp (generated)

000959785.b3lyp_6-31g(d).nwchem.inp (generated) 000959785.b3lyp_6-31g(d).log.xz 000959785.mol 000959785.PUBCHEM 000959785.mol (via Jmol)
000959826.b3lyp_6-31g(d).inp

000959826.b3lyp_6-31g(d).qchem.inp (generated)

000959826.b3lyp_6-31g(d).gjf (generated)

000959826.b3lyp_6-31g(d).firefly.inp (generated)

000959826.b3lyp_6-31g(d).smash.inp (generated)

000959826.b3lyp_6-31g(d).nwchem.inp (generated) 000959826.b3lyp_6-31g(d).log.xz 000959826.mol 000959826.PUBCHEM 000959826.mol (via Jmol)
000959856.b3lyp_6-31g(d).inp

000959856.b3lyp_6-31g(d).qchem.inp (generated)

000959856.b3lyp_6-31g(d).gjf (generated)

000959856.b3lyp_6-31g(d).firefly.inp (generated)

000959856.b3lyp_6-31g(d).smash.inp (generated)

000959856.b3lyp_6-31g(d).nwchem.inp (generated) 000959856.b3lyp_6-31g(d).log.xz 000959856.td-b3lyp_6-31g+(d).inp 000959856.td-b3lyp_6-31g+(d).log.xz

000959856.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959856.td-b3lyp_6-31+g(d).gjf (generated)

000959856.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959856.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959856.mol 000959856.PUBCHEM 000959856.mol (via Jmol)
000959977.b3lyp_6-31g(d).inp

000959977.b3lyp_6-31g(d).qchem.inp (generated)

000959977.b3lyp_6-31g(d).gjf (generated)

000959977.b3lyp_6-31g(d).firefly.inp (generated)

000959977.b3lyp_6-31g(d).smash.inp (generated)

000959977.b3lyp_6-31g(d).nwchem.inp (generated) 000959977.b3lyp_6-31g(d).log.xz 000959977.td-b3lyp_6-31g+(d).inp 000959977.td-b3lyp_6-31g+(d).log.xz

000959977.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959977.td-b3lyp_6-31+g(d).gjf (generated)

000959977.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959977.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959977.mol 000959977.PUBCHEM 000959977.mol (via Jmol)
000959978.b3lyp_6-31g(d).inp

000959978.b3lyp_6-31g(d).qchem.inp (generated)

000959978.b3lyp_6-31g(d).gjf (generated)

000959978.b3lyp_6-31g(d).firefly.inp (generated)

000959978.b3lyp_6-31g(d).smash.inp (generated)

000959978.b3lyp_6-31g(d).nwchem.inp (generated) 000959978.b3lyp_6-31g(d).log.xz 000959978.td-b3lyp_6-31g+(d).inp 000959978.td-b3lyp_6-31g+(d).log.xz

000959978.td-b3lyp_6-31+g(d).qchem.inp (generated)

000959978.td-b3lyp_6-31+g(d).gjf (generated)

000959978.td-b3lyp_6-31+g(d).firefly.inp (generated)

000959978.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000959978.mol 000959978.PUBCHEM 000959978.mol (via Jmol)
000960019.b3lyp_6-31g(d).inp

000960019.b3lyp_6-31g(d).qchem.inp (generated)

000960019.b3lyp_6-31g(d).gjf (generated)

000960019.b3lyp_6-31g(d).firefly.inp (generated)

000960019.b3lyp_6-31g(d).smash.inp (generated)

000960019.b3lyp_6-31g(d).nwchem.inp (generated) 000960019.b3lyp_6-31g(d).log.xz 000960019.td-b3lyp_6-31g+(d).inp 000960019.td-b3lyp_6-31g+(d).log.xz

000960019.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960019.td-b3lyp_6-31+g(d).gjf (generated)

000960019.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960019.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960019.mol 000960019.PUBCHEM 000960019.mol (via Jmol)
000960022.b3lyp_6-31g(d).inp

000960022.b3lyp_6-31g(d).qchem.inp (generated)

000960022.b3lyp_6-31g(d).gjf (generated)

000960022.b3lyp_6-31g(d).firefly.inp (generated)

000960022.b3lyp_6-31g(d).smash.inp (generated)

000960022.b3lyp_6-31g(d).nwchem.inp (generated) 000960022.b3lyp_6-31g(d).log.xz 000960022.td-b3lyp_6-31g+(d).inp 000960022.td-b3lyp_6-31g+(d).log.xz

000960022.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960022.td-b3lyp_6-31+g(d).gjf (generated)

000960022.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960022.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960022.mol 000960022.PUBCHEM 000960022.mol (via Jmol)
000960129.b3lyp_6-31g(d).inp

000960129.b3lyp_6-31g(d).qchem.inp (generated)

000960129.b3lyp_6-31g(d).gjf (generated)

000960129.b3lyp_6-31g(d).firefly.inp (generated)

000960129.b3lyp_6-31g(d).smash.inp (generated)

000960129.b3lyp_6-31g(d).nwchem.inp (generated) 000960129.b3lyp_6-31g(d).log.xz 000960129.mol 000960129.PUBCHEM 000960129.mol (via Jmol)
000960130.b3lyp_6-31g(d).inp

000960130.b3lyp_6-31g(d).qchem.inp (generated)

000960130.b3lyp_6-31g(d).gjf (generated)

000960130.b3lyp_6-31g(d).firefly.inp (generated)

000960130.b3lyp_6-31g(d).smash.inp (generated)

000960130.b3lyp_6-31g(d).nwchem.inp (generated) 000960130.b3lyp_6-31g(d).log.xz 000960130.td-b3lyp_6-31g+(d).inp 000960130.td-b3lyp_6-31g+(d).log.xz

000960130.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960130.td-b3lyp_6-31+g(d).gjf (generated)

000960130.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960130.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960130.mol 000960130.PUBCHEM 000960130.mol (via Jmol)
000960131.b3lyp_6-31g(d).inp

000960131.b3lyp_6-31g(d).qchem.inp (generated)

000960131.b3lyp_6-31g(d).gjf (generated)

000960131.b3lyp_6-31g(d).firefly.inp (generated)

000960131.b3lyp_6-31g(d).smash.inp (generated)

000960131.b3lyp_6-31g(d).nwchem.inp (generated) 000960131.b3lyp_6-31g(d).log.xz 000960131.td-b3lyp_6-31g+(d).inp 000960131.td-b3lyp_6-31g+(d).log.xz

000960131.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960131.td-b3lyp_6-31+g(d).gjf (generated)

000960131.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960131.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960131.mol 000960131.PUBCHEM 000960131.mol (via Jmol)
000960132.b3lyp_6-31g(d).inp

000960132.b3lyp_6-31g(d).qchem.inp (generated)

000960132.b3lyp_6-31g(d).gjf (generated)

000960132.b3lyp_6-31g(d).firefly.inp (generated)

000960132.b3lyp_6-31g(d).smash.inp (generated)

000960132.b3lyp_6-31g(d).nwchem.inp (generated) 000960132.b3lyp_6-31g(d).log.xz 000960132.td-b3lyp_6-31g+(d).inp 000960132.td-b3lyp_6-31g+(d).log.xz

000960132.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960132.td-b3lyp_6-31+g(d).gjf (generated)

000960132.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960132.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960132.mol 000960132.PUBCHEM 000960132.mol (via Jmol)
000960133.b3lyp_6-31g(d).inp

000960133.b3lyp_6-31g(d).qchem.inp (generated)

000960133.b3lyp_6-31g(d).gjf (generated)

000960133.b3lyp_6-31g(d).firefly.inp (generated)

000960133.b3lyp_6-31g(d).smash.inp (generated)

000960133.b3lyp_6-31g(d).nwchem.inp (generated) 000960133.b3lyp_6-31g(d).log.xz 000960133.td-b3lyp_6-31g+(d).inp 000960133.td-b3lyp_6-31g+(d).log.xz

000960133.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960133.td-b3lyp_6-31+g(d).gjf (generated)

000960133.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960133.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960133.mol 000960133.PUBCHEM 000960133.mol (via Jmol)
000960135.b3lyp_6-31g(d).inp

000960135.b3lyp_6-31g(d).qchem.inp (generated)

000960135.b3lyp_6-31g(d).gjf (generated)

000960135.b3lyp_6-31g(d).firefly.inp (generated)

000960135.b3lyp_6-31g(d).smash.inp (generated)

000960135.b3lyp_6-31g(d).nwchem.inp (generated) 000960135.b3lyp_6-31g(d).log.xz 000960135.td-b3lyp_6-31g+(d).inp 000960135.td-b3lyp_6-31g+(d).log.xz

000960135.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960135.td-b3lyp_6-31+g(d).gjf (generated)

000960135.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960135.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960135.mol 000960135.PUBCHEM 000960135.mol (via Jmol)
000960136.b3lyp_6-31g(d).inp

000960136.b3lyp_6-31g(d).qchem.inp (generated)

000960136.b3lyp_6-31g(d).gjf (generated)

000960136.b3lyp_6-31g(d).firefly.inp (generated)

000960136.b3lyp_6-31g(d).smash.inp (generated)

000960136.b3lyp_6-31g(d).nwchem.inp (generated) 000960136.b3lyp_6-31g(d).log.xz 000960136.td-b3lyp_6-31g+(d).inp 000960136.td-b3lyp_6-31g+(d).log.xz

000960136.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960136.td-b3lyp_6-31+g(d).gjf (generated)

000960136.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960136.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960136.mol 000960136.PUBCHEM 000960136.mol (via Jmol)
000960137.b3lyp_6-31g(d).inp

000960137.b3lyp_6-31g(d).qchem.inp (generated)

000960137.b3lyp_6-31g(d).gjf (generated)

000960137.b3lyp_6-31g(d).firefly.inp (generated)

000960137.b3lyp_6-31g(d).smash.inp (generated)

000960137.b3lyp_6-31g(d).nwchem.inp (generated) 000960137.b3lyp_6-31g(d).log.xz 000960137.td-b3lyp_6-31g+(d).inp 000960137.td-b3lyp_6-31g+(d).log.xz

000960137.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960137.td-b3lyp_6-31+g(d).gjf (generated)

000960137.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960137.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960137.mol 000960137.PUBCHEM 000960137.mol (via Jmol)
000960138.b3lyp_6-31g(d).inp

000960138.b3lyp_6-31g(d).qchem.inp (generated)

000960138.b3lyp_6-31g(d).gjf (generated)

000960138.b3lyp_6-31g(d).firefly.inp (generated)

000960138.b3lyp_6-31g(d).smash.inp (generated)

000960138.b3lyp_6-31g(d).nwchem.inp (generated) 000960138.b3lyp_6-31g(d).log.xz 000960138.td-b3lyp_6-31g+(d).inp 000960138.td-b3lyp_6-31g+(d).log.xz

000960138.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960138.td-b3lyp_6-31+g(d).gjf (generated)

000960138.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960138.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960138.mol 000960138.PUBCHEM 000960138.mol (via Jmol)
000960139.b3lyp_6-31g(d).inp

000960139.b3lyp_6-31g(d).qchem.inp (generated)

000960139.b3lyp_6-31g(d).gjf (generated)

000960139.b3lyp_6-31g(d).firefly.inp (generated)

000960139.b3lyp_6-31g(d).smash.inp (generated)

000960139.b3lyp_6-31g(d).nwchem.inp (generated) 000960139.b3lyp_6-31g(d).log.xz 000960139.td-b3lyp_6-31g+(d).inp 000960139.td-b3lyp_6-31g+(d).log.xz

000960139.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960139.td-b3lyp_6-31+g(d).gjf (generated)

000960139.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960139.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960139.mol 000960139.PUBCHEM 000960139.mol (via Jmol)
000960140.b3lyp_6-31g(d).inp

000960140.b3lyp_6-31g(d).qchem.inp (generated)

000960140.b3lyp_6-31g(d).gjf (generated)

000960140.b3lyp_6-31g(d).firefly.inp (generated)

000960140.b3lyp_6-31g(d).smash.inp (generated)

000960140.b3lyp_6-31g(d).nwchem.inp (generated) 000960140.b3lyp_6-31g(d).log.xz 000960140.td-b3lyp_6-31g+(d).inp 000960140.td-b3lyp_6-31g+(d).log.xz

000960140.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960140.td-b3lyp_6-31+g(d).gjf (generated)

000960140.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960140.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960140.mol 000960140.PUBCHEM 000960140.mol (via Jmol)
000960141.b3lyp_6-31g(d).inp

000960141.b3lyp_6-31g(d).qchem.inp (generated)

000960141.b3lyp_6-31g(d).gjf (generated)

000960141.b3lyp_6-31g(d).firefly.inp (generated)

000960141.b3lyp_6-31g(d).smash.inp (generated)

000960141.b3lyp_6-31g(d).nwchem.inp (generated) 000960141.b3lyp_6-31g(d).log.xz 000960141.td-b3lyp_6-31g+(d).inp 000960141.td-b3lyp_6-31g+(d).log.xz

000960141.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960141.td-b3lyp_6-31+g(d).gjf (generated)

000960141.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960141.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960141.mol 000960141.PUBCHEM 000960141.mol (via Jmol)
000960142.b3lyp_6-31g(d).inp

000960142.b3lyp_6-31g(d).qchem.inp (generated)

000960142.b3lyp_6-31g(d).gjf (generated)

000960142.b3lyp_6-31g(d).firefly.inp (generated)

000960142.b3lyp_6-31g(d).smash.inp (generated)

000960142.b3lyp_6-31g(d).nwchem.inp (generated) 000960142.b3lyp_6-31g(d).log.xz 000960142.td-b3lyp_6-31g+(d).inp 000960142.td-b3lyp_6-31g+(d).log.xz

000960142.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960142.td-b3lyp_6-31+g(d).gjf (generated)

000960142.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960142.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960142.mol 000960142.PUBCHEM 000960142.mol (via Jmol)
000960144.b3lyp_6-31g(d).inp

000960144.b3lyp_6-31g(d).qchem.inp (generated)

000960144.b3lyp_6-31g(d).gjf (generated)

000960144.b3lyp_6-31g(d).firefly.inp (generated)

000960144.b3lyp_6-31g(d).smash.inp (generated)

000960144.b3lyp_6-31g(d).nwchem.inp (generated) 000960144.b3lyp_6-31g(d).log.xz 000960144.td-b3lyp_6-31g+(d).inp 000960144.td-b3lyp_6-31g+(d).log.xz

000960144.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960144.td-b3lyp_6-31+g(d).gjf (generated)

000960144.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960144.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960144.mol 000960144.PUBCHEM 000960144.mol (via Jmol)
000960145.b3lyp_6-31g(d).inp

000960145.b3lyp_6-31g(d).qchem.inp (generated)

000960145.b3lyp_6-31g(d).gjf (generated)

000960145.b3lyp_6-31g(d).firefly.inp (generated)

000960145.b3lyp_6-31g(d).smash.inp (generated)

000960145.b3lyp_6-31g(d).nwchem.inp (generated) 000960145.b3lyp_6-31g(d).log.xz 000960145.td-b3lyp_6-31g+(d).inp 000960145.td-b3lyp_6-31g+(d).log.xz

000960145.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960145.td-b3lyp_6-31+g(d).gjf (generated)

000960145.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960145.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960145.mol 000960145.PUBCHEM 000960145.mol (via Jmol)
000960150.b3lyp_6-31g(d).inp

000960150.b3lyp_6-31g(d).qchem.inp (generated)

000960150.b3lyp_6-31g(d).gjf (generated)

000960150.b3lyp_6-31g(d).firefly.inp (generated)

000960150.b3lyp_6-31g(d).smash.inp (generated)

000960150.b3lyp_6-31g(d).nwchem.inp (generated) 000960150.b3lyp_6-31g(d).log.xz 000960150.td-b3lyp_6-31g+(d).inp 000960150.td-b3lyp_6-31g+(d).log.xz

000960150.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960150.td-b3lyp_6-31+g(d).gjf (generated)

000960150.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960150.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960150.mol 000960150.PUBCHEM 000960150.mol (via Jmol)
000960170.b3lyp_6-31g(d).inp

000960170.b3lyp_6-31g(d).qchem.inp (generated)

000960170.b3lyp_6-31g(d).gjf (generated)

000960170.b3lyp_6-31g(d).firefly.inp (generated)

000960170.b3lyp_6-31g(d).smash.inp (generated)

000960170.b3lyp_6-31g(d).nwchem.inp (generated) 000960170.b3lyp_6-31g(d).log.xz 000960170.td-b3lyp_6-31g+(d).inp 000960170.td-b3lyp_6-31g+(d).log.xz

000960170.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960170.td-b3lyp_6-31+g(d).gjf (generated)

000960170.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960170.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960170.mol 000960170.PUBCHEM 000960170.mol (via Jmol)
000960187.b3lyp_6-31g(d).inp

000960187.b3lyp_6-31g(d).qchem.inp (generated)

000960187.b3lyp_6-31g(d).gjf (generated)

000960187.b3lyp_6-31g(d).firefly.inp (generated)

000960187.b3lyp_6-31g(d).smash.inp (generated)

000960187.b3lyp_6-31g(d).nwchem.inp (generated) 000960187.b3lyp_6-31g(d).log.xz 000960187.td-b3lyp_6-31g+(d).inp 000960187.td-b3lyp_6-31g+(d).log.xz

000960187.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960187.td-b3lyp_6-31+g(d).gjf (generated)

000960187.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960187.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960187.mol 000960187.PUBCHEM 000960187.mol (via Jmol)
000960194.b3lyp_6-31g(d).inp

000960194.b3lyp_6-31g(d).qchem.inp (generated)

000960194.b3lyp_6-31g(d).gjf (generated)

000960194.b3lyp_6-31g(d).firefly.inp (generated)

000960194.b3lyp_6-31g(d).smash.inp (generated)

000960194.b3lyp_6-31g(d).nwchem.inp (generated) 000960194.b3lyp_6-31g(d).log.xz 000960194.td-b3lyp_6-31g+(d).inp 000960194.td-b3lyp_6-31g+(d).log.xz

000960194.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960194.td-b3lyp_6-31+g(d).gjf (generated)

000960194.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960194.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960194.mol 000960194.PUBCHEM 000960194.mol (via Jmol)
000960195.b3lyp_6-31g(d).inp

000960195.b3lyp_6-31g(d).qchem.inp (generated)

000960195.b3lyp_6-31g(d).gjf (generated)

000960195.b3lyp_6-31g(d).firefly.inp (generated)

000960195.b3lyp_6-31g(d).smash.inp (generated)

000960195.b3lyp_6-31g(d).nwchem.inp (generated) 000960195.b3lyp_6-31g(d).log.xz 000960195.td-b3lyp_6-31g+(d).inp 000960195.td-b3lyp_6-31g+(d).log.xz

000960195.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960195.td-b3lyp_6-31+g(d).gjf (generated)

000960195.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960195.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960195.mol 000960195.PUBCHEM 000960195.mol (via Jmol)
000960197.b3lyp_6-31g(d).inp

000960197.b3lyp_6-31g(d).qchem.inp (generated)

000960197.b3lyp_6-31g(d).gjf (generated)

000960197.b3lyp_6-31g(d).firefly.inp (generated)

000960197.b3lyp_6-31g(d).smash.inp (generated)

000960197.b3lyp_6-31g(d).nwchem.inp (generated) 000960197.b3lyp_6-31g(d).log.xz 000960197.mol 000960197.PUBCHEM 000960197.mol (via Jmol)
000960204.b3lyp_6-31g(d).inp

000960204.b3lyp_6-31g(d).qchem.inp (generated)

000960204.b3lyp_6-31g(d).gjf (generated)

000960204.b3lyp_6-31g(d).firefly.inp (generated)

000960204.b3lyp_6-31g(d).smash.inp (generated)

000960204.b3lyp_6-31g(d).nwchem.inp (generated) 000960204.b3lyp_6-31g(d).log.xz 000960204.td-b3lyp_6-31g+(d).inp 000960204.td-b3lyp_6-31g+(d).log.xz

000960204.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960204.td-b3lyp_6-31+g(d).gjf (generated)

000960204.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960204.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960204.mol 000960204.PUBCHEM 000960204.mol (via Jmol)
000960230.b3lyp_6-31g(d).inp

000960230.b3lyp_6-31g(d).qchem.inp (generated)

000960230.b3lyp_6-31g(d).gjf (generated)

000960230.b3lyp_6-31g(d).firefly.inp (generated)

000960230.b3lyp_6-31g(d).smash.inp (generated)

000960230.b3lyp_6-31g(d).nwchem.inp (generated) 000960230.b3lyp_6-31g(d).log.xz 000960230.td-b3lyp_6-31g+(d).inp 000960230.td-b3lyp_6-31g+(d).log.xz

000960230.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960230.td-b3lyp_6-31+g(d).gjf (generated)

000960230.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960230.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960230.mol 000960230.PUBCHEM 000960230.mol (via Jmol)
000960231.b3lyp_6-31g(d).inp

000960231.b3lyp_6-31g(d).qchem.inp (generated)

000960231.b3lyp_6-31g(d).gjf (generated)

000960231.b3lyp_6-31g(d).firefly.inp (generated)

000960231.b3lyp_6-31g(d).smash.inp (generated)

000960231.b3lyp_6-31g(d).nwchem.inp (generated) 000960231.b3lyp_6-31g(d).log.xz 000960231.td-b3lyp_6-31g+(d).inp 000960231.td-b3lyp_6-31g+(d).log.xz

000960231.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960231.td-b3lyp_6-31+g(d).gjf (generated)

000960231.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960231.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960231.mol 000960231.PUBCHEM 000960231.mol (via Jmol)
000960232.b3lyp_6-31g(d).inp

000960232.b3lyp_6-31g(d).qchem.inp (generated)

000960232.b3lyp_6-31g(d).gjf (generated)

000960232.b3lyp_6-31g(d).firefly.inp (generated)

000960232.b3lyp_6-31g(d).smash.inp (generated)

000960232.b3lyp_6-31g(d).nwchem.inp (generated) 000960232.b3lyp_6-31g(d).log.xz 000960232.td-b3lyp_6-31g+(d).inp 000960232.td-b3lyp_6-31g+(d).log.xz

000960232.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960232.td-b3lyp_6-31+g(d).gjf (generated)

000960232.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960232.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960232.mol 000960232.PUBCHEM 000960232.mol (via Jmol)
000960293.b3lyp_6-31g(d).inp

000960293.b3lyp_6-31g(d).qchem.inp (generated)

000960293.b3lyp_6-31g(d).gjf (generated)

000960293.b3lyp_6-31g(d).firefly.inp (generated)

000960293.b3lyp_6-31g(d).smash.inp (generated)

000960293.b3lyp_6-31g(d).nwchem.inp (generated) 000960293.b3lyp_6-31g(d).log.xz 000960293.mol 000960293.PUBCHEM 000960293.mol (via Jmol)
000960497.b3lyp_6-31g(d).inp

000960497.b3lyp_6-31g(d).qchem.inp (generated)

000960497.b3lyp_6-31g(d).gjf (generated)

000960497.b3lyp_6-31g(d).firefly.inp (generated)

000960497.b3lyp_6-31g(d).smash.inp (generated)

000960497.b3lyp_6-31g(d).nwchem.inp (generated) 000960497.b3lyp_6-31g(d).log.xz 000960497.td-b3lyp_6-31g+(d).inp 000960497.td-b3lyp_6-31g+(d).log.xz

000960497.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960497.td-b3lyp_6-31+g(d).gjf (generated)

000960497.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960497.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960497.mol 000960497.PUBCHEM 000960497.mol (via Jmol)
000960512.b3lyp_6-31g(d).inp

000960512.b3lyp_6-31g(d).qchem.inp (generated)

000960512.b3lyp_6-31g(d).gjf (generated)

000960512.b3lyp_6-31g(d).firefly.inp (generated)

000960512.b3lyp_6-31g(d).smash.inp (generated)

000960512.b3lyp_6-31g(d).nwchem.inp (generated) 000960512.b3lyp_6-31g(d).log.xz 000960512.td-b3lyp_6-31g+(d).inp 000960512.td-b3lyp_6-31g+(d).log.xz

000960512.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960512.td-b3lyp_6-31+g(d).gjf (generated)

000960512.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960512.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960512.mol 000960512.PUBCHEM 000960512.mol (via Jmol)
000960514.b3lyp_6-31g(d).inp

000960514.b3lyp_6-31g(d).qchem.inp (generated)

000960514.b3lyp_6-31g(d).gjf (generated)

000960514.b3lyp_6-31g(d).firefly.inp (generated)

000960514.b3lyp_6-31g(d).smash.inp (generated)

000960514.b3lyp_6-31g(d).nwchem.inp (generated) 000960514.b3lyp_6-31g(d).log.xz 000960514.td-b3lyp_6-31g+(d).inp 000960514.td-b3lyp_6-31g+(d).log.xz

000960514.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960514.td-b3lyp_6-31+g(d).gjf (generated)

000960514.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960514.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960514.mol 000960514.PUBCHEM 000960514.mol (via Jmol)
000960527.b3lyp_6-31g(d).inp

000960527.b3lyp_6-31g(d).qchem.inp (generated)

000960527.b3lyp_6-31g(d).gjf (generated)

000960527.b3lyp_6-31g(d).firefly.inp (generated)

000960527.b3lyp_6-31g(d).smash.inp (generated)

000960527.b3lyp_6-31g(d).nwchem.inp (generated) 000960527.b3lyp_6-31g(d).log.xz 000960527.td-b3lyp_6-31g+(d).inp 000960527.td-b3lyp_6-31g+(d).log.xz

000960527.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960527.td-b3lyp_6-31+g(d).gjf (generated)

000960527.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960527.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960527.mol 000960527.PUBCHEM 000960527.mol (via Jmol)
000960530.b3lyp_6-31g(d).inp

000960530.b3lyp_6-31g(d).qchem.inp (generated)

000960530.b3lyp_6-31g(d).gjf (generated)

000960530.b3lyp_6-31g(d).firefly.inp (generated)

000960530.b3lyp_6-31g(d).smash.inp (generated)

000960530.b3lyp_6-31g(d).nwchem.inp (generated) 000960530.b3lyp_6-31g(d).log.xz 000960530.mol 000960530.PUBCHEM 000960530.mol (via Jmol)
000960540.b3lyp_6-31g(d).inp

000960540.b3lyp_6-31g(d).qchem.inp (generated)

000960540.b3lyp_6-31g(d).gjf (generated)

000960540.b3lyp_6-31g(d).firefly.inp (generated)

000960540.b3lyp_6-31g(d).smash.inp (generated)

000960540.b3lyp_6-31g(d).nwchem.inp (generated) 000960540.b3lyp_6-31g(d).log.xz 000960540.td-b3lyp_6-31g+(d).inp 000960540.td-b3lyp_6-31g+(d).log.xz

000960540.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960540.td-b3lyp_6-31+g(d).gjf (generated)

000960540.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960540.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960540.mol 000960540.PUBCHEM 000960540.mol (via Jmol)
000960559.b3lyp_6-31g(d).inp

000960559.b3lyp_6-31g(d).qchem.inp (generated)

000960559.b3lyp_6-31g(d).gjf (generated)

000960559.b3lyp_6-31g(d).firefly.inp (generated)

000960559.b3lyp_6-31g(d).smash.inp (generated)

000960559.b3lyp_6-31g(d).nwchem.inp (generated) 000960559.b3lyp_6-31g(d).log.xz 000960559.td-b3lyp_6-31g+(d).inp 000960559.td-b3lyp_6-31g+(d).log.xz

000960559.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960559.td-b3lyp_6-31+g(d).gjf (generated)

000960559.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960559.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960559.mol 000960559.PUBCHEM 000960559.mol (via Jmol)
000960593.b3lyp_6-31g(d).inp

000960593.b3lyp_6-31g(d).qchem.inp (generated)

000960593.b3lyp_6-31g(d).gjf (generated)

000960593.b3lyp_6-31g(d).firefly.inp (generated)

000960593.b3lyp_6-31g(d).smash.inp (generated)

000960593.b3lyp_6-31g(d).nwchem.inp (generated) 000960593.b3lyp_6-31g(d).log.xz 000960593.td-b3lyp_6-31g+(d).inp 000960593.td-b3lyp_6-31g+(d).log.xz

000960593.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960593.td-b3lyp_6-31+g(d).gjf (generated)

000960593.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960593.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960593.mol 000960593.PUBCHEM 000960593.mol (via Jmol)
000960594.b3lyp_6-31g(d).inp

000960594.b3lyp_6-31g(d).qchem.inp (generated)

000960594.b3lyp_6-31g(d).gjf (generated)

000960594.b3lyp_6-31g(d).firefly.inp (generated)

000960594.b3lyp_6-31g(d).smash.inp (generated)

000960594.b3lyp_6-31g(d).nwchem.inp (generated) 000960594.b3lyp_6-31g(d).log.xz 000960594.td-b3lyp_6-31g+(d).inp 000960594.td-b3lyp_6-31g+(d).log.xz

000960594.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960594.td-b3lyp_6-31+g(d).gjf (generated)

000960594.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960594.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960594.mol 000960594.PUBCHEM 000960594.mol (via Jmol)
000960595.b3lyp_6-31g(d).inp

000960595.b3lyp_6-31g(d).qchem.inp (generated)

000960595.b3lyp_6-31g(d).gjf (generated)

000960595.b3lyp_6-31g(d).firefly.inp (generated)

000960595.b3lyp_6-31g(d).smash.inp (generated)

000960595.b3lyp_6-31g(d).nwchem.inp (generated) 000960595.b3lyp_6-31g(d).log.xz 000960595.td-b3lyp_6-31g+(d).inp 000960595.td-b3lyp_6-31g+(d).log.xz

000960595.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960595.td-b3lyp_6-31+g(d).gjf (generated)

000960595.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960595.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960595.mol 000960595.PUBCHEM 000960595.mol (via Jmol)
000960596.b3lyp_6-31g(d).inp

000960596.b3lyp_6-31g(d).qchem.inp (generated)

000960596.b3lyp_6-31g(d).gjf (generated)

000960596.b3lyp_6-31g(d).firefly.inp (generated)

000960596.b3lyp_6-31g(d).smash.inp (generated)

000960596.b3lyp_6-31g(d).nwchem.inp (generated) 000960596.b3lyp_6-31g(d).log.xz 000960596.td-b3lyp_6-31g+(d).inp 000960596.td-b3lyp_6-31g+(d).log.xz

000960596.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960596.td-b3lyp_6-31+g(d).gjf (generated)

000960596.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960596.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960596.mol 000960596.PUBCHEM 000960596.mol (via Jmol)
000960597.b3lyp_6-31g(d).inp

000960597.b3lyp_6-31g(d).qchem.inp (generated)

000960597.b3lyp_6-31g(d).gjf (generated)

000960597.b3lyp_6-31g(d).firefly.inp (generated)

000960597.b3lyp_6-31g(d).smash.inp (generated)

000960597.b3lyp_6-31g(d).nwchem.inp (generated) 000960597.b3lyp_6-31g(d).log.xz 000960597.td-b3lyp_6-31g+(d).inp 000960597.td-b3lyp_6-31g+(d).log.xz

000960597.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960597.td-b3lyp_6-31+g(d).gjf (generated)

000960597.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960597.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960597.mol 000960597.PUBCHEM 000960597.mol (via Jmol)
000960605.b3lyp_6-31g(d).inp

000960605.b3lyp_6-31g(d).qchem.inp (generated)

000960605.b3lyp_6-31g(d).gjf (generated)

000960605.b3lyp_6-31g(d).firefly.inp (generated)

000960605.b3lyp_6-31g(d).smash.inp (generated)

000960605.b3lyp_6-31g(d).nwchem.inp (generated) 000960605.b3lyp_6-31g(d).log.xz 000960605.td-b3lyp_6-31g+(d).inp 000960605.td-b3lyp_6-31g+(d).log.xz

000960605.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960605.td-b3lyp_6-31+g(d).gjf (generated)

000960605.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960605.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960605.mol 000960605.PUBCHEM 000960605.mol (via Jmol)
000960606.b3lyp_6-31g(d).inp

000960606.b3lyp_6-31g(d).qchem.inp (generated)

000960606.b3lyp_6-31g(d).gjf (generated)

000960606.b3lyp_6-31g(d).firefly.inp (generated)

000960606.b3lyp_6-31g(d).smash.inp (generated)

000960606.b3lyp_6-31g(d).nwchem.inp (generated) 000960606.b3lyp_6-31g(d).log.xz 000960606.td-b3lyp_6-31g+(d).inp 000960606.td-b3lyp_6-31g+(d).log.xz

000960606.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960606.td-b3lyp_6-31+g(d).gjf (generated)

000960606.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960606.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960606.mol 000960606.PUBCHEM 000960606.mol (via Jmol)
000960626.b3lyp_6-31g(d).inp

000960626.b3lyp_6-31g(d).qchem.inp (generated)

000960626.b3lyp_6-31g(d).gjf (generated)

000960626.b3lyp_6-31g(d).firefly.inp (generated)

000960626.b3lyp_6-31g(d).smash.inp (generated)

000960626.b3lyp_6-31g(d).nwchem.inp (generated) 000960626.b3lyp_6-31g(d).log.xz 000960626.mol 000960626.PUBCHEM 000960626.mol (via Jmol)
000960627.b3lyp_6-31g(d).inp

000960627.b3lyp_6-31g(d).qchem.inp (generated)

000960627.b3lyp_6-31g(d).gjf (generated)

000960627.b3lyp_6-31g(d).firefly.inp (generated)

000960627.b3lyp_6-31g(d).smash.inp (generated)

000960627.b3lyp_6-31g(d).nwchem.inp (generated) 000960627.b3lyp_6-31g(d).log.xz 000960627.td-b3lyp_6-31g+(d).inp 000960627.td-b3lyp_6-31g+(d).log.xz

000960627.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960627.td-b3lyp_6-31+g(d).gjf (generated)

000960627.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960627.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960627.mol 000960627.PUBCHEM 000960627.mol (via Jmol)
000960629.b3lyp_6-31g(d).inp

000960629.b3lyp_6-31g(d).qchem.inp (generated)

000960629.b3lyp_6-31g(d).gjf (generated)

000960629.b3lyp_6-31g(d).firefly.inp (generated)

000960629.b3lyp_6-31g(d).smash.inp (generated)

000960629.b3lyp_6-31g(d).nwchem.inp (generated) 000960629.b3lyp_6-31g(d).log.xz 000960629.td-b3lyp_6-31g+(d).inp 000960629.td-b3lyp_6-31g+(d).log.xz

000960629.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960629.td-b3lyp_6-31+g(d).gjf (generated)

000960629.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960629.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960629.mol 000960629.PUBCHEM 000960629.mol (via Jmol)
000960630.b3lyp_6-31g(d).inp

000960630.b3lyp_6-31g(d).qchem.inp (generated)

000960630.b3lyp_6-31g(d).gjf (generated)

000960630.b3lyp_6-31g(d).firefly.inp (generated)

000960630.b3lyp_6-31g(d).smash.inp (generated)

000960630.b3lyp_6-31g(d).nwchem.inp (generated) 000960630.b3lyp_6-31g(d).log.xz 000960630.td-b3lyp_6-31g+(d).inp 000960630.td-b3lyp_6-31g+(d).log.xz

000960630.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960630.td-b3lyp_6-31+g(d).gjf (generated)

000960630.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960630.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960630.mol 000960630.PUBCHEM 000960630.mol (via Jmol)
000960631.b3lyp_6-31g(d).inp

000960631.b3lyp_6-31g(d).qchem.inp (generated)

000960631.b3lyp_6-31g(d).gjf (generated)

000960631.b3lyp_6-31g(d).firefly.inp (generated)

000960631.b3lyp_6-31g(d).smash.inp (generated)

000960631.b3lyp_6-31g(d).nwchem.inp (generated) 000960631.b3lyp_6-31g(d).log.xz 000960631.mol 000960631.PUBCHEM 000960631.mol (via Jmol)
000960640.b3lyp_6-31g(d).inp

000960640.b3lyp_6-31g(d).qchem.inp (generated)

000960640.b3lyp_6-31g(d).gjf (generated)

000960640.b3lyp_6-31g(d).firefly.inp (generated)

000960640.b3lyp_6-31g(d).smash.inp (generated)

000960640.b3lyp_6-31g(d).nwchem.inp (generated) 000960640.b3lyp_6-31g(d).log.xz 000960640.td-b3lyp_6-31g+(d).inp 000960640.td-b3lyp_6-31g+(d).log.xz

000960640.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960640.td-b3lyp_6-31+g(d).gjf (generated)

000960640.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960640.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960640.mol 000960640.PUBCHEM 000960640.mol (via Jmol)
000960642.b3lyp_6-31g(d).inp

000960642.b3lyp_6-31g(d).qchem.inp (generated)

000960642.b3lyp_6-31g(d).gjf (generated)

000960642.b3lyp_6-31g(d).firefly.inp (generated)

000960642.b3lyp_6-31g(d).smash.inp (generated)

000960642.b3lyp_6-31g(d).nwchem.inp (generated) 000960642.b3lyp_6-31g(d).log.xz 000960642.td-b3lyp_6-31g+(d).inp 000960642.td-b3lyp_6-31g+(d).log.xz

000960642.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960642.td-b3lyp_6-31+g(d).gjf (generated)

000960642.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960642.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960642.mol 000960642.PUBCHEM 000960642.mol (via Jmol)
000960643.b3lyp_6-31g(d).inp

000960643.b3lyp_6-31g(d).qchem.inp (generated)

000960643.b3lyp_6-31g(d).gjf (generated)

000960643.b3lyp_6-31g(d).firefly.inp (generated)

000960643.b3lyp_6-31g(d).smash.inp (generated)

000960643.b3lyp_6-31g(d).nwchem.inp (generated) 000960643.b3lyp_6-31g(d).log.xz 000960643.td-b3lyp_6-31g+(d).inp 000960643.td-b3lyp_6-31g+(d).log.xz

000960643.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960643.td-b3lyp_6-31+g(d).gjf (generated)

000960643.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960643.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960643.mol 000960643.PUBCHEM 000960643.mol (via Jmol)
000960644.b3lyp_6-31g(d).inp

000960644.b3lyp_6-31g(d).qchem.inp (generated)

000960644.b3lyp_6-31g(d).gjf (generated)

000960644.b3lyp_6-31g(d).firefly.inp (generated)

000960644.b3lyp_6-31g(d).smash.inp (generated)

000960644.b3lyp_6-31g(d).nwchem.inp (generated) 000960644.b3lyp_6-31g(d).log.xz 000960644.td-b3lyp_6-31g+(d).inp 000960644.td-b3lyp_6-31g+(d).log.xz

000960644.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960644.td-b3lyp_6-31+g(d).gjf (generated)

000960644.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960644.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960644.mol 000960644.PUBCHEM 000960644.mol (via Jmol)
000960645.b3lyp_6-31g(d).inp

000960645.b3lyp_6-31g(d).qchem.inp (generated)

000960645.b3lyp_6-31g(d).gjf (generated)

000960645.b3lyp_6-31g(d).firefly.inp (generated)

000960645.b3lyp_6-31g(d).smash.inp (generated)

000960645.b3lyp_6-31g(d).nwchem.inp (generated) 000960645.b3lyp_6-31g(d).log.xz 000960645.td-b3lyp_6-31g+(d).inp 000960645.td-b3lyp_6-31g+(d).log.xz

000960645.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960645.td-b3lyp_6-31+g(d).gjf (generated)

000960645.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960645.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960645.mol 000960645.PUBCHEM 000960645.mol (via Jmol)
000960646.b3lyp_6-31g(d).inp

000960646.b3lyp_6-31g(d).qchem.inp (generated)

000960646.b3lyp_6-31g(d).gjf (generated)

000960646.b3lyp_6-31g(d).firefly.inp (generated)

000960646.b3lyp_6-31g(d).smash.inp (generated)

000960646.b3lyp_6-31g(d).nwchem.inp (generated) 000960646.b3lyp_6-31g(d).log.xz 000960646.td-b3lyp_6-31g+(d).inp 000960646.td-b3lyp_6-31g+(d).log.xz

000960646.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960646.td-b3lyp_6-31+g(d).gjf (generated)

000960646.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960646.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960646.mol 000960646.PUBCHEM 000960646.mol (via Jmol)
000960657.b3lyp_6-31g(d).inp

000960657.b3lyp_6-31g(d).qchem.inp (generated)

000960657.b3lyp_6-31g(d).gjf (generated)

000960657.b3lyp_6-31g(d).firefly.inp (generated)

000960657.b3lyp_6-31g(d).smash.inp (generated)

000960657.b3lyp_6-31g(d).nwchem.inp (generated) 000960657.b3lyp_6-31g(d).log.xz 000960657.mol 000960657.PUBCHEM 000960657.mol (via Jmol)
000960658.b3lyp_6-31g(d).inp

000960658.b3lyp_6-31g(d).qchem.inp (generated)

000960658.b3lyp_6-31g(d).gjf (generated)

000960658.b3lyp_6-31g(d).firefly.inp (generated)

000960658.b3lyp_6-31g(d).smash.inp (generated)

000960658.b3lyp_6-31g(d).nwchem.inp (generated) 000960658.b3lyp_6-31g(d).log.xz 000960658.td-b3lyp_6-31g+(d).inp 000960658.td-b3lyp_6-31g+(d).log.xz

000960658.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960658.td-b3lyp_6-31+g(d).gjf (generated)

000960658.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960658.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960658.mol 000960658.PUBCHEM 000960658.mol (via Jmol)
000960665.b3lyp_6-31g(d).inp

000960665.b3lyp_6-31g(d).qchem.inp (generated)

000960665.b3lyp_6-31g(d).gjf (generated)

000960665.b3lyp_6-31g(d).firefly.inp (generated)

000960665.b3lyp_6-31g(d).smash.inp (generated)

000960665.b3lyp_6-31g(d).nwchem.inp (generated) 000960665.b3lyp_6-31g(d).log.xz 000960665.td-b3lyp_6-31g+(d).inp 000960665.td-b3lyp_6-31g+(d).log.xz

000960665.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960665.td-b3lyp_6-31+g(d).gjf (generated)

000960665.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960665.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960665.mol 000960665.PUBCHEM 000960665.mol (via Jmol)
000960719.b3lyp_6-31g(d).inp

000960719.b3lyp_6-31g(d).qchem.inp (generated)

000960719.b3lyp_6-31g(d).gjf (generated)

000960719.b3lyp_6-31g(d).firefly.inp (generated)

000960719.b3lyp_6-31g(d).smash.inp (generated)

000960719.b3lyp_6-31g(d).nwchem.inp (generated) 000960719.b3lyp_6-31g(d).log.xz 000960719.td-b3lyp_6-31g+(d).inp 000960719.td-b3lyp_6-31g+(d).log.xz

000960719.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960719.td-b3lyp_6-31+g(d).gjf (generated)

000960719.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960719.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960719.mol 000960719.PUBCHEM 000960719.mol (via Jmol)
000960730.b3lyp_6-31g(d).inp

000960730.b3lyp_6-31g(d).qchem.inp (generated)

000960730.b3lyp_6-31g(d).gjf (generated)

000960730.b3lyp_6-31g(d).firefly.inp (generated)

000960730.b3lyp_6-31g(d).smash.inp (generated)

000960730.b3lyp_6-31g(d).nwchem.inp (generated) 000960730.b3lyp_6-31g(d).log.xz 000960730.mol 000960730.PUBCHEM 000960730.mol (via Jmol)
000960734.b3lyp_6-31g(d).inp

000960734.b3lyp_6-31g(d).qchem.inp (generated)

000960734.b3lyp_6-31g(d).gjf (generated)

000960734.b3lyp_6-31g(d).firefly.inp (generated)

000960734.b3lyp_6-31g(d).smash.inp (generated)

000960734.b3lyp_6-31g(d).nwchem.inp (generated) 000960734.b3lyp_6-31g(d).log.xz 000960734.td-b3lyp_6-31g+(d).inp 000960734.td-b3lyp_6-31g+(d).log.xz

000960734.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960734.td-b3lyp_6-31+g(d).gjf (generated)

000960734.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960734.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960734.mol 000960734.PUBCHEM 000960734.mol (via Jmol)
000960757.b3lyp_6-31g(d).inp

000960757.b3lyp_6-31g(d).qchem.inp (generated)

000960757.b3lyp_6-31g(d).gjf (generated)

000960757.b3lyp_6-31g(d).firefly.inp (generated)

000960757.b3lyp_6-31g(d).smash.inp (generated)

000960757.b3lyp_6-31g(d).nwchem.inp (generated) 000960757.b3lyp_6-31g(d).log.xz 000960757.td-b3lyp_6-31g+(d).inp 000960757.td-b3lyp_6-31g+(d).log.xz

000960757.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960757.td-b3lyp_6-31+g(d).gjf (generated)

000960757.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960757.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960757.mol 000960757.PUBCHEM 000960757.mol (via Jmol)
000960760.b3lyp_6-31g(d).inp

000960760.b3lyp_6-31g(d).qchem.inp (generated)

000960760.b3lyp_6-31g(d).gjf (generated)

000960760.b3lyp_6-31g(d).firefly.inp (generated)

000960760.b3lyp_6-31g(d).smash.inp (generated)

000960760.b3lyp_6-31g(d).nwchem.inp (generated) 000960760.b3lyp_6-31g(d).log.xz 000960760.td-b3lyp_6-31g+(d).inp 000960760.td-b3lyp_6-31g+(d).log.xz

000960760.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960760.td-b3lyp_6-31+g(d).gjf (generated)

000960760.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960760.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960760.mol 000960760.PUBCHEM 000960760.mol (via Jmol)
000960761.b3lyp_6-31g(d).inp

000960761.b3lyp_6-31g(d).qchem.inp (generated)

000960761.b3lyp_6-31g(d).gjf (generated)

000960761.b3lyp_6-31g(d).firefly.inp (generated)

000960761.b3lyp_6-31g(d).smash.inp (generated)

000960761.b3lyp_6-31g(d).nwchem.inp (generated) 000960761.b3lyp_6-31g(d).log.xz 000960761.td-b3lyp_6-31g+(d).inp 000960761.td-b3lyp_6-31g+(d).log.xz

000960761.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960761.td-b3lyp_6-31+g(d).gjf (generated)

000960761.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960761.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960761.mol 000960761.PUBCHEM 000960761.mol (via Jmol)
000960772.b3lyp_6-31g(d).inp

000960772.b3lyp_6-31g(d).qchem.inp (generated)

000960772.b3lyp_6-31g(d).gjf (generated)

000960772.b3lyp_6-31g(d).firefly.inp (generated)

000960772.b3lyp_6-31g(d).smash.inp (generated)

000960772.b3lyp_6-31g(d).nwchem.inp (generated) 000960772.b3lyp_6-31g(d).log.xz 000960772.mol 000960772.PUBCHEM 000960772.mol (via Jmol)
000960786.b3lyp_6-31g(d).inp

000960786.b3lyp_6-31g(d).qchem.inp (generated)

000960786.b3lyp_6-31g(d).gjf (generated)

000960786.b3lyp_6-31g(d).firefly.inp (generated)

000960786.b3lyp_6-31g(d).smash.inp (generated)

000960786.b3lyp_6-31g(d).nwchem.inp (generated) 000960786.b3lyp_6-31g(d).log.xz 000960786.td-b3lyp_6-31g+(d).inp 000960786.td-b3lyp_6-31g+(d).log.xz

000960786.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960786.td-b3lyp_6-31+g(d).gjf (generated)

000960786.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960786.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960786.mol 000960786.PUBCHEM 000960786.mol (via Jmol)
000960811.b3lyp_6-31g(d).inp

000960811.b3lyp_6-31g(d).qchem.inp (generated)

000960811.b3lyp_6-31g(d).gjf (generated)

000960811.b3lyp_6-31g(d).firefly.inp (generated)

000960811.b3lyp_6-31g(d).smash.inp (generated)

000960811.b3lyp_6-31g(d).nwchem.inp (generated) 000960811.b3lyp_6-31g(d).log.xz 000960811.td-b3lyp_6-31g+(d).inp 000960811.td-b3lyp_6-31g+(d).log.xz

000960811.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960811.td-b3lyp_6-31+g(d).gjf (generated)

000960811.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960811.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960811.mol 000960811.PUBCHEM 000960811.mol (via Jmol)
000960812.b3lyp_6-31g(d).inp

000960812.b3lyp_6-31g(d).qchem.inp (generated)

000960812.b3lyp_6-31g(d).gjf (generated)

000960812.b3lyp_6-31g(d).firefly.inp (generated)

000960812.b3lyp_6-31g(d).smash.inp (generated)

000960812.b3lyp_6-31g(d).nwchem.inp (generated) 000960812.b3lyp_6-31g(d).log.xz 000960812.td-b3lyp_6-31g+(d).inp 000960812.td-b3lyp_6-31g+(d).log.xz

000960812.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960812.td-b3lyp_6-31+g(d).gjf (generated)

000960812.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960812.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960812.mol 000960812.PUBCHEM 000960812.mol (via Jmol)
000960816.b3lyp_6-31g(d).inp

000960816.b3lyp_6-31g(d).qchem.inp (generated)

000960816.b3lyp_6-31g(d).gjf (generated)

000960816.b3lyp_6-31g(d).firefly.inp (generated)

000960816.b3lyp_6-31g(d).smash.inp (generated)

000960816.b3lyp_6-31g(d).nwchem.inp (generated) 000960816.b3lyp_6-31g(d).log.xz 000960816.td-b3lyp_6-31g+(d).inp 000960816.td-b3lyp_6-31g+(d).log.xz

000960816.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960816.td-b3lyp_6-31+g(d).gjf (generated)

000960816.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960816.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960816.mol 000960816.PUBCHEM 000960816.mol (via Jmol)
000960826.b3lyp_6-31g(d).inp

000960826.b3lyp_6-31g(d).qchem.inp (generated)

000960826.b3lyp_6-31g(d).gjf (generated)

000960826.b3lyp_6-31g(d).firefly.inp (generated)

000960826.b3lyp_6-31g(d).smash.inp (generated)

000960826.b3lyp_6-31g(d).nwchem.inp (generated) 000960826.b3lyp_6-31g(d).log.xz 000960826.td-b3lyp_6-31g+(d).inp 000960826.td-b3lyp_6-31g+(d).log.xz

000960826.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960826.td-b3lyp_6-31+g(d).gjf (generated)

000960826.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960826.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960826.mol 000960826.PUBCHEM 000960826.mol (via Jmol)
000960827.b3lyp_6-31g(d).inp

000960827.b3lyp_6-31g(d).qchem.inp (generated)

000960827.b3lyp_6-31g(d).gjf (generated)

000960827.b3lyp_6-31g(d).firefly.inp (generated)

000960827.b3lyp_6-31g(d).smash.inp (generated)

000960827.b3lyp_6-31g(d).nwchem.inp (generated) 000960827.b3lyp_6-31g(d).log.xz 000960827.td-b3lyp_6-31g+(d).inp 000960827.td-b3lyp_6-31g+(d).log.xz

000960827.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960827.td-b3lyp_6-31+g(d).gjf (generated)

000960827.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960827.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960827.mol 000960827.PUBCHEM 000960827.mol (via Jmol)
000960848.b3lyp_6-31g(d).inp

000960848.b3lyp_6-31g(d).qchem.inp (generated)

000960848.b3lyp_6-31g(d).gjf (generated)

000960848.b3lyp_6-31g(d).firefly.inp (generated)

000960848.b3lyp_6-31g(d).smash.inp (generated)

000960848.b3lyp_6-31g(d).nwchem.inp (generated) 000960848.b3lyp_6-31g(d).log.xz 000960848.td-b3lyp_6-31g+(d).inp 000960848.td-b3lyp_6-31g+(d).log.xz

000960848.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960848.td-b3lyp_6-31+g(d).gjf (generated)

000960848.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960848.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960848.mol 000960848.PUBCHEM 000960848.mol (via Jmol)
000960849.b3lyp_6-31g(d).inp

000960849.b3lyp_6-31g(d).qchem.inp (generated)

000960849.b3lyp_6-31g(d).gjf (generated)

000960849.b3lyp_6-31g(d).firefly.inp (generated)

000960849.b3lyp_6-31g(d).smash.inp (generated)

000960849.b3lyp_6-31g(d).nwchem.inp (generated) 000960849.b3lyp_6-31g(d).log.xz 000960849.td-b3lyp_6-31g+(d).inp 000960849.td-b3lyp_6-31g+(d).log.xz

000960849.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960849.td-b3lyp_6-31+g(d).gjf (generated)

000960849.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960849.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960849.mol 000960849.PUBCHEM 000960849.mol (via Jmol)
000960942.b3lyp_6-31g(d).inp

000960942.b3lyp_6-31g(d).qchem.inp (generated)

000960942.b3lyp_6-31g(d).gjf (generated)

000960942.b3lyp_6-31g(d).firefly.inp (generated)

000960942.b3lyp_6-31g(d).smash.inp (generated)

000960942.b3lyp_6-31g(d).nwchem.inp (generated) 000960942.b3lyp_6-31g(d).log.xz 000960942.td-b3lyp_6-31g+(d).inp 000960942.td-b3lyp_6-31g+(d).log.xz

000960942.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960942.td-b3lyp_6-31+g(d).gjf (generated)

000960942.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960942.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960942.mol 000960942.PUBCHEM 000960942.mol (via Jmol)
000960959.b3lyp_6-31g(d).inp

000960959.b3lyp_6-31g(d).qchem.inp (generated)

000960959.b3lyp_6-31g(d).gjf (generated)

000960959.b3lyp_6-31g(d).firefly.inp (generated)

000960959.b3lyp_6-31g(d).smash.inp (generated)

000960959.b3lyp_6-31g(d).nwchem.inp (generated) 000960959.b3lyp_6-31g(d).log.xz 000960959.td-b3lyp_6-31g+(d).inp 000960959.td-b3lyp_6-31g+(d).log.xz

000960959.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960959.td-b3lyp_6-31+g(d).gjf (generated)

000960959.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960959.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960959.mol 000960959.PUBCHEM 000960959.mol (via Jmol)
000960960.b3lyp_6-31g(d).inp

000960960.b3lyp_6-31g(d).qchem.inp (generated)

000960960.b3lyp_6-31g(d).gjf (generated)

000960960.b3lyp_6-31g(d).firefly.inp (generated)

000960960.b3lyp_6-31g(d).smash.inp (generated)

000960960.b3lyp_6-31g(d).nwchem.inp (generated) 000960960.b3lyp_6-31g(d).log.xz 000960960.td-b3lyp_6-31g+(d).inp 000960960.td-b3lyp_6-31g+(d).log.xz

000960960.td-b3lyp_6-31+g(d).qchem.inp (generated)

000960960.td-b3lyp_6-31+g(d).gjf (generated)

000960960.td-b3lyp_6-31+g(d).firefly.inp (generated)

000960960.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000960960.mol 000960960.PUBCHEM 000960960.mol (via Jmol)
000960961.b3lyp_6-31g(d).inp

000960961.b3lyp_6-31g(d).qchem.inp (generated)

000960961.b3lyp_6-31g(d).gjf (generated)

000960961.b3lyp_6-31g(d).firefly.inp (generated)