Index of

Last updated : Thu Jul 20 01:46:41 JST 2017
Total : 4325 (4323) in this page
000500000.b3lyp_6-31g(d).inp

000500000.b3lyp_6-31g(d).qchem.inp (generated)

000500000.b3lyp_6-31g(d).gjf (generated)

000500000.b3lyp_6-31g(d).firefly.inp (generated)

000500000.b3lyp_6-31g(d).smash.inp (generated)

000500000.b3lyp_6-31g(d).nwchem.inp (generated) 000500000.b3lyp_6-31g(d).log.xz 000500000.td-b3lyp_6-31g+(d).inp 000500000.td-b3lyp_6-31g+(d).log.xz

000500000.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500000.td-b3lyp_6-31+g(d).gjf (generated)

000500000.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500000.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500000.mol 000500000.PUBCHEM 000500000.mol (via Jmol)
000500002.b3lyp_6-31g(d).inp

000500002.b3lyp_6-31g(d).qchem.inp (generated)

000500002.b3lyp_6-31g(d).gjf (generated)

000500002.b3lyp_6-31g(d).firefly.inp (generated)

000500002.b3lyp_6-31g(d).smash.inp (generated)

000500002.b3lyp_6-31g(d).nwchem.inp (generated) 000500002.b3lyp_6-31g(d).log.xz 000500002.td-b3lyp_6-31g+(d).inp 000500002.td-b3lyp_6-31g+(d).log.xz

000500002.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500002.td-b3lyp_6-31+g(d).gjf (generated)

000500002.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500002.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500002.mol 000500002.PUBCHEM 000500002.mol (via Jmol)
000500017.b3lyp_6-31g(d).inp

000500017.b3lyp_6-31g(d).qchem.inp (generated)

000500017.b3lyp_6-31g(d).gjf (generated)

000500017.b3lyp_6-31g(d).firefly.inp (generated)

000500017.b3lyp_6-31g(d).smash.inp (generated)

000500017.b3lyp_6-31g(d).nwchem.inp (generated) 000500017.b3lyp_6-31g(d).log.xz 000500017.td-b3lyp_6-31g+(d).inp 000500017.td-b3lyp_6-31g+(d).log.xz

000500017.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500017.td-b3lyp_6-31+g(d).gjf (generated)

000500017.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500017.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500017.mol 000500017.PUBCHEM 000500017.mol (via Jmol)
000500018.b3lyp_6-31g(d).inp

000500018.b3lyp_6-31g(d).qchem.inp (generated)

000500018.b3lyp_6-31g(d).gjf (generated)

000500018.b3lyp_6-31g(d).firefly.inp (generated)

000500018.b3lyp_6-31g(d).smash.inp (generated)

000500018.b3lyp_6-31g(d).nwchem.inp (generated) 000500018.b3lyp_6-31g(d).log.xz 000500018.td-b3lyp_6-31g+(d).inp 000500018.td-b3lyp_6-31g+(d).log.xz

000500018.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500018.td-b3lyp_6-31+g(d).gjf (generated)

000500018.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500018.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500018.mol 000500018.PUBCHEM 000500018.mol (via Jmol)
000500037.b3lyp_6-31g(d).inp

000500037.b3lyp_6-31g(d).qchem.inp (generated)

000500037.b3lyp_6-31g(d).gjf (generated)

000500037.b3lyp_6-31g(d).firefly.inp (generated)

000500037.b3lyp_6-31g(d).smash.inp (generated)

000500037.b3lyp_6-31g(d).nwchem.inp (generated) 000500037.b3lyp_6-31g(d).log.xz 000500037.td-b3lyp_6-31g+(d).inp 000500037.td-b3lyp_6-31g+(d).log.xz

000500037.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500037.td-b3lyp_6-31+g(d).gjf (generated)

000500037.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500037.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500037.mol 000500037.PUBCHEM 000500037.mol (via Jmol)
000500041.b3lyp_6-31g(d).inp

000500041.b3lyp_6-31g(d).qchem.inp (generated)

000500041.b3lyp_6-31g(d).gjf (generated)

000500041.b3lyp_6-31g(d).firefly.inp (generated)

000500041.b3lyp_6-31g(d).smash.inp (generated)

000500041.b3lyp_6-31g(d).nwchem.inp (generated) 000500041.b3lyp_6-31g(d).log.xz 000500041.td-b3lyp_6-31g+(d).inp 000500041.td-b3lyp_6-31g+(d).log.xz

000500041.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500041.td-b3lyp_6-31+g(d).gjf (generated)

000500041.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500041.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500041.mol 000500041.PUBCHEM 000500041.mol (via Jmol)
000500063.b3lyp_6-31g(d).inp

000500063.b3lyp_6-31g(d).qchem.inp (generated)

000500063.b3lyp_6-31g(d).gjf (generated)

000500063.b3lyp_6-31g(d).firefly.inp (generated)

000500063.b3lyp_6-31g(d).smash.inp (generated)

000500063.b3lyp_6-31g(d).nwchem.inp (generated) 000500063.b3lyp_6-31g(d).log.xz 000500063.td-b3lyp_6-31g+(d).inp 000500063.td-b3lyp_6-31g+(d).log.xz

000500063.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500063.td-b3lyp_6-31+g(d).gjf (generated)

000500063.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500063.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500063.mol 000500063.PUBCHEM 000500063.mol (via Jmol)
000500065.b3lyp_6-31g(d).inp

000500065.b3lyp_6-31g(d).qchem.inp (generated)

000500065.b3lyp_6-31g(d).gjf (generated)

000500065.b3lyp_6-31g(d).firefly.inp (generated)

000500065.b3lyp_6-31g(d).smash.inp (generated)

000500065.b3lyp_6-31g(d).nwchem.inp (generated) 000500065.b3lyp_6-31g(d).log.xz 000500065.td-b3lyp_6-31g+(d).inp 000500065.td-b3lyp_6-31g+(d).log.xz

000500065.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500065.td-b3lyp_6-31+g(d).gjf (generated)

000500065.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500065.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500065.mol 000500065.PUBCHEM 000500065.mol (via Jmol)
000500068.b3lyp_6-31g(d).inp

000500068.b3lyp_6-31g(d).qchem.inp (generated)

000500068.b3lyp_6-31g(d).gjf (generated)

000500068.b3lyp_6-31g(d).firefly.inp (generated)

000500068.b3lyp_6-31g(d).smash.inp (generated)

000500068.b3lyp_6-31g(d).nwchem.inp (generated) 000500068.b3lyp_6-31g(d).log.xz 000500068.td-b3lyp_6-31g+(d).inp 000500068.td-b3lyp_6-31g+(d).log.xz

000500068.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500068.td-b3lyp_6-31+g(d).gjf (generated)

000500068.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500068.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500068.mol 000500068.PUBCHEM 000500068.mol (via Jmol)
000500073.b3lyp_6-31g(d).inp

000500073.b3lyp_6-31g(d).qchem.inp (generated)

000500073.b3lyp_6-31g(d).gjf (generated)

000500073.b3lyp_6-31g(d).firefly.inp (generated)

000500073.b3lyp_6-31g(d).smash.inp (generated)

000500073.b3lyp_6-31g(d).nwchem.inp (generated) 000500073.b3lyp_6-31g(d).log.xz 000500073.td-b3lyp_6-31g+(d).inp 000500073.td-b3lyp_6-31g+(d).log.xz

000500073.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500073.td-b3lyp_6-31+g(d).gjf (generated)

000500073.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500073.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500073.mol 000500073.PUBCHEM 000500073.mol (via Jmol)
000500089.b3lyp_6-31g(d).inp

000500089.b3lyp_6-31g(d).qchem.inp (generated)

000500089.b3lyp_6-31g(d).gjf (generated)

000500089.b3lyp_6-31g(d).firefly.inp (generated)

000500089.b3lyp_6-31g(d).smash.inp (generated)

000500089.b3lyp_6-31g(d).nwchem.inp (generated) 000500089.b3lyp_6-31g(d).log.xz 000500089.td-b3lyp_6-31g+(d).inp 000500089.td-b3lyp_6-31g+(d).log.xz

000500089.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500089.td-b3lyp_6-31+g(d).gjf (generated)

000500089.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500089.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500089.mol 000500089.PUBCHEM 000500089.mol (via Jmol)
000500090.b3lyp_6-31g(d).inp

000500090.b3lyp_6-31g(d).qchem.inp (generated)

000500090.b3lyp_6-31g(d).gjf (generated)

000500090.b3lyp_6-31g(d).firefly.inp (generated)

000500090.b3lyp_6-31g(d).smash.inp (generated)

000500090.b3lyp_6-31g(d).nwchem.inp (generated) 000500090.b3lyp_6-31g(d).log.xz 000500090.td-b3lyp_6-31g+(d).inp 000500090.td-b3lyp_6-31g+(d).log.xz

000500090.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500090.td-b3lyp_6-31+g(d).gjf (generated)

000500090.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500090.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500090.mol 000500090.PUBCHEM 000500090.mol (via Jmol)
000500091.b3lyp_6-31g(d).inp

000500091.b3lyp_6-31g(d).qchem.inp (generated)

000500091.b3lyp_6-31g(d).gjf (generated)

000500091.b3lyp_6-31g(d).firefly.inp (generated)

000500091.b3lyp_6-31g(d).smash.inp (generated)

000500091.b3lyp_6-31g(d).nwchem.inp (generated) 000500091.b3lyp_6-31g(d).log.xz 000500091.td-b3lyp_6-31g+(d).inp 000500091.td-b3lyp_6-31g+(d).log.xz

000500091.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500091.td-b3lyp_6-31+g(d).gjf (generated)

000500091.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500091.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500091.mol 000500091.PUBCHEM 000500091.mol (via Jmol)
000500095.b3lyp_6-31g(d).inp

000500095.b3lyp_6-31g(d).qchem.inp (generated)

000500095.b3lyp_6-31g(d).gjf (generated)

000500095.b3lyp_6-31g(d).firefly.inp (generated)

000500095.b3lyp_6-31g(d).smash.inp (generated)

000500095.b3lyp_6-31g(d).nwchem.inp (generated) 000500095.b3lyp_6-31g(d).log.xz 000500095.td-b3lyp_6-31g+(d).inp 000500095.td-b3lyp_6-31g+(d).log.xz

000500095.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500095.td-b3lyp_6-31+g(d).gjf (generated)

000500095.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500095.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500095.mol 000500095.PUBCHEM 000500095.mol (via Jmol)
000500108.b3lyp_6-31g(d).inp

000500108.b3lyp_6-31g(d).qchem.inp (generated)

000500108.b3lyp_6-31g(d).gjf (generated)

000500108.b3lyp_6-31g(d).firefly.inp (generated)

000500108.b3lyp_6-31g(d).smash.inp (generated)

000500108.b3lyp_6-31g(d).nwchem.inp (generated) 000500108.b3lyp_6-31g(d).log.xz 000500108.td-b3lyp_6-31g+(d).inp 000500108.td-b3lyp_6-31g+(d).log.xz

000500108.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500108.td-b3lyp_6-31+g(d).gjf (generated)

000500108.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500108.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500108.mol 000500108.PUBCHEM 000500108.mol (via Jmol)
000500125.b3lyp_6-31g(d).inp

000500125.b3lyp_6-31g(d).qchem.inp (generated)

000500125.b3lyp_6-31g(d).gjf (generated)

000500125.b3lyp_6-31g(d).firefly.inp (generated)

000500125.b3lyp_6-31g(d).smash.inp (generated)

000500125.b3lyp_6-31g(d).nwchem.inp (generated) 000500125.b3lyp_6-31g(d).log.xz 000500125.td-b3lyp_6-31g+(d).inp 000500125.td-b3lyp_6-31g+(d).log.xz

000500125.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500125.td-b3lyp_6-31+g(d).gjf (generated)

000500125.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500125.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500125.mol 000500125.PUBCHEM 000500125.mol (via Jmol)
000500130.b3lyp_6-31g(d).inp

000500130.b3lyp_6-31g(d).qchem.inp (generated)

000500130.b3lyp_6-31g(d).gjf (generated)

000500130.b3lyp_6-31g(d).firefly.inp (generated)

000500130.b3lyp_6-31g(d).smash.inp (generated)

000500130.b3lyp_6-31g(d).nwchem.inp (generated) 000500130.b3lyp_6-31g(d).log.xz 000500130.td-b3lyp_6-31g+(d).inp 000500130.td-b3lyp_6-31g+(d).log.xz

000500130.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500130.td-b3lyp_6-31+g(d).gjf (generated)

000500130.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500130.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500130.mol 000500130.PUBCHEM 000500130.mol (via Jmol)
000500131.b3lyp_6-31g(d).inp

000500131.b3lyp_6-31g(d).qchem.inp (generated)

000500131.b3lyp_6-31g(d).gjf (generated)

000500131.b3lyp_6-31g(d).firefly.inp (generated)

000500131.b3lyp_6-31g(d).smash.inp (generated)

000500131.b3lyp_6-31g(d).nwchem.inp (generated) 000500131.b3lyp_6-31g(d).log.xz 000500131.td-b3lyp_6-31g+(d).inp 000500131.td-b3lyp_6-31g+(d).log.xz

000500131.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500131.td-b3lyp_6-31+g(d).gjf (generated)

000500131.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500131.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500131.mol 000500131.PUBCHEM 000500131.mol (via Jmol)
000500158.b3lyp_6-31g(d).inp

000500158.b3lyp_6-31g(d).qchem.inp (generated)

000500158.b3lyp_6-31g(d).gjf (generated)

000500158.b3lyp_6-31g(d).firefly.inp (generated)

000500158.b3lyp_6-31g(d).smash.inp (generated)

000500158.b3lyp_6-31g(d).nwchem.inp (generated) 000500158.b3lyp_6-31g(d).log.xz 000500158.td-b3lyp_6-31g+(d).inp 000500158.td-b3lyp_6-31g+(d).log.xz

000500158.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500158.td-b3lyp_6-31+g(d).gjf (generated)

000500158.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500158.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500158.mol 000500158.PUBCHEM 000500158.mol (via Jmol)
000500172.b3lyp_6-31g(d).inp

000500172.b3lyp_6-31g(d).qchem.inp (generated)

000500172.b3lyp_6-31g(d).gjf (generated)

000500172.b3lyp_6-31g(d).firefly.inp (generated)

000500172.b3lyp_6-31g(d).smash.inp (generated)

000500172.b3lyp_6-31g(d).nwchem.inp (generated) 000500172.b3lyp_6-31g(d).log.xz 000500172.td-b3lyp_6-31g+(d).inp 000500172.td-b3lyp_6-31g+(d).log.xz

000500172.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500172.td-b3lyp_6-31+g(d).gjf (generated)

000500172.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500172.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500172.mol 000500172.PUBCHEM 000500172.mol (via Jmol)
000500187.b3lyp_6-31g(d).inp

000500187.b3lyp_6-31g(d).qchem.inp (generated)

000500187.b3lyp_6-31g(d).gjf (generated)

000500187.b3lyp_6-31g(d).firefly.inp (generated)

000500187.b3lyp_6-31g(d).smash.inp (generated)

000500187.b3lyp_6-31g(d).nwchem.inp (generated) 000500187.b3lyp_6-31g(d).log.xz 000500187.td-b3lyp_6-31g+(d).inp 000500187.td-b3lyp_6-31g+(d).log.xz

000500187.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500187.td-b3lyp_6-31+g(d).gjf (generated)

000500187.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500187.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500187.mol 000500187.PUBCHEM 000500187.mol (via Jmol)
000500190.b3lyp_6-31g(d).inp

000500190.b3lyp_6-31g(d).qchem.inp (generated)

000500190.b3lyp_6-31g(d).gjf (generated)

000500190.b3lyp_6-31g(d).firefly.inp (generated)

000500190.b3lyp_6-31g(d).smash.inp (generated)

000500190.b3lyp_6-31g(d).nwchem.inp (generated) 000500190.b3lyp_6-31g(d).log.xz 000500190.td-b3lyp_6-31g+(d).inp 000500190.td-b3lyp_6-31g+(d).log.xz

000500190.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500190.td-b3lyp_6-31+g(d).gjf (generated)

000500190.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500190.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500190.mol 000500190.PUBCHEM 000500190.mol (via Jmol)
000500232.b3lyp_6-31g(d).inp

000500232.b3lyp_6-31g(d).qchem.inp (generated)

000500232.b3lyp_6-31g(d).gjf (generated)

000500232.b3lyp_6-31g(d).firefly.inp (generated)

000500232.b3lyp_6-31g(d).smash.inp (generated)

000500232.b3lyp_6-31g(d).nwchem.inp (generated) 000500232.b3lyp_6-31g(d).log.xz 000500232.td-b3lyp_6-31g+(d).inp 000500232.td-b3lyp_6-31g+(d).log.xz

000500232.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500232.td-b3lyp_6-31+g(d).gjf (generated)

000500232.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500232.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500232.mol 000500232.PUBCHEM 000500232.mol (via Jmol)
000500233.b3lyp_6-31g(d).inp

000500233.b3lyp_6-31g(d).qchem.inp (generated)

000500233.b3lyp_6-31g(d).gjf (generated)

000500233.b3lyp_6-31g(d).firefly.inp (generated)

000500233.b3lyp_6-31g(d).smash.inp (generated)

000500233.b3lyp_6-31g(d).nwchem.inp (generated) 000500233.b3lyp_6-31g(d).log.xz 000500233.td-b3lyp_6-31g+(d).inp 000500233.td-b3lyp_6-31g+(d).log.xz

000500233.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500233.td-b3lyp_6-31+g(d).gjf (generated)

000500233.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500233.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500233.mol 000500233.PUBCHEM 000500233.mol (via Jmol)
000500239.b3lyp_6-31g(d).inp

000500239.b3lyp_6-31g(d).qchem.inp (generated)

000500239.b3lyp_6-31g(d).gjf (generated)

000500239.b3lyp_6-31g(d).firefly.inp (generated)

000500239.b3lyp_6-31g(d).smash.inp (generated)

000500239.b3lyp_6-31g(d).nwchem.inp (generated) 000500239.b3lyp_6-31g(d).log.xz 000500239.td-b3lyp_6-31g+(d).inp 000500239.td-b3lyp_6-31g+(d).log.xz

000500239.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500239.td-b3lyp_6-31+g(d).gjf (generated)

000500239.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500239.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500239.mol 000500239.PUBCHEM 000500239.mol (via Jmol)
000500240.b3lyp_6-31g(d).inp

000500240.b3lyp_6-31g(d).qchem.inp (generated)

000500240.b3lyp_6-31g(d).gjf (generated)

000500240.b3lyp_6-31g(d).firefly.inp (generated)

000500240.b3lyp_6-31g(d).smash.inp (generated)

000500240.b3lyp_6-31g(d).nwchem.inp (generated) 000500240.b3lyp_6-31g(d).log.xz 000500240.td-b3lyp_6-31g+(d).inp 000500240.td-b3lyp_6-31g+(d).log.xz

000500240.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500240.td-b3lyp_6-31+g(d).gjf (generated)

000500240.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500240.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500240.mol 000500240.PUBCHEM 000500240.mol (via Jmol)
000500249.b3lyp_6-31g(d).inp

000500249.b3lyp_6-31g(d).qchem.inp (generated)

000500249.b3lyp_6-31g(d).gjf (generated)

000500249.b3lyp_6-31g(d).firefly.inp (generated)

000500249.b3lyp_6-31g(d).smash.inp (generated)

000500249.b3lyp_6-31g(d).nwchem.inp (generated) 000500249.b3lyp_6-31g(d).log.xz 000500249.td-b3lyp_6-31g+(d).inp 000500249.td-b3lyp_6-31g+(d).log.xz

000500249.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500249.td-b3lyp_6-31+g(d).gjf (generated)

000500249.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500249.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500249.mol 000500249.PUBCHEM 000500249.mol (via Jmol)
000500251.b3lyp_6-31g(d).inp

000500251.b3lyp_6-31g(d).qchem.inp (generated)

000500251.b3lyp_6-31g(d).gjf (generated)

000500251.b3lyp_6-31g(d).firefly.inp (generated)

000500251.b3lyp_6-31g(d).smash.inp (generated)

000500251.b3lyp_6-31g(d).nwchem.inp (generated) 000500251.b3lyp_6-31g(d).log.xz 000500251.td-b3lyp_6-31g+(d).inp 000500251.td-b3lyp_6-31g+(d).log.xz

000500251.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500251.td-b3lyp_6-31+g(d).gjf (generated)

000500251.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500251.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500251.mol 000500251.PUBCHEM 000500251.mol (via Jmol)
000500272.b3lyp_6-31g(d).inp

000500272.b3lyp_6-31g(d).qchem.inp (generated)

000500272.b3lyp_6-31g(d).gjf (generated)

000500272.b3lyp_6-31g(d).firefly.inp (generated)

000500272.b3lyp_6-31g(d).smash.inp (generated)

000500272.b3lyp_6-31g(d).nwchem.inp (generated) 000500272.b3lyp_6-31g(d).log.xz 000500272.td-b3lyp_6-31g+(d).inp 000500272.td-b3lyp_6-31g+(d).log.xz

000500272.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500272.td-b3lyp_6-31+g(d).gjf (generated)

000500272.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500272.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500272.mol 000500272.PUBCHEM 000500272.mol (via Jmol)
000500273.b3lyp_6-31g(d).inp

000500273.b3lyp_6-31g(d).qchem.inp (generated)

000500273.b3lyp_6-31g(d).gjf (generated)

000500273.b3lyp_6-31g(d).firefly.inp (generated)

000500273.b3lyp_6-31g(d).smash.inp (generated)

000500273.b3lyp_6-31g(d).nwchem.inp (generated) 000500273.b3lyp_6-31g(d).log.xz 000500273.td-b3lyp_6-31g+(d).inp 000500273.td-b3lyp_6-31g+(d).log.xz

000500273.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500273.td-b3lyp_6-31+g(d).gjf (generated)

000500273.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500273.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500273.mol 000500273.PUBCHEM 000500273.mol (via Jmol)
000500274.b3lyp_6-31g(d).inp

000500274.b3lyp_6-31g(d).qchem.inp (generated)

000500274.b3lyp_6-31g(d).gjf (generated)

000500274.b3lyp_6-31g(d).firefly.inp (generated)

000500274.b3lyp_6-31g(d).smash.inp (generated)

000500274.b3lyp_6-31g(d).nwchem.inp (generated) 000500274.b3lyp_6-31g(d).log.xz 000500274.td-b3lyp_6-31g+(d).inp 000500274.td-b3lyp_6-31g+(d).log.xz

000500274.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500274.td-b3lyp_6-31+g(d).gjf (generated)

000500274.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500274.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500274.mol 000500274.PUBCHEM 000500274.mol (via Jmol)
000500293.b3lyp_6-31g(d).inp

000500293.b3lyp_6-31g(d).qchem.inp (generated)

000500293.b3lyp_6-31g(d).gjf (generated)

000500293.b3lyp_6-31g(d).firefly.inp (generated)

000500293.b3lyp_6-31g(d).smash.inp (generated)

000500293.b3lyp_6-31g(d).nwchem.inp (generated) 000500293.b3lyp_6-31g(d).log.xz 000500293.td-b3lyp_6-31g+(d).inp 000500293.td-b3lyp_6-31g+(d).log.xz

000500293.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500293.td-b3lyp_6-31+g(d).gjf (generated)

000500293.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500293.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500293.mol 000500293.PUBCHEM 000500293.mol (via Jmol)
000500294.b3lyp_6-31g(d).inp

000500294.b3lyp_6-31g(d).qchem.inp (generated)

000500294.b3lyp_6-31g(d).gjf (generated)

000500294.b3lyp_6-31g(d).firefly.inp (generated)

000500294.b3lyp_6-31g(d).smash.inp (generated)

000500294.b3lyp_6-31g(d).nwchem.inp (generated) 000500294.b3lyp_6-31g(d).log.xz 000500294.td-b3lyp_6-31g+(d).inp 000500294.td-b3lyp_6-31g+(d).log.xz

000500294.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500294.td-b3lyp_6-31+g(d).gjf (generated)

000500294.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500294.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500294.mol 000500294.PUBCHEM 000500294.mol (via Jmol)
000500297.b3lyp_6-31g(d).inp

000500297.b3lyp_6-31g(d).qchem.inp (generated)

000500297.b3lyp_6-31g(d).gjf (generated)

000500297.b3lyp_6-31g(d).firefly.inp (generated)

000500297.b3lyp_6-31g(d).smash.inp (generated)

000500297.b3lyp_6-31g(d).nwchem.inp (generated) 000500297.b3lyp_6-31g(d).log.xz 000500297.td-b3lyp_6-31g+(d).inp 000500297.td-b3lyp_6-31g+(d).log.xz

000500297.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500297.td-b3lyp_6-31+g(d).gjf (generated)

000500297.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500297.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500297.mol 000500297.PUBCHEM 000500297.mol (via Jmol)
000500321.b3lyp_6-31g(d).inp

000500321.b3lyp_6-31g(d).qchem.inp (generated)

000500321.b3lyp_6-31g(d).gjf (generated)

000500321.b3lyp_6-31g(d).firefly.inp (generated)

000500321.b3lyp_6-31g(d).smash.inp (generated)

000500321.b3lyp_6-31g(d).nwchem.inp (generated) 000500321.b3lyp_6-31g(d).log.xz 000500321.td-b3lyp_6-31g+(d).inp 000500321.td-b3lyp_6-31g+(d).log.xz

000500321.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500321.td-b3lyp_6-31+g(d).gjf (generated)

000500321.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500321.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500321.mol 000500321.PUBCHEM 000500321.mol (via Jmol)
000500323.b3lyp_6-31g(d).inp

000500323.b3lyp_6-31g(d).qchem.inp (generated)

000500323.b3lyp_6-31g(d).gjf (generated)

000500323.b3lyp_6-31g(d).firefly.inp (generated)

000500323.b3lyp_6-31g(d).smash.inp (generated)

000500323.b3lyp_6-31g(d).nwchem.inp (generated) 000500323.b3lyp_6-31g(d).log.xz 000500323.td-b3lyp_6-31g+(d).inp 000500323.td-b3lyp_6-31g+(d).log.xz

000500323.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500323.td-b3lyp_6-31+g(d).gjf (generated)

000500323.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500323.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500323.mol 000500323.PUBCHEM 000500323.mol (via Jmol)
000500328.b3lyp_6-31g(d).inp

000500328.b3lyp_6-31g(d).qchem.inp (generated)

000500328.b3lyp_6-31g(d).gjf (generated)

000500328.b3lyp_6-31g(d).firefly.inp (generated)

000500328.b3lyp_6-31g(d).smash.inp (generated)

000500328.b3lyp_6-31g(d).nwchem.inp (generated) 000500328.b3lyp_6-31g(d).log.xz 000500328.td-b3lyp_6-31g+(d).inp 000500328.td-b3lyp_6-31g+(d).log.xz

000500328.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500328.td-b3lyp_6-31+g(d).gjf (generated)

000500328.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500328.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500328.mol 000500328.PUBCHEM 000500328.mol (via Jmol)
000500334.b3lyp_6-31g(d).inp

000500334.b3lyp_6-31g(d).qchem.inp (generated)

000500334.b3lyp_6-31g(d).gjf (generated)

000500334.b3lyp_6-31g(d).firefly.inp (generated)

000500334.b3lyp_6-31g(d).smash.inp (generated)

000500334.b3lyp_6-31g(d).nwchem.inp (generated) 000500334.b3lyp_6-31g(d).log.xz 000500334.td-b3lyp_6-31g+(d).inp 000500334.td-b3lyp_6-31g+(d).log.xz

000500334.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500334.td-b3lyp_6-31+g(d).gjf (generated)

000500334.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500334.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500334.mol 000500334.PUBCHEM 000500334.mol (via Jmol)
000500387.b3lyp_6-31g(d).inp

000500387.b3lyp_6-31g(d).qchem.inp (generated)

000500387.b3lyp_6-31g(d).gjf (generated)

000500387.b3lyp_6-31g(d).firefly.inp (generated)

000500387.b3lyp_6-31g(d).smash.inp (generated)

000500387.b3lyp_6-31g(d).nwchem.inp (generated) 000500387.b3lyp_6-31g(d).log.xz 000500387.td-b3lyp_6-31g+(d).inp 000500387.td-b3lyp_6-31g+(d).log.xz

000500387.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500387.td-b3lyp_6-31+g(d).gjf (generated)

000500387.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500387.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500387.mol 000500387.PUBCHEM 000500387.mol (via Jmol)
000500460.b3lyp_6-31g(d).inp

000500460.b3lyp_6-31g(d).qchem.inp (generated)

000500460.b3lyp_6-31g(d).gjf (generated)

000500460.b3lyp_6-31g(d).firefly.inp (generated)

000500460.b3lyp_6-31g(d).smash.inp (generated)

000500460.b3lyp_6-31g(d).nwchem.inp (generated) 000500460.b3lyp_6-31g(d).log.xz 000500460.td-b3lyp_6-31g+(d).inp 000500460.td-b3lyp_6-31g+(d).log.xz

000500460.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500460.td-b3lyp_6-31+g(d).gjf (generated)

000500460.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500460.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500460.mol 000500460.PUBCHEM 000500460.mol (via Jmol)
000500464.b3lyp_6-31g(d).inp

000500464.b3lyp_6-31g(d).qchem.inp (generated)

000500464.b3lyp_6-31g(d).gjf (generated)

000500464.b3lyp_6-31g(d).firefly.inp (generated)

000500464.b3lyp_6-31g(d).smash.inp (generated)

000500464.b3lyp_6-31g(d).nwchem.inp (generated) 000500464.b3lyp_6-31g(d).log.xz 000500464.td-b3lyp_6-31g+(d).inp 000500464.td-b3lyp_6-31g+(d).log.xz

000500464.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500464.td-b3lyp_6-31+g(d).gjf (generated)

000500464.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500464.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500464.mol 000500464.PUBCHEM 000500464.mol (via Jmol)
000500465.b3lyp_6-31g(d).inp

000500465.b3lyp_6-31g(d).qchem.inp (generated)

000500465.b3lyp_6-31g(d).gjf (generated)

000500465.b3lyp_6-31g(d).firefly.inp (generated)

000500465.b3lyp_6-31g(d).smash.inp (generated)

000500465.b3lyp_6-31g(d).nwchem.inp (generated) 000500465.b3lyp_6-31g(d).log.xz 000500465.td-b3lyp_6-31g+(d).inp 000500465.td-b3lyp_6-31g+(d).log.xz

000500465.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500465.td-b3lyp_6-31+g(d).gjf (generated)

000500465.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500465.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500465.mol 000500465.PUBCHEM 000500465.mol (via Jmol)
000500472.b3lyp_6-31g(d).inp

000500472.b3lyp_6-31g(d).qchem.inp (generated)

000500472.b3lyp_6-31g(d).gjf (generated)

000500472.b3lyp_6-31g(d).firefly.inp (generated)

000500472.b3lyp_6-31g(d).smash.inp (generated)

000500472.b3lyp_6-31g(d).nwchem.inp (generated) 000500472.b3lyp_6-31g(d).log.xz 000500472.td-b3lyp_6-31g+(d).inp 000500472.td-b3lyp_6-31g+(d).log.xz

000500472.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500472.td-b3lyp_6-31+g(d).gjf (generated)

000500472.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500472.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500472.mol 000500472.PUBCHEM 000500472.mol (via Jmol)
000500476.b3lyp_6-31g(d).inp

000500476.b3lyp_6-31g(d).qchem.inp (generated)

000500476.b3lyp_6-31g(d).gjf (generated)

000500476.b3lyp_6-31g(d).firefly.inp (generated)

000500476.b3lyp_6-31g(d).smash.inp (generated)

000500476.b3lyp_6-31g(d).nwchem.inp (generated) 000500476.b3lyp_6-31g(d).log.xz 000500476.td-b3lyp_6-31g+(d).inp 000500476.td-b3lyp_6-31g+(d).log.xz

000500476.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500476.td-b3lyp_6-31+g(d).gjf (generated)

000500476.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500476.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500476.mol 000500476.PUBCHEM 000500476.mol (via Jmol)
000500477.b3lyp_6-31g(d).inp

000500477.b3lyp_6-31g(d).qchem.inp (generated)

000500477.b3lyp_6-31g(d).gjf (generated)

000500477.b3lyp_6-31g(d).firefly.inp (generated)

000500477.b3lyp_6-31g(d).smash.inp (generated)

000500477.b3lyp_6-31g(d).nwchem.inp (generated) 000500477.b3lyp_6-31g(d).log.xz 000500477.td-b3lyp_6-31g+(d).inp 000500477.td-b3lyp_6-31g+(d).log.xz

000500477.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500477.td-b3lyp_6-31+g(d).gjf (generated)

000500477.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500477.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500477.mol 000500477.PUBCHEM 000500477.mol (via Jmol)
000500480.b3lyp_6-31g(d).inp

000500480.b3lyp_6-31g(d).qchem.inp (generated)

000500480.b3lyp_6-31g(d).gjf (generated)

000500480.b3lyp_6-31g(d).firefly.inp (generated)

000500480.b3lyp_6-31g(d).smash.inp (generated)

000500480.b3lyp_6-31g(d).nwchem.inp (generated) 000500480.b3lyp_6-31g(d).log.xz 000500480.td-b3lyp_6-31g+(d).inp 000500480.td-b3lyp_6-31g+(d).log.xz

000500480.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500480.td-b3lyp_6-31+g(d).gjf (generated)

000500480.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500480.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500480.mol 000500480.PUBCHEM 000500480.mol (via Jmol)
000500481.b3lyp_6-31g(d).inp

000500481.b3lyp_6-31g(d).qchem.inp (generated)

000500481.b3lyp_6-31g(d).gjf (generated)

000500481.b3lyp_6-31g(d).firefly.inp (generated)

000500481.b3lyp_6-31g(d).smash.inp (generated)

000500481.b3lyp_6-31g(d).nwchem.inp (generated) 000500481.b3lyp_6-31g(d).log.xz 000500481.td-b3lyp_6-31g+(d).inp 000500481.td-b3lyp_6-31g+(d).log.xz

000500481.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500481.td-b3lyp_6-31+g(d).gjf (generated)

000500481.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500481.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500481.mol 000500481.PUBCHEM 000500481.mol (via Jmol)
000500505.b3lyp_6-31g(d).inp

000500505.b3lyp_6-31g(d).qchem.inp (generated)

000500505.b3lyp_6-31g(d).gjf (generated)

000500505.b3lyp_6-31g(d).firefly.inp (generated)

000500505.b3lyp_6-31g(d).smash.inp (generated)

000500505.b3lyp_6-31g(d).nwchem.inp (generated) 000500505.b3lyp_6-31g(d).log.xz 000500505.td-b3lyp_6-31g+(d).inp 000500505.td-b3lyp_6-31g+(d).log.xz

000500505.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500505.td-b3lyp_6-31+g(d).gjf (generated)

000500505.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500505.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500505.mol 000500505.PUBCHEM 000500505.mol (via Jmol)
000500506.b3lyp_6-31g(d).inp

000500506.b3lyp_6-31g(d).qchem.inp (generated)

000500506.b3lyp_6-31g(d).gjf (generated)

000500506.b3lyp_6-31g(d).firefly.inp (generated)

000500506.b3lyp_6-31g(d).smash.inp (generated)

000500506.b3lyp_6-31g(d).nwchem.inp (generated) 000500506.b3lyp_6-31g(d).log.xz 000500506.td-b3lyp_6-31g+(d).inp 000500506.td-b3lyp_6-31g+(d).log.xz

000500506.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500506.td-b3lyp_6-31+g(d).gjf (generated)

000500506.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500506.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500506.mol 000500506.PUBCHEM 000500506.mol (via Jmol)
000500507.b3lyp_6-31g(d).inp

000500507.b3lyp_6-31g(d).qchem.inp (generated)

000500507.b3lyp_6-31g(d).gjf (generated)

000500507.b3lyp_6-31g(d).firefly.inp (generated)

000500507.b3lyp_6-31g(d).smash.inp (generated)

000500507.b3lyp_6-31g(d).nwchem.inp (generated) 000500507.b3lyp_6-31g(d).log.xz 000500507.td-b3lyp_6-31g+(d).inp 000500507.td-b3lyp_6-31g+(d).log.xz

000500507.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500507.td-b3lyp_6-31+g(d).gjf (generated)

000500507.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500507.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500507.mol 000500507.PUBCHEM 000500507.mol (via Jmol)
000500508.b3lyp_6-31g(d).inp

000500508.b3lyp_6-31g(d).qchem.inp (generated)

000500508.b3lyp_6-31g(d).gjf (generated)

000500508.b3lyp_6-31g(d).firefly.inp (generated)

000500508.b3lyp_6-31g(d).smash.inp (generated)

000500508.b3lyp_6-31g(d).nwchem.inp (generated) 000500508.b3lyp_6-31g(d).log.xz 000500508.td-b3lyp_6-31g+(d).inp 000500508.td-b3lyp_6-31g+(d).log.xz

000500508.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500508.td-b3lyp_6-31+g(d).gjf (generated)

000500508.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500508.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500508.mol 000500508.PUBCHEM 000500508.mol (via Jmol)
000500509.b3lyp_6-31g(d).inp

000500509.b3lyp_6-31g(d).qchem.inp (generated)

000500509.b3lyp_6-31g(d).gjf (generated)

000500509.b3lyp_6-31g(d).firefly.inp (generated)

000500509.b3lyp_6-31g(d).smash.inp (generated)

000500509.b3lyp_6-31g(d).nwchem.inp (generated) 000500509.b3lyp_6-31g(d).log.xz 000500509.td-b3lyp_6-31g+(d).inp 000500509.td-b3lyp_6-31g+(d).log.xz

000500509.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500509.td-b3lyp_6-31+g(d).gjf (generated)

000500509.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500509.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500509.mol 000500509.PUBCHEM 000500509.mol (via Jmol)
000500844.b3lyp_6-31g(d).inp

000500844.b3lyp_6-31g(d).qchem.inp (generated)

000500844.b3lyp_6-31g(d).gjf (generated)

000500844.b3lyp_6-31g(d).firefly.inp (generated)

000500844.b3lyp_6-31g(d).smash.inp (generated)

000500844.b3lyp_6-31g(d).nwchem.inp (generated) 000500844.b3lyp_6-31g(d).log.xz 000500844.td-b3lyp_6-31g+(d).inp 000500844.td-b3lyp_6-31g+(d).log.xz

000500844.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500844.td-b3lyp_6-31+g(d).gjf (generated)

000500844.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500844.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500844.mol 000500844.PUBCHEM 000500844.mol (via Jmol)
000500845.b3lyp_6-31g(d).inp

000500845.b3lyp_6-31g(d).qchem.inp (generated)

000500845.b3lyp_6-31g(d).gjf (generated)

000500845.b3lyp_6-31g(d).firefly.inp (generated)

000500845.b3lyp_6-31g(d).smash.inp (generated)

000500845.b3lyp_6-31g(d).nwchem.inp (generated) 000500845.b3lyp_6-31g(d).log.xz 000500845.td-b3lyp_6-31g+(d).inp 000500845.td-b3lyp_6-31g+(d).log.xz

000500845.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500845.td-b3lyp_6-31+g(d).gjf (generated)

000500845.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500845.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500845.mol 000500845.PUBCHEM 000500845.mol (via Jmol)
000500846.b3lyp_6-31g(d).inp

000500846.b3lyp_6-31g(d).qchem.inp (generated)

000500846.b3lyp_6-31g(d).gjf (generated)

000500846.b3lyp_6-31g(d).firefly.inp (generated)

000500846.b3lyp_6-31g(d).smash.inp (generated)

000500846.b3lyp_6-31g(d).nwchem.inp (generated) 000500846.b3lyp_6-31g(d).log.xz 000500846.td-b3lyp_6-31g+(d).inp 000500846.td-b3lyp_6-31g+(d).log.xz

000500846.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500846.td-b3lyp_6-31+g(d).gjf (generated)

000500846.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500846.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500846.mol 000500846.PUBCHEM 000500846.mol (via Jmol)
000500847.b3lyp_6-31g(d).inp

000500847.b3lyp_6-31g(d).qchem.inp (generated)

000500847.b3lyp_6-31g(d).gjf (generated)

000500847.b3lyp_6-31g(d).firefly.inp (generated)

000500847.b3lyp_6-31g(d).smash.inp (generated)

000500847.b3lyp_6-31g(d).nwchem.inp (generated) 000500847.b3lyp_6-31g(d).log.xz 000500847.td-b3lyp_6-31g+(d).inp 000500847.td-b3lyp_6-31g+(d).log.xz

000500847.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500847.td-b3lyp_6-31+g(d).gjf (generated)

000500847.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500847.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500847.mol 000500847.PUBCHEM 000500847.mol (via Jmol)
000500850.b3lyp_6-31g(d).inp

000500850.b3lyp_6-31g(d).qchem.inp (generated)

000500850.b3lyp_6-31g(d).gjf (generated)

000500850.b3lyp_6-31g(d).firefly.inp (generated)

000500850.b3lyp_6-31g(d).smash.inp (generated)

000500850.b3lyp_6-31g(d).nwchem.inp (generated) 000500850.b3lyp_6-31g(d).log.xz 000500850.td-b3lyp_6-31g+(d).inp 000500850.td-b3lyp_6-31g+(d).log.xz

000500850.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500850.td-b3lyp_6-31+g(d).gjf (generated)

000500850.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500850.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500850.mol 000500850.PUBCHEM 000500850.mol (via Jmol)
000500950.b3lyp_6-31g(d).inp

000500950.b3lyp_6-31g(d).qchem.inp (generated)

000500950.b3lyp_6-31g(d).gjf (generated)

000500950.b3lyp_6-31g(d).firefly.inp (generated)

000500950.b3lyp_6-31g(d).smash.inp (generated)

000500950.b3lyp_6-31g(d).nwchem.inp (generated) 000500950.b3lyp_6-31g(d).log.xz 000500950.td-b3lyp_6-31g+(d).inp 000500950.td-b3lyp_6-31g+(d).log.xz

000500950.td-b3lyp_6-31+g(d).qchem.inp (generated)

000500950.td-b3lyp_6-31+g(d).gjf (generated)

000500950.td-b3lyp_6-31+g(d).firefly.inp (generated)

000500950.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000500950.mol 000500950.PUBCHEM 000500950.mol (via Jmol)
000501065.b3lyp_6-31g(d).inp

000501065.b3lyp_6-31g(d).qchem.inp (generated)

000501065.b3lyp_6-31g(d).gjf (generated)

000501065.b3lyp_6-31g(d).firefly.inp (generated)

000501065.b3lyp_6-31g(d).smash.inp (generated)

000501065.b3lyp_6-31g(d).nwchem.inp (generated) 000501065.b3lyp_6-31g(d).log.xz 000501065.td-b3lyp_6-31g+(d).inp 000501065.td-b3lyp_6-31g+(d).log.xz

000501065.td-b3lyp_6-31+g(d).qchem.inp (generated)

000501065.td-b3lyp_6-31+g(d).gjf (generated)

000501065.td-b3lyp_6-31+g(d).firefly.inp (generated)

000501065.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000501065.mol 000501065.PUBCHEM 000501065.mol (via Jmol)
000501066.b3lyp_6-31g(d).inp

000501066.b3lyp_6-31g(d).qchem.inp (generated)

000501066.b3lyp_6-31g(d).gjf (generated)

000501066.b3lyp_6-31g(d).firefly.inp (generated)

000501066.b3lyp_6-31g(d).smash.inp (generated)

000501066.b3lyp_6-31g(d).nwchem.inp (generated) 000501066.b3lyp_6-31g(d).log.xz 000501066.td-b3lyp_6-31g+(d).inp 000501066.td-b3lyp_6-31g+(d).log.xz

000501066.td-b3lyp_6-31+g(d).qchem.inp (generated)

000501066.td-b3lyp_6-31+g(d).gjf (generated)

000501066.td-b3lyp_6-31+g(d).firefly.inp (generated)

000501066.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000501066.mol 000501066.PUBCHEM 000501066.mol (via Jmol)
000501233.b3lyp_6-31g(d).inp

000501233.b3lyp_6-31g(d).qchem.inp (generated)

000501233.b3lyp_6-31g(d).gjf (generated)

000501233.b3lyp_6-31g(d).firefly.inp (generated)

000501233.b3lyp_6-31g(d).smash.inp (generated)

000501233.b3lyp_6-31g(d).nwchem.inp (generated) 000501233.b3lyp_6-31g(d).log.xz 000501233.td-b3lyp_6-31g+(d).inp 000501233.td-b3lyp_6-31g+(d).log.xz

000501233.td-b3lyp_6-31+g(d).qchem.inp (generated)

000501233.td-b3lyp_6-31+g(d).gjf (generated)

000501233.td-b3lyp_6-31+g(d).firefly.inp (generated)

000501233.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000501233.mol 000501233.PUBCHEM 000501233.mol (via Jmol)
000501234.b3lyp_6-31g(d).inp

000501234.b3lyp_6-31g(d).qchem.inp (generated)

000501234.b3lyp_6-31g(d).gjf (generated)

000501234.b3lyp_6-31g(d).firefly.inp (generated)

000501234.b3lyp_6-31g(d).smash.inp (generated)

000501234.b3lyp_6-31g(d).nwchem.inp (generated) 000501234.b3lyp_6-31g(d).log.xz 000501234.td-b3lyp_6-31g+(d).inp 000501234.td-b3lyp_6-31g+(d).log.xz

000501234.td-b3lyp_6-31+g(d).qchem.inp (generated)

000501234.td-b3lyp_6-31+g(d).gjf (generated)

000501234.td-b3lyp_6-31+g(d).firefly.inp (generated)

000501234.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000501234.mol 000501234.PUBCHEM 000501234.mol (via Jmol)
000501238.b3lyp_6-31g(d).inp

000501238.b3lyp_6-31g(d).qchem.inp (generated)

000501238.b3lyp_6-31g(d).gjf (generated)

000501238.b3lyp_6-31g(d).firefly.inp (generated)

000501238.b3lyp_6-31g(d).smash.inp (generated)

000501238.b3lyp_6-31g(d).nwchem.inp (generated) 000501238.b3lyp_6-31g(d).log.xz 000501238.td-b3lyp_6-31g+(d).inp 000501238.td-b3lyp_6-31g+(d).log.xz

000501238.td-b3lyp_6-31+g(d).qchem.inp (generated)

000501238.td-b3lyp_6-31+g(d).gjf (generated)

000501238.td-b3lyp_6-31+g(d).firefly.inp (generated)

000501238.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000501238.mol 000501238.PUBCHEM 000501238.mol (via Jmol)
000501247.b3lyp_6-31g(d).inp

000501247.b3lyp_6-31g(d).qchem.inp (generated)

000501247.b3lyp_6-31g(d).gjf (generated)

000501247.b3lyp_6-31g(d).firefly.inp (generated)

000501247.b3lyp_6-31g(d).smash.inp (generated)

000501247.b3lyp_6-31g(d).nwchem.inp (generated) 000501247.b3lyp_6-31g(d).log.xz 000501247.td-b3lyp_6-31g+(d).inp 000501247.td-b3lyp_6-31g+(d).log.xz

000501247.td-b3lyp_6-31+g(d).qchem.inp (generated)

000501247.td-b3lyp_6-31+g(d).gjf (generated)

000501247.td-b3lyp_6-31+g(d).firefly.inp (generated)

000501247.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000501247.mol 000501247.PUBCHEM 000501247.mol (via Jmol)
000501251.b3lyp_6-31g(d).inp

000501251.b3lyp_6-31g(d).qchem.inp (generated)

000501251.b3lyp_6-31g(d).gjf (generated)

000501251.b3lyp_6-31g(d).firefly.inp (generated)

000501251.b3lyp_6-31g(d).smash.inp (generated)

000501251.b3lyp_6-31g(d).nwchem.inp (generated) 000501251.b3lyp_6-31g(d).log.xz 000501251.td-b3lyp_6-31g+(d).inp 000501251.td-b3lyp_6-31g+(d).log.xz

000501251.td-b3lyp_6-31+g(d).qchem.inp (generated)

000501251.td-b3lyp_6-31+g(d).gjf (generated)

000501251.td-b3lyp_6-31+g(d).firefly.inp (generated)

000501251.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000501251.mol 000501251.PUBCHEM 000501251.mol (via Jmol)
000501285.b3lyp_6-31g(d).inp

000501285.b3lyp_6-31g(d).qchem.inp (generated)

000501285.b3lyp_6-31g(d).gjf (generated)

000501285.b3lyp_6-31g(d).firefly.inp (generated)

000501285.b3lyp_6-31g(d).smash.inp (generated)

000501285.b3lyp_6-31g(d).nwchem.inp (generated) 000501285.b3lyp_6-31g(d).log.xz 000501285.td-b3lyp_6-31g+(d).inp 000501285.td-b3lyp_6-31g+(d).log.xz

000501285.td-b3lyp_6-31+g(d).qchem.inp (generated)

000501285.td-b3lyp_6-31+g(d).gjf (generated)

000501285.td-b3lyp_6-31+g(d).firefly.inp (generated)

000501285.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000501285.mol 000501285.PUBCHEM 000501285.mol (via Jmol)
000501286.b3lyp_6-31g(d).inp

000501286.b3lyp_6-31g(d).qchem.inp (generated)

000501286.b3lyp_6-31g(d).gjf (generated)

000501286.b3lyp_6-31g(d).firefly.inp (generated)

000501286.b3lyp_6-31g(d).smash.inp (generated)

000501286.b3lyp_6-31g(d).nwchem.inp (generated) 000501286.b3lyp_6-31g(d).log.xz 000501286.td-b3lyp_6-31g+(d).inp 000501286.td-b3lyp_6-31g+(d).log.xz

000501286.td-b3lyp_6-31+g(d).qchem.inp (generated)

000501286.td-b3lyp_6-31+g(d).gjf (generated)

000501286.td-b3lyp_6-31+g(d).firefly.inp (generated)

000501286.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000501286.mol 000501286.PUBCHEM 000501286.mol (via Jmol)
000501287.b3lyp_6-31g(d).inp

000501287.b3lyp_6-31g(d).qchem.inp (generated)

000501287.b3lyp_6-31g(d).gjf (generated)

000501287.b3lyp_6-31g(d).firefly.inp (generated)

000501287.b3lyp_6-31g(d).smash.inp (generated)

000501287.b3lyp_6-31g(d).nwchem.inp (generated) 000501287.b3lyp_6-31g(d).log.xz 000501287.td-b3lyp_6-31g+(d).inp 000501287.td-b3lyp_6-31g+(d).log.xz

000501287.td-b3lyp_6-31+g(d).qchem.inp (generated)

000501287.td-b3lyp_6-31+g(d).gjf (generated)

000501287.td-b3lyp_6-31+g(d).firefly.inp (generated)

000501287.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000501287.mol 000501287.PUBCHEM 000501287.mol (via Jmol)
000501295.b3lyp_6-31g(d).inp

000501295.b3lyp_6-31g(d).qchem.inp (generated)

000501295.b3lyp_6-31g(d).gjf (generated)

000501295.b3lyp_6-31g(d).firefly.inp (generated)

000501295.b3lyp_6-31g(d).smash.inp (generated)

000501295.b3lyp_6-31g(d).nwchem.inp (generated) 000501295.b3lyp_6-31g(d).log.xz 000501295.td-b3lyp_6-31g+(d).inp 000501295.td-b3lyp_6-31g+(d).log.xz

000501295.td-b3lyp_6-31+g(d).qchem.inp (generated)

000501295.td-b3lyp_6-31+g(d).gjf (generated)

000501295.td-b3lyp_6-31+g(d).firefly.inp (generated)

000501295.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000501295.mol 000501295.PUBCHEM 000501295.mol (via Jmol)
000501296.b3lyp_6-31g(d).inp

000501296.b3lyp_6-31g(d).qchem.inp (generated)

000501296.b3lyp_6-31g(d).gjf (generated)

000501296.b3lyp_6-31g(d).firefly.inp (generated)

000501296.b3lyp_6-31g(d).smash.inp (generated)

000501296.b3lyp_6-31g(d).nwchem.inp (generated) 000501296.b3lyp_6-31g(d).log.xz 000501296.td-b3lyp_6-31g+(d).inp 000501296.td-b3lyp_6-31g+(d).log.xz

000501296.td-b3lyp_6-31+g(d).qchem.inp (generated)

000501296.td-b3lyp_6-31+g(d).gjf (generated)

000501296.td-b3lyp_6-31+g(d).firefly.inp (generated)

000501296.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000501296.mol 000501296.PUBCHEM 000501296.mol (via Jmol)
000501297.b3lyp_6-31g(d).inp

000501297.b3lyp_6-31g(d).qchem.inp (generated)

000501297.b3lyp_6-31g(d).gjf (generated)

000501297.b3lyp_6-31g(d).firefly.inp (generated)

000501297.b3lyp_6-31g(d).smash.inp (generated)

000501297.b3lyp_6-31g(d).nwchem.inp (generated) 000501297.b3lyp_6-31g(d).log.xz 000501297.td-b3lyp_6-31g+(d).inp 000501297.td-b3lyp_6-31g+(d).log.xz

000501297.td-b3lyp_6-31+g(d).qchem.inp (generated)

000501297.td-b3lyp_6-31+g(d).gjf (generated)

000501297.td-b3lyp_6-31+g(d).firefly.inp (generated)

000501297.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000501297.mol 000501297.PUBCHEM 000501297.mol (via Jmol)
000501377.b3lyp_6-31g(d).inp

000501377.b3lyp_6-31g(d).qchem.inp (generated)

000501377.b3lyp_6-31g(d).gjf (generated)

000501377.b3lyp_6-31g(d).firefly.inp (generated)

000501377.b3lyp_6-31g(d).smash.inp (generated)

000501377.b3lyp_6-31g(d).nwchem.inp (generated) 000501377.b3lyp_6-31g(d).log.xz 000501377.td-b3lyp_6-31g+(d).inp 000501377.td-b3lyp_6-31g+(d).log.xz

000501377.td-b3lyp_6-31+g(d).qchem.inp (generated)

000501377.td-b3lyp_6-31+g(d).gjf (generated)

000501377.td-b3lyp_6-31+g(d).firefly.inp (generated)

000501377.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000501377.mol 000501377.PUBCHEM 000501377.mol (via Jmol)
000501378.b3lyp_6-31g(d).inp

000501378.b3lyp_6-31g(d).qchem.inp (generated)

000501378.b3lyp_6-31g(d).gjf (generated)

000501378.b3lyp_6-31g(d).firefly.inp (generated)

000501378.b3lyp_6-31g(d).smash.inp (generated)

000501378.b3lyp_6-31g(d).nwchem.inp (generated) 000501378.b3lyp_6-31g(d).log.xz 000501378.td-b3lyp_6-31g+(d).inp 000501378.td-b3lyp_6-31g+(d).log.xz

000501378.td-b3lyp_6-31+g(d).qchem.inp (generated)

000501378.td-b3lyp_6-31+g(d).gjf (generated)

000501378.td-b3lyp_6-31+g(d).firefly.inp (generated)

000501378.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000501378.mol 000501378.PUBCHEM 000501378.mol (via Jmol)
000501379.b3lyp_6-31g(d).inp

000501379.b3lyp_6-31g(d).qchem.inp (generated)

000501379.b3lyp_6-31g(d).gjf (generated)

000501379.b3lyp_6-31g(d).firefly.inp (generated)

000501379.b3lyp_6-31g(d).smash.inp (generated)

000501379.b3lyp_6-31g(d).nwchem.inp (generated) 000501379.b3lyp_6-31g(d).log.xz 000501379.td-b3lyp_6-31g+(d).inp 000501379.td-b3lyp_6-31g+(d).log.xz

000501379.td-b3lyp_6-31+g(d).qchem.inp (generated)

000501379.td-b3lyp_6-31+g(d).gjf (generated)

000501379.td-b3lyp_6-31+g(d).firefly.inp (generated)

000501379.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000501379.mol 000501379.PUBCHEM 000501379.mol (via Jmol)
000501382.b3lyp_6-31g(d).inp

000501382.b3lyp_6-31g(d).qchem.inp (generated)

000501382.b3lyp_6-31g(d).gjf (generated)

000501382.b3lyp_6-31g(d).firefly.inp (generated)

000501382.b3lyp_6-31g(d).smash.inp (generated)

000501382.b3lyp_6-31g(d).nwchem.inp (generated) 000501382.b3lyp_6-31g(d).log.xz 000501382.td-b3lyp_6-31g+(d).inp 000501382.td-b3lyp_6-31g+(d).log.xz

000501382.td-b3lyp_6-31+g(d).qchem.inp (generated)

000501382.td-b3lyp_6-31+g(d).gjf (generated)

000501382.td-b3lyp_6-31+g(d).firefly.inp (generated)

000501382.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000501382.mol 000501382.PUBCHEM 000501382.mol (via Jmol)
000501383.b3lyp_6-31g(d).inp

000501383.b3lyp_6-31g(d).qchem.inp (generated)

000501383.b3lyp_6-31g(d).gjf (generated)

000501383.b3lyp_6-31g(d).firefly.inp (generated)

000501383.b3lyp_6-31g(d).smash.inp (generated)

000501383.b3lyp_6-31g(d).nwchem.inp (generated) 000501383.b3lyp_6-31g(d).log.xz 000501383.td-b3lyp_6-31g+(d).inp 000501383.td-b3lyp_6-31g+(d).log.xz

000501383.td-b3lyp_6-31+g(d).qchem.inp (generated)

000501383.td-b3lyp_6-31+g(d).gjf (generated)

000501383.td-b3lyp_6-31+g(d).firefly.inp (generated)

000501383.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000501383.mol 000501383.PUBCHEM 000501383.mol (via Jmol)
000501385.b3lyp_6-31g(d).inp

000501385.b3lyp_6-31g(d).qchem.inp (generated)

000501385.b3lyp_6-31g(d).gjf (generated)

000501385.b3lyp_6-31g(d).firefly.inp (generated)

000501385.b3lyp_6-31g(d).smash.inp (generated)

000501385.b3lyp_6-31g(d).nwchem.inp (generated) 000501385.b3lyp_6-31g(d).log.xz 000501385.td-b3lyp_6-31g+(d).inp 000501385.td-b3lyp_6-31g+(d).log.xz

000501385.td-b3lyp_6-31+g(d).qchem.inp (generated)

000501385.td-b3lyp_6-31+g(d).gjf (generated)

000501385.td-b3lyp_6-31+g(d).firefly.inp (generated)

000501385.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000501385.mol 000501385.PUBCHEM 000501385.mol (via Jmol)
000501387.b3lyp_6-31g(d).inp

000501387.b3lyp_6-31g(d).qchem.inp (generated)

000501387.b3lyp_6-31g(d).gjf (generated)

000501387.b3lyp_6-31g(d).firefly.inp (generated)

000501387.b3lyp_6-31g(d).smash.inp (generated)

000501387.b3lyp_6-31g(d).nwchem.inp (generated) 000501387.b3lyp_6-31g(d).log.xz 000501387.td-b3lyp_6-31g+(d).inp 000501387.td-b3lyp_6-31g+(d).log.xz

000501387.td-b3lyp_6-31+g(d).qchem.inp (generated)

000501387.td-b3lyp_6-31+g(d).gjf (generated)

000501387.td-b3lyp_6-31+g(d).firefly.inp (generated)

000501387.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000501387.mol 000501387.PUBCHEM 000501387.mol (via Jmol)
000501391.b3lyp_6-31g(d).inp

000501391.b3lyp_6-31g(d).qchem.inp (generated)

000501391.b3lyp_6-31g(d).gjf (generated)

000501391.b3lyp_6-31g(d).firefly.inp (generated)

000501391.b3lyp_6-31g(d).smash.inp (generated)

000501391.b3lyp_6-31g(d).nwchem.inp (generated) 000501391.b3lyp_6-31g(d).log.xz 000501391.td-b3lyp_6-31g+(d).inp 000501391.td-b3lyp_6-31g+(d).log.xz

000501391.td-b3lyp_6-31+g(d).qchem.inp (generated)

000501391.td-b3lyp_6-31+g(d).gjf (generated)

000501391.td-b3lyp_6-31+g(d).firefly.inp (generated)

000501391.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000501391.mol 000501391.PUBCHEM 000501391.mol (via Jmol)
000501477.b3lyp_6-31g(d).inp

000501477.b3lyp_6-31g(d).qchem.inp (generated)

000501477.b3lyp_6-31g(d).gjf (generated)

000501477.b3lyp_6-31g(d).firefly.inp (generated)

000501477.b3lyp_6-31g(d).smash.inp (generated)

000501477.b3lyp_6-31g(d).nwchem.inp (generated) 000501477.b3lyp_6-31g(d).log.xz 000501477.td-b3lyp_6-31g+(d).inp 000501477.td-b3lyp_6-31g+(d).log.xz

000501477.td-b3lyp_6-31+g(d).qchem.inp (generated)

000501477.td-b3lyp_6-31+g(d).gjf (generated)

000501477.td-b3lyp_6-31+g(d).firefly.inp (generated)

000501477.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000501477.mol 000501477.PUBCHEM 000501477.mol (via Jmol)
000501478.b3lyp_6-31g(d).inp

000501478.b3lyp_6-31g(d).qchem.inp (generated)

000501478.b3lyp_6-31g(d).gjf (generated)

000501478.b3lyp_6-31g(d).firefly.inp (generated)

000501478.b3lyp_6-31g(d).smash.inp (generated)

000501478.b3lyp_6-31g(d).nwchem.inp (generated) 000501478.b3lyp_6-31g(d).log.xz 000501478.td-b3lyp_6-31g+(d).inp 000501478.td-b3lyp_6-31g+(d).log.xz

000501478.td-b3lyp_6-31+g(d).qchem.inp (generated)

000501478.td-b3lyp_6-31+g(d).gjf (generated)

000501478.td-b3lyp_6-31+g(d).firefly.inp (generated)

000501478.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000501478.mol 000501478.PUBCHEM 000501478.mol (via Jmol)
000501666.b3lyp_6-31g(d).inp

000501666.b3lyp_6-31g(d).qchem.inp (generated)

000501666.b3lyp_6-31g(d).gjf (generated)

000501666.b3lyp_6-31g(d).firefly.inp (generated)

000501666.b3lyp_6-31g(d).smash.inp (generated)

000501666.b3lyp_6-31g(d).nwchem.inp (generated) 000501666.b3lyp_6-31g(d).log.xz 000501666.td-b3lyp_6-31g+(d).inp 000501666.td-b3lyp_6-31g+(d).log.xz

000501666.td-b3lyp_6-31+g(d).qchem.inp (generated)

000501666.td-b3lyp_6-31+g(d).gjf (generated)

000501666.td-b3lyp_6-31+g(d).firefly.inp (generated)

000501666.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000501666.mol 000501666.PUBCHEM 000501666.mol (via Jmol)
000502129.b3lyp_6-31g(d).inp

000502129.b3lyp_6-31g(d).qchem.inp (generated)

000502129.b3lyp_6-31g(d).gjf (generated)

000502129.b3lyp_6-31g(d).firefly.inp (generated)

000502129.b3lyp_6-31g(d).smash.inp (generated)

000502129.b3lyp_6-31g(d).nwchem.inp (generated) 000502129.b3lyp_6-31g(d).log.xz 000502129.td-b3lyp_6-31g+(d).inp 000502129.td-b3lyp_6-31g+(d).log.xz

000502129.td-b3lyp_6-31+g(d).qchem.inp (generated)

000502129.td-b3lyp_6-31+g(d).gjf (generated)

000502129.td-b3lyp_6-31+g(d).firefly.inp (generated)

000502129.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000502129.mol 000502129.PUBCHEM 000502129.mol (via Jmol)
000502130.b3lyp_6-31g(d).inp

000502130.b3lyp_6-31g(d).qchem.inp (generated)

000502130.b3lyp_6-31g(d).gjf (generated)

000502130.b3lyp_6-31g(d).firefly.inp (generated)

000502130.b3lyp_6-31g(d).smash.inp (generated)

000502130.b3lyp_6-31g(d).nwchem.inp (generated) 000502130.b3lyp_6-31g(d).log.xz 000502130.td-b3lyp_6-31g+(d).inp 000502130.td-b3lyp_6-31g+(d).log.xz

000502130.td-b3lyp_6-31+g(d).qchem.inp (generated)

000502130.td-b3lyp_6-31+g(d).gjf (generated)

000502130.td-b3lyp_6-31+g(d).firefly.inp (generated)

000502130.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000502130.mol 000502130.PUBCHEM 000502130.mol (via Jmol)
000502131.b3lyp_6-31g(d).inp

000502131.b3lyp_6-31g(d).qchem.inp (generated)

000502131.b3lyp_6-31g(d).gjf (generated)

000502131.b3lyp_6-31g(d).firefly.inp (generated)

000502131.b3lyp_6-31g(d).smash.inp (generated)

000502131.b3lyp_6-31g(d).nwchem.inp (generated) 000502131.b3lyp_6-31g(d).log.xz 000502131.td-b3lyp_6-31g+(d).inp 000502131.td-b3lyp_6-31g+(d).log.xz

000502131.td-b3lyp_6-31+g(d).qchem.inp (generated)

000502131.td-b3lyp_6-31+g(d).gjf (generated)

000502131.td-b3lyp_6-31+g(d).firefly.inp (generated)

000502131.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000502131.mol 000502131.PUBCHEM 000502131.mol (via Jmol)
000502132.b3lyp_6-31g(d).inp

000502132.b3lyp_6-31g(d).qchem.inp (generated)

000502132.b3lyp_6-31g(d).gjf (generated)

000502132.b3lyp_6-31g(d).firefly.inp (generated)

000502132.b3lyp_6-31g(d).smash.inp (generated)

000502132.b3lyp_6-31g(d).nwchem.inp (generated) 000502132.b3lyp_6-31g(d).log.xz 000502132.td-b3lyp_6-31g+(d).inp 000502132.td-b3lyp_6-31g+(d).log.xz

000502132.td-b3lyp_6-31+g(d).qchem.inp (generated)

000502132.td-b3lyp_6-31+g(d).gjf (generated)

000502132.td-b3lyp_6-31+g(d).firefly.inp (generated)

000502132.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000502132.mol 000502132.PUBCHEM 000502132.mol (via Jmol)
000502135.b3lyp_6-31g(d).inp

000502135.b3lyp_6-31g(d).qchem.inp (generated)

000502135.b3lyp_6-31g(d).gjf (generated)

000502135.b3lyp_6-31g(d).firefly.inp (generated)

000502135.b3lyp_6-31g(d).smash.inp (generated)

000502135.b3lyp_6-31g(d).nwchem.inp (generated) 000502135.b3lyp_6-31g(d).log.xz 000502135.td-b3lyp_6-31g+(d).inp 000502135.td-b3lyp_6-31g+(d).log.xz

000502135.td-b3lyp_6-31+g(d).qchem.inp (generated)

000502135.td-b3lyp_6-31+g(d).gjf (generated)

000502135.td-b3lyp_6-31+g(d).firefly.inp (generated)

000502135.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000502135.mol 000502135.PUBCHEM 000502135.mol (via Jmol)
000502136.b3lyp_6-31g(d).inp

000502136.b3lyp_6-31g(d).qchem.inp (generated)

000502136.b3lyp_6-31g(d).gjf (generated)

000502136.b3lyp_6-31g(d).firefly.inp (generated)

000502136.b3lyp_6-31g(d).smash.inp (generated)

000502136.b3lyp_6-31g(d).nwchem.inp (generated) 000502136.b3lyp_6-31g(d).log.xz 000502136.td-b3lyp_6-31g+(d).inp 000502136.td-b3lyp_6-31g+(d).log.xz

000502136.td-b3lyp_6-31+g(d).qchem.inp (generated)

000502136.td-b3lyp_6-31+g(d).gjf (generated)

000502136.td-b3lyp_6-31+g(d).firefly.inp (generated)

000502136.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000502136.mol 000502136.PUBCHEM 000502136.mol (via Jmol)
000502137.b3lyp_6-31g(d).inp

000502137.b3lyp_6-31g(d).qchem.inp (generated)

000502137.b3lyp_6-31g(d).gjf (generated)

000502137.b3lyp_6-31g(d).firefly.inp (generated)

000502137.b3lyp_6-31g(d).smash.inp (generated)

000502137.b3lyp_6-31g(d).nwchem.inp (generated) 000502137.b3lyp_6-31g(d).log.xz 000502137.td-b3lyp_6-31g+(d).inp 000502137.td-b3lyp_6-31g+(d).log.xz

000502137.td-b3lyp_6-31+g(d).qchem.inp (generated)

000502137.td-b3lyp_6-31+g(d).gjf (generated)

000502137.td-b3lyp_6-31+g(d).firefly.inp (generated)

000502137.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000502137.mol 000502137.PUBCHEM 000502137.mol (via Jmol)
000502138.b3lyp_6-31g(d).inp

000502138.b3lyp_6-31g(d).qchem.inp (generated)

000502138.b3lyp_6-31g(d).gjf (generated)

000502138.b3lyp_6-31g(d).firefly.inp (generated)

000502138.b3lyp_6-31g(d).smash.inp (generated)

000502138.b3lyp_6-31g(d).nwchem.inp (generated) 000502138.b3lyp_6-31g(d).log.xz 000502138.td-b3lyp_6-31g+(d).inp 000502138.td-b3lyp_6-31g+(d).log.xz

000502138.td-b3lyp_6-31+g(d).qchem.inp (generated)

000502138.td-b3lyp_6-31+g(d).gjf (generated)

000502138.td-b3lyp_6-31+g(d).firefly.inp (generated)

000502138.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000502138.mol 000502138.PUBCHEM 000502138.mol (via Jmol)
000502234.b3lyp_6-31g(d).inp

000502234.b3lyp_6-31g(d).qchem.inp (generated)

000502234.b3lyp_6-31g(d).gjf (generated)

000502234.b3lyp_6-31g(d).firefly.inp (generated)

000502234.b3lyp_6-31g(d).smash.inp (generated)

000502234.b3lyp_6-31g(d).nwchem.inp (generated) 000502234.b3lyp_6-31g(d).log.xz 000502234.td-b3lyp_6-31g+(d).inp 000502234.td-b3lyp_6-31g+(d).log.xz

000502234.td-b3lyp_6-31+g(d).qchem.inp (generated)

000502234.td-b3lyp_6-31+g(d).gjf (generated)

000502234.td-b3lyp_6-31+g(d).firefly.inp (generated)

000502234.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000502234.mol 000502234.PUBCHEM 000502234.mol (via Jmol)
000502247.b3lyp_6-31g(d).inp

000502247.b3lyp_6-31g(d).qchem.inp (generated)

000502247.b3lyp_6-31g(d).gjf (generated)

000502247.b3lyp_6-31g(d).firefly.inp (generated)

000502247.b3lyp_6-31g(d).smash.inp (generated)

000502247.b3lyp_6-31g(d).nwchem.inp (generated) 000502247.b3lyp_6-31g(d).log.xz 000502247.td-b3lyp_6-31g+(d).inp 000502247.td-b3lyp_6-31g+(d).log.xz

000502247.td-b3lyp_6-31+g(d).qchem.inp (generated)

000502247.td-b3lyp_6-31+g(d).gjf (generated)

000502247.td-b3lyp_6-31+g(d).firefly.inp (generated)

000502247.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000502247.mol 000502247.PUBCHEM 000502247.mol (via Jmol)
000502382.b3lyp_6-31g(d).inp

000502382.b3lyp_6-31g(d).qchem.inp (generated)

000502382.b3lyp_6-31g(d).gjf (generated)

000502382.b3lyp_6-31g(d).firefly.inp (generated)

000502382.b3lyp_6-31g(d).smash.inp (generated)

000502382.b3lyp_6-31g(d).nwchem.inp (generated) 000502382.b3lyp_6-31g(d).log.xz 000502382.td-b3lyp_6-31g+(d).inp 000502382.td-b3lyp_6-31g+(d).log.xz

000502382.td-b3lyp_6-31+g(d).qchem.inp (generated)

000502382.td-b3lyp_6-31+g(d).gjf (generated)

000502382.td-b3lyp_6-31+g(d).firefly.inp (generated)

000502382.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000502382.mol 000502382.PUBCHEM 000502382.mol (via Jmol)
000502875.b3lyp_6-31g(d).inp

000502875.b3lyp_6-31g(d).qchem.inp (generated)

000502875.b3lyp_6-31g(d).gjf (generated)

000502875.b3lyp_6-31g(d).firefly.inp (generated)

000502875.b3lyp_6-31g(d).smash.inp (generated)

000502875.b3lyp_6-31g(d).nwchem.inp (generated) 000502875.b3lyp_6-31g(d).log.xz 000502875.td-b3lyp_6-31g+(d).inp 000502875.td-b3lyp_6-31g+(d).log.xz

000502875.td-b3lyp_6-31+g(d).qchem.inp (generated)

000502875.td-b3lyp_6-31+g(d).gjf (generated)

000502875.td-b3lyp_6-31+g(d).firefly.inp (generated)

000502875.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000502875.mol 000502875.PUBCHEM 000502875.mol (via Jmol)
000502920.b3lyp_6-31g(d).inp

000502920.b3lyp_6-31g(d).qchem.inp (generated)

000502920.b3lyp_6-31g(d).gjf (generated)

000502920.b3lyp_6-31g(d).firefly.inp (generated)

000502920.b3lyp_6-31g(d).smash.inp (generated)

000502920.b3lyp_6-31g(d).nwchem.inp (generated) 000502920.b3lyp_6-31g(d).log.xz 000502920.td-b3lyp_6-31g+(d).inp 000502920.td-b3lyp_6-31g+(d).log.xz

000502920.td-b3lyp_6-31+g(d).qchem.inp (generated)

000502920.td-b3lyp_6-31+g(d).gjf (generated)

000502920.td-b3lyp_6-31+g(d).firefly.inp (generated)

000502920.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000502920.mol 000502920.PUBCHEM 000502920.mol (via Jmol)
000502926.b3lyp_6-31g(d).inp

000502926.b3lyp_6-31g(d).qchem.inp (generated)

000502926.b3lyp_6-31g(d).gjf (generated)

000502926.b3lyp_6-31g(d).firefly.inp (generated)

000502926.b3lyp_6-31g(d).smash.inp (generated)

000502926.b3lyp_6-31g(d).nwchem.inp (generated) 000502926.b3lyp_6-31g(d).log.xz 000502926.td-b3lyp_6-31g+(d).inp 000502926.td-b3lyp_6-31g+(d).log.xz

000502926.td-b3lyp_6-31+g(d).qchem.inp (generated)

000502926.td-b3lyp_6-31+g(d).gjf (generated)

000502926.td-b3lyp_6-31+g(d).firefly.inp (generated)

000502926.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000502926.mol 000502926.PUBCHEM 000502926.mol (via Jmol)
000503107.b3lyp_6-31g(d).inp

000503107.b3lyp_6-31g(d).qchem.inp (generated)

000503107.b3lyp_6-31g(d).gjf (generated)

000503107.b3lyp_6-31g(d).firefly.inp (generated)

000503107.b3lyp_6-31g(d).smash.inp (generated)

000503107.b3lyp_6-31g(d).nwchem.inp (generated) 000503107.b3lyp_6-31g(d).log.xz 000503107.td-b3lyp_6-31g+(d).inp 000503107.td-b3lyp_6-31g+(d).log.xz

000503107.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503107.td-b3lyp_6-31+g(d).gjf (generated)

000503107.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503107.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503107.mol 000503107.PUBCHEM 000503107.mol (via Jmol)
000503162.b3lyp_6-31g(d).inp

000503162.b3lyp_6-31g(d).qchem.inp (generated)

000503162.b3lyp_6-31g(d).gjf (generated)

000503162.b3lyp_6-31g(d).firefly.inp (generated)

000503162.b3lyp_6-31g(d).smash.inp (generated)

000503162.b3lyp_6-31g(d).nwchem.inp (generated) 000503162.b3lyp_6-31g(d).log.xz 000503162.td-b3lyp_6-31g+(d).inp 000503162.td-b3lyp_6-31g+(d).log.xz

000503162.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503162.td-b3lyp_6-31+g(d).gjf (generated)

000503162.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503162.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503162.mol 000503162.PUBCHEM 000503162.mol (via Jmol)
000503165.b3lyp_6-31g(d).inp

000503165.b3lyp_6-31g(d).qchem.inp (generated)

000503165.b3lyp_6-31g(d).gjf (generated)

000503165.b3lyp_6-31g(d).firefly.inp (generated)

000503165.b3lyp_6-31g(d).smash.inp (generated)

000503165.b3lyp_6-31g(d).nwchem.inp (generated) 000503165.b3lyp_6-31g(d).log.xz 000503165.td-b3lyp_6-31g+(d).inp 000503165.td-b3lyp_6-31g+(d).log.xz

000503165.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503165.td-b3lyp_6-31+g(d).gjf (generated)

000503165.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503165.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503165.mol 000503165.PUBCHEM 000503165.mol (via Jmol)
000503252.b3lyp_6-31g(d).inp

000503252.b3lyp_6-31g(d).qchem.inp (generated)

000503252.b3lyp_6-31g(d).gjf (generated)

000503252.b3lyp_6-31g(d).firefly.inp (generated)

000503252.b3lyp_6-31g(d).smash.inp (generated)

000503252.b3lyp_6-31g(d).nwchem.inp (generated) 000503252.b3lyp_6-31g(d).log.xz 000503252.td-b3lyp_6-31g+(d).inp 000503252.td-b3lyp_6-31g+(d).log.xz

000503252.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503252.td-b3lyp_6-31+g(d).gjf (generated)

000503252.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503252.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503252.mol 000503252.PUBCHEM 000503252.mol (via Jmol)
000503298.b3lyp_6-31g(d).inp

000503298.b3lyp_6-31g(d).qchem.inp (generated)

000503298.b3lyp_6-31g(d).gjf (generated)

000503298.b3lyp_6-31g(d).firefly.inp (generated)

000503298.b3lyp_6-31g(d).smash.inp (generated)

000503298.b3lyp_6-31g(d).nwchem.inp (generated) 000503298.b3lyp_6-31g(d).log.xz 000503298.td-b3lyp_6-31g+(d).inp 000503298.td-b3lyp_6-31g+(d).log.xz

000503298.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503298.td-b3lyp_6-31+g(d).gjf (generated)

000503298.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503298.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503298.mol 000503298.PUBCHEM 000503298.mol (via Jmol)
000503300.b3lyp_6-31g(d).inp

000503300.b3lyp_6-31g(d).qchem.inp (generated)

000503300.b3lyp_6-31g(d).gjf (generated)

000503300.b3lyp_6-31g(d).firefly.inp (generated)

000503300.b3lyp_6-31g(d).smash.inp (generated)

000503300.b3lyp_6-31g(d).nwchem.inp (generated) 000503300.b3lyp_6-31g(d).log.xz 000503300.td-b3lyp_6-31g+(d).inp 000503300.td-b3lyp_6-31g+(d).log.xz

000503300.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503300.td-b3lyp_6-31+g(d).gjf (generated)

000503300.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503300.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503300.mol 000503300.PUBCHEM 000503300.mol (via Jmol)
000503302.b3lyp_6-31g(d).inp

000503302.b3lyp_6-31g(d).qchem.inp (generated)

000503302.b3lyp_6-31g(d).gjf (generated)

000503302.b3lyp_6-31g(d).firefly.inp (generated)

000503302.b3lyp_6-31g(d).smash.inp (generated)

000503302.b3lyp_6-31g(d).nwchem.inp (generated) 000503302.b3lyp_6-31g(d).log.xz 000503302.td-b3lyp_6-31g+(d).inp 000503302.td-b3lyp_6-31g+(d).log.xz

000503302.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503302.td-b3lyp_6-31+g(d).gjf (generated)

000503302.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503302.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503302.mol 000503302.PUBCHEM 000503302.mol (via Jmol)
000503308.b3lyp_6-31g(d).inp

000503308.b3lyp_6-31g(d).qchem.inp (generated)

000503308.b3lyp_6-31g(d).gjf (generated)

000503308.b3lyp_6-31g(d).firefly.inp (generated)

000503308.b3lyp_6-31g(d).smash.inp (generated)

000503308.b3lyp_6-31g(d).nwchem.inp (generated) 000503308.b3lyp_6-31g(d).log.xz 000503308.td-b3lyp_6-31g+(d).inp 000503308.td-b3lyp_6-31g+(d).log.xz

000503308.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503308.td-b3lyp_6-31+g(d).gjf (generated)

000503308.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503308.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503308.mol 000503308.PUBCHEM 000503308.mol (via Jmol)
000503408.b3lyp_6-31g(d).inp

000503408.b3lyp_6-31g(d).qchem.inp (generated)

000503408.b3lyp_6-31g(d).gjf (generated)

000503408.b3lyp_6-31g(d).firefly.inp (generated)

000503408.b3lyp_6-31g(d).smash.inp (generated)

000503408.b3lyp_6-31g(d).nwchem.inp (generated) 000503408.b3lyp_6-31g(d).log.xz 000503408.td-b3lyp_6-31g+(d).inp 000503408.td-b3lyp_6-31g+(d).log.xz

000503408.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503408.td-b3lyp_6-31+g(d).gjf (generated)

000503408.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503408.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503408.mol 000503408.PUBCHEM 000503408.mol (via Jmol)
000503409.b3lyp_6-31g(d).inp

000503409.b3lyp_6-31g(d).qchem.inp (generated)

000503409.b3lyp_6-31g(d).gjf (generated)

000503409.b3lyp_6-31g(d).firefly.inp (generated)

000503409.b3lyp_6-31g(d).smash.inp (generated)

000503409.b3lyp_6-31g(d).nwchem.inp (generated) 000503409.b3lyp_6-31g(d).log.xz 000503409.td-b3lyp_6-31g+(d).inp 000503409.td-b3lyp_6-31g+(d).log.xz

000503409.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503409.td-b3lyp_6-31+g(d).gjf (generated)

000503409.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503409.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503409.mol 000503409.PUBCHEM 000503409.mol (via Jmol)
000503416.b3lyp_6-31g(d).inp

000503416.b3lyp_6-31g(d).qchem.inp (generated)

000503416.b3lyp_6-31g(d).gjf (generated)

000503416.b3lyp_6-31g(d).firefly.inp (generated)

000503416.b3lyp_6-31g(d).smash.inp (generated)

000503416.b3lyp_6-31g(d).nwchem.inp (generated) 000503416.b3lyp_6-31g(d).log.xz 000503416.td-b3lyp_6-31g+(d).inp 000503416.td-b3lyp_6-31g+(d).log.xz

000503416.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503416.td-b3lyp_6-31+g(d).gjf (generated)

000503416.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503416.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503416.mol 000503416.PUBCHEM 000503416.mol (via Jmol)
000503440.b3lyp_6-31g(d).inp

000503440.b3lyp_6-31g(d).qchem.inp (generated)

000503440.b3lyp_6-31g(d).gjf (generated)

000503440.b3lyp_6-31g(d).firefly.inp (generated)

000503440.b3lyp_6-31g(d).smash.inp (generated)

000503440.b3lyp_6-31g(d).nwchem.inp (generated) 000503440.b3lyp_6-31g(d).log.xz 000503440.td-b3lyp_6-31g+(d).inp 000503440.td-b3lyp_6-31g+(d).log.xz

000503440.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503440.td-b3lyp_6-31+g(d).gjf (generated)

000503440.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503440.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503440.mol 000503440.PUBCHEM 000503440.mol (via Jmol)
000503443.b3lyp_6-31g(d).inp

000503443.b3lyp_6-31g(d).qchem.inp (generated)

000503443.b3lyp_6-31g(d).gjf (generated)

000503443.b3lyp_6-31g(d).firefly.inp (generated)

000503443.b3lyp_6-31g(d).smash.inp (generated)

000503443.b3lyp_6-31g(d).nwchem.inp (generated) 000503443.b3lyp_6-31g(d).log.xz 000503443.td-b3lyp_6-31g+(d).inp 000503443.td-b3lyp_6-31g+(d).log.xz

000503443.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503443.td-b3lyp_6-31+g(d).gjf (generated)

000503443.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503443.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503443.mol 000503443.PUBCHEM 000503443.mol (via Jmol)
000503513.b3lyp_6-31g(d).inp

000503513.b3lyp_6-31g(d).qchem.inp (generated)

000503513.b3lyp_6-31g(d).gjf (generated)

000503513.b3lyp_6-31g(d).firefly.inp (generated)

000503513.b3lyp_6-31g(d).smash.inp (generated)

000503513.b3lyp_6-31g(d).nwchem.inp (generated) 000503513.b3lyp_6-31g(d).log.xz 000503513.td-b3lyp_6-31g+(d).inp 000503513.td-b3lyp_6-31g+(d).log.xz

000503513.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503513.td-b3lyp_6-31+g(d).gjf (generated)

000503513.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503513.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503513.mol 000503513.PUBCHEM 000503513.mol (via Jmol)
000503700.b3lyp_6-31g(d).inp

000503700.b3lyp_6-31g(d).qchem.inp (generated)

000503700.b3lyp_6-31g(d).gjf (generated)

000503700.b3lyp_6-31g(d).firefly.inp (generated)

000503700.b3lyp_6-31g(d).smash.inp (generated)

000503700.b3lyp_6-31g(d).nwchem.inp (generated) 000503700.b3lyp_6-31g(d).log.xz 000503700.td-b3lyp_6-31g+(d).inp 000503700.td-b3lyp_6-31g+(d).log.xz

000503700.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503700.td-b3lyp_6-31+g(d).gjf (generated)

000503700.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503700.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503700.mol 000503700.PUBCHEM 000503700.mol (via Jmol)
000503702.b3lyp_6-31g(d).inp

000503702.b3lyp_6-31g(d).qchem.inp (generated)

000503702.b3lyp_6-31g(d).gjf (generated)

000503702.b3lyp_6-31g(d).firefly.inp (generated)

000503702.b3lyp_6-31g(d).smash.inp (generated)

000503702.b3lyp_6-31g(d).nwchem.inp (generated) 000503702.b3lyp_6-31g(d).log.xz 000503702.td-b3lyp_6-31g+(d).inp 000503702.td-b3lyp_6-31g+(d).log.xz

000503702.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503702.td-b3lyp_6-31+g(d).gjf (generated)

000503702.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503702.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503702.mol 000503702.PUBCHEM 000503702.mol (via Jmol)
000503703.b3lyp_6-31g(d).inp

000503703.b3lyp_6-31g(d).qchem.inp (generated)

000503703.b3lyp_6-31g(d).gjf (generated)

000503703.b3lyp_6-31g(d).firefly.inp (generated)

000503703.b3lyp_6-31g(d).smash.inp (generated)

000503703.b3lyp_6-31g(d).nwchem.inp (generated) 000503703.b3lyp_6-31g(d).log.xz 000503703.td-b3lyp_6-31g+(d).inp 000503703.td-b3lyp_6-31g+(d).log.xz

000503703.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503703.td-b3lyp_6-31+g(d).gjf (generated)

000503703.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503703.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503703.mol 000503703.PUBCHEM 000503703.mol (via Jmol)
000503711.b3lyp_6-31g(d).inp

000503711.b3lyp_6-31g(d).qchem.inp (generated)

000503711.b3lyp_6-31g(d).gjf (generated)

000503711.b3lyp_6-31g(d).firefly.inp (generated)

000503711.b3lyp_6-31g(d).smash.inp (generated)

000503711.b3lyp_6-31g(d).nwchem.inp (generated) 000503711.b3lyp_6-31g(d).log.xz 000503711.td-b3lyp_6-31g+(d).inp 000503711.td-b3lyp_6-31g+(d).log.xz

000503711.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503711.td-b3lyp_6-31+g(d).gjf (generated)

000503711.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503711.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503711.mol 000503711.PUBCHEM 000503711.mol (via Jmol)
000503713.b3lyp_6-31g(d).inp

000503713.b3lyp_6-31g(d).qchem.inp (generated)

000503713.b3lyp_6-31g(d).gjf (generated)

000503713.b3lyp_6-31g(d).firefly.inp (generated)

000503713.b3lyp_6-31g(d).smash.inp (generated)

000503713.b3lyp_6-31g(d).nwchem.inp (generated) 000503713.b3lyp_6-31g(d).log.xz 000503713.td-b3lyp_6-31g+(d).inp 000503713.td-b3lyp_6-31g+(d).log.xz

000503713.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503713.td-b3lyp_6-31+g(d).gjf (generated)

000503713.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503713.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503713.mol 000503713.PUBCHEM 000503713.mol (via Jmol)
000503714.b3lyp_6-31g(d).inp

000503714.b3lyp_6-31g(d).qchem.inp (generated)

000503714.b3lyp_6-31g(d).gjf (generated)

000503714.b3lyp_6-31g(d).firefly.inp (generated)

000503714.b3lyp_6-31g(d).smash.inp (generated)

000503714.b3lyp_6-31g(d).nwchem.inp (generated) 000503714.b3lyp_6-31g(d).log.xz 000503714.td-b3lyp_6-31g+(d).inp 000503714.td-b3lyp_6-31g+(d).log.xz

000503714.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503714.td-b3lyp_6-31+g(d).gjf (generated)

000503714.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503714.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503714.mol 000503714.PUBCHEM 000503714.mol (via Jmol)
000503929.b3lyp_6-31g(d).inp

000503929.b3lyp_6-31g(d).qchem.inp (generated)

000503929.b3lyp_6-31g(d).gjf (generated)

000503929.b3lyp_6-31g(d).firefly.inp (generated)

000503929.b3lyp_6-31g(d).smash.inp (generated)

000503929.b3lyp_6-31g(d).nwchem.inp (generated) 000503929.b3lyp_6-31g(d).log.xz 000503929.td-b3lyp_6-31g+(d).inp 000503929.td-b3lyp_6-31g+(d).log.xz

000503929.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503929.td-b3lyp_6-31+g(d).gjf (generated)

000503929.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503929.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503929.mol 000503929.PUBCHEM 000503929.mol (via Jmol)
000503930.b3lyp_6-31g(d).inp

000503930.b3lyp_6-31g(d).qchem.inp (generated)

000503930.b3lyp_6-31g(d).gjf (generated)

000503930.b3lyp_6-31g(d).firefly.inp (generated)

000503930.b3lyp_6-31g(d).smash.inp (generated)

000503930.b3lyp_6-31g(d).nwchem.inp (generated) 000503930.b3lyp_6-31g(d).log.xz 000503930.td-b3lyp_6-31g+(d).inp 000503930.td-b3lyp_6-31g+(d).log.xz

000503930.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503930.td-b3lyp_6-31+g(d).gjf (generated)

000503930.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503930.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503930.mol 000503930.PUBCHEM 000503930.mol (via Jmol)
000503931.b3lyp_6-31g(d).inp

000503931.b3lyp_6-31g(d).qchem.inp (generated)

000503931.b3lyp_6-31g(d).gjf (generated)

000503931.b3lyp_6-31g(d).firefly.inp (generated)

000503931.b3lyp_6-31g(d).smash.inp (generated)

000503931.b3lyp_6-31g(d).nwchem.inp (generated) 000503931.b3lyp_6-31g(d).log.xz 000503931.td-b3lyp_6-31g+(d).inp 000503931.td-b3lyp_6-31g+(d).log.xz

000503931.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503931.td-b3lyp_6-31+g(d).gjf (generated)

000503931.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503931.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503931.mol 000503931.PUBCHEM 000503931.mol (via Jmol)
000503984.b3lyp_6-31g(d).inp

000503984.b3lyp_6-31g(d).qchem.inp (generated)

000503984.b3lyp_6-31g(d).gjf (generated)

000503984.b3lyp_6-31g(d).firefly.inp (generated)

000503984.b3lyp_6-31g(d).smash.inp (generated)

000503984.b3lyp_6-31g(d).nwchem.inp (generated) 000503984.b3lyp_6-31g(d).log.xz 000503984.td-b3lyp_6-31g+(d).inp 000503984.td-b3lyp_6-31g+(d).log.xz

000503984.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503984.td-b3lyp_6-31+g(d).gjf (generated)

000503984.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503984.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503984.mol 000503984.PUBCHEM 000503984.mol (via Jmol)
000503985.b3lyp_6-31g(d).inp

000503985.b3lyp_6-31g(d).qchem.inp (generated)

000503985.b3lyp_6-31g(d).gjf (generated)

000503985.b3lyp_6-31g(d).firefly.inp (generated)

000503985.b3lyp_6-31g(d).smash.inp (generated)

000503985.b3lyp_6-31g(d).nwchem.inp (generated) 000503985.b3lyp_6-31g(d).log.xz 000503985.td-b3lyp_6-31g+(d).inp 000503985.td-b3lyp_6-31g+(d).log.xz

000503985.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503985.td-b3lyp_6-31+g(d).gjf (generated)

000503985.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503985.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503985.mol 000503985.PUBCHEM 000503985.mol (via Jmol)
000503986.b3lyp_6-31g(d).inp

000503986.b3lyp_6-31g(d).qchem.inp (generated)

000503986.b3lyp_6-31g(d).gjf (generated)

000503986.b3lyp_6-31g(d).firefly.inp (generated)

000503986.b3lyp_6-31g(d).smash.inp (generated)

000503986.b3lyp_6-31g(d).nwchem.inp (generated) 000503986.b3lyp_6-31g(d).log.xz 000503986.td-b3lyp_6-31g+(d).inp 000503986.td-b3lyp_6-31g+(d).log.xz

000503986.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503986.td-b3lyp_6-31+g(d).gjf (generated)

000503986.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503986.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503986.mol 000503986.PUBCHEM 000503986.mol (via Jmol)
000503987.b3lyp_6-31g(d).inp

000503987.b3lyp_6-31g(d).qchem.inp (generated)

000503987.b3lyp_6-31g(d).gjf (generated)

000503987.b3lyp_6-31g(d).firefly.inp (generated)

000503987.b3lyp_6-31g(d).smash.inp (generated)

000503987.b3lyp_6-31g(d).nwchem.inp (generated) 000503987.b3lyp_6-31g(d).log.xz 000503987.td-b3lyp_6-31g+(d).inp 000503987.td-b3lyp_6-31g+(d).log.xz

000503987.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503987.td-b3lyp_6-31+g(d).gjf (generated)

000503987.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503987.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503987.mol 000503987.PUBCHEM 000503987.mol (via Jmol)
000503989.b3lyp_6-31g(d).inp

000503989.b3lyp_6-31g(d).qchem.inp (generated)

000503989.b3lyp_6-31g(d).gjf (generated)

000503989.b3lyp_6-31g(d).firefly.inp (generated)

000503989.b3lyp_6-31g(d).smash.inp (generated)

000503989.b3lyp_6-31g(d).nwchem.inp (generated) 000503989.b3lyp_6-31g(d).log.xz 000503989.td-b3lyp_6-31g+(d).inp 000503989.td-b3lyp_6-31g+(d).log.xz

000503989.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503989.td-b3lyp_6-31+g(d).gjf (generated)

000503989.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503989.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503989.mol 000503989.PUBCHEM 000503989.mol (via Jmol)
000503990.b3lyp_6-31g(d).inp

000503990.b3lyp_6-31g(d).qchem.inp (generated)

000503990.b3lyp_6-31g(d).gjf (generated)

000503990.b3lyp_6-31g(d).firefly.inp (generated)

000503990.b3lyp_6-31g(d).smash.inp (generated)

000503990.b3lyp_6-31g(d).nwchem.inp (generated) 000503990.b3lyp_6-31g(d).log.xz 000503990.td-b3lyp_6-31g+(d).inp 000503990.td-b3lyp_6-31g+(d).log.xz

000503990.td-b3lyp_6-31+g(d).qchem.inp (generated)

000503990.td-b3lyp_6-31+g(d).gjf (generated)

000503990.td-b3lyp_6-31+g(d).firefly.inp (generated)

000503990.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000503990.mol 000503990.PUBCHEM 000503990.mol (via Jmol)
000504004.b3lyp_6-31g(d).inp

000504004.b3lyp_6-31g(d).qchem.inp (generated)

000504004.b3lyp_6-31g(d).gjf (generated)

000504004.b3lyp_6-31g(d).firefly.inp (generated)

000504004.b3lyp_6-31g(d).smash.inp (generated)

000504004.b3lyp_6-31g(d).nwchem.inp (generated) 000504004.b3lyp_6-31g(d).log.xz 000504004.td-b3lyp_6-31g+(d).inp 000504004.td-b3lyp_6-31g+(d).log.xz

000504004.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504004.td-b3lyp_6-31+g(d).gjf (generated)

000504004.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504004.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504004.mol 000504004.PUBCHEM 000504004.mol (via Jmol)
000504005.b3lyp_6-31g(d).inp

000504005.b3lyp_6-31g(d).qchem.inp (generated)

000504005.b3lyp_6-31g(d).gjf (generated)

000504005.b3lyp_6-31g(d).firefly.inp (generated)

000504005.b3lyp_6-31g(d).smash.inp (generated)

000504005.b3lyp_6-31g(d).nwchem.inp (generated) 000504005.b3lyp_6-31g(d).log.xz 000504005.td-b3lyp_6-31g+(d).inp 000504005.td-b3lyp_6-31g+(d).log.xz

000504005.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504005.td-b3lyp_6-31+g(d).gjf (generated)

000504005.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504005.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504005.mol 000504005.PUBCHEM 000504005.mol (via Jmol)
000504006.b3lyp_6-31g(d).inp

000504006.b3lyp_6-31g(d).qchem.inp (generated)

000504006.b3lyp_6-31g(d).gjf (generated)

000504006.b3lyp_6-31g(d).firefly.inp (generated)

000504006.b3lyp_6-31g(d).smash.inp (generated)

000504006.b3lyp_6-31g(d).nwchem.inp (generated) 000504006.b3lyp_6-31g(d).log.xz 000504006.td-b3lyp_6-31g+(d).inp 000504006.td-b3lyp_6-31g+(d).log.xz

000504006.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504006.td-b3lyp_6-31+g(d).gjf (generated)

000504006.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504006.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504006.mol 000504006.PUBCHEM 000504006.mol (via Jmol)
000504007.b3lyp_6-31g(d).inp

000504007.b3lyp_6-31g(d).qchem.inp (generated)

000504007.b3lyp_6-31g(d).gjf (generated)

000504007.b3lyp_6-31g(d).firefly.inp (generated)

000504007.b3lyp_6-31g(d).smash.inp (generated)

000504007.b3lyp_6-31g(d).nwchem.inp (generated) 000504007.b3lyp_6-31g(d).log.xz 000504007.td-b3lyp_6-31g+(d).inp 000504007.td-b3lyp_6-31g+(d).log.xz

000504007.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504007.td-b3lyp_6-31+g(d).gjf (generated)

000504007.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504007.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504007.mol 000504007.PUBCHEM 000504007.mol (via Jmol)
000504008.b3lyp_6-31g(d).inp

000504008.b3lyp_6-31g(d).qchem.inp (generated)

000504008.b3lyp_6-31g(d).gjf (generated)

000504008.b3lyp_6-31g(d).firefly.inp (generated)

000504008.b3lyp_6-31g(d).smash.inp (generated)

000504008.b3lyp_6-31g(d).nwchem.inp (generated) 000504008.b3lyp_6-31g(d).log.xz 000504008.td-b3lyp_6-31g+(d).inp 000504008.td-b3lyp_6-31g+(d).log.xz

000504008.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504008.td-b3lyp_6-31+g(d).gjf (generated)

000504008.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504008.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504008.mol 000504008.PUBCHEM 000504008.mol (via Jmol)
000504009.b3lyp_6-31g(d).inp

000504009.b3lyp_6-31g(d).qchem.inp (generated)

000504009.b3lyp_6-31g(d).gjf (generated)

000504009.b3lyp_6-31g(d).firefly.inp (generated)

000504009.b3lyp_6-31g(d).smash.inp (generated)

000504009.b3lyp_6-31g(d).nwchem.inp (generated) 000504009.b3lyp_6-31g(d).log.xz 000504009.td-b3lyp_6-31g+(d).inp 000504009.td-b3lyp_6-31g+(d).log.xz

000504009.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504009.td-b3lyp_6-31+g(d).gjf (generated)

000504009.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504009.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504009.mol 000504009.PUBCHEM 000504009.mol (via Jmol)
000504010.b3lyp_6-31g(d).inp

000504010.b3lyp_6-31g(d).qchem.inp (generated)

000504010.b3lyp_6-31g(d).gjf (generated)

000504010.b3lyp_6-31g(d).firefly.inp (generated)

000504010.b3lyp_6-31g(d).smash.inp (generated)

000504010.b3lyp_6-31g(d).nwchem.inp (generated) 000504010.b3lyp_6-31g(d).log.xz 000504010.td-b3lyp_6-31g+(d).inp 000504010.td-b3lyp_6-31g+(d).log.xz

000504010.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504010.td-b3lyp_6-31+g(d).gjf (generated)

000504010.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504010.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504010.mol 000504010.PUBCHEM 000504010.mol (via Jmol)
000504011.b3lyp_6-31g(d).inp

000504011.b3lyp_6-31g(d).qchem.inp (generated)

000504011.b3lyp_6-31g(d).gjf (generated)

000504011.b3lyp_6-31g(d).firefly.inp (generated)

000504011.b3lyp_6-31g(d).smash.inp (generated)

000504011.b3lyp_6-31g(d).nwchem.inp (generated) 000504011.b3lyp_6-31g(d).log.xz 000504011.td-b3lyp_6-31g+(d).inp 000504011.td-b3lyp_6-31g+(d).log.xz

000504011.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504011.td-b3lyp_6-31+g(d).gjf (generated)

000504011.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504011.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504011.mol 000504011.PUBCHEM 000504011.mol (via Jmol)
000504012.b3lyp_6-31g(d).inp

000504012.b3lyp_6-31g(d).qchem.inp (generated)

000504012.b3lyp_6-31g(d).gjf (generated)

000504012.b3lyp_6-31g(d).firefly.inp (generated)

000504012.b3lyp_6-31g(d).smash.inp (generated)

000504012.b3lyp_6-31g(d).nwchem.inp (generated) 000504012.b3lyp_6-31g(d).log.xz 000504012.td-b3lyp_6-31g+(d).inp 000504012.td-b3lyp_6-31g+(d).log.xz

000504012.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504012.td-b3lyp_6-31+g(d).gjf (generated)

000504012.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504012.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504012.mol 000504012.PUBCHEM 000504012.mol (via Jmol)
000504013.b3lyp_6-31g(d).inp

000504013.b3lyp_6-31g(d).qchem.inp (generated)

000504013.b3lyp_6-31g(d).gjf (generated)

000504013.b3lyp_6-31g(d).firefly.inp (generated)

000504013.b3lyp_6-31g(d).smash.inp (generated)

000504013.b3lyp_6-31g(d).nwchem.inp (generated) 000504013.b3lyp_6-31g(d).log.xz 000504013.td-b3lyp_6-31g+(d).inp 000504013.td-b3lyp_6-31g+(d).log.xz

000504013.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504013.td-b3lyp_6-31+g(d).gjf (generated)

000504013.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504013.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504013.mol 000504013.PUBCHEM 000504013.mol (via Jmol)
000504014.b3lyp_6-31g(d).inp

000504014.b3lyp_6-31g(d).qchem.inp (generated)

000504014.b3lyp_6-31g(d).gjf (generated)

000504014.b3lyp_6-31g(d).firefly.inp (generated)

000504014.b3lyp_6-31g(d).smash.inp (generated)

000504014.b3lyp_6-31g(d).nwchem.inp (generated) 000504014.b3lyp_6-31g(d).log.xz 000504014.td-b3lyp_6-31g+(d).inp 000504014.td-b3lyp_6-31g+(d).log.xz

000504014.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504014.td-b3lyp_6-31+g(d).gjf (generated)

000504014.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504014.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504014.mol 000504014.PUBCHEM 000504014.mol (via Jmol)
000504015.b3lyp_6-31g(d).inp

000504015.b3lyp_6-31g(d).qchem.inp (generated)

000504015.b3lyp_6-31g(d).gjf (generated)

000504015.b3lyp_6-31g(d).firefly.inp (generated)

000504015.b3lyp_6-31g(d).smash.inp (generated)

000504015.b3lyp_6-31g(d).nwchem.inp (generated) 000504015.b3lyp_6-31g(d).log.xz 000504015.td-b3lyp_6-31g+(d).inp 000504015.td-b3lyp_6-31g+(d).log.xz

000504015.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504015.td-b3lyp_6-31+g(d).gjf (generated)

000504015.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504015.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504015.mol 000504015.PUBCHEM 000504015.mol (via Jmol)
000504016.b3lyp_6-31g(d).inp

000504016.b3lyp_6-31g(d).qchem.inp (generated)

000504016.b3lyp_6-31g(d).gjf (generated)

000504016.b3lyp_6-31g(d).firefly.inp (generated)

000504016.b3lyp_6-31g(d).smash.inp (generated)

000504016.b3lyp_6-31g(d).nwchem.inp (generated) 000504016.b3lyp_6-31g(d).log.xz 000504016.td-b3lyp_6-31g+(d).inp 000504016.td-b3lyp_6-31g+(d).log.xz

000504016.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504016.td-b3lyp_6-31+g(d).gjf (generated)

000504016.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504016.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504016.mol 000504016.PUBCHEM 000504016.mol (via Jmol)
000504017.b3lyp_6-31g(d).inp

000504017.b3lyp_6-31g(d).qchem.inp (generated)

000504017.b3lyp_6-31g(d).gjf (generated)

000504017.b3lyp_6-31g(d).firefly.inp (generated)

000504017.b3lyp_6-31g(d).smash.inp (generated)

000504017.b3lyp_6-31g(d).nwchem.inp (generated) 000504017.b3lyp_6-31g(d).log.xz 000504017.td-b3lyp_6-31g+(d).inp 000504017.td-b3lyp_6-31g+(d).log.xz

000504017.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504017.td-b3lyp_6-31+g(d).gjf (generated)

000504017.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504017.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504017.mol 000504017.PUBCHEM 000504017.mol (via Jmol)
000504018.b3lyp_6-31g(d).inp

000504018.b3lyp_6-31g(d).qchem.inp (generated)

000504018.b3lyp_6-31g(d).gjf (generated)

000504018.b3lyp_6-31g(d).firefly.inp (generated)

000504018.b3lyp_6-31g(d).smash.inp (generated)

000504018.b3lyp_6-31g(d).nwchem.inp (generated) 000504018.b3lyp_6-31g(d).log.xz 000504018.td-b3lyp_6-31g+(d).inp 000504018.td-b3lyp_6-31g+(d).log.xz

000504018.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504018.td-b3lyp_6-31+g(d).gjf (generated)

000504018.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504018.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504018.mol 000504018.PUBCHEM 000504018.mol (via Jmol)
000504019.b3lyp_6-31g(d).inp

000504019.b3lyp_6-31g(d).qchem.inp (generated)

000504019.b3lyp_6-31g(d).gjf (generated)

000504019.b3lyp_6-31g(d).firefly.inp (generated)

000504019.b3lyp_6-31g(d).smash.inp (generated)

000504019.b3lyp_6-31g(d).nwchem.inp (generated) 000504019.b3lyp_6-31g(d).log.xz 000504019.td-b3lyp_6-31g+(d).inp 000504019.td-b3lyp_6-31g+(d).log.xz

000504019.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504019.td-b3lyp_6-31+g(d).gjf (generated)

000504019.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504019.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504019.mol 000504019.PUBCHEM 000504019.mol (via Jmol)
000504020.b3lyp_6-31g(d).inp

000504020.b3lyp_6-31g(d).qchem.inp (generated)

000504020.b3lyp_6-31g(d).gjf (generated)

000504020.b3lyp_6-31g(d).firefly.inp (generated)

000504020.b3lyp_6-31g(d).smash.inp (generated)

000504020.b3lyp_6-31g(d).nwchem.inp (generated) 000504020.b3lyp_6-31g(d).log.xz 000504020.td-b3lyp_6-31g+(d).inp 000504020.td-b3lyp_6-31g+(d).log.xz

000504020.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504020.td-b3lyp_6-31+g(d).gjf (generated)

000504020.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504020.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504020.mol 000504020.PUBCHEM 000504020.mol (via Jmol)
000504035.b3lyp_6-31g(d).inp

000504035.b3lyp_6-31g(d).qchem.inp (generated)

000504035.b3lyp_6-31g(d).gjf (generated)

000504035.b3lyp_6-31g(d).firefly.inp (generated)

000504035.b3lyp_6-31g(d).smash.inp (generated)

000504035.b3lyp_6-31g(d).nwchem.inp (generated) 000504035.b3lyp_6-31g(d).log.xz 000504035.td-b3lyp_6-31g+(d).inp 000504035.td-b3lyp_6-31g+(d).log.xz

000504035.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504035.td-b3lyp_6-31+g(d).gjf (generated)

000504035.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504035.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504035.mol 000504035.PUBCHEM 000504035.mol (via Jmol)
000504045.b3lyp_6-31g(d).inp

000504045.b3lyp_6-31g(d).qchem.inp (generated)

000504045.b3lyp_6-31g(d).gjf (generated)

000504045.b3lyp_6-31g(d).firefly.inp (generated)

000504045.b3lyp_6-31g(d).smash.inp (generated)

000504045.b3lyp_6-31g(d).nwchem.inp (generated) 000504045.b3lyp_6-31g(d).log.xz 000504045.td-b3lyp_6-31g+(d).inp 000504045.td-b3lyp_6-31g+(d).log.xz

000504045.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504045.td-b3lyp_6-31+g(d).gjf (generated)

000504045.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504045.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504045.mol 000504045.PUBCHEM 000504045.mol (via Jmol)
000504046.b3lyp_6-31g(d).inp

000504046.b3lyp_6-31g(d).qchem.inp (generated)

000504046.b3lyp_6-31g(d).gjf (generated)

000504046.b3lyp_6-31g(d).firefly.inp (generated)

000504046.b3lyp_6-31g(d).smash.inp (generated)

000504046.b3lyp_6-31g(d).nwchem.inp (generated) 000504046.b3lyp_6-31g(d).log.xz 000504046.td-b3lyp_6-31g+(d).inp 000504046.td-b3lyp_6-31g+(d).log.xz

000504046.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504046.td-b3lyp_6-31+g(d).gjf (generated)

000504046.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504046.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504046.mol 000504046.PUBCHEM 000504046.mol (via Jmol)
000504048.b3lyp_6-31g(d).inp

000504048.b3lyp_6-31g(d).qchem.inp (generated)

000504048.b3lyp_6-31g(d).gjf (generated)

000504048.b3lyp_6-31g(d).firefly.inp (generated)

000504048.b3lyp_6-31g(d).smash.inp (generated)

000504048.b3lyp_6-31g(d).nwchem.inp (generated) 000504048.b3lyp_6-31g(d).log.xz 000504048.td-b3lyp_6-31g+(d).inp 000504048.td-b3lyp_6-31g+(d).log.xz

000504048.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504048.td-b3lyp_6-31+g(d).gjf (generated)

000504048.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504048.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504048.mol 000504048.PUBCHEM 000504048.mol (via Jmol)
000504055.b3lyp_6-31g(d).inp

000504055.b3lyp_6-31g(d).qchem.inp (generated)

000504055.b3lyp_6-31g(d).gjf (generated)

000504055.b3lyp_6-31g(d).firefly.inp (generated)

000504055.b3lyp_6-31g(d).smash.inp (generated)

000504055.b3lyp_6-31g(d).nwchem.inp (generated) 000504055.b3lyp_6-31g(d).log.xz 000504055.td-b3lyp_6-31g+(d).inp 000504055.td-b3lyp_6-31g+(d).log.xz

000504055.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504055.td-b3lyp_6-31+g(d).gjf (generated)

000504055.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504055.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504055.mol 000504055.PUBCHEM 000504055.mol (via Jmol)
000504056.b3lyp_6-31g(d).inp

000504056.b3lyp_6-31g(d).qchem.inp (generated)

000504056.b3lyp_6-31g(d).gjf (generated)

000504056.b3lyp_6-31g(d).firefly.inp (generated)

000504056.b3lyp_6-31g(d).smash.inp (generated)

000504056.b3lyp_6-31g(d).nwchem.inp (generated) 000504056.b3lyp_6-31g(d).log.xz 000504056.td-b3lyp_6-31g+(d).inp 000504056.td-b3lyp_6-31g+(d).log.xz

000504056.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504056.td-b3lyp_6-31+g(d).gjf (generated)

000504056.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504056.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504056.mol 000504056.PUBCHEM 000504056.mol (via Jmol)
000504067.b3lyp_6-31g(d).inp

000504067.b3lyp_6-31g(d).qchem.inp (generated)

000504067.b3lyp_6-31g(d).gjf (generated)

000504067.b3lyp_6-31g(d).firefly.inp (generated)

000504067.b3lyp_6-31g(d).smash.inp (generated)

000504067.b3lyp_6-31g(d).nwchem.inp (generated) 000504067.b3lyp_6-31g(d).log.xz 000504067.td-b3lyp_6-31g+(d).inp 000504067.td-b3lyp_6-31g+(d).log.xz

000504067.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504067.td-b3lyp_6-31+g(d).gjf (generated)

000504067.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504067.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504067.mol 000504067.PUBCHEM 000504067.mol (via Jmol)
000504068.b3lyp_6-31g(d).inp

000504068.b3lyp_6-31g(d).qchem.inp (generated)

000504068.b3lyp_6-31g(d).gjf (generated)

000504068.b3lyp_6-31g(d).firefly.inp (generated)

000504068.b3lyp_6-31g(d).smash.inp (generated)

000504068.b3lyp_6-31g(d).nwchem.inp (generated) 000504068.b3lyp_6-31g(d).log.xz 000504068.td-b3lyp_6-31g+(d).inp 000504068.td-b3lyp_6-31g+(d).log.xz

000504068.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504068.td-b3lyp_6-31+g(d).gjf (generated)

000504068.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504068.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504068.mol 000504068.PUBCHEM 000504068.mol (via Jmol)
000504069.b3lyp_6-31g(d).inp

000504069.b3lyp_6-31g(d).qchem.inp (generated)

000504069.b3lyp_6-31g(d).gjf (generated)

000504069.b3lyp_6-31g(d).firefly.inp (generated)

000504069.b3lyp_6-31g(d).smash.inp (generated)

000504069.b3lyp_6-31g(d).nwchem.inp (generated) 000504069.b3lyp_6-31g(d).log.xz 000504069.td-b3lyp_6-31g+(d).inp 000504069.td-b3lyp_6-31g+(d).log.xz

000504069.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504069.td-b3lyp_6-31+g(d).gjf (generated)

000504069.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504069.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504069.mol 000504069.PUBCHEM 000504069.mol (via Jmol)
000504071.b3lyp_6-31g(d).inp

000504071.b3lyp_6-31g(d).qchem.inp (generated)

000504071.b3lyp_6-31g(d).gjf (generated)

000504071.b3lyp_6-31g(d).firefly.inp (generated)

000504071.b3lyp_6-31g(d).smash.inp (generated)

000504071.b3lyp_6-31g(d).nwchem.inp (generated) 000504071.b3lyp_6-31g(d).log.xz 000504071.td-b3lyp_6-31g+(d).inp 000504071.td-b3lyp_6-31g+(d).log.xz

000504071.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504071.td-b3lyp_6-31+g(d).gjf (generated)

000504071.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504071.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504071.mol 000504071.PUBCHEM 000504071.mol (via Jmol)
000504072.b3lyp_6-31g(d).inp

000504072.b3lyp_6-31g(d).qchem.inp (generated)

000504072.b3lyp_6-31g(d).gjf (generated)

000504072.b3lyp_6-31g(d).firefly.inp (generated)

000504072.b3lyp_6-31g(d).smash.inp (generated)

000504072.b3lyp_6-31g(d).nwchem.inp (generated) 000504072.b3lyp_6-31g(d).log.xz 000504072.td-b3lyp_6-31g+(d).inp 000504072.td-b3lyp_6-31g+(d).log.xz

000504072.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504072.td-b3lyp_6-31+g(d).gjf (generated)

000504072.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504072.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504072.mol 000504072.PUBCHEM 000504072.mol (via Jmol)
000504073.b3lyp_6-31g(d).inp

000504073.b3lyp_6-31g(d).qchem.inp (generated)

000504073.b3lyp_6-31g(d).gjf (generated)

000504073.b3lyp_6-31g(d).firefly.inp (generated)

000504073.b3lyp_6-31g(d).smash.inp (generated)

000504073.b3lyp_6-31g(d).nwchem.inp (generated) 000504073.b3lyp_6-31g(d).log.xz 000504073.td-b3lyp_6-31g+(d).inp 000504073.td-b3lyp_6-31g+(d).log.xz

000504073.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504073.td-b3lyp_6-31+g(d).gjf (generated)

000504073.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504073.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504073.mol 000504073.PUBCHEM 000504073.mol (via Jmol)
000504074.b3lyp_6-31g(d).inp

000504074.b3lyp_6-31g(d).qchem.inp (generated)

000504074.b3lyp_6-31g(d).gjf (generated)

000504074.b3lyp_6-31g(d).firefly.inp (generated)

000504074.b3lyp_6-31g(d).smash.inp (generated)

000504074.b3lyp_6-31g(d).nwchem.inp (generated) 000504074.b3lyp_6-31g(d).log.xz 000504074.td-b3lyp_6-31g+(d).inp 000504074.td-b3lyp_6-31g+(d).log.xz

000504074.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504074.td-b3lyp_6-31+g(d).gjf (generated)

000504074.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504074.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504074.mol 000504074.PUBCHEM 000504074.mol (via Jmol)
000504075.b3lyp_6-31g(d).inp

000504075.b3lyp_6-31g(d).qchem.inp (generated)

000504075.b3lyp_6-31g(d).gjf (generated)

000504075.b3lyp_6-31g(d).firefly.inp (generated)

000504075.b3lyp_6-31g(d).smash.inp (generated)

000504075.b3lyp_6-31g(d).nwchem.inp (generated) 000504075.b3lyp_6-31g(d).log.xz 000504075.td-b3lyp_6-31g+(d).inp 000504075.td-b3lyp_6-31g+(d).log.xz

000504075.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504075.td-b3lyp_6-31+g(d).gjf (generated)

000504075.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504075.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504075.mol 000504075.PUBCHEM 000504075.mol (via Jmol)
000504154.b3lyp_6-31g(d).inp

000504154.b3lyp_6-31g(d).qchem.inp (generated)

000504154.b3lyp_6-31g(d).gjf (generated)

000504154.b3lyp_6-31g(d).firefly.inp (generated)

000504154.b3lyp_6-31g(d).smash.inp (generated)

000504154.b3lyp_6-31g(d).nwchem.inp (generated) 000504154.b3lyp_6-31g(d).log.xz 000504154.td-b3lyp_6-31g+(d).inp 000504154.td-b3lyp_6-31g+(d).log.xz

000504154.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504154.td-b3lyp_6-31+g(d).gjf (generated)

000504154.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504154.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504154.mol 000504154.PUBCHEM 000504154.mol (via Jmol)
000504175.b3lyp_6-31g(d).inp

000504175.b3lyp_6-31g(d).qchem.inp (generated)

000504175.b3lyp_6-31g(d).gjf (generated)

000504175.b3lyp_6-31g(d).firefly.inp (generated)

000504175.b3lyp_6-31g(d).smash.inp (generated)

000504175.b3lyp_6-31g(d).nwchem.inp (generated) 000504175.b3lyp_6-31g(d).log.xz 000504175.td-b3lyp_6-31g+(d).inp 000504175.td-b3lyp_6-31g+(d).log.xz

000504175.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504175.td-b3lyp_6-31+g(d).gjf (generated)

000504175.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504175.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504175.mol 000504175.PUBCHEM 000504175.mol (via Jmol)
000504176.b3lyp_6-31g(d).inp

000504176.b3lyp_6-31g(d).qchem.inp (generated)

000504176.b3lyp_6-31g(d).gjf (generated)

000504176.b3lyp_6-31g(d).firefly.inp (generated)

000504176.b3lyp_6-31g(d).smash.inp (generated)

000504176.b3lyp_6-31g(d).nwchem.inp (generated) 000504176.b3lyp_6-31g(d).log.xz 000504176.td-b3lyp_6-31g+(d).inp 000504176.td-b3lyp_6-31g+(d).log.xz

000504176.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504176.td-b3lyp_6-31+g(d).gjf (generated)

000504176.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504176.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504176.mol 000504176.PUBCHEM 000504176.mol (via Jmol)
000504177.b3lyp_6-31g(d).inp

000504177.b3lyp_6-31g(d).qchem.inp (generated)

000504177.b3lyp_6-31g(d).gjf (generated)

000504177.b3lyp_6-31g(d).firefly.inp (generated)

000504177.b3lyp_6-31g(d).smash.inp (generated)

000504177.b3lyp_6-31g(d).nwchem.inp (generated) 000504177.b3lyp_6-31g(d).log.xz 000504177.td-b3lyp_6-31g+(d).inp 000504177.td-b3lyp_6-31g+(d).log.xz

000504177.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504177.td-b3lyp_6-31+g(d).gjf (generated)

000504177.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504177.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504177.mol 000504177.PUBCHEM 000504177.mol (via Jmol)
000504178.b3lyp_6-31g(d).inp

000504178.b3lyp_6-31g(d).qchem.inp (generated)

000504178.b3lyp_6-31g(d).gjf (generated)

000504178.b3lyp_6-31g(d).firefly.inp (generated)

000504178.b3lyp_6-31g(d).smash.inp (generated)

000504178.b3lyp_6-31g(d).nwchem.inp (generated) 000504178.b3lyp_6-31g(d).log.xz 000504178.td-b3lyp_6-31g+(d).inp 000504178.td-b3lyp_6-31g+(d).log.xz

000504178.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504178.td-b3lyp_6-31+g(d).gjf (generated)

000504178.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504178.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504178.mol 000504178.PUBCHEM 000504178.mol (via Jmol)
000504179.b3lyp_6-31g(d).inp

000504179.b3lyp_6-31g(d).qchem.inp (generated)

000504179.b3lyp_6-31g(d).gjf (generated)

000504179.b3lyp_6-31g(d).firefly.inp (generated)

000504179.b3lyp_6-31g(d).smash.inp (generated)

000504179.b3lyp_6-31g(d).nwchem.inp (generated) 000504179.b3lyp_6-31g(d).log.xz 000504179.td-b3lyp_6-31g+(d).inp 000504179.td-b3lyp_6-31g+(d).log.xz

000504179.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504179.td-b3lyp_6-31+g(d).gjf (generated)

000504179.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504179.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504179.mol 000504179.PUBCHEM 000504179.mol (via Jmol)
000504232.b3lyp_6-31g(d).inp

000504232.b3lyp_6-31g(d).qchem.inp (generated)

000504232.b3lyp_6-31g(d).gjf (generated)

000504232.b3lyp_6-31g(d).firefly.inp (generated)

000504232.b3lyp_6-31g(d).smash.inp (generated)

000504232.b3lyp_6-31g(d).nwchem.inp (generated) 000504232.b3lyp_6-31g(d).log.xz 000504232.td-b3lyp_6-31g+(d).inp 000504232.td-b3lyp_6-31g+(d).log.xz

000504232.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504232.td-b3lyp_6-31+g(d).gjf (generated)

000504232.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504232.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504232.mol 000504232.PUBCHEM 000504232.mol (via Jmol)
000504234.b3lyp_6-31g(d).inp

000504234.b3lyp_6-31g(d).qchem.inp (generated)

000504234.b3lyp_6-31g(d).gjf (generated)

000504234.b3lyp_6-31g(d).firefly.inp (generated)

000504234.b3lyp_6-31g(d).smash.inp (generated)

000504234.b3lyp_6-31g(d).nwchem.inp (generated) 000504234.b3lyp_6-31g(d).log.xz 000504234.td-b3lyp_6-31g+(d).inp 000504234.td-b3lyp_6-31g+(d).log.xz

000504234.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504234.td-b3lyp_6-31+g(d).gjf (generated)

000504234.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504234.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504234.mol 000504234.PUBCHEM 000504234.mol (via Jmol)
000504238.b3lyp_6-31g(d).inp

000504238.b3lyp_6-31g(d).qchem.inp (generated)

000504238.b3lyp_6-31g(d).gjf (generated)

000504238.b3lyp_6-31g(d).firefly.inp (generated)

000504238.b3lyp_6-31g(d).smash.inp (generated)

000504238.b3lyp_6-31g(d).nwchem.inp (generated) 000504238.b3lyp_6-31g(d).log.xz 000504238.td-b3lyp_6-31g+(d).inp 000504238.td-b3lyp_6-31g+(d).log.xz

000504238.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504238.td-b3lyp_6-31+g(d).gjf (generated)

000504238.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504238.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504238.mol 000504238.PUBCHEM 000504238.mol (via Jmol)
000504240.b3lyp_6-31g(d).inp

000504240.b3lyp_6-31g(d).qchem.inp (generated)

000504240.b3lyp_6-31g(d).gjf (generated)

000504240.b3lyp_6-31g(d).firefly.inp (generated)

000504240.b3lyp_6-31g(d).smash.inp (generated)

000504240.b3lyp_6-31g(d).nwchem.inp (generated) 000504240.b3lyp_6-31g(d).log.xz 000504240.td-b3lyp_6-31g+(d).inp 000504240.td-b3lyp_6-31g+(d).log.xz

000504240.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504240.td-b3lyp_6-31+g(d).gjf (generated)

000504240.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504240.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504240.mol 000504240.PUBCHEM 000504240.mol (via Jmol)
000504241.b3lyp_6-31g(d).inp

000504241.b3lyp_6-31g(d).qchem.inp (generated)

000504241.b3lyp_6-31g(d).gjf (generated)

000504241.b3lyp_6-31g(d).firefly.inp (generated)

000504241.b3lyp_6-31g(d).smash.inp (generated)

000504241.b3lyp_6-31g(d).nwchem.inp (generated) 000504241.b3lyp_6-31g(d).log.xz 000504241.td-b3lyp_6-31g+(d).inp 000504241.td-b3lyp_6-31g+(d).log.xz

000504241.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504241.td-b3lyp_6-31+g(d).gjf (generated)

000504241.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504241.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504241.mol 000504241.PUBCHEM 000504241.mol (via Jmol)
000504243.b3lyp_6-31g(d).inp

000504243.b3lyp_6-31g(d).qchem.inp (generated)

000504243.b3lyp_6-31g(d).gjf (generated)

000504243.b3lyp_6-31g(d).firefly.inp (generated)

000504243.b3lyp_6-31g(d).smash.inp (generated)

000504243.b3lyp_6-31g(d).nwchem.inp (generated) 000504243.b3lyp_6-31g(d).log.xz 000504243.td-b3lyp_6-31g+(d).inp 000504243.td-b3lyp_6-31g+(d).log.xz

000504243.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504243.td-b3lyp_6-31+g(d).gjf (generated)

000504243.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504243.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504243.mol 000504243.PUBCHEM 000504243.mol (via Jmol)
000504248.b3lyp_6-31g(d).inp

000504248.b3lyp_6-31g(d).qchem.inp (generated)

000504248.b3lyp_6-31g(d).gjf (generated)

000504248.b3lyp_6-31g(d).firefly.inp (generated)

000504248.b3lyp_6-31g(d).smash.inp (generated)

000504248.b3lyp_6-31g(d).nwchem.inp (generated) 000504248.b3lyp_6-31g(d).log.xz 000504248.td-b3lyp_6-31g+(d).inp 000504248.td-b3lyp_6-31g+(d).log.xz

000504248.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504248.td-b3lyp_6-31+g(d).gjf (generated)

000504248.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504248.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504248.mol 000504248.PUBCHEM 000504248.mol (via Jmol)
000504251.b3lyp_6-31g(d).inp

000504251.b3lyp_6-31g(d).qchem.inp (generated)

000504251.b3lyp_6-31g(d).gjf (generated)

000504251.b3lyp_6-31g(d).firefly.inp (generated)

000504251.b3lyp_6-31g(d).smash.inp (generated)

000504251.b3lyp_6-31g(d).nwchem.inp (generated) 000504251.b3lyp_6-31g(d).log.xz 000504251.td-b3lyp_6-31g+(d).inp 000504251.td-b3lyp_6-31g+(d).log.xz

000504251.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504251.td-b3lyp_6-31+g(d).gjf (generated)

000504251.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504251.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504251.mol 000504251.PUBCHEM 000504251.mol (via Jmol)
000504258.b3lyp_6-31g(d).inp

000504258.b3lyp_6-31g(d).qchem.inp (generated)

000504258.b3lyp_6-31g(d).gjf (generated)

000504258.b3lyp_6-31g(d).firefly.inp (generated)

000504258.b3lyp_6-31g(d).smash.inp (generated)

000504258.b3lyp_6-31g(d).nwchem.inp (generated) 000504258.b3lyp_6-31g(d).log.xz 000504258.td-b3lyp_6-31g+(d).inp 000504258.td-b3lyp_6-31g+(d).log.xz

000504258.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504258.td-b3lyp_6-31+g(d).gjf (generated)

000504258.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504258.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504258.mol 000504258.PUBCHEM 000504258.mol (via Jmol)
000504259.b3lyp_6-31g(d).inp

000504259.b3lyp_6-31g(d).qchem.inp (generated)

000504259.b3lyp_6-31g(d).gjf (generated)

000504259.b3lyp_6-31g(d).firefly.inp (generated)

000504259.b3lyp_6-31g(d).smash.inp (generated)

000504259.b3lyp_6-31g(d).nwchem.inp (generated) 000504259.b3lyp_6-31g(d).log.xz 000504259.td-b3lyp_6-31g+(d).inp 000504259.td-b3lyp_6-31g+(d).log.xz

000504259.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504259.td-b3lyp_6-31+g(d).gjf (generated)

000504259.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504259.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504259.mol 000504259.PUBCHEM 000504259.mol (via Jmol)
000504287.b3lyp_6-31g(d).inp

000504287.b3lyp_6-31g(d).qchem.inp (generated)

000504287.b3lyp_6-31g(d).gjf (generated)

000504287.b3lyp_6-31g(d).firefly.inp (generated)

000504287.b3lyp_6-31g(d).smash.inp (generated)

000504287.b3lyp_6-31g(d).nwchem.inp (generated) 000504287.b3lyp_6-31g(d).log.xz 000504287.td-b3lyp_6-31g+(d).inp 000504287.td-b3lyp_6-31g+(d).log.xz

000504287.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504287.td-b3lyp_6-31+g(d).gjf (generated)

000504287.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504287.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504287.mol 000504287.PUBCHEM 000504287.mol (via Jmol)
000504288.b3lyp_6-31g(d).inp

000504288.b3lyp_6-31g(d).qchem.inp (generated)

000504288.b3lyp_6-31g(d).gjf (generated)

000504288.b3lyp_6-31g(d).firefly.inp (generated)

000504288.b3lyp_6-31g(d).smash.inp (generated)

000504288.b3lyp_6-31g(d).nwchem.inp (generated) 000504288.b3lyp_6-31g(d).log.xz 000504288.td-b3lyp_6-31g+(d).inp 000504288.td-b3lyp_6-31g+(d).log.xz

000504288.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504288.td-b3lyp_6-31+g(d).gjf (generated)

000504288.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504288.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504288.mol 000504288.PUBCHEM 000504288.mol (via Jmol)
000504290.b3lyp_6-31g(d).inp

000504290.b3lyp_6-31g(d).qchem.inp (generated)

000504290.b3lyp_6-31g(d).gjf (generated)

000504290.b3lyp_6-31g(d).firefly.inp (generated)

000504290.b3lyp_6-31g(d).smash.inp (generated)

000504290.b3lyp_6-31g(d).nwchem.inp (generated) 000504290.b3lyp_6-31g(d).log.xz 000504290.td-b3lyp_6-31g+(d).inp 000504290.td-b3lyp_6-31g+(d).log.xz

000504290.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504290.td-b3lyp_6-31+g(d).gjf (generated)

000504290.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504290.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504290.mol 000504290.PUBCHEM 000504290.mol (via Jmol)
000504291.b3lyp_6-31g(d).inp

000504291.b3lyp_6-31g(d).qchem.inp (generated)

000504291.b3lyp_6-31g(d).gjf (generated)

000504291.b3lyp_6-31g(d).firefly.inp (generated)

000504291.b3lyp_6-31g(d).smash.inp (generated)

000504291.b3lyp_6-31g(d).nwchem.inp (generated) 000504291.b3lyp_6-31g(d).log.xz 000504291.td-b3lyp_6-31g+(d).inp 000504291.td-b3lyp_6-31g+(d).log.xz

000504291.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504291.td-b3lyp_6-31+g(d).gjf (generated)

000504291.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504291.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504291.mol 000504291.PUBCHEM 000504291.mol (via Jmol)
000504299.b3lyp_6-31g(d).inp

000504299.b3lyp_6-31g(d).qchem.inp (generated)

000504299.b3lyp_6-31g(d).gjf (generated)

000504299.b3lyp_6-31g(d).firefly.inp (generated)

000504299.b3lyp_6-31g(d).smash.inp (generated)

000504299.b3lyp_6-31g(d).nwchem.inp (generated) 000504299.b3lyp_6-31g(d).log.xz 000504299.td-b3lyp_6-31g+(d).inp 000504299.td-b3lyp_6-31g+(d).log.xz

000504299.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504299.td-b3lyp_6-31+g(d).gjf (generated)

000504299.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504299.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504299.mol 000504299.PUBCHEM 000504299.mol (via Jmol)
000504301.b3lyp_6-31g(d).inp

000504301.b3lyp_6-31g(d).qchem.inp (generated)

000504301.b3lyp_6-31g(d).gjf (generated)

000504301.b3lyp_6-31g(d).firefly.inp (generated)

000504301.b3lyp_6-31g(d).smash.inp (generated)

000504301.b3lyp_6-31g(d).nwchem.inp (generated) 000504301.b3lyp_6-31g(d).log.xz 000504301.td-b3lyp_6-31g+(d).inp 000504301.td-b3lyp_6-31g+(d).log.xz

000504301.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504301.td-b3lyp_6-31+g(d).gjf (generated)

000504301.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504301.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504301.mol 000504301.PUBCHEM 000504301.mol (via Jmol)
000504307.b3lyp_6-31g(d).inp

000504307.b3lyp_6-31g(d).qchem.inp (generated)

000504307.b3lyp_6-31g(d).gjf (generated)

000504307.b3lyp_6-31g(d).firefly.inp (generated)

000504307.b3lyp_6-31g(d).smash.inp (generated)

000504307.b3lyp_6-31g(d).nwchem.inp (generated) 000504307.b3lyp_6-31g(d).log.xz 000504307.td-b3lyp_6-31g+(d).inp 000504307.td-b3lyp_6-31g+(d).log.xz

000504307.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504307.td-b3lyp_6-31+g(d).gjf (generated)

000504307.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504307.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504307.mol 000504307.PUBCHEM 000504307.mol (via Jmol)
000504310.b3lyp_6-31g(d).inp

000504310.b3lyp_6-31g(d).qchem.inp (generated)

000504310.b3lyp_6-31g(d).gjf (generated)

000504310.b3lyp_6-31g(d).firefly.inp (generated)

000504310.b3lyp_6-31g(d).smash.inp (generated)

000504310.b3lyp_6-31g(d).nwchem.inp (generated) 000504310.b3lyp_6-31g(d).log.xz 000504310.td-b3lyp_6-31g+(d).inp 000504310.td-b3lyp_6-31g+(d).log.xz

000504310.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504310.td-b3lyp_6-31+g(d).gjf (generated)

000504310.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504310.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504310.mol 000504310.PUBCHEM 000504310.mol (via Jmol)
000504313.b3lyp_6-31g(d).inp

000504313.b3lyp_6-31g(d).qchem.inp (generated)

000504313.b3lyp_6-31g(d).gjf (generated)

000504313.b3lyp_6-31g(d).firefly.inp (generated)

000504313.b3lyp_6-31g(d).smash.inp (generated)

000504313.b3lyp_6-31g(d).nwchem.inp (generated) 000504313.b3lyp_6-31g(d).log.xz 000504313.td-b3lyp_6-31g+(d).inp 000504313.td-b3lyp_6-31g+(d).log.xz

000504313.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504313.td-b3lyp_6-31+g(d).gjf (generated)

000504313.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504313.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504313.mol 000504313.PUBCHEM 000504313.mol (via Jmol)
000504322.b3lyp_6-31g(d).inp

000504322.b3lyp_6-31g(d).qchem.inp (generated)

000504322.b3lyp_6-31g(d).gjf (generated)

000504322.b3lyp_6-31g(d).firefly.inp (generated)

000504322.b3lyp_6-31g(d).smash.inp (generated)

000504322.b3lyp_6-31g(d).nwchem.inp (generated) 000504322.b3lyp_6-31g(d).log.xz 000504322.td-b3lyp_6-31g+(d).inp 000504322.td-b3lyp_6-31g+(d).log.xz

000504322.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504322.td-b3lyp_6-31+g(d).gjf (generated)

000504322.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504322.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504322.mol 000504322.PUBCHEM 000504322.mol (via Jmol)
000504336.b3lyp_6-31g(d).inp

000504336.b3lyp_6-31g(d).qchem.inp (generated)

000504336.b3lyp_6-31g(d).gjf (generated)

000504336.b3lyp_6-31g(d).firefly.inp (generated)

000504336.b3lyp_6-31g(d).smash.inp (generated)

000504336.b3lyp_6-31g(d).nwchem.inp (generated) 000504336.b3lyp_6-31g(d).log.xz 000504336.td-b3lyp_6-31g+(d).inp 000504336.td-b3lyp_6-31g+(d).log.xz

000504336.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504336.td-b3lyp_6-31+g(d).gjf (generated)

000504336.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504336.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504336.mol 000504336.PUBCHEM 000504336.mol (via Jmol)
000504340.b3lyp_6-31g(d).inp

000504340.b3lyp_6-31g(d).qchem.inp (generated)

000504340.b3lyp_6-31g(d).gjf (generated)

000504340.b3lyp_6-31g(d).firefly.inp (generated)

000504340.b3lyp_6-31g(d).smash.inp (generated)

000504340.b3lyp_6-31g(d).nwchem.inp (generated) 000504340.b3lyp_6-31g(d).log.xz 000504340.td-b3lyp_6-31g+(d).inp 000504340.td-b3lyp_6-31g+(d).log.xz

000504340.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504340.td-b3lyp_6-31+g(d).gjf (generated)

000504340.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504340.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504340.mol 000504340.PUBCHEM 000504340.mol (via Jmol)
000504341.b3lyp_6-31g(d).inp

000504341.b3lyp_6-31g(d).qchem.inp (generated)

000504341.b3lyp_6-31g(d).gjf (generated)

000504341.b3lyp_6-31g(d).firefly.inp (generated)

000504341.b3lyp_6-31g(d).smash.inp (generated)

000504341.b3lyp_6-31g(d).nwchem.inp (generated) 000504341.b3lyp_6-31g(d).log.xz 000504341.td-b3lyp_6-31g+(d).inp 000504341.td-b3lyp_6-31g+(d).log.xz

000504341.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504341.td-b3lyp_6-31+g(d).gjf (generated)

000504341.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504341.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504341.mol 000504341.PUBCHEM 000504341.mol (via Jmol)
000504342.b3lyp_6-31g(d).inp

000504342.b3lyp_6-31g(d).qchem.inp (generated)

000504342.b3lyp_6-31g(d).gjf (generated)

000504342.b3lyp_6-31g(d).firefly.inp (generated)

000504342.b3lyp_6-31g(d).smash.inp (generated)

000504342.b3lyp_6-31g(d).nwchem.inp (generated) 000504342.b3lyp_6-31g(d).log.xz 000504342.td-b3lyp_6-31g+(d).inp 000504342.td-b3lyp_6-31g+(d).log.xz

000504342.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504342.td-b3lyp_6-31+g(d).gjf (generated)

000504342.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504342.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504342.mol 000504342.PUBCHEM 000504342.mol (via Jmol)
000504345.b3lyp_6-31g(d).inp

000504345.b3lyp_6-31g(d).qchem.inp (generated)

000504345.b3lyp_6-31g(d).gjf (generated)

000504345.b3lyp_6-31g(d).firefly.inp (generated)

000504345.b3lyp_6-31g(d).smash.inp (generated)

000504345.b3lyp_6-31g(d).nwchem.inp (generated) 000504345.b3lyp_6-31g(d).log.xz 000504345.td-b3lyp_6-31g+(d).inp 000504345.td-b3lyp_6-31g+(d).log.xz

000504345.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504345.td-b3lyp_6-31+g(d).gjf (generated)

000504345.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504345.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504345.mol 000504345.PUBCHEM 000504345.mol (via Jmol)
000504347.b3lyp_6-31g(d).inp

000504347.b3lyp_6-31g(d).qchem.inp (generated)

000504347.b3lyp_6-31g(d).gjf (generated)

000504347.b3lyp_6-31g(d).firefly.inp (generated)

000504347.b3lyp_6-31g(d).smash.inp (generated)

000504347.b3lyp_6-31g(d).nwchem.inp (generated) 000504347.b3lyp_6-31g(d).log.xz 000504347.td-b3lyp_6-31g+(d).inp 000504347.td-b3lyp_6-31g+(d).log.xz

000504347.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504347.td-b3lyp_6-31+g(d).gjf (generated)

000504347.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504347.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504347.mol 000504347.PUBCHEM 000504347.mol (via Jmol)
000504349.b3lyp_6-31g(d).inp

000504349.b3lyp_6-31g(d).qchem.inp (generated)

000504349.b3lyp_6-31g(d).gjf (generated)

000504349.b3lyp_6-31g(d).firefly.inp (generated)

000504349.b3lyp_6-31g(d).smash.inp (generated)

000504349.b3lyp_6-31g(d).nwchem.inp (generated) 000504349.b3lyp_6-31g(d).log.xz 000504349.td-b3lyp_6-31g+(d).inp 000504349.td-b3lyp_6-31g+(d).log.xz

000504349.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504349.td-b3lyp_6-31+g(d).gjf (generated)

000504349.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504349.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504349.mol 000504349.PUBCHEM 000504349.mol (via Jmol)
000504350.b3lyp_6-31g(d).inp

000504350.b3lyp_6-31g(d).qchem.inp (generated)

000504350.b3lyp_6-31g(d).gjf (generated)

000504350.b3lyp_6-31g(d).firefly.inp (generated)

000504350.b3lyp_6-31g(d).smash.inp (generated)

000504350.b3lyp_6-31g(d).nwchem.inp (generated) 000504350.b3lyp_6-31g(d).log.xz 000504350.td-b3lyp_6-31g+(d).inp 000504350.td-b3lyp_6-31g+(d).log.xz

000504350.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504350.td-b3lyp_6-31+g(d).gjf (generated)

000504350.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504350.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504350.mol 000504350.PUBCHEM 000504350.mol (via Jmol)
000504351.b3lyp_6-31g(d).inp

000504351.b3lyp_6-31g(d).qchem.inp (generated)

000504351.b3lyp_6-31g(d).gjf (generated)

000504351.b3lyp_6-31g(d).firefly.inp (generated)

000504351.b3lyp_6-31g(d).smash.inp (generated)

000504351.b3lyp_6-31g(d).nwchem.inp (generated) 000504351.b3lyp_6-31g(d).log.xz 000504351.td-b3lyp_6-31g+(d).inp 000504351.td-b3lyp_6-31g+(d).log.xz

000504351.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504351.td-b3lyp_6-31+g(d).gjf (generated)

000504351.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504351.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504351.mol 000504351.PUBCHEM 000504351.mol (via Jmol)
000504353.b3lyp_6-31g(d).inp

000504353.b3lyp_6-31g(d).qchem.inp (generated)

000504353.b3lyp_6-31g(d).gjf (generated)

000504353.b3lyp_6-31g(d).firefly.inp (generated)

000504353.b3lyp_6-31g(d).smash.inp (generated)

000504353.b3lyp_6-31g(d).nwchem.inp (generated) 000504353.b3lyp_6-31g(d).log.xz 000504353.td-b3lyp_6-31g+(d).inp 000504353.td-b3lyp_6-31g+(d).log.xz

000504353.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504353.td-b3lyp_6-31+g(d).gjf (generated)

000504353.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504353.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504353.mol 000504353.PUBCHEM 000504353.mol (via Jmol)
000504354.b3lyp_6-31g(d).inp

000504354.b3lyp_6-31g(d).qchem.inp (generated)

000504354.b3lyp_6-31g(d).gjf (generated)

000504354.b3lyp_6-31g(d).firefly.inp (generated)

000504354.b3lyp_6-31g(d).smash.inp (generated)

000504354.b3lyp_6-31g(d).nwchem.inp (generated) 000504354.b3lyp_6-31g(d).log.xz 000504354.td-b3lyp_6-31g+(d).inp 000504354.td-b3lyp_6-31g+(d).log.xz

000504354.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504354.td-b3lyp_6-31+g(d).gjf (generated)

000504354.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504354.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504354.mol 000504354.PUBCHEM 000504354.mol (via Jmol)
000504534.b3lyp_6-31g(d).inp

000504534.b3lyp_6-31g(d).qchem.inp (generated)

000504534.b3lyp_6-31g(d).gjf (generated)

000504534.b3lyp_6-31g(d).firefly.inp (generated)

000504534.b3lyp_6-31g(d).smash.inp (generated)

000504534.b3lyp_6-31g(d).nwchem.inp (generated) 000504534.b3lyp_6-31g(d).log.xz 000504534.td-b3lyp_6-31g+(d).inp 000504534.td-b3lyp_6-31g+(d).log.xz

000504534.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504534.td-b3lyp_6-31+g(d).gjf (generated)

000504534.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504534.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504534.mol 000504534.PUBCHEM 000504534.mol (via Jmol)
000504535.b3lyp_6-31g(d).inp

000504535.b3lyp_6-31g(d).qchem.inp (generated)

000504535.b3lyp_6-31g(d).gjf (generated)

000504535.b3lyp_6-31g(d).firefly.inp (generated)

000504535.b3lyp_6-31g(d).smash.inp (generated)

000504535.b3lyp_6-31g(d).nwchem.inp (generated) 000504535.b3lyp_6-31g(d).log.xz 000504535.td-b3lyp_6-31g+(d).inp 000504535.td-b3lyp_6-31g+(d).log.xz

000504535.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504535.td-b3lyp_6-31+g(d).gjf (generated)

000504535.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504535.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504535.mol 000504535.PUBCHEM 000504535.mol (via Jmol)
000504538.b3lyp_6-31g(d).inp

000504538.b3lyp_6-31g(d).qchem.inp (generated)

000504538.b3lyp_6-31g(d).gjf (generated)

000504538.b3lyp_6-31g(d).firefly.inp (generated)

000504538.b3lyp_6-31g(d).smash.inp (generated)

000504538.b3lyp_6-31g(d).nwchem.inp (generated) 000504538.b3lyp_6-31g(d).log.xz 000504538.td-b3lyp_6-31g+(d).inp 000504538.td-b3lyp_6-31g+(d).log.xz

000504538.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504538.td-b3lyp_6-31+g(d).gjf (generated)

000504538.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504538.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504538.mol 000504538.PUBCHEM 000504538.mol (via Jmol)
000504545.b3lyp_6-31g(d).inp

000504545.b3lyp_6-31g(d).qchem.inp (generated)

000504545.b3lyp_6-31g(d).gjf (generated)

000504545.b3lyp_6-31g(d).firefly.inp (generated)

000504545.b3lyp_6-31g(d).smash.inp (generated)

000504545.b3lyp_6-31g(d).nwchem.inp (generated) 000504545.b3lyp_6-31g(d).log.xz 000504545.td-b3lyp_6-31g+(d).inp 000504545.td-b3lyp_6-31g+(d).log.xz

000504545.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504545.td-b3lyp_6-31+g(d).gjf (generated)

000504545.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504545.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504545.mol 000504545.PUBCHEM 000504545.mol (via Jmol)
000504551.b3lyp_6-31g(d).inp

000504551.b3lyp_6-31g(d).qchem.inp (generated)

000504551.b3lyp_6-31g(d).gjf (generated)

000504551.b3lyp_6-31g(d).firefly.inp (generated)

000504551.b3lyp_6-31g(d).smash.inp (generated)

000504551.b3lyp_6-31g(d).nwchem.inp (generated) 000504551.b3lyp_6-31g(d).log.xz 000504551.td-b3lyp_6-31g+(d).inp 000504551.td-b3lyp_6-31g+(d).log.xz

000504551.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504551.td-b3lyp_6-31+g(d).gjf (generated)

000504551.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504551.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504551.mol 000504551.PUBCHEM 000504551.mol (via Jmol)
000504555.b3lyp_6-31g(d).inp

000504555.b3lyp_6-31g(d).qchem.inp (generated)

000504555.b3lyp_6-31g(d).gjf (generated)

000504555.b3lyp_6-31g(d).firefly.inp (generated)

000504555.b3lyp_6-31g(d).smash.inp (generated)

000504555.b3lyp_6-31g(d).nwchem.inp (generated) 000504555.b3lyp_6-31g(d).log.xz 000504555.td-b3lyp_6-31g+(d).inp 000504555.td-b3lyp_6-31g+(d).log.xz

000504555.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504555.td-b3lyp_6-31+g(d).gjf (generated)

000504555.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504555.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504555.mol 000504555.PUBCHEM 000504555.mol (via Jmol)
000504571.b3lyp_6-31g(d).inp

000504571.b3lyp_6-31g(d).qchem.inp (generated)

000504571.b3lyp_6-31g(d).gjf (generated)

000504571.b3lyp_6-31g(d).firefly.inp (generated)

000504571.b3lyp_6-31g(d).smash.inp (generated)

000504571.b3lyp_6-31g(d).nwchem.inp (generated) 000504571.b3lyp_6-31g(d).log.xz 000504571.td-b3lyp_6-31g+(d).inp 000504571.td-b3lyp_6-31g+(d).log.xz

000504571.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504571.td-b3lyp_6-31+g(d).gjf (generated)

000504571.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504571.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504571.mol 000504571.PUBCHEM 000504571.mol (via Jmol)
000504572.b3lyp_6-31g(d).inp

000504572.b3lyp_6-31g(d).qchem.inp (generated)

000504572.b3lyp_6-31g(d).gjf (generated)

000504572.b3lyp_6-31g(d).firefly.inp (generated)

000504572.b3lyp_6-31g(d).smash.inp (generated)

000504572.b3lyp_6-31g(d).nwchem.inp (generated) 000504572.b3lyp_6-31g(d).log.xz 000504572.td-b3lyp_6-31g+(d).inp 000504572.td-b3lyp_6-31g+(d).log.xz

000504572.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504572.td-b3lyp_6-31+g(d).gjf (generated)

000504572.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504572.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504572.mol 000504572.PUBCHEM 000504572.mol (via Jmol)
000504575.b3lyp_6-31g(d).inp

000504575.b3lyp_6-31g(d).qchem.inp (generated)

000504575.b3lyp_6-31g(d).gjf (generated)

000504575.b3lyp_6-31g(d).firefly.inp (generated)

000504575.b3lyp_6-31g(d).smash.inp (generated)

000504575.b3lyp_6-31g(d).nwchem.inp (generated) 000504575.b3lyp_6-31g(d).log.xz 000504575.td-b3lyp_6-31g+(d).inp 000504575.td-b3lyp_6-31g+(d).log.xz

000504575.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504575.td-b3lyp_6-31+g(d).gjf (generated)

000504575.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504575.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504575.mol 000504575.PUBCHEM 000504575.mol (via Jmol)
000504590.b3lyp_6-31g(d).inp

000504590.b3lyp_6-31g(d).qchem.inp (generated)

000504590.b3lyp_6-31g(d).gjf (generated)

000504590.b3lyp_6-31g(d).firefly.inp (generated)

000504590.b3lyp_6-31g(d).smash.inp (generated)

000504590.b3lyp_6-31g(d).nwchem.inp (generated) 000504590.b3lyp_6-31g(d).log.xz 000504590.td-b3lyp_6-31g+(d).inp 000504590.td-b3lyp_6-31g+(d).log.xz

000504590.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504590.td-b3lyp_6-31+g(d).gjf (generated)

000504590.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504590.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504590.mol 000504590.PUBCHEM 000504590.mol (via Jmol)
000504591.b3lyp_6-31g(d).inp

000504591.b3lyp_6-31g(d).qchem.inp (generated)

000504591.b3lyp_6-31g(d).gjf (generated)

000504591.b3lyp_6-31g(d).firefly.inp (generated)

000504591.b3lyp_6-31g(d).smash.inp (generated)

000504591.b3lyp_6-31g(d).nwchem.inp (generated) 000504591.b3lyp_6-31g(d).log.xz 000504591.td-b3lyp_6-31g+(d).inp 000504591.td-b3lyp_6-31g+(d).log.xz

000504591.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504591.td-b3lyp_6-31+g(d).gjf (generated)

000504591.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504591.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504591.mol 000504591.PUBCHEM 000504591.mol (via Jmol)
000504592.b3lyp_6-31g(d).inp

000504592.b3lyp_6-31g(d).qchem.inp (generated)

000504592.b3lyp_6-31g(d).gjf (generated)

000504592.b3lyp_6-31g(d).firefly.inp (generated)

000504592.b3lyp_6-31g(d).smash.inp (generated)

000504592.b3lyp_6-31g(d).nwchem.inp (generated) 000504592.b3lyp_6-31g(d).log.xz 000504592.td-b3lyp_6-31g+(d).inp 000504592.td-b3lyp_6-31g+(d).log.xz

000504592.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504592.td-b3lyp_6-31+g(d).gjf (generated)

000504592.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504592.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504592.mol 000504592.PUBCHEM 000504592.mol (via Jmol)
000504604.b3lyp_6-31g(d).inp

000504604.b3lyp_6-31g(d).qchem.inp (generated)

000504604.b3lyp_6-31g(d).gjf (generated)

000504604.b3lyp_6-31g(d).firefly.inp (generated)

000504604.b3lyp_6-31g(d).smash.inp (generated)

000504604.b3lyp_6-31g(d).nwchem.inp (generated) 000504604.b3lyp_6-31g(d).log.xz 000504604.td-b3lyp_6-31g+(d).inp 000504604.td-b3lyp_6-31g+(d).log.xz

000504604.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504604.td-b3lyp_6-31+g(d).gjf (generated)

000504604.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504604.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504604.mol 000504604.PUBCHEM 000504604.mol (via Jmol)
000504605.b3lyp_6-31g(d).inp

000504605.b3lyp_6-31g(d).qchem.inp (generated)

000504605.b3lyp_6-31g(d).gjf (generated)

000504605.b3lyp_6-31g(d).firefly.inp (generated)

000504605.b3lyp_6-31g(d).smash.inp (generated)

000504605.b3lyp_6-31g(d).nwchem.inp (generated) 000504605.b3lyp_6-31g(d).log.xz 000504605.td-b3lyp_6-31g+(d).inp 000504605.td-b3lyp_6-31g+(d).log.xz

000504605.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504605.td-b3lyp_6-31+g(d).gjf (generated)

000504605.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504605.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504605.mol 000504605.PUBCHEM 000504605.mol (via Jmol)
000504659.b3lyp_6-31g(d).inp

000504659.b3lyp_6-31g(d).qchem.inp (generated)

000504659.b3lyp_6-31g(d).gjf (generated)

000504659.b3lyp_6-31g(d).firefly.inp (generated)

000504659.b3lyp_6-31g(d).smash.inp (generated)

000504659.b3lyp_6-31g(d).nwchem.inp (generated) 000504659.b3lyp_6-31g(d).log.xz 000504659.td-b3lyp_6-31g+(d).inp 000504659.td-b3lyp_6-31g+(d).log.xz

000504659.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504659.td-b3lyp_6-31+g(d).gjf (generated)

000504659.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504659.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504659.mol 000504659.PUBCHEM 000504659.mol (via Jmol)
000504660.b3lyp_6-31g(d).inp

000504660.b3lyp_6-31g(d).qchem.inp (generated)

000504660.b3lyp_6-31g(d).gjf (generated)

000504660.b3lyp_6-31g(d).firefly.inp (generated)

000504660.b3lyp_6-31g(d).smash.inp (generated)

000504660.b3lyp_6-31g(d).nwchem.inp (generated) 000504660.b3lyp_6-31g(d).log.xz 000504660.td-b3lyp_6-31g+(d).inp 000504660.td-b3lyp_6-31g+(d).log.xz

000504660.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504660.td-b3lyp_6-31+g(d).gjf (generated)

000504660.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504660.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504660.mol 000504660.PUBCHEM 000504660.mol (via Jmol)
000504661.b3lyp_6-31g(d).inp

000504661.b3lyp_6-31g(d).qchem.inp (generated)

000504661.b3lyp_6-31g(d).gjf (generated)

000504661.b3lyp_6-31g(d).firefly.inp (generated)

000504661.b3lyp_6-31g(d).smash.inp (generated)

000504661.b3lyp_6-31g(d).nwchem.inp (generated) 000504661.b3lyp_6-31g(d).log.xz 000504661.td-b3lyp_6-31g+(d).inp 000504661.td-b3lyp_6-31g+(d).log.xz

000504661.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504661.td-b3lyp_6-31+g(d).gjf (generated)

000504661.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504661.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504661.mol 000504661.PUBCHEM 000504661.mol (via Jmol)
000504662.b3lyp_6-31g(d).inp

000504662.b3lyp_6-31g(d).qchem.inp (generated)

000504662.b3lyp_6-31g(d).gjf (generated)

000504662.b3lyp_6-31g(d).firefly.inp (generated)

000504662.b3lyp_6-31g(d).smash.inp (generated)

000504662.b3lyp_6-31g(d).nwchem.inp (generated) 000504662.b3lyp_6-31g(d).log.xz 000504662.td-b3lyp_6-31g+(d).inp 000504662.td-b3lyp_6-31g+(d).log.xz

000504662.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504662.td-b3lyp_6-31+g(d).gjf (generated)

000504662.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504662.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504662.mol 000504662.PUBCHEM 000504662.mol (via Jmol)
000504663.b3lyp_6-31g(d).inp

000504663.b3lyp_6-31g(d).qchem.inp (generated)

000504663.b3lyp_6-31g(d).gjf (generated)

000504663.b3lyp_6-31g(d).firefly.inp (generated)

000504663.b3lyp_6-31g(d).smash.inp (generated)

000504663.b3lyp_6-31g(d).nwchem.inp (generated) 000504663.b3lyp_6-31g(d).log.xz 000504663.td-b3lyp_6-31g+(d).inp 000504663.td-b3lyp_6-31g+(d).log.xz

000504663.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504663.td-b3lyp_6-31+g(d).gjf (generated)

000504663.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504663.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504663.mol 000504663.PUBCHEM 000504663.mol (via Jmol)
000504665.b3lyp_6-31g(d).inp

000504665.b3lyp_6-31g(d).qchem.inp (generated)

000504665.b3lyp_6-31g(d).gjf (generated)

000504665.b3lyp_6-31g(d).firefly.inp (generated)

000504665.b3lyp_6-31g(d).smash.inp (generated)

000504665.b3lyp_6-31g(d).nwchem.inp (generated) 000504665.b3lyp_6-31g(d).log.xz 000504665.td-b3lyp_6-31g+(d).inp 000504665.td-b3lyp_6-31g+(d).log.xz

000504665.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504665.td-b3lyp_6-31+g(d).gjf (generated)

000504665.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504665.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504665.mol 000504665.PUBCHEM 000504665.mol (via Jmol)
000504666.b3lyp_6-31g(d).inp

000504666.b3lyp_6-31g(d).qchem.inp (generated)

000504666.b3lyp_6-31g(d).gjf (generated)

000504666.b3lyp_6-31g(d).firefly.inp (generated)

000504666.b3lyp_6-31g(d).smash.inp (generated)

000504666.b3lyp_6-31g(d).nwchem.inp (generated) 000504666.b3lyp_6-31g(d).log.xz 000504666.td-b3lyp_6-31g+(d).inp 000504666.td-b3lyp_6-31g+(d).log.xz

000504666.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504666.td-b3lyp_6-31+g(d).gjf (generated)

000504666.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504666.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504666.mol 000504666.PUBCHEM 000504666.mol (via Jmol)
000504699.b3lyp_6-31g(d).inp

000504699.b3lyp_6-31g(d).qchem.inp (generated)

000504699.b3lyp_6-31g(d).gjf (generated)

000504699.b3lyp_6-31g(d).firefly.inp (generated)

000504699.b3lyp_6-31g(d).smash.inp (generated)

000504699.b3lyp_6-31g(d).nwchem.inp (generated) 000504699.b3lyp_6-31g(d).log.xz 000504699.td-b3lyp_6-31g+(d).inp 000504699.td-b3lyp_6-31g+(d).log.xz

000504699.td-b3lyp_6-31+g(d).qchem.inp (generated)

000504699.td-b3lyp_6-31+g(d).gjf (generated)

000504699.td-b3lyp_6-31+g(d).firefly.inp (generated)

000504699.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000504699.mol 000504699.PUBCHEM 000504699.mol (via Jmol)
000505903.b3lyp_6-31g(d).inp

000505903.b3lyp_6-31g(d).qchem.inp (generated)

000505903.b3lyp_6-31g(d).gjf (generated)

000505903.b3lyp_6-31g(d).firefly.inp (generated)

000505903.b3lyp_6-31g(d).smash.inp (generated)

000505903.b3lyp_6-31g(d).nwchem.inp (generated) 000505903.b3lyp_6-31g(d).log.xz 000505903.td-b3lyp_6-31g+(d).inp 000505903.td-b3lyp_6-31g+(d).log.xz

000505903.td-b3lyp_6-31+g(d).qchem.inp (generated)

000505903.td-b3lyp_6-31+g(d).gjf (generated)

000505903.td-b3lyp_6-31+g(d).firefly.inp (generated)

000505903.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000505903.mol 000505903.PUBCHEM 000505903.mol (via Jmol)
000506050.b3lyp_6-31g(d).inp

000506050.b3lyp_6-31g(d).qchem.inp (generated)

000506050.b3lyp_6-31g(d).gjf (generated)

000506050.b3lyp_6-31g(d).firefly.inp (generated)

000506050.b3lyp_6-31g(d).smash.inp (generated)

000506050.b3lyp_6-31g(d).nwchem.inp (generated) 000506050.b3lyp_6-31g(d).log.xz 000506050.td-b3lyp_6-31g+(d).inp 000506050.td-b3lyp_6-31g+(d).log.xz

000506050.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506050.td-b3lyp_6-31+g(d).gjf (generated)

000506050.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506050.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506050.mol 000506050.PUBCHEM 000506050.mol (via Jmol)
000506051.b3lyp_6-31g(d).inp

000506051.b3lyp_6-31g(d).qchem.inp (generated)

000506051.b3lyp_6-31g(d).gjf (generated)

000506051.b3lyp_6-31g(d).firefly.inp (generated)

000506051.b3lyp_6-31g(d).smash.inp (generated)

000506051.b3lyp_6-31g(d).nwchem.inp (generated) 000506051.b3lyp_6-31g(d).log.xz 000506051.td-b3lyp_6-31g+(d).inp 000506051.td-b3lyp_6-31g+(d).log.xz

000506051.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506051.td-b3lyp_6-31+g(d).gjf (generated)

000506051.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506051.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506051.mol 000506051.PUBCHEM 000506051.mol (via Jmol)
000506054.b3lyp_6-31g(d).inp

000506054.b3lyp_6-31g(d).qchem.inp (generated)

000506054.b3lyp_6-31g(d).gjf (generated)

000506054.b3lyp_6-31g(d).firefly.inp (generated)

000506054.b3lyp_6-31g(d).smash.inp (generated)

000506054.b3lyp_6-31g(d).nwchem.inp (generated) 000506054.b3lyp_6-31g(d).log.xz 000506054.td-b3lyp_6-31g+(d).inp 000506054.td-b3lyp_6-31g+(d).log.xz

000506054.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506054.td-b3lyp_6-31+g(d).gjf (generated)

000506054.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506054.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506054.mol 000506054.PUBCHEM 000506054.mol (via Jmol)
000506055.b3lyp_6-31g(d).inp

000506055.b3lyp_6-31g(d).qchem.inp (generated)

000506055.b3lyp_6-31g(d).gjf (generated)

000506055.b3lyp_6-31g(d).firefly.inp (generated)

000506055.b3lyp_6-31g(d).smash.inp (generated)

000506055.b3lyp_6-31g(d).nwchem.inp (generated) 000506055.b3lyp_6-31g(d).log.xz 000506055.td-b3lyp_6-31g+(d).inp 000506055.td-b3lyp_6-31g+(d).log.xz

000506055.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506055.td-b3lyp_6-31+g(d).gjf (generated)

000506055.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506055.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506055.mol 000506055.PUBCHEM 000506055.mol (via Jmol)
000506057.b3lyp_6-31g(d).inp

000506057.b3lyp_6-31g(d).qchem.inp (generated)

000506057.b3lyp_6-31g(d).gjf (generated)

000506057.b3lyp_6-31g(d).firefly.inp (generated)

000506057.b3lyp_6-31g(d).smash.inp (generated)

000506057.b3lyp_6-31g(d).nwchem.inp (generated) 000506057.b3lyp_6-31g(d).log.xz 000506057.td-b3lyp_6-31g+(d).inp 000506057.td-b3lyp_6-31g+(d).log.xz

000506057.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506057.td-b3lyp_6-31+g(d).gjf (generated)

000506057.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506057.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506057.mol 000506057.PUBCHEM 000506057.mol (via Jmol)
000506058.b3lyp_6-31g(d).inp

000506058.b3lyp_6-31g(d).qchem.inp (generated)

000506058.b3lyp_6-31g(d).gjf (generated)

000506058.b3lyp_6-31g(d).firefly.inp (generated)

000506058.b3lyp_6-31g(d).smash.inp (generated)

000506058.b3lyp_6-31g(d).nwchem.inp (generated) 000506058.b3lyp_6-31g(d).log.xz 000506058.td-b3lyp_6-31g+(d).inp 000506058.td-b3lyp_6-31g+(d).log.xz

000506058.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506058.td-b3lyp_6-31+g(d).gjf (generated)

000506058.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506058.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506058.mol 000506058.PUBCHEM 000506058.mol (via Jmol)
000506061.b3lyp_6-31g(d).inp

000506061.b3lyp_6-31g(d).qchem.inp (generated)

000506061.b3lyp_6-31g(d).gjf (generated)

000506061.b3lyp_6-31g(d).firefly.inp (generated)

000506061.b3lyp_6-31g(d).smash.inp (generated)

000506061.b3lyp_6-31g(d).nwchem.inp (generated) 000506061.b3lyp_6-31g(d).log.xz 000506061.td-b3lyp_6-31g+(d).inp 000506061.td-b3lyp_6-31g+(d).log.xz

000506061.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506061.td-b3lyp_6-31+g(d).gjf (generated)

000506061.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506061.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506061.mol 000506061.PUBCHEM 000506061.mol (via Jmol)
000506062.b3lyp_6-31g(d).inp

000506062.b3lyp_6-31g(d).qchem.inp (generated)

000506062.b3lyp_6-31g(d).gjf (generated)

000506062.b3lyp_6-31g(d).firefly.inp (generated)

000506062.b3lyp_6-31g(d).smash.inp (generated)

000506062.b3lyp_6-31g(d).nwchem.inp (generated) 000506062.b3lyp_6-31g(d).log.xz 000506062.td-b3lyp_6-31g+(d).inp 000506062.td-b3lyp_6-31g+(d).log.xz

000506062.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506062.td-b3lyp_6-31+g(d).gjf (generated)

000506062.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506062.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506062.mol 000506062.PUBCHEM 000506062.mol (via Jmol)
000506063.b3lyp_6-31g(d).inp

000506063.b3lyp_6-31g(d).qchem.inp (generated)

000506063.b3lyp_6-31g(d).gjf (generated)

000506063.b3lyp_6-31g(d).firefly.inp (generated)

000506063.b3lyp_6-31g(d).smash.inp (generated)

000506063.b3lyp_6-31g(d).nwchem.inp (generated) 000506063.b3lyp_6-31g(d).log.xz 000506063.td-b3lyp_6-31g+(d).inp 000506063.td-b3lyp_6-31g+(d).log.xz

000506063.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506063.td-b3lyp_6-31+g(d).gjf (generated)

000506063.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506063.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506063.mol 000506063.PUBCHEM 000506063.mol (via Jmol)
000506064.b3lyp_6-31g(d).inp

000506064.b3lyp_6-31g(d).qchem.inp (generated)

000506064.b3lyp_6-31g(d).gjf (generated)

000506064.b3lyp_6-31g(d).firefly.inp (generated)

000506064.b3lyp_6-31g(d).smash.inp (generated)

000506064.b3lyp_6-31g(d).nwchem.inp (generated) 000506064.b3lyp_6-31g(d).log.xz 000506064.td-b3lyp_6-31g+(d).inp 000506064.td-b3lyp_6-31g+(d).log.xz

000506064.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506064.td-b3lyp_6-31+g(d).gjf (generated)

000506064.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506064.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506064.mol 000506064.PUBCHEM 000506064.mol (via Jmol)
000506065.b3lyp_6-31g(d).inp

000506065.b3lyp_6-31g(d).qchem.inp (generated)

000506065.b3lyp_6-31g(d).gjf (generated)

000506065.b3lyp_6-31g(d).firefly.inp (generated)

000506065.b3lyp_6-31g(d).smash.inp (generated)

000506065.b3lyp_6-31g(d).nwchem.inp (generated) 000506065.b3lyp_6-31g(d).log.xz 000506065.td-b3lyp_6-31g+(d).inp 000506065.td-b3lyp_6-31g+(d).log.xz

000506065.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506065.td-b3lyp_6-31+g(d).gjf (generated)

000506065.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506065.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506065.mol 000506065.PUBCHEM 000506065.mol (via Jmol)
000506066.b3lyp_6-31g(d).inp

000506066.b3lyp_6-31g(d).qchem.inp (generated)

000506066.b3lyp_6-31g(d).gjf (generated)

000506066.b3lyp_6-31g(d).firefly.inp (generated)

000506066.b3lyp_6-31g(d).smash.inp (generated)

000506066.b3lyp_6-31g(d).nwchem.inp (generated) 000506066.b3lyp_6-31g(d).log.xz 000506066.td-b3lyp_6-31g+(d).inp 000506066.td-b3lyp_6-31g+(d).log.xz

000506066.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506066.td-b3lyp_6-31+g(d).gjf (generated)

000506066.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506066.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506066.mol 000506066.PUBCHEM 000506066.mol (via Jmol)
000506067.b3lyp_6-31g(d).inp

000506067.b3lyp_6-31g(d).qchem.inp (generated)

000506067.b3lyp_6-31g(d).gjf (generated)

000506067.b3lyp_6-31g(d).firefly.inp (generated)

000506067.b3lyp_6-31g(d).smash.inp (generated)

000506067.b3lyp_6-31g(d).nwchem.inp (generated) 000506067.b3lyp_6-31g(d).log.xz 000506067.td-b3lyp_6-31g+(d).inp 000506067.td-b3lyp_6-31g+(d).log.xz

000506067.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506067.td-b3lyp_6-31+g(d).gjf (generated)

000506067.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506067.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506067.mol 000506067.PUBCHEM 000506067.mol (via Jmol)
000506068.b3lyp_6-31g(d).inp

000506068.b3lyp_6-31g(d).qchem.inp (generated)

000506068.b3lyp_6-31g(d).gjf (generated)

000506068.b3lyp_6-31g(d).firefly.inp (generated)

000506068.b3lyp_6-31g(d).smash.inp (generated)

000506068.b3lyp_6-31g(d).nwchem.inp (generated) 000506068.b3lyp_6-31g(d).log.xz 000506068.td-b3lyp_6-31g+(d).inp 000506068.td-b3lyp_6-31g+(d).log.xz

000506068.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506068.td-b3lyp_6-31+g(d).gjf (generated)

000506068.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506068.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506068.mol 000506068.PUBCHEM 000506068.mol (via Jmol)
000506070.b3lyp_6-31g(d).inp

000506070.b3lyp_6-31g(d).qchem.inp (generated)

000506070.b3lyp_6-31g(d).gjf (generated)

000506070.b3lyp_6-31g(d).firefly.inp (generated)

000506070.b3lyp_6-31g(d).smash.inp (generated)

000506070.b3lyp_6-31g(d).nwchem.inp (generated) 000506070.b3lyp_6-31g(d).log.xz 000506070.td-b3lyp_6-31g+(d).inp 000506070.td-b3lyp_6-31g+(d).log.xz

000506070.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506070.td-b3lyp_6-31+g(d).gjf (generated)

000506070.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506070.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506070.mol 000506070.PUBCHEM 000506070.mol (via Jmol)
000506071.b3lyp_6-31g(d).inp

000506071.b3lyp_6-31g(d).qchem.inp (generated)

000506071.b3lyp_6-31g(d).gjf (generated)

000506071.b3lyp_6-31g(d).firefly.inp (generated)

000506071.b3lyp_6-31g(d).smash.inp (generated)

000506071.b3lyp_6-31g(d).nwchem.inp (generated) 000506071.b3lyp_6-31g(d).log.xz 000506071.td-b3lyp_6-31g+(d).inp 000506071.td-b3lyp_6-31g+(d).log.xz

000506071.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506071.td-b3lyp_6-31+g(d).gjf (generated)

000506071.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506071.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506071.mol 000506071.PUBCHEM 000506071.mol (via Jmol)
000506072.b3lyp_6-31g(d).inp

000506072.b3lyp_6-31g(d).qchem.inp (generated)

000506072.b3lyp_6-31g(d).gjf (generated)

000506072.b3lyp_6-31g(d).firefly.inp (generated)

000506072.b3lyp_6-31g(d).smash.inp (generated)

000506072.b3lyp_6-31g(d).nwchem.inp (generated) 000506072.b3lyp_6-31g(d).log.xz 000506072.td-b3lyp_6-31g+(d).inp 000506072.td-b3lyp_6-31g+(d).log.xz

000506072.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506072.td-b3lyp_6-31+g(d).gjf (generated)

000506072.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506072.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506072.mol 000506072.PUBCHEM 000506072.mol (via Jmol)
000506073.b3lyp_6-31g(d).inp

000506073.b3lyp_6-31g(d).qchem.inp (generated)

000506073.b3lyp_6-31g(d).gjf (generated)

000506073.b3lyp_6-31g(d).firefly.inp (generated)

000506073.b3lyp_6-31g(d).smash.inp (generated)

000506073.b3lyp_6-31g(d).nwchem.inp (generated) 000506073.b3lyp_6-31g(d).log.xz 000506073.td-b3lyp_6-31g+(d).inp 000506073.td-b3lyp_6-31g+(d).log.xz

000506073.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506073.td-b3lyp_6-31+g(d).gjf (generated)

000506073.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506073.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506073.mol 000506073.PUBCHEM 000506073.mol (via Jmol)
000506074.b3lyp_6-31g(d).inp

000506074.b3lyp_6-31g(d).qchem.inp (generated)

000506074.b3lyp_6-31g(d).gjf (generated)

000506074.b3lyp_6-31g(d).firefly.inp (generated)

000506074.b3lyp_6-31g(d).smash.inp (generated)

000506074.b3lyp_6-31g(d).nwchem.inp (generated) 000506074.b3lyp_6-31g(d).log.xz 000506074.td-b3lyp_6-31g+(d).inp 000506074.td-b3lyp_6-31g+(d).log.xz

000506074.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506074.td-b3lyp_6-31+g(d).gjf (generated)

000506074.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506074.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506074.mol 000506074.PUBCHEM 000506074.mol (via Jmol)
000506075.b3lyp_6-31g(d).inp

000506075.b3lyp_6-31g(d).qchem.inp (generated)

000506075.b3lyp_6-31g(d).gjf (generated)

000506075.b3lyp_6-31g(d).firefly.inp (generated)

000506075.b3lyp_6-31g(d).smash.inp (generated)

000506075.b3lyp_6-31g(d).nwchem.inp (generated) 000506075.b3lyp_6-31g(d).log.xz 000506075.td-b3lyp_6-31g+(d).inp 000506075.td-b3lyp_6-31g+(d).log.xz

000506075.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506075.td-b3lyp_6-31+g(d).gjf (generated)

000506075.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506075.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506075.mol 000506075.PUBCHEM 000506075.mol (via Jmol)
000506076.b3lyp_6-31g(d).inp

000506076.b3lyp_6-31g(d).qchem.inp (generated)

000506076.b3lyp_6-31g(d).gjf (generated)

000506076.b3lyp_6-31g(d).firefly.inp (generated)

000506076.b3lyp_6-31g(d).smash.inp (generated)

000506076.b3lyp_6-31g(d).nwchem.inp (generated) 000506076.b3lyp_6-31g(d).log.xz 000506076.td-b3lyp_6-31g+(d).inp 000506076.td-b3lyp_6-31g+(d).log.xz

000506076.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506076.td-b3lyp_6-31+g(d).gjf (generated)

000506076.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506076.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506076.mol 000506076.PUBCHEM 000506076.mol (via Jmol)
000506077.b3lyp_6-31g(d).inp

000506077.b3lyp_6-31g(d).qchem.inp (generated)

000506077.b3lyp_6-31g(d).gjf (generated)

000506077.b3lyp_6-31g(d).firefly.inp (generated)

000506077.b3lyp_6-31g(d).smash.inp (generated)

000506077.b3lyp_6-31g(d).nwchem.inp (generated) 000506077.b3lyp_6-31g(d).log.xz 000506077.td-b3lyp_6-31g+(d).inp 000506077.td-b3lyp_6-31g+(d).log.xz

000506077.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506077.td-b3lyp_6-31+g(d).gjf (generated)

000506077.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506077.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506077.mol 000506077.PUBCHEM 000506077.mol (via Jmol)
000506078.b3lyp_6-31g(d).inp

000506078.b3lyp_6-31g(d).qchem.inp (generated)

000506078.b3lyp_6-31g(d).gjf (generated)

000506078.b3lyp_6-31g(d).firefly.inp (generated)

000506078.b3lyp_6-31g(d).smash.inp (generated)

000506078.b3lyp_6-31g(d).nwchem.inp (generated) 000506078.b3lyp_6-31g(d).log.xz 000506078.td-b3lyp_6-31g+(d).inp 000506078.td-b3lyp_6-31g+(d).log.xz

000506078.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506078.td-b3lyp_6-31+g(d).gjf (generated)

000506078.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506078.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506078.mol 000506078.PUBCHEM 000506078.mol (via Jmol)
000506079.b3lyp_6-31g(d).inp

000506079.b3lyp_6-31g(d).qchem.inp (generated)

000506079.b3lyp_6-31g(d).gjf (generated)

000506079.b3lyp_6-31g(d).firefly.inp (generated)

000506079.b3lyp_6-31g(d).smash.inp (generated)

000506079.b3lyp_6-31g(d).nwchem.inp (generated) 000506079.b3lyp_6-31g(d).log.xz 000506079.td-b3lyp_6-31g+(d).inp 000506079.td-b3lyp_6-31g+(d).log.xz

000506079.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506079.td-b3lyp_6-31+g(d).gjf (generated)

000506079.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506079.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506079.mol 000506079.PUBCHEM 000506079.mol (via Jmol)
000506080.b3lyp_6-31g(d).inp

000506080.b3lyp_6-31g(d).qchem.inp (generated)

000506080.b3lyp_6-31g(d).gjf (generated)

000506080.b3lyp_6-31g(d).firefly.inp (generated)

000506080.b3lyp_6-31g(d).smash.inp (generated)

000506080.b3lyp_6-31g(d).nwchem.inp (generated) 000506080.b3lyp_6-31g(d).log.xz 000506080.td-b3lyp_6-31g+(d).inp 000506080.td-b3lyp_6-31g+(d).log.xz

000506080.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506080.td-b3lyp_6-31+g(d).gjf (generated)

000506080.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506080.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506080.mol 000506080.PUBCHEM 000506080.mol (via Jmol)
000506081.b3lyp_6-31g(d).inp

000506081.b3lyp_6-31g(d).qchem.inp (generated)

000506081.b3lyp_6-31g(d).gjf (generated)

000506081.b3lyp_6-31g(d).firefly.inp (generated)

000506081.b3lyp_6-31g(d).smash.inp (generated)

000506081.b3lyp_6-31g(d).nwchem.inp (generated) 000506081.b3lyp_6-31g(d).log.xz 000506081.td-b3lyp_6-31g+(d).inp 000506081.td-b3lyp_6-31g+(d).log.xz

000506081.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506081.td-b3lyp_6-31+g(d).gjf (generated)

000506081.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506081.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506081.mol 000506081.PUBCHEM 000506081.mol (via Jmol)
000506082.b3lyp_6-31g(d).inp

000506082.b3lyp_6-31g(d).qchem.inp (generated)

000506082.b3lyp_6-31g(d).gjf (generated)

000506082.b3lyp_6-31g(d).firefly.inp (generated)

000506082.b3lyp_6-31g(d).smash.inp (generated)

000506082.b3lyp_6-31g(d).nwchem.inp (generated) 000506082.b3lyp_6-31g(d).log.xz 000506082.td-b3lyp_6-31g+(d).inp 000506082.td-b3lyp_6-31g+(d).log.xz

000506082.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506082.td-b3lyp_6-31+g(d).gjf (generated)

000506082.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506082.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506082.mol 000506082.PUBCHEM 000506082.mol (via Jmol)
000506083.b3lyp_6-31g(d).inp

000506083.b3lyp_6-31g(d).qchem.inp (generated)

000506083.b3lyp_6-31g(d).gjf (generated)

000506083.b3lyp_6-31g(d).firefly.inp (generated)

000506083.b3lyp_6-31g(d).smash.inp (generated)

000506083.b3lyp_6-31g(d).nwchem.inp (generated) 000506083.b3lyp_6-31g(d).log.xz 000506083.td-b3lyp_6-31g+(d).inp 000506083.td-b3lyp_6-31g+(d).log.xz

000506083.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506083.td-b3lyp_6-31+g(d).gjf (generated)

000506083.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506083.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506083.mol 000506083.PUBCHEM 000506083.mol (via Jmol)
000506088.b3lyp_6-31g(d).inp

000506088.b3lyp_6-31g(d).qchem.inp (generated)

000506088.b3lyp_6-31g(d).gjf (generated)

000506088.b3lyp_6-31g(d).firefly.inp (generated)

000506088.b3lyp_6-31g(d).smash.inp (generated)

000506088.b3lyp_6-31g(d).nwchem.inp (generated) 000506088.b3lyp_6-31g(d).log.xz 000506088.td-b3lyp_6-31g+(d).inp 000506088.td-b3lyp_6-31g+(d).log.xz

000506088.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506088.td-b3lyp_6-31+g(d).gjf (generated)

000506088.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506088.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506088.mol 000506088.PUBCHEM 000506088.mol (via Jmol)
000506089.b3lyp_6-31g(d).inp

000506089.b3lyp_6-31g(d).qchem.inp (generated)

000506089.b3lyp_6-31g(d).gjf (generated)

000506089.b3lyp_6-31g(d).firefly.inp (generated)

000506089.b3lyp_6-31g(d).smash.inp (generated)

000506089.b3lyp_6-31g(d).nwchem.inp (generated) 000506089.b3lyp_6-31g(d).log.xz 000506089.td-b3lyp_6-31g+(d).inp 000506089.td-b3lyp_6-31g+(d).log.xz

000506089.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506089.td-b3lyp_6-31+g(d).gjf (generated)

000506089.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506089.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506089.mol 000506089.PUBCHEM 000506089.mol (via Jmol)
000506091.b3lyp_6-31g(d).inp

000506091.b3lyp_6-31g(d).qchem.inp (generated)

000506091.b3lyp_6-31g(d).gjf (generated)

000506091.b3lyp_6-31g(d).firefly.inp (generated)

000506091.b3lyp_6-31g(d).smash.inp (generated)

000506091.b3lyp_6-31g(d).nwchem.inp (generated) 000506091.b3lyp_6-31g(d).log.xz 000506091.td-b3lyp_6-31g+(d).inp 000506091.td-b3lyp_6-31g+(d).log.xz

000506091.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506091.td-b3lyp_6-31+g(d).gjf (generated)

000506091.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506091.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506091.mol 000506091.PUBCHEM 000506091.mol (via Jmol)
000506096.b3lyp_6-31g(d).inp

000506096.b3lyp_6-31g(d).qchem.inp (generated)

000506096.b3lyp_6-31g(d).gjf (generated)

000506096.b3lyp_6-31g(d).firefly.inp (generated)

000506096.b3lyp_6-31g(d).smash.inp (generated)

000506096.b3lyp_6-31g(d).nwchem.inp (generated) 000506096.b3lyp_6-31g(d).log.xz 000506096.td-b3lyp_6-31g+(d).inp 000506096.td-b3lyp_6-31g+(d).log.xz

000506096.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506096.td-b3lyp_6-31+g(d).gjf (generated)

000506096.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506096.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506096.mol 000506096.PUBCHEM 000506096.mol (via Jmol)
000506098.b3lyp_6-31g(d).inp

000506098.b3lyp_6-31g(d).qchem.inp (generated)

000506098.b3lyp_6-31g(d).gjf (generated)

000506098.b3lyp_6-31g(d).firefly.inp (generated)

000506098.b3lyp_6-31g(d).smash.inp (generated)

000506098.b3lyp_6-31g(d).nwchem.inp (generated) 000506098.b3lyp_6-31g(d).log.xz 000506098.td-b3lyp_6-31g+(d).inp 000506098.td-b3lyp_6-31g+(d).log.xz

000506098.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506098.td-b3lyp_6-31+g(d).gjf (generated)

000506098.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506098.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506098.mol 000506098.PUBCHEM 000506098.mol (via Jmol)
000506101.b3lyp_6-31g(d).inp

000506101.b3lyp_6-31g(d).qchem.inp (generated)

000506101.b3lyp_6-31g(d).gjf (generated)

000506101.b3lyp_6-31g(d).firefly.inp (generated)

000506101.b3lyp_6-31g(d).smash.inp (generated)

000506101.b3lyp_6-31g(d).nwchem.inp (generated) 000506101.b3lyp_6-31g(d).log.xz 000506101.td-b3lyp_6-31g+(d).inp 000506101.td-b3lyp_6-31g+(d).log.xz

000506101.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506101.td-b3lyp_6-31+g(d).gjf (generated)

000506101.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506101.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506101.mol 000506101.PUBCHEM 000506101.mol (via Jmol)
000506102.b3lyp_6-31g(d).inp

000506102.b3lyp_6-31g(d).qchem.inp (generated)

000506102.b3lyp_6-31g(d).gjf (generated)

000506102.b3lyp_6-31g(d).firefly.inp (generated)

000506102.b3lyp_6-31g(d).smash.inp (generated)

000506102.b3lyp_6-31g(d).nwchem.inp (generated) 000506102.b3lyp_6-31g(d).log.xz 000506102.td-b3lyp_6-31g+(d).inp 000506102.td-b3lyp_6-31g+(d).log.xz

000506102.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506102.td-b3lyp_6-31+g(d).gjf (generated)

000506102.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506102.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506102.mol 000506102.PUBCHEM 000506102.mol (via Jmol)
000506103.b3lyp_6-31g(d).inp

000506103.b3lyp_6-31g(d).qchem.inp (generated)

000506103.b3lyp_6-31g(d).gjf (generated)

000506103.b3lyp_6-31g(d).firefly.inp (generated)

000506103.b3lyp_6-31g(d).smash.inp (generated)

000506103.b3lyp_6-31g(d).nwchem.inp (generated) 000506103.b3lyp_6-31g(d).log.xz 000506103.td-b3lyp_6-31g+(d).inp 000506103.td-b3lyp_6-31g+(d).log.xz

000506103.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506103.td-b3lyp_6-31+g(d).gjf (generated)

000506103.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506103.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506103.mol 000506103.PUBCHEM 000506103.mol (via Jmol)
000506104.b3lyp_6-31g(d).inp

000506104.b3lyp_6-31g(d).qchem.inp (generated)

000506104.b3lyp_6-31g(d).gjf (generated)

000506104.b3lyp_6-31g(d).firefly.inp (generated)

000506104.b3lyp_6-31g(d).smash.inp (generated)

000506104.b3lyp_6-31g(d).nwchem.inp (generated) 000506104.b3lyp_6-31g(d).log.xz 000506104.td-b3lyp_6-31g+(d).inp 000506104.td-b3lyp_6-31g+(d).log.xz

000506104.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506104.td-b3lyp_6-31+g(d).gjf (generated)

000506104.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506104.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506104.mol 000506104.PUBCHEM 000506104.mol (via Jmol)
000506107.b3lyp_6-31g(d).inp

000506107.b3lyp_6-31g(d).qchem.inp (generated)

000506107.b3lyp_6-31g(d).gjf (generated)

000506107.b3lyp_6-31g(d).firefly.inp (generated)

000506107.b3lyp_6-31g(d).smash.inp (generated)

000506107.b3lyp_6-31g(d).nwchem.inp (generated) 000506107.b3lyp_6-31g(d).log.xz 000506107.td-b3lyp_6-31g+(d).inp 000506107.td-b3lyp_6-31g+(d).log.xz

000506107.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506107.td-b3lyp_6-31+g(d).gjf (generated)

000506107.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506107.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506107.mol 000506107.PUBCHEM 000506107.mol (via Jmol)
000506154.b3lyp_6-31g(d).inp

000506154.b3lyp_6-31g(d).qchem.inp (generated)

000506154.b3lyp_6-31g(d).gjf (generated)

000506154.b3lyp_6-31g(d).firefly.inp (generated)

000506154.b3lyp_6-31g(d).smash.inp (generated)

000506154.b3lyp_6-31g(d).nwchem.inp (generated) 000506154.b3lyp_6-31g(d).log.xz 000506154.td-b3lyp_6-31g+(d).inp 000506154.td-b3lyp_6-31g+(d).log.xz

000506154.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506154.td-b3lyp_6-31+g(d).gjf (generated)

000506154.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506154.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506154.mol 000506154.PUBCHEM 000506154.mol (via Jmol)
000506521.b3lyp_6-31g(d).inp

000506521.b3lyp_6-31g(d).qchem.inp (generated)

000506521.b3lyp_6-31g(d).gjf (generated)

000506521.b3lyp_6-31g(d).firefly.inp (generated)

000506521.b3lyp_6-31g(d).smash.inp (generated)

000506521.b3lyp_6-31g(d).nwchem.inp (generated) 000506521.b3lyp_6-31g(d).log.xz 000506521.td-b3lyp_6-31g+(d).inp 000506521.td-b3lyp_6-31g+(d).log.xz

000506521.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506521.td-b3lyp_6-31+g(d).gjf (generated)

000506521.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506521.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506521.mol 000506521.PUBCHEM 000506521.mol (via Jmol)
000506530.b3lyp_6-31g(d).inp

000506530.b3lyp_6-31g(d).qchem.inp (generated)

000506530.b3lyp_6-31g(d).gjf (generated)

000506530.b3lyp_6-31g(d).firefly.inp (generated)

000506530.b3lyp_6-31g(d).smash.inp (generated)

000506530.b3lyp_6-31g(d).nwchem.inp (generated) 000506530.b3lyp_6-31g(d).log.xz 000506530.td-b3lyp_6-31g+(d).inp 000506530.td-b3lyp_6-31g+(d).log.xz

000506530.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506530.td-b3lyp_6-31+g(d).gjf (generated)

000506530.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506530.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506530.mol 000506530.PUBCHEM 000506530.mol (via Jmol)
000506531.b3lyp_6-31g(d).inp

000506531.b3lyp_6-31g(d).qchem.inp (generated)

000506531.b3lyp_6-31g(d).gjf (generated)

000506531.b3lyp_6-31g(d).firefly.inp (generated)

000506531.b3lyp_6-31g(d).smash.inp (generated)

000506531.b3lyp_6-31g(d).nwchem.inp (generated) 000506531.b3lyp_6-31g(d).log.xz 000506531.td-b3lyp_6-31g+(d).inp 000506531.td-b3lyp_6-31g+(d).log.xz

000506531.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506531.td-b3lyp_6-31+g(d).gjf (generated)

000506531.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506531.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506531.mol 000506531.PUBCHEM 000506531.mol (via Jmol)
000506532.b3lyp_6-31g(d).inp

000506532.b3lyp_6-31g(d).qchem.inp (generated)

000506532.b3lyp_6-31g(d).gjf (generated)

000506532.b3lyp_6-31g(d).firefly.inp (generated)

000506532.b3lyp_6-31g(d).smash.inp (generated)

000506532.b3lyp_6-31g(d).nwchem.inp (generated) 000506532.b3lyp_6-31g(d).log.xz 000506532.td-b3lyp_6-31g+(d).inp 000506532.td-b3lyp_6-31g+(d).log.xz

000506532.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506532.td-b3lyp_6-31+g(d).gjf (generated)

000506532.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506532.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506532.mol 000506532.PUBCHEM 000506532.mol (via Jmol)
000506533.b3lyp_6-31g(d).inp

000506533.b3lyp_6-31g(d).qchem.inp (generated)

000506533.b3lyp_6-31g(d).gjf (generated)

000506533.b3lyp_6-31g(d).firefly.inp (generated)

000506533.b3lyp_6-31g(d).smash.inp (generated)

000506533.b3lyp_6-31g(d).nwchem.inp (generated) 000506533.b3lyp_6-31g(d).log.xz 000506533.td-b3lyp_6-31g+(d).inp 000506533.td-b3lyp_6-31g+(d).log.xz

000506533.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506533.td-b3lyp_6-31+g(d).gjf (generated)

000506533.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506533.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506533.mol 000506533.PUBCHEM 000506533.mol (via Jmol)
000506534.b3lyp_6-31g(d).inp

000506534.b3lyp_6-31g(d).qchem.inp (generated)

000506534.b3lyp_6-31g(d).gjf (generated)

000506534.b3lyp_6-31g(d).firefly.inp (generated)

000506534.b3lyp_6-31g(d).smash.inp (generated)

000506534.b3lyp_6-31g(d).nwchem.inp (generated) 000506534.b3lyp_6-31g(d).log.xz 000506534.td-b3lyp_6-31g+(d).inp 000506534.td-b3lyp_6-31g+(d).log.xz

000506534.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506534.td-b3lyp_6-31+g(d).gjf (generated)

000506534.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506534.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506534.mol 000506534.PUBCHEM 000506534.mol (via Jmol)
000506537.b3lyp_6-31g(d).inp

000506537.b3lyp_6-31g(d).qchem.inp (generated)

000506537.b3lyp_6-31g(d).gjf (generated)

000506537.b3lyp_6-31g(d).firefly.inp (generated)

000506537.b3lyp_6-31g(d).smash.inp (generated)

000506537.b3lyp_6-31g(d).nwchem.inp (generated) 000506537.b3lyp_6-31g(d).log.xz 000506537.td-b3lyp_6-31g+(d).inp 000506537.td-b3lyp_6-31g+(d).log.xz

000506537.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506537.td-b3lyp_6-31+g(d).gjf (generated)

000506537.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506537.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506537.mol 000506537.PUBCHEM 000506537.mol (via Jmol)
000506538.b3lyp_6-31g(d).inp

000506538.b3lyp_6-31g(d).qchem.inp (generated)

000506538.b3lyp_6-31g(d).gjf (generated)

000506538.b3lyp_6-31g(d).firefly.inp (generated)

000506538.b3lyp_6-31g(d).smash.inp (generated)

000506538.b3lyp_6-31g(d).nwchem.inp (generated) 000506538.b3lyp_6-31g(d).log.xz 000506538.td-b3lyp_6-31g+(d).inp 000506538.td-b3lyp_6-31g+(d).log.xz

000506538.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506538.td-b3lyp_6-31+g(d).gjf (generated)

000506538.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506538.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506538.mol 000506538.PUBCHEM 000506538.mol (via Jmol)
000506539.b3lyp_6-31g(d).inp

000506539.b3lyp_6-31g(d).qchem.inp (generated)

000506539.b3lyp_6-31g(d).gjf (generated)

000506539.b3lyp_6-31g(d).firefly.inp (generated)

000506539.b3lyp_6-31g(d).smash.inp (generated)

000506539.b3lyp_6-31g(d).nwchem.inp (generated) 000506539.b3lyp_6-31g(d).log.xz 000506539.td-b3lyp_6-31g+(d).inp 000506539.td-b3lyp_6-31g+(d).log.xz

000506539.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506539.td-b3lyp_6-31+g(d).gjf (generated)

000506539.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506539.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506539.mol 000506539.PUBCHEM 000506539.mol (via Jmol)
000506542.b3lyp_6-31g(d).inp

000506542.b3lyp_6-31g(d).qchem.inp (generated)

000506542.b3lyp_6-31g(d).gjf (generated)

000506542.b3lyp_6-31g(d).firefly.inp (generated)

000506542.b3lyp_6-31g(d).smash.inp (generated)

000506542.b3lyp_6-31g(d).nwchem.inp (generated) 000506542.b3lyp_6-31g(d).log.xz 000506542.td-b3lyp_6-31g+(d).inp 000506542.td-b3lyp_6-31g+(d).log.xz

000506542.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506542.td-b3lyp_6-31+g(d).gjf (generated)

000506542.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506542.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506542.mol 000506542.PUBCHEM 000506542.mol (via Jmol)
000506543.b3lyp_6-31g(d).inp

000506543.b3lyp_6-31g(d).qchem.inp (generated)

000506543.b3lyp_6-31g(d).gjf (generated)

000506543.b3lyp_6-31g(d).firefly.inp (generated)

000506543.b3lyp_6-31g(d).smash.inp (generated)

000506543.b3lyp_6-31g(d).nwchem.inp (generated) 000506543.b3lyp_6-31g(d).log.xz 000506543.td-b3lyp_6-31g+(d).inp 000506543.td-b3lyp_6-31g+(d).log.xz

000506543.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506543.td-b3lyp_6-31+g(d).gjf (generated)

000506543.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506543.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506543.mol 000506543.PUBCHEM 000506543.mol (via Jmol)
000506544.b3lyp_6-31g(d).inp

000506544.b3lyp_6-31g(d).qchem.inp (generated)

000506544.b3lyp_6-31g(d).gjf (generated)

000506544.b3lyp_6-31g(d).firefly.inp (generated)

000506544.b3lyp_6-31g(d).smash.inp (generated)

000506544.b3lyp_6-31g(d).nwchem.inp (generated) 000506544.b3lyp_6-31g(d).log.xz 000506544.td-b3lyp_6-31g+(d).inp 000506544.td-b3lyp_6-31g+(d).log.xz

000506544.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506544.td-b3lyp_6-31+g(d).gjf (generated)

000506544.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506544.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506544.mol 000506544.PUBCHEM 000506544.mol (via Jmol)
000506548.b3lyp_6-31g(d).inp

000506548.b3lyp_6-31g(d).qchem.inp (generated)

000506548.b3lyp_6-31g(d).gjf (generated)

000506548.b3lyp_6-31g(d).firefly.inp (generated)

000506548.b3lyp_6-31g(d).smash.inp (generated)

000506548.b3lyp_6-31g(d).nwchem.inp (generated) 000506548.b3lyp_6-31g(d).log.xz 000506548.td-b3lyp_6-31g+(d).inp 000506548.td-b3lyp_6-31g+(d).log.xz

000506548.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506548.td-b3lyp_6-31+g(d).gjf (generated)

000506548.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506548.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506548.mol 000506548.PUBCHEM 000506548.mol (via Jmol)
000506550.b3lyp_6-31g(d).inp

000506550.b3lyp_6-31g(d).qchem.inp (generated)

000506550.b3lyp_6-31g(d).gjf (generated)

000506550.b3lyp_6-31g(d).firefly.inp (generated)

000506550.b3lyp_6-31g(d).smash.inp (generated)

000506550.b3lyp_6-31g(d).nwchem.inp (generated) 000506550.b3lyp_6-31g(d).log.xz 000506550.td-b3lyp_6-31g+(d).inp 000506550.td-b3lyp_6-31g+(d).log.xz

000506550.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506550.td-b3lyp_6-31+g(d).gjf (generated)

000506550.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506550.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506550.mol 000506550.PUBCHEM 000506550.mol (via Jmol)
000506551.b3lyp_6-31g(d).inp

000506551.b3lyp_6-31g(d).qchem.inp (generated)

000506551.b3lyp_6-31g(d).gjf (generated)

000506551.b3lyp_6-31g(d).firefly.inp (generated)

000506551.b3lyp_6-31g(d).smash.inp (generated)

000506551.b3lyp_6-31g(d).nwchem.inp (generated) 000506551.b3lyp_6-31g(d).log.xz 000506551.td-b3lyp_6-31g+(d).inp 000506551.td-b3lyp_6-31g+(d).log.xz

000506551.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506551.td-b3lyp_6-31+g(d).gjf (generated)

000506551.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506551.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506551.mol 000506551.PUBCHEM 000506551.mol (via Jmol)
000506552.b3lyp_6-31g(d).inp

000506552.b3lyp_6-31g(d).qchem.inp (generated)

000506552.b3lyp_6-31g(d).gjf (generated)

000506552.b3lyp_6-31g(d).firefly.inp (generated)

000506552.b3lyp_6-31g(d).smash.inp (generated)

000506552.b3lyp_6-31g(d).nwchem.inp (generated) 000506552.b3lyp_6-31g(d).log.xz 000506552.td-b3lyp_6-31g+(d).inp 000506552.td-b3lyp_6-31g+(d).log.xz

000506552.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506552.td-b3lyp_6-31+g(d).gjf (generated)

000506552.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506552.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506552.mol 000506552.PUBCHEM 000506552.mol (via Jmol)
000506553.b3lyp_6-31g(d).inp

000506553.b3lyp_6-31g(d).qchem.inp (generated)

000506553.b3lyp_6-31g(d).gjf (generated)

000506553.b3lyp_6-31g(d).firefly.inp (generated)

000506553.b3lyp_6-31g(d).smash.inp (generated)

000506553.b3lyp_6-31g(d).nwchem.inp (generated) 000506553.b3lyp_6-31g(d).log.xz 000506553.td-b3lyp_6-31g+(d).inp 000506553.td-b3lyp_6-31g+(d).log.xz

000506553.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506553.td-b3lyp_6-31+g(d).gjf (generated)

000506553.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506553.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506553.mol 000506553.PUBCHEM 000506553.mol (via Jmol)
000506554.b3lyp_6-31g(d).inp

000506554.b3lyp_6-31g(d).qchem.inp (generated)

000506554.b3lyp_6-31g(d).gjf (generated)

000506554.b3lyp_6-31g(d).firefly.inp (generated)

000506554.b3lyp_6-31g(d).smash.inp (generated)

000506554.b3lyp_6-31g(d).nwchem.inp (generated) 000506554.b3lyp_6-31g(d).log.xz 000506554.td-b3lyp_6-31g+(d).inp 000506554.td-b3lyp_6-31g+(d).log.xz

000506554.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506554.td-b3lyp_6-31+g(d).gjf (generated)

000506554.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506554.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506554.mol 000506554.PUBCHEM 000506554.mol (via Jmol)
000506555.b3lyp_6-31g(d).inp

000506555.b3lyp_6-31g(d).qchem.inp (generated)

000506555.b3lyp_6-31g(d).gjf (generated)

000506555.b3lyp_6-31g(d).firefly.inp (generated)

000506555.b3lyp_6-31g(d).smash.inp (generated)

000506555.b3lyp_6-31g(d).nwchem.inp (generated) 000506555.b3lyp_6-31g(d).log.xz 000506555.td-b3lyp_6-31g+(d).inp 000506555.td-b3lyp_6-31g+(d).log.xz

000506555.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506555.td-b3lyp_6-31+g(d).gjf (generated)

000506555.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506555.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506555.mol 000506555.PUBCHEM 000506555.mol (via Jmol)
000506562.b3lyp_6-31g(d).inp

000506562.b3lyp_6-31g(d).qchem.inp (generated)

000506562.b3lyp_6-31g(d).gjf (generated)

000506562.b3lyp_6-31g(d).firefly.inp (generated)

000506562.b3lyp_6-31g(d).smash.inp (generated)

000506562.b3lyp_6-31g(d).nwchem.inp (generated) 000506562.b3lyp_6-31g(d).log.xz 000506562.td-b3lyp_6-31g+(d).inp 000506562.td-b3lyp_6-31g+(d).log.xz

000506562.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506562.td-b3lyp_6-31+g(d).gjf (generated)

000506562.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506562.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506562.mol 000506562.PUBCHEM 000506562.mol (via Jmol)
000506582.b3lyp_6-31g(d).inp

000506582.b3lyp_6-31g(d).qchem.inp (generated)

000506582.b3lyp_6-31g(d).gjf (generated)

000506582.b3lyp_6-31g(d).firefly.inp (generated)

000506582.b3lyp_6-31g(d).smash.inp (generated)

000506582.b3lyp_6-31g(d).nwchem.inp (generated) 000506582.b3lyp_6-31g(d).log.xz 000506582.td-b3lyp_6-31g+(d).inp 000506582.td-b3lyp_6-31g+(d).log.xz

000506582.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506582.td-b3lyp_6-31+g(d).gjf (generated)

000506582.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506582.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506582.mol 000506582.PUBCHEM 000506582.mol (via Jmol)
000506586.b3lyp_6-31g(d).inp

000506586.b3lyp_6-31g(d).qchem.inp (generated)

000506586.b3lyp_6-31g(d).gjf (generated)

000506586.b3lyp_6-31g(d).firefly.inp (generated)

000506586.b3lyp_6-31g(d).smash.inp (generated)

000506586.b3lyp_6-31g(d).nwchem.inp (generated) 000506586.b3lyp_6-31g(d).log.xz 000506586.td-b3lyp_6-31g+(d).inp 000506586.td-b3lyp_6-31g+(d).log.xz

000506586.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506586.td-b3lyp_6-31+g(d).gjf (generated)

000506586.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506586.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506586.mol 000506586.PUBCHEM 000506586.mol (via Jmol)
000506589.b3lyp_6-31g(d).inp

000506589.b3lyp_6-31g(d).qchem.inp (generated)

000506589.b3lyp_6-31g(d).gjf (generated)

000506589.b3lyp_6-31g(d).firefly.inp (generated)

000506589.b3lyp_6-31g(d).smash.inp (generated)

000506589.b3lyp_6-31g(d).nwchem.inp (generated) 000506589.b3lyp_6-31g(d).log.xz 000506589.td-b3lyp_6-31g+(d).inp 000506589.td-b3lyp_6-31g+(d).log.xz

000506589.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506589.td-b3lyp_6-31+g(d).gjf (generated)

000506589.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506589.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506589.mol 000506589.PUBCHEM 000506589.mol (via Jmol)
000506597.b3lyp_6-31g(d).inp

000506597.b3lyp_6-31g(d).qchem.inp (generated)

000506597.b3lyp_6-31g(d).gjf (generated)

000506597.b3lyp_6-31g(d).firefly.inp (generated)

000506597.b3lyp_6-31g(d).smash.inp (generated)

000506597.b3lyp_6-31g(d).nwchem.inp (generated) 000506597.b3lyp_6-31g(d).log.xz 000506597.td-b3lyp_6-31g+(d).inp 000506597.td-b3lyp_6-31g+(d).log.xz

000506597.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506597.td-b3lyp_6-31+g(d).gjf (generated)

000506597.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506597.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506597.mol 000506597.PUBCHEM 000506597.mol (via Jmol)
000506600.b3lyp_6-31g(d).inp

000506600.b3lyp_6-31g(d).qchem.inp (generated)

000506600.b3lyp_6-31g(d).gjf (generated)

000506600.b3lyp_6-31g(d).firefly.inp (generated)

000506600.b3lyp_6-31g(d).smash.inp (generated)

000506600.b3lyp_6-31g(d).nwchem.inp (generated) 000506600.b3lyp_6-31g(d).log.xz 000506600.td-b3lyp_6-31g+(d).inp 000506600.td-b3lyp_6-31g+(d).log.xz

000506600.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506600.td-b3lyp_6-31+g(d).gjf (generated)

000506600.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506600.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506600.mol 000506600.PUBCHEM 000506600.mol (via Jmol)
000506601.b3lyp_6-31g(d).inp

000506601.b3lyp_6-31g(d).qchem.inp (generated)

000506601.b3lyp_6-31g(d).gjf (generated)

000506601.b3lyp_6-31g(d).firefly.inp (generated)

000506601.b3lyp_6-31g(d).smash.inp (generated)

000506601.b3lyp_6-31g(d).nwchem.inp (generated) 000506601.b3lyp_6-31g(d).log.xz 000506601.td-b3lyp_6-31g+(d).inp 000506601.td-b3lyp_6-31g+(d).log.xz

000506601.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506601.td-b3lyp_6-31+g(d).gjf (generated)

000506601.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506601.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506601.mol 000506601.PUBCHEM 000506601.mol (via Jmol)
000506605.b3lyp_6-31g(d).inp

000506605.b3lyp_6-31g(d).qchem.inp (generated)

000506605.b3lyp_6-31g(d).gjf (generated)

000506605.b3lyp_6-31g(d).firefly.inp (generated)

000506605.b3lyp_6-31g(d).smash.inp (generated)

000506605.b3lyp_6-31g(d).nwchem.inp (generated) 000506605.b3lyp_6-31g(d).log.xz 000506605.td-b3lyp_6-31g+(d).inp 000506605.td-b3lyp_6-31g+(d).log.xz

000506605.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506605.td-b3lyp_6-31+g(d).gjf (generated)

000506605.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506605.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506605.mol 000506605.PUBCHEM 000506605.mol (via Jmol)
000506606.b3lyp_6-31g(d).inp

000506606.b3lyp_6-31g(d).qchem.inp (generated)

000506606.b3lyp_6-31g(d).gjf (generated)

000506606.b3lyp_6-31g(d).firefly.inp (generated)

000506606.b3lyp_6-31g(d).smash.inp (generated)

000506606.b3lyp_6-31g(d).nwchem.inp (generated) 000506606.b3lyp_6-31g(d).log.xz 000506606.td-b3lyp_6-31g+(d).inp 000506606.td-b3lyp_6-31g+(d).log.xz

000506606.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506606.td-b3lyp_6-31+g(d).gjf (generated)

000506606.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506606.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506606.mol 000506606.PUBCHEM 000506606.mol (via Jmol)
000506607.b3lyp_6-31g(d).inp

000506607.b3lyp_6-31g(d).qchem.inp (generated)

000506607.b3lyp_6-31g(d).gjf (generated)

000506607.b3lyp_6-31g(d).firefly.inp (generated)

000506607.b3lyp_6-31g(d).smash.inp (generated)

000506607.b3lyp_6-31g(d).nwchem.inp (generated) 000506607.b3lyp_6-31g(d).log.xz 000506607.td-b3lyp_6-31g+(d).inp 000506607.td-b3lyp_6-31g+(d).log.xz

000506607.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506607.td-b3lyp_6-31+g(d).gjf (generated)

000506607.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506607.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506607.mol 000506607.PUBCHEM 000506607.mol (via Jmol)
000506608.b3lyp_6-31g(d).inp

000506608.b3lyp_6-31g(d).qchem.inp (generated)

000506608.b3lyp_6-31g(d).gjf (generated)

000506608.b3lyp_6-31g(d).firefly.inp (generated)

000506608.b3lyp_6-31g(d).smash.inp (generated)

000506608.b3lyp_6-31g(d).nwchem.inp (generated) 000506608.b3lyp_6-31g(d).log.xz 000506608.td-b3lyp_6-31g+(d).inp 000506608.td-b3lyp_6-31g+(d).log.xz

000506608.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506608.td-b3lyp_6-31+g(d).gjf (generated)

000506608.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506608.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506608.mol 000506608.PUBCHEM 000506608.mol (via Jmol)
000506613.b3lyp_6-31g(d).inp

000506613.b3lyp_6-31g(d).qchem.inp (generated)

000506613.b3lyp_6-31g(d).gjf (generated)

000506613.b3lyp_6-31g(d).firefly.inp (generated)

000506613.b3lyp_6-31g(d).smash.inp (generated)

000506613.b3lyp_6-31g(d).nwchem.inp (generated) 000506613.b3lyp_6-31g(d).log.xz 000506613.td-b3lyp_6-31g+(d).inp 000506613.td-b3lyp_6-31g+(d).log.xz

000506613.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506613.td-b3lyp_6-31+g(d).gjf (generated)

000506613.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506613.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506613.mol 000506613.PUBCHEM 000506613.mol (via Jmol)
000506615.b3lyp_6-31g(d).inp

000506615.b3lyp_6-31g(d).qchem.inp (generated)

000506615.b3lyp_6-31g(d).gjf (generated)

000506615.b3lyp_6-31g(d).firefly.inp (generated)

000506615.b3lyp_6-31g(d).smash.inp (generated)

000506615.b3lyp_6-31g(d).nwchem.inp (generated) 000506615.b3lyp_6-31g(d).log.xz 000506615.td-b3lyp_6-31g+(d).inp 000506615.td-b3lyp_6-31g+(d).log.xz

000506615.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506615.td-b3lyp_6-31+g(d).gjf (generated)

000506615.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506615.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506615.mol 000506615.PUBCHEM 000506615.mol (via Jmol)
000506616.b3lyp_6-31g(d).inp

000506616.b3lyp_6-31g(d).qchem.inp (generated)

000506616.b3lyp_6-31g(d).gjf (generated)

000506616.b3lyp_6-31g(d).firefly.inp (generated)

000506616.b3lyp_6-31g(d).smash.inp (generated)

000506616.b3lyp_6-31g(d).nwchem.inp (generated) 000506616.b3lyp_6-31g(d).log.xz 000506616.td-b3lyp_6-31g+(d).inp 000506616.td-b3lyp_6-31g+(d).log.xz

000506616.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506616.td-b3lyp_6-31+g(d).gjf (generated)

000506616.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506616.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506616.mol 000506616.PUBCHEM 000506616.mol (via Jmol)
000506617.b3lyp_6-31g(d).inp

000506617.b3lyp_6-31g(d).qchem.inp (generated)

000506617.b3lyp_6-31g(d).gjf (generated)

000506617.b3lyp_6-31g(d).firefly.inp (generated)

000506617.b3lyp_6-31g(d).smash.inp (generated)

000506617.b3lyp_6-31g(d).nwchem.inp (generated) 000506617.b3lyp_6-31g(d).log.xz 000506617.td-b3lyp_6-31g+(d).inp 000506617.td-b3lyp_6-31g+(d).log.xz

000506617.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506617.td-b3lyp_6-31+g(d).gjf (generated)

000506617.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506617.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506617.mol 000506617.PUBCHEM 000506617.mol (via Jmol)
000506618.b3lyp_6-31g(d).inp

000506618.b3lyp_6-31g(d).qchem.inp (generated)

000506618.b3lyp_6-31g(d).gjf (generated)

000506618.b3lyp_6-31g(d).firefly.inp (generated)

000506618.b3lyp_6-31g(d).smash.inp (generated)

000506618.b3lyp_6-31g(d).nwchem.inp (generated) 000506618.b3lyp_6-31g(d).log.xz 000506618.td-b3lyp_6-31g+(d).inp 000506618.td-b3lyp_6-31g+(d).log.xz

000506618.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506618.td-b3lyp_6-31+g(d).gjf (generated)

000506618.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506618.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506618.mol 000506618.PUBCHEM 000506618.mol (via Jmol)
000506620.b3lyp_6-31g(d).inp

000506620.b3lyp_6-31g(d).qchem.inp (generated)

000506620.b3lyp_6-31g(d).gjf (generated)

000506620.b3lyp_6-31g(d).firefly.inp (generated)

000506620.b3lyp_6-31g(d).smash.inp (generated)

000506620.b3lyp_6-31g(d).nwchem.inp (generated) 000506620.b3lyp_6-31g(d).log.xz 000506620.td-b3lyp_6-31g+(d).inp 000506620.td-b3lyp_6-31g+(d).log.xz

000506620.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506620.td-b3lyp_6-31+g(d).gjf (generated)

000506620.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506620.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506620.mol 000506620.PUBCHEM 000506620.mol (via Jmol)
000506622.b3lyp_6-31g(d).inp

000506622.b3lyp_6-31g(d).qchem.inp (generated)

000506622.b3lyp_6-31g(d).gjf (generated)

000506622.b3lyp_6-31g(d).firefly.inp (generated)

000506622.b3lyp_6-31g(d).smash.inp (generated)

000506622.b3lyp_6-31g(d).nwchem.inp (generated) 000506622.b3lyp_6-31g(d).log.xz 000506622.td-b3lyp_6-31g+(d).inp 000506622.td-b3lyp_6-31g+(d).log.xz

000506622.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506622.td-b3lyp_6-31+g(d).gjf (generated)

000506622.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506622.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506622.mol 000506622.PUBCHEM 000506622.mol (via Jmol)
000506623.b3lyp_6-31g(d).inp

000506623.b3lyp_6-31g(d).qchem.inp (generated)

000506623.b3lyp_6-31g(d).gjf (generated)

000506623.b3lyp_6-31g(d).firefly.inp (generated)

000506623.b3lyp_6-31g(d).smash.inp (generated)

000506623.b3lyp_6-31g(d).nwchem.inp (generated) 000506623.b3lyp_6-31g(d).log.xz 000506623.td-b3lyp_6-31g+(d).inp 000506623.td-b3lyp_6-31g+(d).log.xz

000506623.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506623.td-b3lyp_6-31+g(d).gjf (generated)

000506623.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506623.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506623.mol 000506623.PUBCHEM 000506623.mol (via Jmol)
000506624.b3lyp_6-31g(d).inp

000506624.b3lyp_6-31g(d).qchem.inp (generated)

000506624.b3lyp_6-31g(d).gjf (generated)

000506624.b3lyp_6-31g(d).firefly.inp (generated)

000506624.b3lyp_6-31g(d).smash.inp (generated)

000506624.b3lyp_6-31g(d).nwchem.inp (generated) 000506624.b3lyp_6-31g(d).log.xz 000506624.td-b3lyp_6-31g+(d).inp 000506624.td-b3lyp_6-31g+(d).log.xz

000506624.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506624.td-b3lyp_6-31+g(d).gjf (generated)

000506624.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506624.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506624.mol 000506624.PUBCHEM 000506624.mol (via Jmol)
000506625.b3lyp_6-31g(d).inp

000506625.b3lyp_6-31g(d).qchem.inp (generated)

000506625.b3lyp_6-31g(d).gjf (generated)

000506625.b3lyp_6-31g(d).firefly.inp (generated)

000506625.b3lyp_6-31g(d).smash.inp (generated)

000506625.b3lyp_6-31g(d).nwchem.inp (generated) 000506625.b3lyp_6-31g(d).log.xz 000506625.td-b3lyp_6-31g+(d).inp 000506625.td-b3lyp_6-31g+(d).log.xz

000506625.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506625.td-b3lyp_6-31+g(d).gjf (generated)

000506625.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506625.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506625.mol 000506625.PUBCHEM 000506625.mol (via Jmol)
000506627.b3lyp_6-31g(d).inp

000506627.b3lyp_6-31g(d).qchem.inp (generated)

000506627.b3lyp_6-31g(d).gjf (generated)

000506627.b3lyp_6-31g(d).firefly.inp (generated)

000506627.b3lyp_6-31g(d).smash.inp (generated)

000506627.b3lyp_6-31g(d).nwchem.inp (generated) 000506627.b3lyp_6-31g(d).log.xz 000506627.td-b3lyp_6-31g+(d).inp 000506627.td-b3lyp_6-31g+(d).log.xz

000506627.td-b3lyp_6-31+g(d).qchem.inp (generated)

000506627.td-b3lyp_6-31+g(d).gjf (generated)

000506627.td-b3lyp_6-31+g(d).firefly.inp (generated)

000506627.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000506627.mol 000506627.PUBCHEM 000506627.mol (via Jmol)
000507033.b3lyp_6-31g(d).inp

000507033.b3lyp_6-31g(d).qchem.inp (generated)

000507033.b3lyp_6-31g(d).gjf (generated)

000507033.b3lyp_6-31g(d).firefly.inp (generated)

000507033.b3lyp_6-31g(d).smash.inp (generated)

000507033.b3lyp_6-31g(d).nwchem.inp (generated) 000507033.b3lyp_6-31g(d).log.xz 000507033.td-b3lyp_6-31g+(d).inp 000507033.td-b3lyp_6-31g+(d).log.xz

000507033.td-b3lyp_6-31+g(d).qchem.inp (generated)

000507033.td-b3lyp_6-31+g(d).gjf (generated)

000507033.td-b3lyp_6-31+g(d).firefly.inp (generated)

000507033.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000507033.mol 000507033.PUBCHEM 000507033.mol (via Jmol)
000507039.b3lyp_6-31g(d).inp

000507039.b3lyp_6-31g(d).qchem.inp (generated)

000507039.b3lyp_6-31g(d).gjf (generated)

000507039.b3lyp_6-31g(d).firefly.inp (generated)

000507039.b3lyp_6-31g(d).smash.inp (generated)

000507039.b3lyp_6-31g(d).nwchem.inp (generated) 000507039.b3lyp_6-31g(d).log.xz 000507039.td-b3lyp_6-31g+(d).inp 000507039.td-b3lyp_6-31g+(d).log.xz

000507039.td-b3lyp_6-31+g(d).qchem.inp (generated)

000507039.td-b3lyp_6-31+g(d).gjf (generated)

000507039.td-b3lyp_6-31+g(d).firefly.inp (generated)

000507039.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000507039.mol 000507039.PUBCHEM 000507039.mol (via Jmol)
000507187.b3lyp_6-31g(d).inp

000507187.b3lyp_6-31g(d).qchem.inp (generated)

000507187.b3lyp_6-31g(d).gjf (generated)

000507187.b3lyp_6-31g(d).firefly.inp (generated)

000507187.b3lyp_6-31g(d).smash.inp (generated)

000507187.b3lyp_6-31g(d).nwchem.inp (generated) 000507187.b3lyp_6-31g(d).log.xz 000507187.td-b3lyp_6-31g+(d).inp 000507187.td-b3lyp_6-31g+(d).log.xz

000507187.td-b3lyp_6-31+g(d).qchem.inp (generated)

000507187.td-b3lyp_6-31+g(d).gjf (generated)

000507187.td-b3lyp_6-31+g(d).firefly.inp (generated)

000507187.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000507187.mol 000507187.PUBCHEM 000507187.mol (via Jmol)
000507221.b3lyp_6-31g(d).inp

000507221.b3lyp_6-31g(d).qchem.inp (generated)

000507221.b3lyp_6-31g(d).gjf (generated)

000507221.b3lyp_6-31g(d).firefly.inp (generated)

000507221.b3lyp_6-31g(d).smash.inp (generated)

000507221.b3lyp_6-31g(d).nwchem.inp (generated) 000507221.b3lyp_6-31g(d).log.xz 000507221.td-b3lyp_6-31g+(d).inp 000507221.td-b3lyp_6-31g+(d).log.xz

000507221.td-b3lyp_6-31+g(d).qchem.inp (generated)

000507221.td-b3lyp_6-31+g(d).gjf (generated)

000507221.td-b3lyp_6-31+g(d).firefly.inp (generated)

000507221.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000507221.mol 000507221.PUBCHEM 000507221.mol (via Jmol)
000507301.b3lyp_6-31g(d).inp

000507301.b3lyp_6-31g(d).qchem.inp (generated)

000507301.b3lyp_6-31g(d).gjf (generated)

000507301.b3lyp_6-31g(d).firefly.inp (generated)

000507301.b3lyp_6-31g(d).smash.inp (generated)

000507301.b3lyp_6-31g(d).nwchem.inp (generated) 000507301.b3lyp_6-31g(d).log.xz 000507301.td-b3lyp_6-31g+(d).inp 000507301.td-b3lyp_6-31g+(d).log.xz

000507301.td-b3lyp_6-31+g(d).qchem.inp (generated)

000507301.td-b3lyp_6-31+g(d).gjf (generated)

000507301.td-b3lyp_6-31+g(d).firefly.inp (generated)

000507301.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000507301.mol 000507301.PUBCHEM 000507301.mol (via Jmol)
000507302.b3lyp_6-31g(d).inp

000507302.b3lyp_6-31g(d).qchem.inp (generated)

000507302.b3lyp_6-31g(d).gjf (generated)

000507302.b3lyp_6-31g(d).firefly.inp (generated)

000507302.b3lyp_6-31g(d).smash.inp (generated)

000507302.b3lyp_6-31g(d).nwchem.inp (generated) 000507302.b3lyp_6-31g(d).log.xz 000507302.td-b3lyp_6-31g+(d).inp 000507302.td-b3lyp_6-31g+(d).log.xz

000507302.td-b3lyp_6-31+g(d).qchem.inp (generated)

000507302.td-b3lyp_6-31+g(d).gjf (generated)

000507302.td-b3lyp_6-31+g(d).firefly.inp (generated)

000507302.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000507302.mol 000507302.PUBCHEM 000507302.mol (via Jmol)
000507303.b3lyp_6-31g(d).inp

000507303.b3lyp_6-31g(d).qchem.inp (generated)

000507303.b3lyp_6-31g(d).gjf (generated)

000507303.b3lyp_6-31g(d).firefly.inp (generated)

000507303.b3lyp_6-31g(d).smash.inp (generated)

000507303.b3lyp_6-31g(d).nwchem.inp (generated) 000507303.b3lyp_6-31g(d).log.xz 000507303.td-b3lyp_6-31g+(d).inp 000507303.td-b3lyp_6-31g+(d).log.xz

000507303.td-b3lyp_6-31+g(d).qchem.inp (generated)

000507303.td-b3lyp_6-31+g(d).gjf (generated)

000507303.td-b3lyp_6-31+g(d).firefly.inp (generated)

000507303.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000507303.mol 000507303.PUBCHEM 000507303.mol (via Jmol)
000508057.b3lyp_6-31g(d).inp

000508057.b3lyp_6-31g(d).qchem.inp (generated)

000508057.b3lyp_6-31g(d).gjf (generated)

000508057.b3lyp_6-31g(d).firefly.inp (generated)

000508057.b3lyp_6-31g(d).smash.inp (generated)

000508057.b3lyp_6-31g(d).nwchem.inp (generated) 000508057.b3lyp_6-31g(d).log.xz 000508057.td-b3lyp_6-31g+(d).inp 000508057.td-b3lyp_6-31g+(d).log.xz

000508057.td-b3lyp_6-31+g(d).qchem.inp (generated)

000508057.td-b3lyp_6-31+g(d).gjf (generated)

000508057.td-b3lyp_6-31+g(d).firefly.inp (generated)

000508057.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000508057.mol 000508057.PUBCHEM 000508057.mol (via Jmol)
000508058.b3lyp_6-31g(d).inp

000508058.b3lyp_6-31g(d).qchem.inp (generated)

000508058.b3lyp_6-31g(d).gjf (generated)

000508058.b3lyp_6-31g(d).firefly.inp (generated)

000508058.b3lyp_6-31g(d).smash.inp (generated)

000508058.b3lyp_6-31g(d).nwchem.inp (generated) 000508058.b3lyp_6-31g(d).log.xz 000508058.td-b3lyp_6-31g+(d).inp 000508058.td-b3lyp_6-31g+(d).log.xz

000508058.td-b3lyp_6-31+g(d).qchem.inp (generated)

000508058.td-b3lyp_6-31+g(d).gjf (generated)

000508058.td-b3lyp_6-31+g(d).firefly.inp (generated)

000508058.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000508058.mol 000508058.PUBCHEM 000508058.mol (via Jmol)
000508059.b3lyp_6-31g(d).inp

000508059.b3lyp_6-31g(d).qchem.inp (generated)

000508059.b3lyp_6-31g(d).gjf (generated)

000508059.b3lyp_6-31g(d).firefly.inp (generated)

000508059.b3lyp_6-31g(d).smash.inp (generated)

000508059.b3lyp_6-31g(d).nwchem.inp (generated) 000508059.b3lyp_6-31g(d).log.xz 000508059.td-b3lyp_6-31g+(d).inp 000508059.td-b3lyp_6-31g+(d).log.xz

000508059.td-b3lyp_6-31+g(d).qchem.inp (generated)

000508059.td-b3lyp_6-31+g(d).gjf (generated)

000508059.td-b3lyp_6-31+g(d).firefly.inp (generated)

000508059.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000508059.mol 000508059.PUBCHEM 000508059.mol (via Jmol)
000508060.b3lyp_6-31g(d).inp

000508060.b3lyp_6-31g(d).qchem.inp (generated)

000508060.b3lyp_6-31g(d).gjf (generated)

000508060.b3lyp_6-31g(d).firefly.inp (generated)

000508060.b3lyp_6-31g(d).smash.inp (generated)

000508060.b3lyp_6-31g(d).nwchem.inp (generated) 000508060.b3lyp_6-31g(d).log.xz 000508060.td-b3lyp_6-31g+(d).inp 000508060.td-b3lyp_6-31g+(d).log.xz

000508060.td-b3lyp_6-31+g(d).qchem.inp (generated)

000508060.td-b3lyp_6-31+g(d).gjf (generated)

000508060.td-b3lyp_6-31+g(d).firefly.inp (generated)

000508060.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000508060.mol 000508060.PUBCHEM 000508060.mol (via Jmol)
000508061.b3lyp_6-31g(d).inp

000508061.b3lyp_6-31g(d).qchem.inp (generated)

000508061.b3lyp_6-31g(d).gjf (generated)

000508061.b3lyp_6-31g(d).firefly.inp (generated)

000508061.b3lyp_6-31g(d).smash.inp (generated)

000508061.b3lyp_6-31g(d).nwchem.inp (generated) 000508061.b3lyp_6-31g(d).log.xz 000508061.td-b3lyp_6-31g+(d).inp 000508061.td-b3lyp_6-31g+(d).log.xz

000508061.td-b3lyp_6-31+g(d).qchem.inp (generated)

000508061.td-b3lyp_6-31+g(d).gjf (generated)

000508061.td-b3lyp_6-31+g(d).firefly.inp (generated)

000508061.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000508061.mol 000508061.PUBCHEM 000508061.mol (via Jmol)
000508062.b3lyp_6-31g(d).inp

000508062.b3lyp_6-31g(d).qchem.inp (generated)

000508062.b3lyp_6-31g(d).gjf (generated)

000508062.b3lyp_6-31g(d).firefly.inp (generated)

000508062.b3lyp_6-31g(d).smash.inp (generated)

000508062.b3lyp_6-31g(d).nwchem.inp (generated) 000508062.b3lyp_6-31g(d).log.xz 000508062.td-b3lyp_6-31g+(d).inp 000508062.td-b3lyp_6-31g+(d).log.xz

000508062.td-b3lyp_6-31+g(d).qchem.inp (generated)

000508062.td-b3lyp_6-31+g(d).gjf (generated)

000508062.td-b3lyp_6-31+g(d).firefly.inp (generated)

000508062.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000508062.mol 000508062.PUBCHEM 000508062.mol (via Jmol)
000508063.b3lyp_6-31g(d).inp

000508063.b3lyp_6-31g(d).qchem.inp (generated)

000508063.b3lyp_6-31g(d).gjf (generated)

000508063.b3lyp_6-31g(d).firefly.inp (generated)

000508063.b3lyp_6-31g(d).smash.inp (generated)

000508063.b3lyp_6-31g(d).nwchem.inp (generated) 000508063.b3lyp_6-31g(d).log.xz 000508063.td-b3lyp_6-31g+(d).inp 000508063.td-b3lyp_6-31g+(d).log.xz

000508063.td-b3lyp_6-31+g(d).qchem.inp (generated)

000508063.td-b3lyp_6-31+g(d).gjf (generated)

000508063.td-b3lyp_6-31+g(d).firefly.inp (generated)

000508063.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000508063.mol 000508063.PUBCHEM 000508063.mol (via Jmol)
000508064.b3lyp_6-31g(d).inp

000508064.b3lyp_6-31g(d).qchem.inp (generated)

000508064.b3lyp_6-31g(d).gjf (generated)

000508064.b3lyp_6-31g(d).firefly.inp (generated)

000508064.b3lyp_6-31g(d).smash.inp (generated)

000508064.b3lyp_6-31g(d).nwchem.inp (generated) 000508064.b3lyp_6-31g(d).log.xz 000508064.td-b3lyp_6-31g+(d).inp 000508064.td-b3lyp_6-31g+(d).log.xz

000508064.td-b3lyp_6-31+g(d).qchem.inp (generated)

000508064.td-b3lyp_6-31+g(d).gjf (generated)

000508064.td-b3lyp_6-31+g(d).firefly.inp (generated)

000508064.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000508064.mol 000508064.PUBCHEM 000508064.mol (via Jmol)
000508465.b3lyp_6-31g(d).inp

000508465.b3lyp_6-31g(d).qchem.inp (generated)

000508465.b3lyp_6-31g(d).gjf (generated)

000508465.b3lyp_6-31g(d).firefly.inp (generated)

000508465.b3lyp_6-31g(d).smash.inp (generated)

000508465.b3lyp_6-31g(d).nwchem.inp (generated) 000508465.b3lyp_6-31g(d).log.xz 000508465.td-b3lyp_6-31g+(d).inp 000508465.td-b3lyp_6-31g+(d).log.xz

000508465.td-b3lyp_6-31+g(d).qchem.inp (generated)

000508465.td-b3lyp_6-31+g(d).gjf (generated)

000508465.td-b3lyp_6-31+g(d).firefly.inp (generated)

000508465.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000508465.mol 000508465.PUBCHEM 000508465.mol (via Jmol)
000509069.b3lyp_6-31g(d).inp

000509069.b3lyp_6-31g(d).qchem.inp (generated)

000509069.b3lyp_6-31g(d).gjf (generated)

000509069.b3lyp_6-31g(d).firefly.inp (generated)

000509069.b3lyp_6-31g(d).smash.inp (generated)

000509069.b3lyp_6-31g(d).nwchem.inp (generated) 000509069.b3lyp_6-31g(d).log.xz 000509069.td-b3lyp_6-31g+(d).inp 000509069.td-b3lyp_6-31g+(d).log.xz

000509069.td-b3lyp_6-31+g(d).qchem.inp (generated)

000509069.td-b3lyp_6-31+g(d).gjf (generated)

000509069.td-b3lyp_6-31+g(d).firefly.inp (generated)

000509069.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000509069.mol 000509069.PUBCHEM 000509069.mol (via Jmol)
000509072.b3lyp_6-31g(d).inp

000509072.b3lyp_6-31g(d).qchem.inp (generated)

000509072.b3lyp_6-31g(d).gjf (generated)

000509072.b3lyp_6-31g(d).firefly.inp (generated)

000509072.b3lyp_6-31g(d).smash.inp (generated)

000509072.b3lyp_6-31g(d).nwchem.inp (generated) 000509072.b3lyp_6-31g(d).log.xz 000509072.td-b3lyp_6-31g+(d).inp 000509072.td-b3lyp_6-31g+(d).log.xz

000509072.td-b3lyp_6-31+g(d).qchem.inp (generated)

000509072.td-b3lyp_6-31+g(d).gjf (generated)

000509072.td-b3lyp_6-31+g(d).firefly.inp (generated)

000509072.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000509072.mol 000509072.PUBCHEM 000509072.mol (via Jmol)
000509073.b3lyp_6-31g(d).inp

000509073.b3lyp_6-31g(d).qchem.inp (generated)

000509073.b3lyp_6-31g(d).gjf (generated)

000509073.b3lyp_6-31g(d).firefly.inp (generated)

000509073.b3lyp_6-31g(d).smash.inp (generated)

000509073.b3lyp_6-31g(d).nwchem.inp (generated) 000509073.b3lyp_6-31g(d).log.xz 000509073.td-b3lyp_6-31g+(d).inp 000509073.td-b3lyp_6-31g+(d).log.xz

000509073.td-b3lyp_6-31+g(d).qchem.inp (generated)

000509073.td-b3lyp_6-31+g(d).gjf (generated)

000509073.td-b3lyp_6-31+g(d).firefly.inp (generated)

000509073.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000509073.mol 000509073.PUBCHEM 000509073.mol (via Jmol)
000509074.b3lyp_6-31g(d).inp

000509074.b3lyp_6-31g(d).qchem.inp (generated)

000509074.b3lyp_6-31g(d).gjf (generated)

000509074.b3lyp_6-31g(d).firefly.inp (generated)

000509074.b3lyp_6-31g(d).smash.inp (generated)

000509074.b3lyp_6-31g(d).nwchem.inp (generated) 000509074.b3lyp_6-31g(d).log.xz 000509074.td-b3lyp_6-31g+(d).inp 000509074.td-b3lyp_6-31g+(d).log.xz

000509074.td-b3lyp_6-31+g(d).qchem.inp (generated)

000509074.td-b3lyp_6-31+g(d).gjf (generated)

000509074.td-b3lyp_6-31+g(d).firefly.inp (generated)

000509074.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000509074.mol 000509074.PUBCHEM 000509074.mol (via Jmol)
000509075.b3lyp_6-31g(d).inp

000509075.b3lyp_6-31g(d).qchem.inp (generated)

000509075.b3lyp_6-31g(d).gjf (generated)

000509075.b3lyp_6-31g(d).firefly.inp (generated)

000509075.b3lyp_6-31g(d).smash.inp (generated)

000509075.b3lyp_6-31g(d).nwchem.inp (generated) 000509075.b3lyp_6-31g(d).log.xz 000509075.td-b3lyp_6-31g+(d).inp 000509075.td-b3lyp_6-31g+(d).log.xz

000509075.td-b3lyp_6-31+g(d).qchem.inp (generated)

000509075.td-b3lyp_6-31+g(d).gjf (generated)

000509075.td-b3lyp_6-31+g(d).firefly.inp (generated)

000509075.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000509075.mol 000509075.PUBCHEM 000509075.mol (via Jmol)
000509076.b3lyp_6-31g(d).inp

000509076.b3lyp_6-31g(d).qchem.inp (generated)

000509076.b3lyp_6-31g(d).gjf (generated)

000509076.b3lyp_6-31g(d).firefly.inp (generated)

000509076.b3lyp_6-31g(d).smash.inp (generated)

000509076.b3lyp_6-31g(d).nwchem.inp (generated) 000509076.b3lyp_6-31g(d).log.xz 000509076.td-b3lyp_6-31g+(d).inp 000509076.td-b3lyp_6-31g+(d).log.xz

000509076.td-b3lyp_6-31+g(d).qchem.inp (generated)

000509076.td-b3lyp_6-31+g(d).gjf (generated)

000509076.td-b3lyp_6-31+g(d).firefly.inp (generated)

000509076.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000509076.mol 000509076.PUBCHEM 000509076.mol (via Jmol)
000509077.b3lyp_6-31g(d).inp

000509077.b3lyp_6-31g(d).qchem.inp (generated)

000509077.b3lyp_6-31g(d).gjf (generated)

000509077.b3lyp_6-31g(d).firefly.inp (generated)

000509077.b3lyp_6-31g(d).smash.inp (generated)

000509077.b3lyp_6-31g(d).nwchem.inp (generated) 000509077.b3lyp_6-31g(d).log.xz 000509077.td-b3lyp_6-31g+(d).inp 000509077.td-b3lyp_6-31g+(d).log.xz

000509077.td-b3lyp_6-31+g(d).qchem.inp (generated)

000509077.td-b3lyp_6-31+g(d).gjf (generated)

000509077.td-b3lyp_6-31+g(d).firefly.inp (generated)

000509077.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000509077.mol 000509077.PUBCHEM 000509077.mol (via Jmol)
000509183.b3lyp_6-31g(d).inp

000509183.b3lyp_6-31g(d).qchem.inp (generated)

000509183.b3lyp_6-31g(d).gjf (generated)

000509183.b3lyp_6-31g(d).firefly.inp (generated)

000509183.b3lyp_6-31g(d).smash.inp (generated)

000509183.b3lyp_6-31g(d).nwchem.inp (generated) 000509183.b3lyp_6-31g(d).log.xz 000509183.td-b3lyp_6-31g+(d).inp 000509183.td-b3lyp_6-31g+(d).log.xz

000509183.td-b3lyp_6-31+g(d).qchem.inp (generated)

000509183.td-b3lyp_6-31+g(d).gjf (generated)

000509183.td-b3lyp_6-31+g(d).firefly.inp (generated)

000509183.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000509183.mol 000509183.PUBCHEM 000509183.mol (via Jmol)
000509190.b3lyp_6-31g(d).inp

000509190.b3lyp_6-31g(d).qchem.inp (generated)

000509190.b3lyp_6-31g(d).gjf (generated)

000509190.b3lyp_6-31g(d).firefly.inp (generated)

000509190.b3lyp_6-31g(d).smash.inp (generated)

000509190.b3lyp_6-31g(d).nwchem.inp (generated) 000509190.b3lyp_6-31g(d).log.xz 000509190.td-b3lyp_6-31g+(d).inp 000509190.td-b3lyp_6-31g+(d).log.xz

000509190.td-b3lyp_6-31+g(d).qchem.inp (generated)

000509190.td-b3lyp_6-31+g(d).gjf (generated)

000509190.td-b3lyp_6-31+g(d).firefly.inp (generated)

000509190.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000509190.mol 000509190.PUBCHEM 000509190.mol (via Jmol)
000509191.b3lyp_6-31g(d).inp

000509191.b3lyp_6-31g(d).qchem.inp (generated)

000509191.b3lyp_6-31g(d).gjf (generated)

000509191.b3lyp_6-31g(d).firefly.inp (generated)

000509191.b3lyp_6-31g(d).smash.inp (generated)

000509191.b3lyp_6-31g(d).nwchem.inp (generated) 000509191.b3lyp_6-31g(d).log.xz 000509191.td-b3lyp_6-31g+(d).inp 000509191.td-b3lyp_6-31g+(d).log.xz

000509191.td-b3lyp_6-31+g(d).qchem.inp (generated)

000509191.td-b3lyp_6-31+g(d).gjf (generated)

000509191.td-b3lyp_6-31+g(d).firefly.inp (generated)

000509191.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000509191.mol 000509191.PUBCHEM 000509191.mol (via Jmol)
000509488.b3lyp_6-31g(d).inp

000509488.b3lyp_6-31g(d).qchem.inp (generated)

000509488.b3lyp_6-31g(d).gjf (generated)

000509488.b3lyp_6-31g(d).firefly.inp (generated)

000509488.b3lyp_6-31g(d).smash.inp (generated)

000509488.b3lyp_6-31g(d).nwchem.inp (generated) 000509488.b3lyp_6-31g(d).log.xz 000509488.td-b3lyp_6-31g+(d).inp 000509488.td-b3lyp_6-31g+(d).log.xz

000509488.td-b3lyp_6-31+g(d).qchem.inp (generated)

000509488.td-b3lyp_6-31+g(d).gjf (generated)

000509488.td-b3lyp_6-31+g(d).firefly.inp (generated)

000509488.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000509488.mol 000509488.PUBCHEM 000509488.mol (via Jmol)
000509505.b3lyp_6-31g(d).inp

000509505.b3lyp_6-31g(d).qchem.inp (generated)

000509505.b3lyp_6-31g(d).gjf (generated)

000509505.b3lyp_6-31g(d).firefly.inp (generated)

000509505.b3lyp_6-31g(d).smash.inp (generated)

000509505.b3lyp_6-31g(d).nwchem.inp (generated) 000509505.b3lyp_6-31g(d).log.xz 000509505.td-b3lyp_6-31g+(d).inp 000509505.td-b3lyp_6-31g+(d).log.xz

000509505.td-b3lyp_6-31+g(d).qchem.inp (generated)

000509505.td-b3lyp_6-31+g(d).gjf (generated)

000509505.td-b3lyp_6-31+g(d).firefly.inp (generated)

000509505.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000509505.mol 000509505.PUBCHEM 000509505.mol (via Jmol)
000509514.b3lyp_6-31g(d).inp

000509514.b3lyp_6-31g(d).qchem.inp (generated)

000509514.b3lyp_6-31g(d).gjf (generated)

000509514.b3lyp_6-31g(d).firefly.inp (generated)

000509514.b3lyp_6-31g(d).smash.inp (generated)

000509514.b3lyp_6-31g(d).nwchem.inp (generated) 000509514.b3lyp_6-31g(d).log.xz 000509514.td-b3lyp_6-31g+(d).inp 000509514.td-b3lyp_6-31g+(d).log.xz

000509514.td-b3lyp_6-31+g(d).qchem.inp (generated)

000509514.td-b3lyp_6-31+g(d).gjf (generated)

000509514.td-b3lyp_6-31+g(d).firefly.inp (generated)

000509514.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000509514.mol 000509514.PUBCHEM 000509514.mol (via Jmol)
000509517.b3lyp_6-31g(d).inp

000509517.b3lyp_6-31g(d).qchem.inp (generated)

000509517.b3lyp_6-31g(d).gjf (generated)

000509517.b3lyp_6-31g(d).firefly.inp (generated)

000509517.b3lyp_6-31g(d).smash.inp (generated)

000509517.b3lyp_6-31g(d).nwchem.inp (generated) 000509517.b3lyp_6-31g(d).log.xz 000509517.td-b3lyp_6-31g+(d).inp 000509517.td-b3lyp_6-31g+(d).log.xz

000509517.td-b3lyp_6-31+g(d).qchem.inp (generated)

000509517.td-b3lyp_6-31+g(d).gjf (generated)

000509517.td-b3lyp_6-31+g(d).firefly.inp (generated)

000509517.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000509517.mol 000509517.PUBCHEM 000509517.mol (via Jmol)
000510026.b3lyp_6-31g(d).inp

000510026.b3lyp_6-31g(d).qchem.inp (generated)

000510026.b3lyp_6-31g(d).gjf (generated)

000510026.b3lyp_6-31g(d).firefly.inp (generated)

000510026.b3lyp_6-31g(d).smash.inp (generated)

000510026.b3lyp_6-31g(d).nwchem.inp (generated) 000510026.b3lyp_6-31g(d).log.xz 000510026.td-b3lyp_6-31g+(d).inp 000510026.td-b3lyp_6-31g+(d).log.xz

000510026.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510026.td-b3lyp_6-31+g(d).gjf (generated)

000510026.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510026.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510026.mol 000510026.PUBCHEM 000510026.mol (via Jmol)
000510105.b3lyp_6-31g(d).inp

000510105.b3lyp_6-31g(d).qchem.inp (generated)

000510105.b3lyp_6-31g(d).gjf (generated)

000510105.b3lyp_6-31g(d).firefly.inp (generated)

000510105.b3lyp_6-31g(d).smash.inp (generated)

000510105.b3lyp_6-31g(d).nwchem.inp (generated) 000510105.b3lyp_6-31g(d).log.xz 000510105.td-b3lyp_6-31g+(d).inp 000510105.td-b3lyp_6-31g+(d).log.xz

000510105.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510105.td-b3lyp_6-31+g(d).gjf (generated)

000510105.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510105.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510105.mol 000510105.PUBCHEM 000510105.mol (via Jmol)
000510118.b3lyp_6-31g(d).inp

000510118.b3lyp_6-31g(d).qchem.inp (generated)

000510118.b3lyp_6-31g(d).gjf (generated)

000510118.b3lyp_6-31g(d).firefly.inp (generated)

000510118.b3lyp_6-31g(d).smash.inp (generated)

000510118.b3lyp_6-31g(d).nwchem.inp (generated) 000510118.b3lyp_6-31g(d).log.xz 000510118.td-b3lyp_6-31g+(d).inp 000510118.td-b3lyp_6-31g+(d).log.xz

000510118.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510118.td-b3lyp_6-31+g(d).gjf (generated)

000510118.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510118.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510118.mol 000510118.PUBCHEM 000510118.mol (via Jmol)
000510119.b3lyp_6-31g(d).inp

000510119.b3lyp_6-31g(d).qchem.inp (generated)

000510119.b3lyp_6-31g(d).gjf (generated)

000510119.b3lyp_6-31g(d).firefly.inp (generated)

000510119.b3lyp_6-31g(d).smash.inp (generated)

000510119.b3lyp_6-31g(d).nwchem.inp (generated) 000510119.b3lyp_6-31g(d).log.xz 000510119.td-b3lyp_6-31g+(d).inp 000510119.td-b3lyp_6-31g+(d).log.xz

000510119.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510119.td-b3lyp_6-31+g(d).gjf (generated)

000510119.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510119.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510119.mol 000510119.PUBCHEM 000510119.mol (via Jmol)
000510123.b3lyp_6-31g(d).inp

000510123.b3lyp_6-31g(d).qchem.inp (generated)

000510123.b3lyp_6-31g(d).gjf (generated)

000510123.b3lyp_6-31g(d).firefly.inp (generated)

000510123.b3lyp_6-31g(d).smash.inp (generated)

000510123.b3lyp_6-31g(d).nwchem.inp (generated) 000510123.b3lyp_6-31g(d).log.xz 000510123.td-b3lyp_6-31g+(d).inp 000510123.td-b3lyp_6-31g+(d).log.xz

000510123.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510123.td-b3lyp_6-31+g(d).gjf (generated)

000510123.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510123.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510123.mol 000510123.PUBCHEM 000510123.mol (via Jmol)
000510370.b3lyp_6-31g(d).inp

000510370.b3lyp_6-31g(d).qchem.inp (generated)

000510370.b3lyp_6-31g(d).gjf (generated)

000510370.b3lyp_6-31g(d).firefly.inp (generated)

000510370.b3lyp_6-31g(d).smash.inp (generated)

000510370.b3lyp_6-31g(d).nwchem.inp (generated) 000510370.b3lyp_6-31g(d).log.xz 000510370.td-b3lyp_6-31g+(d).inp 000510370.td-b3lyp_6-31g+(d).log.xz

000510370.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510370.td-b3lyp_6-31+g(d).gjf (generated)

000510370.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510370.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510370.mol 000510370.PUBCHEM 000510370.mol (via Jmol)
000510425.b3lyp_6-31g(d).inp

000510425.b3lyp_6-31g(d).qchem.inp (generated)

000510425.b3lyp_6-31g(d).gjf (generated)

000510425.b3lyp_6-31g(d).firefly.inp (generated)

000510425.b3lyp_6-31g(d).smash.inp (generated)

000510425.b3lyp_6-31g(d).nwchem.inp (generated) 000510425.b3lyp_6-31g(d).log.xz 000510425.td-b3lyp_6-31g+(d).inp 000510425.td-b3lyp_6-31g+(d).log.xz

000510425.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510425.td-b3lyp_6-31+g(d).gjf (generated)

000510425.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510425.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510425.mol 000510425.PUBCHEM 000510425.mol (via Jmol)
000510426.b3lyp_6-31g(d).inp

000510426.b3lyp_6-31g(d).qchem.inp (generated)

000510426.b3lyp_6-31g(d).gjf (generated)

000510426.b3lyp_6-31g(d).firefly.inp (generated)

000510426.b3lyp_6-31g(d).smash.inp (generated)

000510426.b3lyp_6-31g(d).nwchem.inp (generated) 000510426.b3lyp_6-31g(d).log.xz 000510426.td-b3lyp_6-31g+(d).inp 000510426.td-b3lyp_6-31g+(d).log.xz

000510426.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510426.td-b3lyp_6-31+g(d).gjf (generated)

000510426.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510426.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510426.mol 000510426.PUBCHEM 000510426.mol (via Jmol)
000510427.b3lyp_6-31g(d).inp

000510427.b3lyp_6-31g(d).qchem.inp (generated)

000510427.b3lyp_6-31g(d).gjf (generated)

000510427.b3lyp_6-31g(d).firefly.inp (generated)

000510427.b3lyp_6-31g(d).smash.inp (generated)

000510427.b3lyp_6-31g(d).nwchem.inp (generated) 000510427.b3lyp_6-31g(d).log.xz 000510427.td-b3lyp_6-31g+(d).inp 000510427.td-b3lyp_6-31g+(d).log.xz

000510427.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510427.td-b3lyp_6-31+g(d).gjf (generated)

000510427.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510427.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510427.mol 000510427.PUBCHEM 000510427.mol (via Jmol)
000510429.b3lyp_6-31g(d).inp

000510429.b3lyp_6-31g(d).qchem.inp (generated)

000510429.b3lyp_6-31g(d).gjf (generated)

000510429.b3lyp_6-31g(d).firefly.inp (generated)

000510429.b3lyp_6-31g(d).smash.inp (generated)

000510429.b3lyp_6-31g(d).nwchem.inp (generated) 000510429.b3lyp_6-31g(d).log.xz 000510429.td-b3lyp_6-31g+(d).inp 000510429.td-b3lyp_6-31g+(d).log.xz

000510429.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510429.td-b3lyp_6-31+g(d).gjf (generated)

000510429.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510429.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510429.mol 000510429.PUBCHEM 000510429.mol (via Jmol)
000510434.b3lyp_6-31g(d).inp

000510434.b3lyp_6-31g(d).qchem.inp (generated)

000510434.b3lyp_6-31g(d).gjf (generated)

000510434.b3lyp_6-31g(d).firefly.inp (generated)

000510434.b3lyp_6-31g(d).smash.inp (generated)

000510434.b3lyp_6-31g(d).nwchem.inp (generated) 000510434.b3lyp_6-31g(d).log.xz 000510434.td-b3lyp_6-31g+(d).inp 000510434.td-b3lyp_6-31g+(d).log.xz

000510434.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510434.td-b3lyp_6-31+g(d).gjf (generated)

000510434.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510434.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510434.mol 000510434.PUBCHEM 000510434.mol (via Jmol)
000510435.b3lyp_6-31g(d).inp

000510435.b3lyp_6-31g(d).qchem.inp (generated)

000510435.b3lyp_6-31g(d).gjf (generated)

000510435.b3lyp_6-31g(d).firefly.inp (generated)

000510435.b3lyp_6-31g(d).smash.inp (generated)

000510435.b3lyp_6-31g(d).nwchem.inp (generated) 000510435.b3lyp_6-31g(d).log.xz 000510435.td-b3lyp_6-31g+(d).inp 000510435.td-b3lyp_6-31g+(d).log.xz

000510435.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510435.td-b3lyp_6-31+g(d).gjf (generated)

000510435.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510435.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510435.mol 000510435.PUBCHEM 000510435.mol (via Jmol)
000510436.b3lyp_6-31g(d).inp

000510436.b3lyp_6-31g(d).qchem.inp (generated)

000510436.b3lyp_6-31g(d).gjf (generated)

000510436.b3lyp_6-31g(d).firefly.inp (generated)

000510436.b3lyp_6-31g(d).smash.inp (generated)

000510436.b3lyp_6-31g(d).nwchem.inp (generated) 000510436.b3lyp_6-31g(d).log.xz 000510436.td-b3lyp_6-31g+(d).inp 000510436.td-b3lyp_6-31g+(d).log.xz

000510436.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510436.td-b3lyp_6-31+g(d).gjf (generated)

000510436.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510436.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510436.mol 000510436.PUBCHEM 000510436.mol (via Jmol)
000510567.b3lyp_6-31g(d).inp

000510567.b3lyp_6-31g(d).qchem.inp (generated)

000510567.b3lyp_6-31g(d).gjf (generated)

000510567.b3lyp_6-31g(d).firefly.inp (generated)

000510567.b3lyp_6-31g(d).smash.inp (generated)

000510567.b3lyp_6-31g(d).nwchem.inp (generated) 000510567.b3lyp_6-31g(d).log.xz 000510567.td-b3lyp_6-31g+(d).inp 000510567.td-b3lyp_6-31g+(d).log.xz

000510567.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510567.td-b3lyp_6-31+g(d).gjf (generated)

000510567.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510567.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510567.mol 000510567.PUBCHEM 000510567.mol (via Jmol)
000510628.b3lyp_6-31g(d).inp

000510628.b3lyp_6-31g(d).qchem.inp (generated)

000510628.b3lyp_6-31g(d).gjf (generated)

000510628.b3lyp_6-31g(d).firefly.inp (generated)

000510628.b3lyp_6-31g(d).smash.inp (generated)

000510628.b3lyp_6-31g(d).nwchem.inp (generated) 000510628.b3lyp_6-31g(d).log.xz 000510628.td-b3lyp_6-31g+(d).inp 000510628.td-b3lyp_6-31g+(d).log.xz

000510628.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510628.td-b3lyp_6-31+g(d).gjf (generated)

000510628.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510628.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510628.mol 000510628.PUBCHEM 000510628.mol (via Jmol)
000510633.b3lyp_6-31g(d).inp

000510633.b3lyp_6-31g(d).qchem.inp (generated)

000510633.b3lyp_6-31g(d).gjf (generated)

000510633.b3lyp_6-31g(d).firefly.inp (generated)

000510633.b3lyp_6-31g(d).smash.inp (generated)

000510633.b3lyp_6-31g(d).nwchem.inp (generated) 000510633.b3lyp_6-31g(d).log.xz 000510633.td-b3lyp_6-31g+(d).inp 000510633.td-b3lyp_6-31g+(d).log.xz

000510633.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510633.td-b3lyp_6-31+g(d).gjf (generated)

000510633.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510633.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510633.mol 000510633.PUBCHEM 000510633.mol (via Jmol)
000510638.b3lyp_6-31g(d).inp

000510638.b3lyp_6-31g(d).qchem.inp (generated)

000510638.b3lyp_6-31g(d).gjf (generated)

000510638.b3lyp_6-31g(d).firefly.inp (generated)

000510638.b3lyp_6-31g(d).smash.inp (generated)

000510638.b3lyp_6-31g(d).nwchem.inp (generated) 000510638.b3lyp_6-31g(d).log.xz 000510638.td-b3lyp_6-31g+(d).inp 000510638.td-b3lyp_6-31g+(d).log.xz

000510638.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510638.td-b3lyp_6-31+g(d).gjf (generated)

000510638.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510638.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510638.mol 000510638.PUBCHEM 000510638.mol (via Jmol)
000510658.b3lyp_6-31g(d).inp

000510658.b3lyp_6-31g(d).qchem.inp (generated)

000510658.b3lyp_6-31g(d).gjf (generated)

000510658.b3lyp_6-31g(d).firefly.inp (generated)

000510658.b3lyp_6-31g(d).smash.inp (generated)

000510658.b3lyp_6-31g(d).nwchem.inp (generated) 000510658.b3lyp_6-31g(d).log.xz 000510658.td-b3lyp_6-31g+(d).inp 000510658.td-b3lyp_6-31g+(d).log.xz

000510658.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510658.td-b3lyp_6-31+g(d).gjf (generated)

000510658.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510658.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510658.mol 000510658.PUBCHEM 000510658.mol (via Jmol)
000510669.b3lyp_6-31g(d).inp

000510669.b3lyp_6-31g(d).qchem.inp (generated)

000510669.b3lyp_6-31g(d).gjf (generated)

000510669.b3lyp_6-31g(d).firefly.inp (generated)

000510669.b3lyp_6-31g(d).smash.inp (generated)

000510669.b3lyp_6-31g(d).nwchem.inp (generated) 000510669.b3lyp_6-31g(d).log.xz 000510669.td-b3lyp_6-31g+(d).inp 000510669.td-b3lyp_6-31g+(d).log.xz

000510669.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510669.td-b3lyp_6-31+g(d).gjf (generated)

000510669.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510669.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510669.mol 000510669.PUBCHEM 000510669.mol (via Jmol)
000510699.b3lyp_6-31g(d).inp

000510699.b3lyp_6-31g(d).qchem.inp (generated)

000510699.b3lyp_6-31g(d).gjf (generated)

000510699.b3lyp_6-31g(d).firefly.inp (generated)

000510699.b3lyp_6-31g(d).smash.inp (generated)

000510699.b3lyp_6-31g(d).nwchem.inp (generated) 000510699.b3lyp_6-31g(d).log.xz 000510699.td-b3lyp_6-31g+(d).inp 000510699.td-b3lyp_6-31g+(d).log.xz

000510699.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510699.td-b3lyp_6-31+g(d).gjf (generated)

000510699.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510699.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510699.mol 000510699.PUBCHEM 000510699.mol (via Jmol)
000510701.b3lyp_6-31g(d).inp

000510701.b3lyp_6-31g(d).qchem.inp (generated)

000510701.b3lyp_6-31g(d).gjf (generated)

000510701.b3lyp_6-31g(d).firefly.inp (generated)

000510701.b3lyp_6-31g(d).smash.inp (generated)

000510701.b3lyp_6-31g(d).nwchem.inp (generated) 000510701.b3lyp_6-31g(d).log.xz 000510701.td-b3lyp_6-31g+(d).inp 000510701.td-b3lyp_6-31g+(d).log.xz

000510701.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510701.td-b3lyp_6-31+g(d).gjf (generated)

000510701.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510701.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510701.mol 000510701.PUBCHEM 000510701.mol (via Jmol)
000510785.b3lyp_6-31g(d).inp

000510785.b3lyp_6-31g(d).qchem.inp (generated)

000510785.b3lyp_6-31g(d).gjf (generated)

000510785.b3lyp_6-31g(d).firefly.inp (generated)

000510785.b3lyp_6-31g(d).smash.inp (generated)

000510785.b3lyp_6-31g(d).nwchem.inp (generated) 000510785.b3lyp_6-31g(d).log.xz 000510785.td-b3lyp_6-31g+(d).inp 000510785.td-b3lyp_6-31g+(d).log.xz

000510785.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510785.td-b3lyp_6-31+g(d).gjf (generated)

000510785.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510785.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510785.mol 000510785.PUBCHEM 000510785.mol (via Jmol)
000510790.b3lyp_6-31g(d).inp

000510790.b3lyp_6-31g(d).qchem.inp (generated)

000510790.b3lyp_6-31g(d).gjf (generated)

000510790.b3lyp_6-31g(d).firefly.inp (generated)

000510790.b3lyp_6-31g(d).smash.inp (generated)

000510790.b3lyp_6-31g(d).nwchem.inp (generated) 000510790.b3lyp_6-31g(d).log.xz 000510790.td-b3lyp_6-31g+(d).inp 000510790.td-b3lyp_6-31g+(d).log.xz

000510790.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510790.td-b3lyp_6-31+g(d).gjf (generated)

000510790.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510790.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510790.mol 000510790.PUBCHEM 000510790.mol (via Jmol)
000510791.b3lyp_6-31g(d).inp

000510791.b3lyp_6-31g(d).qchem.inp (generated)

000510791.b3lyp_6-31g(d).gjf (generated)

000510791.b3lyp_6-31g(d).firefly.inp (generated)

000510791.b3lyp_6-31g(d).smash.inp (generated)

000510791.b3lyp_6-31g(d).nwchem.inp (generated) 000510791.b3lyp_6-31g(d).log.xz 000510791.td-b3lyp_6-31g+(d).inp 000510791.td-b3lyp_6-31g+(d).log.xz

000510791.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510791.td-b3lyp_6-31+g(d).gjf (generated)

000510791.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510791.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510791.mol 000510791.PUBCHEM 000510791.mol (via Jmol)
000510792.b3lyp_6-31g(d).inp

000510792.b3lyp_6-31g(d).qchem.inp (generated)

000510792.b3lyp_6-31g(d).gjf (generated)

000510792.b3lyp_6-31g(d).firefly.inp (generated)

000510792.b3lyp_6-31g(d).smash.inp (generated)

000510792.b3lyp_6-31g(d).nwchem.inp (generated) 000510792.b3lyp_6-31g(d).log.xz 000510792.td-b3lyp_6-31g+(d).inp 000510792.td-b3lyp_6-31g+(d).log.xz

000510792.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510792.td-b3lyp_6-31+g(d).gjf (generated)

000510792.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510792.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510792.mol 000510792.PUBCHEM 000510792.mol (via Jmol)
000510793.b3lyp_6-31g(d).inp

000510793.b3lyp_6-31g(d).qchem.inp (generated)

000510793.b3lyp_6-31g(d).gjf (generated)

000510793.b3lyp_6-31g(d).firefly.inp (generated)

000510793.b3lyp_6-31g(d).smash.inp (generated)

000510793.b3lyp_6-31g(d).nwchem.inp (generated) 000510793.b3lyp_6-31g(d).log.xz 000510793.td-b3lyp_6-31g+(d).inp 000510793.td-b3lyp_6-31g+(d).log.xz

000510793.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510793.td-b3lyp_6-31+g(d).gjf (generated)

000510793.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510793.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510793.mol 000510793.PUBCHEM 000510793.mol (via Jmol)
000510816.b3lyp_6-31g(d).inp

000510816.b3lyp_6-31g(d).qchem.inp (generated)

000510816.b3lyp_6-31g(d).gjf (generated)

000510816.b3lyp_6-31g(d).firefly.inp (generated)

000510816.b3lyp_6-31g(d).smash.inp (generated)

000510816.b3lyp_6-31g(d).nwchem.inp (generated) 000510816.b3lyp_6-31g(d).log.xz 000510816.td-b3lyp_6-31g+(d).inp 000510816.td-b3lyp_6-31g+(d).log.xz

000510816.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510816.td-b3lyp_6-31+g(d).gjf (generated)

000510816.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510816.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510816.mol 000510816.PUBCHEM 000510816.mol (via Jmol)
000510817.b3lyp_6-31g(d).inp

000510817.b3lyp_6-31g(d).qchem.inp (generated)

000510817.b3lyp_6-31g(d).gjf (generated)

000510817.b3lyp_6-31g(d).firefly.inp (generated)

000510817.b3lyp_6-31g(d).smash.inp (generated)

000510817.b3lyp_6-31g(d).nwchem.inp (generated) 000510817.b3lyp_6-31g(d).log.xz 000510817.td-b3lyp_6-31g+(d).inp 000510817.td-b3lyp_6-31g+(d).log.xz

000510817.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510817.td-b3lyp_6-31+g(d).gjf (generated)

000510817.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510817.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510817.mol 000510817.PUBCHEM 000510817.mol (via Jmol)
000510818.b3lyp_6-31g(d).inp

000510818.b3lyp_6-31g(d).qchem.inp (generated)

000510818.b3lyp_6-31g(d).gjf (generated)

000510818.b3lyp_6-31g(d).firefly.inp (generated)

000510818.b3lyp_6-31g(d).smash.inp (generated)

000510818.b3lyp_6-31g(d).nwchem.inp (generated) 000510818.b3lyp_6-31g(d).log.xz 000510818.td-b3lyp_6-31g+(d).inp 000510818.td-b3lyp_6-31g+(d).log.xz

000510818.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510818.td-b3lyp_6-31+g(d).gjf (generated)

000510818.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510818.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510818.mol 000510818.PUBCHEM 000510818.mol (via Jmol)
000510819.b3lyp_6-31g(d).inp

000510819.b3lyp_6-31g(d).qchem.inp (generated)

000510819.b3lyp_6-31g(d).gjf (generated)

000510819.b3lyp_6-31g(d).firefly.inp (generated)

000510819.b3lyp_6-31g(d).smash.inp (generated)

000510819.b3lyp_6-31g(d).nwchem.inp (generated) 000510819.b3lyp_6-31g(d).log.xz 000510819.td-b3lyp_6-31g+(d).inp 000510819.td-b3lyp_6-31g+(d).log.xz

000510819.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510819.td-b3lyp_6-31+g(d).gjf (generated)

000510819.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510819.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510819.mol 000510819.PUBCHEM 000510819.mol (via Jmol)
000510839.b3lyp_6-31g(d).inp

000510839.b3lyp_6-31g(d).qchem.inp (generated)

000510839.b3lyp_6-31g(d).gjf (generated)

000510839.b3lyp_6-31g(d).firefly.inp (generated)

000510839.b3lyp_6-31g(d).smash.inp (generated)

000510839.b3lyp_6-31g(d).nwchem.inp (generated) 000510839.b3lyp_6-31g(d).log.xz 000510839.td-b3lyp_6-31g+(d).inp 000510839.td-b3lyp_6-31g+(d).log.xz

000510839.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510839.td-b3lyp_6-31+g(d).gjf (generated)

000510839.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510839.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510839.mol 000510839.PUBCHEM 000510839.mol (via Jmol)
000510840.b3lyp_6-31g(d).inp

000510840.b3lyp_6-31g(d).qchem.inp (generated)

000510840.b3lyp_6-31g(d).gjf (generated)

000510840.b3lyp_6-31g(d).firefly.inp (generated)

000510840.b3lyp_6-31g(d).smash.inp (generated)

000510840.b3lyp_6-31g(d).nwchem.inp (generated) 000510840.b3lyp_6-31g(d).log.xz 000510840.td-b3lyp_6-31g+(d).inp 000510840.td-b3lyp_6-31g+(d).log.xz

000510840.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510840.td-b3lyp_6-31+g(d).gjf (generated)

000510840.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510840.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510840.mol 000510840.PUBCHEM 000510840.mol (via Jmol)
000510841.b3lyp_6-31g(d).inp

000510841.b3lyp_6-31g(d).qchem.inp (generated)

000510841.b3lyp_6-31g(d).gjf (generated)

000510841.b3lyp_6-31g(d).firefly.inp (generated)

000510841.b3lyp_6-31g(d).smash.inp (generated)

000510841.b3lyp_6-31g(d).nwchem.inp (generated) 000510841.b3lyp_6-31g(d).log.xz 000510841.td-b3lyp_6-31g+(d).inp 000510841.td-b3lyp_6-31g+(d).log.xz

000510841.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510841.td-b3lyp_6-31+g(d).gjf (generated)

000510841.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510841.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510841.mol 000510841.PUBCHEM 000510841.mol (via Jmol)
000510844.b3lyp_6-31g(d).inp

000510844.b3lyp_6-31g(d).qchem.inp (generated)

000510844.b3lyp_6-31g(d).gjf (generated)

000510844.b3lyp_6-31g(d).firefly.inp (generated)

000510844.b3lyp_6-31g(d).smash.inp (generated)

000510844.b3lyp_6-31g(d).nwchem.inp (generated) 000510844.b3lyp_6-31g(d).log.xz 000510844.td-b3lyp_6-31g+(d).inp 000510844.td-b3lyp_6-31g+(d).log.xz

000510844.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510844.td-b3lyp_6-31+g(d).gjf (generated)

000510844.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510844.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510844.mol 000510844.PUBCHEM 000510844.mol (via Jmol)
000510845.b3lyp_6-31g(d).inp

000510845.b3lyp_6-31g(d).qchem.inp (generated)

000510845.b3lyp_6-31g(d).gjf (generated)

000510845.b3lyp_6-31g(d).firefly.inp (generated)

000510845.b3lyp_6-31g(d).smash.inp (generated)

000510845.b3lyp_6-31g(d).nwchem.inp (generated) 000510845.b3lyp_6-31g(d).log.xz 000510845.td-b3lyp_6-31g+(d).inp 000510845.td-b3lyp_6-31g+(d).log.xz

000510845.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510845.td-b3lyp_6-31+g(d).gjf (generated)

000510845.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510845.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510845.mol 000510845.PUBCHEM 000510845.mol (via Jmol)
000510858.b3lyp_6-31g(d).inp

000510858.b3lyp_6-31g(d).qchem.inp (generated)

000510858.b3lyp_6-31g(d).gjf (generated)

000510858.b3lyp_6-31g(d).firefly.inp (generated)

000510858.b3lyp_6-31g(d).smash.inp (generated)

000510858.b3lyp_6-31g(d).nwchem.inp (generated) 000510858.b3lyp_6-31g(d).log.xz 000510858.td-b3lyp_6-31g+(d).inp 000510858.td-b3lyp_6-31g+(d).log.xz

000510858.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510858.td-b3lyp_6-31+g(d).gjf (generated)

000510858.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510858.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510858.mol 000510858.PUBCHEM 000510858.mol (via Jmol)
000510859.b3lyp_6-31g(d).inp

000510859.b3lyp_6-31g(d).qchem.inp (generated)

000510859.b3lyp_6-31g(d).gjf (generated)

000510859.b3lyp_6-31g(d).firefly.inp (generated)

000510859.b3lyp_6-31g(d).smash.inp (generated)

000510859.b3lyp_6-31g(d).nwchem.inp (generated) 000510859.b3lyp_6-31g(d).log.xz 000510859.td-b3lyp_6-31g+(d).inp 000510859.td-b3lyp_6-31g+(d).log.xz

000510859.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510859.td-b3lyp_6-31+g(d).gjf (generated)

000510859.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510859.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510859.mol 000510859.PUBCHEM 000510859.mol (via Jmol)
000510860.b3lyp_6-31g(d).inp

000510860.b3lyp_6-31g(d).qchem.inp (generated)

000510860.b3lyp_6-31g(d).gjf (generated)

000510860.b3lyp_6-31g(d).firefly.inp (generated)

000510860.b3lyp_6-31g(d).smash.inp (generated)

000510860.b3lyp_6-31g(d).nwchem.inp (generated) 000510860.b3lyp_6-31g(d).log.xz 000510860.td-b3lyp_6-31g+(d).inp 000510860.td-b3lyp_6-31g+(d).log.xz

000510860.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510860.td-b3lyp_6-31+g(d).gjf (generated)

000510860.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510860.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510860.mol 000510860.PUBCHEM 000510860.mol (via Jmol)
000510861.b3lyp_6-31g(d).inp

000510861.b3lyp_6-31g(d).qchem.inp (generated)

000510861.b3lyp_6-31g(d).gjf (generated)

000510861.b3lyp_6-31g(d).firefly.inp (generated)

000510861.b3lyp_6-31g(d).smash.inp (generated)

000510861.b3lyp_6-31g(d).nwchem.inp (generated) 000510861.b3lyp_6-31g(d).log.xz 000510861.td-b3lyp_6-31g+(d).inp 000510861.td-b3lyp_6-31g+(d).log.xz

000510861.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510861.td-b3lyp_6-31+g(d).gjf (generated)

000510861.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510861.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510861.mol 000510861.PUBCHEM 000510861.mol (via Jmol)
000510862.b3lyp_6-31g(d).inp

000510862.b3lyp_6-31g(d).qchem.inp (generated)

000510862.b3lyp_6-31g(d).gjf (generated)

000510862.b3lyp_6-31g(d).firefly.inp (generated)

000510862.b3lyp_6-31g(d).smash.inp (generated)

000510862.b3lyp_6-31g(d).nwchem.inp (generated) 000510862.b3lyp_6-31g(d).log.xz 000510862.td-b3lyp_6-31g+(d).inp 000510862.td-b3lyp_6-31g+(d).log.xz

000510862.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510862.td-b3lyp_6-31+g(d).gjf (generated)

000510862.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510862.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510862.mol 000510862.PUBCHEM 000510862.mol (via Jmol)
000510863.b3lyp_6-31g(d).inp

000510863.b3lyp_6-31g(d).qchem.inp (generated)

000510863.b3lyp_6-31g(d).gjf (generated)

000510863.b3lyp_6-31g(d).firefly.inp (generated)

000510863.b3lyp_6-31g(d).smash.inp (generated)

000510863.b3lyp_6-31g(d).nwchem.inp (generated) 000510863.b3lyp_6-31g(d).log.xz 000510863.td-b3lyp_6-31g+(d).inp 000510863.td-b3lyp_6-31g+(d).log.xz

000510863.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510863.td-b3lyp_6-31+g(d).gjf (generated)

000510863.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510863.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510863.mol 000510863.PUBCHEM 000510863.mol (via Jmol)
000510875.b3lyp_6-31g(d).inp

000510875.b3lyp_6-31g(d).qchem.inp (generated)

000510875.b3lyp_6-31g(d).gjf (generated)

000510875.b3lyp_6-31g(d).firefly.inp (generated)

000510875.b3lyp_6-31g(d).smash.inp (generated)

000510875.b3lyp_6-31g(d).nwchem.inp (generated) 000510875.b3lyp_6-31g(d).log.xz 000510875.td-b3lyp_6-31g+(d).inp 000510875.td-b3lyp_6-31g+(d).log.xz

000510875.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510875.td-b3lyp_6-31+g(d).gjf (generated)

000510875.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510875.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510875.mol 000510875.PUBCHEM 000510875.mol (via Jmol)
000510876.b3lyp_6-31g(d).inp

000510876.b3lyp_6-31g(d).qchem.inp (generated)

000510876.b3lyp_6-31g(d).gjf (generated)

000510876.b3lyp_6-31g(d).firefly.inp (generated)

000510876.b3lyp_6-31g(d).smash.inp (generated)

000510876.b3lyp_6-31g(d).nwchem.inp (generated) 000510876.b3lyp_6-31g(d).log.xz 000510876.td-b3lyp_6-31g+(d).inp 000510876.td-b3lyp_6-31g+(d).log.xz

000510876.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510876.td-b3lyp_6-31+g(d).gjf (generated)

000510876.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510876.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510876.mol 000510876.PUBCHEM 000510876.mol (via Jmol)
000510877.b3lyp_6-31g(d).inp

000510877.b3lyp_6-31g(d).qchem.inp (generated)

000510877.b3lyp_6-31g(d).gjf (generated)

000510877.b3lyp_6-31g(d).firefly.inp (generated)

000510877.b3lyp_6-31g(d).smash.inp (generated)

000510877.b3lyp_6-31g(d).nwchem.inp (generated) 000510877.b3lyp_6-31g(d).log.xz 000510877.td-b3lyp_6-31g+(d).inp 000510877.td-b3lyp_6-31g+(d).log.xz

000510877.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510877.td-b3lyp_6-31+g(d).gjf (generated)

000510877.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510877.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510877.mol 000510877.PUBCHEM 000510877.mol (via Jmol)
000510878.b3lyp_6-31g(d).inp

000510878.b3lyp_6-31g(d).qchem.inp (generated)

000510878.b3lyp_6-31g(d).gjf (generated)

000510878.b3lyp_6-31g(d).firefly.inp (generated)

000510878.b3lyp_6-31g(d).smash.inp (generated)

000510878.b3lyp_6-31g(d).nwchem.inp (generated) 000510878.b3lyp_6-31g(d).log.xz 000510878.td-b3lyp_6-31g+(d).inp 000510878.td-b3lyp_6-31g+(d).log.xz

000510878.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510878.td-b3lyp_6-31+g(d).gjf (generated)

000510878.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510878.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510878.mol 000510878.PUBCHEM 000510878.mol (via Jmol)
000510938.b3lyp_6-31g(d).inp

000510938.b3lyp_6-31g(d).qchem.inp (generated)

000510938.b3lyp_6-31g(d).gjf (generated)

000510938.b3lyp_6-31g(d).firefly.inp (generated)

000510938.b3lyp_6-31g(d).smash.inp (generated)

000510938.b3lyp_6-31g(d).nwchem.inp (generated) 000510938.b3lyp_6-31g(d).log.xz 000510938.td-b3lyp_6-31g+(d).inp 000510938.td-b3lyp_6-31g+(d).log.xz

000510938.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510938.td-b3lyp_6-31+g(d).gjf (generated)

000510938.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510938.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510938.mol 000510938.PUBCHEM 000510938.mol (via Jmol)
000510939.b3lyp_6-31g(d).inp

000510939.b3lyp_6-31g(d).qchem.inp (generated)

000510939.b3lyp_6-31g(d).gjf (generated)

000510939.b3lyp_6-31g(d).firefly.inp (generated)

000510939.b3lyp_6-31g(d).smash.inp (generated)

000510939.b3lyp_6-31g(d).nwchem.inp (generated) 000510939.b3lyp_6-31g(d).log.xz 000510939.td-b3lyp_6-31g+(d).inp 000510939.td-b3lyp_6-31g+(d).log.xz

000510939.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510939.td-b3lyp_6-31+g(d).gjf (generated)

000510939.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510939.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510939.mol 000510939.PUBCHEM 000510939.mol (via Jmol)
000510940.b3lyp_6-31g(d).inp

000510940.b3lyp_6-31g(d).qchem.inp (generated)

000510940.b3lyp_6-31g(d).gjf (generated)

000510940.b3lyp_6-31g(d).firefly.inp (generated)

000510940.b3lyp_6-31g(d).smash.inp (generated)

000510940.b3lyp_6-31g(d).nwchem.inp (generated) 000510940.b3lyp_6-31g(d).log.xz 000510940.td-b3lyp_6-31g+(d).inp 000510940.td-b3lyp_6-31g+(d).log.xz

000510940.td-b3lyp_6-31+g(d).qchem.inp (generated)

000510940.td-b3lyp_6-31+g(d).gjf (generated)

000510940.td-b3lyp_6-31+g(d).firefly.inp (generated)

000510940.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000510940.mol 000510940.PUBCHEM 000510940.mol (via Jmol)
000511002.b3lyp_6-31g(d).inp

000511002.b3lyp_6-31g(d).qchem.inp (generated)

000511002.b3lyp_6-31g(d).gjf (generated)

000511002.b3lyp_6-31g(d).firefly.inp (generated)

000511002.b3lyp_6-31g(d).smash.inp (generated)

000511002.b3lyp_6-31g(d).nwchem.inp (generated) 000511002.b3lyp_6-31g(d).log.xz 000511002.td-b3lyp_6-31g+(d).inp 000511002.td-b3lyp_6-31g+(d).log.xz

000511002.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511002.td-b3lyp_6-31+g(d).gjf (generated)

000511002.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511002.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511002.mol 000511002.PUBCHEM 000511002.mol (via Jmol)
000511386.b3lyp_6-31g(d).inp

000511386.b3lyp_6-31g(d).qchem.inp (generated)

000511386.b3lyp_6-31g(d).gjf (generated)

000511386.b3lyp_6-31g(d).firefly.inp (generated)

000511386.b3lyp_6-31g(d).smash.inp (generated)

000511386.b3lyp_6-31g(d).nwchem.inp (generated) 000511386.b3lyp_6-31g(d).log.xz 000511386.td-b3lyp_6-31g+(d).inp 000511386.td-b3lyp_6-31g+(d).log.xz

000511386.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511386.td-b3lyp_6-31+g(d).gjf (generated)

000511386.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511386.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511386.mol 000511386.PUBCHEM 000511386.mol (via Jmol)
000511387.b3lyp_6-31g(d).inp

000511387.b3lyp_6-31g(d).qchem.inp (generated)

000511387.b3lyp_6-31g(d).gjf (generated)

000511387.b3lyp_6-31g(d).firefly.inp (generated)

000511387.b3lyp_6-31g(d).smash.inp (generated)

000511387.b3lyp_6-31g(d).nwchem.inp (generated) 000511387.b3lyp_6-31g(d).log.xz 000511387.td-b3lyp_6-31g+(d).inp 000511387.td-b3lyp_6-31g+(d).log.xz

000511387.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511387.td-b3lyp_6-31+g(d).gjf (generated)

000511387.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511387.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511387.mol 000511387.PUBCHEM 000511387.mol (via Jmol)
000511389.b3lyp_6-31g(d).inp

000511389.b3lyp_6-31g(d).qchem.inp (generated)

000511389.b3lyp_6-31g(d).gjf (generated)

000511389.b3lyp_6-31g(d).firefly.inp (generated)

000511389.b3lyp_6-31g(d).smash.inp (generated)

000511389.b3lyp_6-31g(d).nwchem.inp (generated) 000511389.b3lyp_6-31g(d).log.xz 000511389.td-b3lyp_6-31g+(d).inp 000511389.td-b3lyp_6-31g+(d).log.xz

000511389.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511389.td-b3lyp_6-31+g(d).gjf (generated)

000511389.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511389.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511389.mol 000511389.PUBCHEM 000511389.mol (via Jmol)
000511390.b3lyp_6-31g(d).inp

000511390.b3lyp_6-31g(d).qchem.inp (generated)

000511390.b3lyp_6-31g(d).gjf (generated)

000511390.b3lyp_6-31g(d).firefly.inp (generated)

000511390.b3lyp_6-31g(d).smash.inp (generated)

000511390.b3lyp_6-31g(d).nwchem.inp (generated) 000511390.b3lyp_6-31g(d).log.xz 000511390.td-b3lyp_6-31g+(d).inp 000511390.td-b3lyp_6-31g+(d).log.xz

000511390.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511390.td-b3lyp_6-31+g(d).gjf (generated)

000511390.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511390.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511390.mol 000511390.PUBCHEM 000511390.mol (via Jmol)
000511392.b3lyp_6-31g(d).inp

000511392.b3lyp_6-31g(d).qchem.inp (generated)

000511392.b3lyp_6-31g(d).gjf (generated)

000511392.b3lyp_6-31g(d).firefly.inp (generated)

000511392.b3lyp_6-31g(d).smash.inp (generated)

000511392.b3lyp_6-31g(d).nwchem.inp (generated) 000511392.b3lyp_6-31g(d).log.xz 000511392.td-b3lyp_6-31g+(d).inp 000511392.td-b3lyp_6-31g+(d).log.xz

000511392.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511392.td-b3lyp_6-31+g(d).gjf (generated)

000511392.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511392.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511392.mol 000511392.PUBCHEM 000511392.mol (via Jmol)
000511393.b3lyp_6-31g(d).inp

000511393.b3lyp_6-31g(d).qchem.inp (generated)

000511393.b3lyp_6-31g(d).gjf (generated)

000511393.b3lyp_6-31g(d).firefly.inp (generated)

000511393.b3lyp_6-31g(d).smash.inp (generated)

000511393.b3lyp_6-31g(d).nwchem.inp (generated) 000511393.b3lyp_6-31g(d).log.xz 000511393.td-b3lyp_6-31g+(d).inp 000511393.td-b3lyp_6-31g+(d).log.xz

000511393.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511393.td-b3lyp_6-31+g(d).gjf (generated)

000511393.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511393.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511393.mol 000511393.PUBCHEM 000511393.mol (via Jmol)
000511394.b3lyp_6-31g(d).inp

000511394.b3lyp_6-31g(d).qchem.inp (generated)

000511394.b3lyp_6-31g(d).gjf (generated)

000511394.b3lyp_6-31g(d).firefly.inp (generated)

000511394.b3lyp_6-31g(d).smash.inp (generated)

000511394.b3lyp_6-31g(d).nwchem.inp (generated) 000511394.b3lyp_6-31g(d).log.xz 000511394.td-b3lyp_6-31g+(d).inp 000511394.td-b3lyp_6-31g+(d).log.xz

000511394.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511394.td-b3lyp_6-31+g(d).gjf (generated)

000511394.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511394.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511394.mol 000511394.PUBCHEM 000511394.mol (via Jmol)
000511450.b3lyp_6-31g(d).inp

000511450.b3lyp_6-31g(d).qchem.inp (generated)

000511450.b3lyp_6-31g(d).gjf (generated)

000511450.b3lyp_6-31g(d).firefly.inp (generated)

000511450.b3lyp_6-31g(d).smash.inp (generated)

000511450.b3lyp_6-31g(d).nwchem.inp (generated) 000511450.b3lyp_6-31g(d).log.xz 000511450.td-b3lyp_6-31g+(d).inp 000511450.td-b3lyp_6-31g+(d).log.xz

000511450.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511450.td-b3lyp_6-31+g(d).gjf (generated)

000511450.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511450.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511450.mol 000511450.PUBCHEM 000511450.mol (via Jmol)
000511451.b3lyp_6-31g(d).inp

000511451.b3lyp_6-31g(d).qchem.inp (generated)

000511451.b3lyp_6-31g(d).gjf (generated)

000511451.b3lyp_6-31g(d).firefly.inp (generated)

000511451.b3lyp_6-31g(d).smash.inp (generated)

000511451.b3lyp_6-31g(d).nwchem.inp (generated) 000511451.b3lyp_6-31g(d).log.xz 000511451.td-b3lyp_6-31g+(d).inp 000511451.td-b3lyp_6-31g+(d).log.xz

000511451.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511451.td-b3lyp_6-31+g(d).gjf (generated)

000511451.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511451.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511451.mol 000511451.PUBCHEM 000511451.mol (via Jmol)
000511452.b3lyp_6-31g(d).inp

000511452.b3lyp_6-31g(d).qchem.inp (generated)

000511452.b3lyp_6-31g(d).gjf (generated)

000511452.b3lyp_6-31g(d).firefly.inp (generated)

000511452.b3lyp_6-31g(d).smash.inp (generated)

000511452.b3lyp_6-31g(d).nwchem.inp (generated) 000511452.b3lyp_6-31g(d).log.xz 000511452.td-b3lyp_6-31g+(d).inp 000511452.td-b3lyp_6-31g+(d).log.xz

000511452.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511452.td-b3lyp_6-31+g(d).gjf (generated)

000511452.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511452.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511452.mol 000511452.PUBCHEM 000511452.mol (via Jmol)
000511453.b3lyp_6-31g(d).inp

000511453.b3lyp_6-31g(d).qchem.inp (generated)

000511453.b3lyp_6-31g(d).gjf (generated)

000511453.b3lyp_6-31g(d).firefly.inp (generated)

000511453.b3lyp_6-31g(d).smash.inp (generated)

000511453.b3lyp_6-31g(d).nwchem.inp (generated) 000511453.b3lyp_6-31g(d).log.xz 000511453.td-b3lyp_6-31g+(d).inp 000511453.td-b3lyp_6-31g+(d).log.xz

000511453.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511453.td-b3lyp_6-31+g(d).gjf (generated)

000511453.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511453.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511453.mol 000511453.PUBCHEM 000511453.mol (via Jmol)
000511454.b3lyp_6-31g(d).inp

000511454.b3lyp_6-31g(d).qchem.inp (generated)

000511454.b3lyp_6-31g(d).gjf (generated)

000511454.b3lyp_6-31g(d).firefly.inp (generated)

000511454.b3lyp_6-31g(d).smash.inp (generated)

000511454.b3lyp_6-31g(d).nwchem.inp (generated) 000511454.b3lyp_6-31g(d).log.xz 000511454.td-b3lyp_6-31g+(d).inp 000511454.td-b3lyp_6-31g+(d).log.xz

000511454.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511454.td-b3lyp_6-31+g(d).gjf (generated)

000511454.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511454.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511454.mol 000511454.PUBCHEM 000511454.mol (via Jmol)
000511455.b3lyp_6-31g(d).inp

000511455.b3lyp_6-31g(d).qchem.inp (generated)

000511455.b3lyp_6-31g(d).gjf (generated)

000511455.b3lyp_6-31g(d).firefly.inp (generated)

000511455.b3lyp_6-31g(d).smash.inp (generated)

000511455.b3lyp_6-31g(d).nwchem.inp (generated) 000511455.b3lyp_6-31g(d).log.xz 000511455.td-b3lyp_6-31g+(d).inp 000511455.td-b3lyp_6-31g+(d).log.xz

000511455.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511455.td-b3lyp_6-31+g(d).gjf (generated)

000511455.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511455.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511455.mol 000511455.PUBCHEM 000511455.mol (via Jmol)
000511456.b3lyp_6-31g(d).inp

000511456.b3lyp_6-31g(d).qchem.inp (generated)

000511456.b3lyp_6-31g(d).gjf (generated)

000511456.b3lyp_6-31g(d).firefly.inp (generated)

000511456.b3lyp_6-31g(d).smash.inp (generated)

000511456.b3lyp_6-31g(d).nwchem.inp (generated) 000511456.b3lyp_6-31g(d).log.xz 000511456.td-b3lyp_6-31g+(d).inp 000511456.td-b3lyp_6-31g+(d).log.xz

000511456.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511456.td-b3lyp_6-31+g(d).gjf (generated)

000511456.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511456.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511456.mol 000511456.PUBCHEM 000511456.mol (via Jmol)
000511457.b3lyp_6-31g(d).inp

000511457.b3lyp_6-31g(d).qchem.inp (generated)

000511457.b3lyp_6-31g(d).gjf (generated)

000511457.b3lyp_6-31g(d).firefly.inp (generated)

000511457.b3lyp_6-31g(d).smash.inp (generated)

000511457.b3lyp_6-31g(d).nwchem.inp (generated) 000511457.b3lyp_6-31g(d).log.xz 000511457.td-b3lyp_6-31g+(d).inp 000511457.td-b3lyp_6-31g+(d).log.xz

000511457.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511457.td-b3lyp_6-31+g(d).gjf (generated)

000511457.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511457.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511457.mol 000511457.PUBCHEM 000511457.mol (via Jmol)
000511458.b3lyp_6-31g(d).inp

000511458.b3lyp_6-31g(d).qchem.inp (generated)

000511458.b3lyp_6-31g(d).gjf (generated)

000511458.b3lyp_6-31g(d).firefly.inp (generated)

000511458.b3lyp_6-31g(d).smash.inp (generated)

000511458.b3lyp_6-31g(d).nwchem.inp (generated) 000511458.b3lyp_6-31g(d).log.xz 000511458.td-b3lyp_6-31g+(d).inp 000511458.td-b3lyp_6-31g+(d).log.xz

000511458.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511458.td-b3lyp_6-31+g(d).gjf (generated)

000511458.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511458.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511458.mol 000511458.PUBCHEM 000511458.mol (via Jmol)
000511459.b3lyp_6-31g(d).inp

000511459.b3lyp_6-31g(d).qchem.inp (generated)

000511459.b3lyp_6-31g(d).gjf (generated)

000511459.b3lyp_6-31g(d).firefly.inp (generated)

000511459.b3lyp_6-31g(d).smash.inp (generated)

000511459.b3lyp_6-31g(d).nwchem.inp (generated) 000511459.b3lyp_6-31g(d).log.xz 000511459.td-b3lyp_6-31g+(d).inp 000511459.td-b3lyp_6-31g+(d).log.xz

000511459.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511459.td-b3lyp_6-31+g(d).gjf (generated)

000511459.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511459.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511459.mol 000511459.PUBCHEM 000511459.mol (via Jmol)
000511460.b3lyp_6-31g(d).inp

000511460.b3lyp_6-31g(d).qchem.inp (generated)

000511460.b3lyp_6-31g(d).gjf (generated)

000511460.b3lyp_6-31g(d).firefly.inp (generated)

000511460.b3lyp_6-31g(d).smash.inp (generated)

000511460.b3lyp_6-31g(d).nwchem.inp (generated) 000511460.b3lyp_6-31g(d).log.xz 000511460.td-b3lyp_6-31g+(d).inp 000511460.td-b3lyp_6-31g+(d).log.xz

000511460.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511460.td-b3lyp_6-31+g(d).gjf (generated)

000511460.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511460.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511460.mol 000511460.PUBCHEM 000511460.mol (via Jmol)
000511461.b3lyp_6-31g(d).inp

000511461.b3lyp_6-31g(d).qchem.inp (generated)

000511461.b3lyp_6-31g(d).gjf (generated)

000511461.b3lyp_6-31g(d).firefly.inp (generated)

000511461.b3lyp_6-31g(d).smash.inp (generated)

000511461.b3lyp_6-31g(d).nwchem.inp (generated) 000511461.b3lyp_6-31g(d).log.xz 000511461.td-b3lyp_6-31g+(d).inp 000511461.td-b3lyp_6-31g+(d).log.xz

000511461.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511461.td-b3lyp_6-31+g(d).gjf (generated)

000511461.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511461.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511461.mol 000511461.PUBCHEM 000511461.mol (via Jmol)
000511462.b3lyp_6-31g(d).inp

000511462.b3lyp_6-31g(d).qchem.inp (generated)

000511462.b3lyp_6-31g(d).gjf (generated)

000511462.b3lyp_6-31g(d).firefly.inp (generated)

000511462.b3lyp_6-31g(d).smash.inp (generated)

000511462.b3lyp_6-31g(d).nwchem.inp (generated) 000511462.b3lyp_6-31g(d).log.xz 000511462.td-b3lyp_6-31g+(d).inp 000511462.td-b3lyp_6-31g+(d).log.xz

000511462.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511462.td-b3lyp_6-31+g(d).gjf (generated)

000511462.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511462.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511462.mol 000511462.PUBCHEM 000511462.mol (via Jmol)
000511486.b3lyp_6-31g(d).inp

000511486.b3lyp_6-31g(d).qchem.inp (generated)

000511486.b3lyp_6-31g(d).gjf (generated)

000511486.b3lyp_6-31g(d).firefly.inp (generated)

000511486.b3lyp_6-31g(d).smash.inp (generated)

000511486.b3lyp_6-31g(d).nwchem.inp (generated) 000511486.b3lyp_6-31g(d).log.xz 000511486.td-b3lyp_6-31g+(d).inp 000511486.td-b3lyp_6-31g+(d).log.xz

000511486.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511486.td-b3lyp_6-31+g(d).gjf (generated)

000511486.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511486.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511486.mol 000511486.PUBCHEM 000511486.mol (via Jmol)
000511492.b3lyp_6-31g(d).inp

000511492.b3lyp_6-31g(d).qchem.inp (generated)

000511492.b3lyp_6-31g(d).gjf (generated)

000511492.b3lyp_6-31g(d).firefly.inp (generated)

000511492.b3lyp_6-31g(d).smash.inp (generated)

000511492.b3lyp_6-31g(d).nwchem.inp (generated) 000511492.b3lyp_6-31g(d).log.xz 000511492.td-b3lyp_6-31g+(d).inp 000511492.td-b3lyp_6-31g+(d).log.xz

000511492.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511492.td-b3lyp_6-31+g(d).gjf (generated)

000511492.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511492.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511492.mol 000511492.PUBCHEM 000511492.mol (via Jmol)
000511494.b3lyp_6-31g(d).inp

000511494.b3lyp_6-31g(d).qchem.inp (generated)

000511494.b3lyp_6-31g(d).gjf (generated)

000511494.b3lyp_6-31g(d).firefly.inp (generated)

000511494.b3lyp_6-31g(d).smash.inp (generated)

000511494.b3lyp_6-31g(d).nwchem.inp (generated) 000511494.b3lyp_6-31g(d).log.xz 000511494.td-b3lyp_6-31g+(d).inp 000511494.td-b3lyp_6-31g+(d).log.xz

000511494.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511494.td-b3lyp_6-31+g(d).gjf (generated)

000511494.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511494.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511494.mol 000511494.PUBCHEM 000511494.mol (via Jmol)
000511497.b3lyp_6-31g(d).inp

000511497.b3lyp_6-31g(d).qchem.inp (generated)

000511497.b3lyp_6-31g(d).gjf (generated)

000511497.b3lyp_6-31g(d).firefly.inp (generated)

000511497.b3lyp_6-31g(d).smash.inp (generated)

000511497.b3lyp_6-31g(d).nwchem.inp (generated) 000511497.b3lyp_6-31g(d).log.xz 000511497.td-b3lyp_6-31g+(d).inp 000511497.td-b3lyp_6-31g+(d).log.xz

000511497.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511497.td-b3lyp_6-31+g(d).gjf (generated)

000511497.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511497.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511497.mol 000511497.PUBCHEM 000511497.mol (via Jmol)
000511601.b3lyp_6-31g(d).inp

000511601.b3lyp_6-31g(d).qchem.inp (generated)

000511601.b3lyp_6-31g(d).gjf (generated)

000511601.b3lyp_6-31g(d).firefly.inp (generated)

000511601.b3lyp_6-31g(d).smash.inp (generated)

000511601.b3lyp_6-31g(d).nwchem.inp (generated) 000511601.b3lyp_6-31g(d).log.xz 000511601.td-b3lyp_6-31g+(d).inp 000511601.td-b3lyp_6-31g+(d).log.xz

000511601.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511601.td-b3lyp_6-31+g(d).gjf (generated)

000511601.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511601.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511601.mol 000511601.PUBCHEM 000511601.mol (via Jmol)
000511619.b3lyp_6-31g(d).inp

000511619.b3lyp_6-31g(d).qchem.inp (generated)

000511619.b3lyp_6-31g(d).gjf (generated)

000511619.b3lyp_6-31g(d).firefly.inp (generated)

000511619.b3lyp_6-31g(d).smash.inp (generated)

000511619.b3lyp_6-31g(d).nwchem.inp (generated) 000511619.b3lyp_6-31g(d).log.xz 000511619.td-b3lyp_6-31g+(d).inp 000511619.td-b3lyp_6-31g+(d).log.xz

000511619.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511619.td-b3lyp_6-31+g(d).gjf (generated)

000511619.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511619.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511619.mol 000511619.PUBCHEM 000511619.mol (via Jmol)
000511643.b3lyp_6-31g(d).inp

000511643.b3lyp_6-31g(d).qchem.inp (generated)

000511643.b3lyp_6-31g(d).gjf (generated)

000511643.b3lyp_6-31g(d).firefly.inp (generated)

000511643.b3lyp_6-31g(d).smash.inp (generated)

000511643.b3lyp_6-31g(d).nwchem.inp (generated) 000511643.b3lyp_6-31g(d).log.xz 000511643.td-b3lyp_6-31g+(d).inp 000511643.td-b3lyp_6-31g+(d).log.xz

000511643.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511643.td-b3lyp_6-31+g(d).gjf (generated)

000511643.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511643.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511643.mol 000511643.PUBCHEM 000511643.mol (via Jmol)
000511672.b3lyp_6-31g(d).inp

000511672.b3lyp_6-31g(d).qchem.inp (generated)

000511672.b3lyp_6-31g(d).gjf (generated)

000511672.b3lyp_6-31g(d).firefly.inp (generated)

000511672.b3lyp_6-31g(d).smash.inp (generated)

000511672.b3lyp_6-31g(d).nwchem.inp (generated) 000511672.b3lyp_6-31g(d).log.xz 000511672.td-b3lyp_6-31g+(d).inp 000511672.td-b3lyp_6-31g+(d).log.xz

000511672.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511672.td-b3lyp_6-31+g(d).gjf (generated)

000511672.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511672.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511672.mol 000511672.PUBCHEM 000511672.mol (via Jmol)
000511673.b3lyp_6-31g(d).inp

000511673.b3lyp_6-31g(d).qchem.inp (generated)

000511673.b3lyp_6-31g(d).gjf (generated)

000511673.b3lyp_6-31g(d).firefly.inp (generated)

000511673.b3lyp_6-31g(d).smash.inp (generated)

000511673.b3lyp_6-31g(d).nwchem.inp (generated) 000511673.b3lyp_6-31g(d).log.xz 000511673.td-b3lyp_6-31g+(d).inp 000511673.td-b3lyp_6-31g+(d).log.xz

000511673.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511673.td-b3lyp_6-31+g(d).gjf (generated)

000511673.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511673.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511673.mol 000511673.PUBCHEM 000511673.mol (via Jmol)
000511730.b3lyp_6-31g(d).inp

000511730.b3lyp_6-31g(d).qchem.inp (generated)

000511730.b3lyp_6-31g(d).gjf (generated)

000511730.b3lyp_6-31g(d).firefly.inp (generated)

000511730.b3lyp_6-31g(d).smash.inp (generated)

000511730.b3lyp_6-31g(d).nwchem.inp (generated) 000511730.b3lyp_6-31g(d).log.xz 000511730.td-b3lyp_6-31g+(d).inp 000511730.td-b3lyp_6-31g+(d).log.xz

000511730.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511730.td-b3lyp_6-31+g(d).gjf (generated)

000511730.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511730.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511730.mol 000511730.PUBCHEM 000511730.mol (via Jmol)
000511736.b3lyp_6-31g(d).inp

000511736.b3lyp_6-31g(d).qchem.inp (generated)

000511736.b3lyp_6-31g(d).gjf (generated)

000511736.b3lyp_6-31g(d).firefly.inp (generated)

000511736.b3lyp_6-31g(d).smash.inp (generated)

000511736.b3lyp_6-31g(d).nwchem.inp (generated) 000511736.b3lyp_6-31g(d).log.xz 000511736.td-b3lyp_6-31g+(d).inp 000511736.td-b3lyp_6-31g+(d).log.xz

000511736.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511736.td-b3lyp_6-31+g(d).gjf (generated)

000511736.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511736.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511736.mol 000511736.PUBCHEM 000511736.mol (via Jmol)
000511737.b3lyp_6-31g(d).inp

000511737.b3lyp_6-31g(d).qchem.inp (generated)

000511737.b3lyp_6-31g(d).gjf (generated)

000511737.b3lyp_6-31g(d).firefly.inp (generated)

000511737.b3lyp_6-31g(d).smash.inp (generated)

000511737.b3lyp_6-31g(d).nwchem.inp (generated) 000511737.b3lyp_6-31g(d).log.xz 000511737.td-b3lyp_6-31g+(d).inp 000511737.td-b3lyp_6-31g+(d).log.xz

000511737.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511737.td-b3lyp_6-31+g(d).gjf (generated)

000511737.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511737.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511737.mol 000511737.PUBCHEM 000511737.mol (via Jmol)
000511738.b3lyp_6-31g(d).inp

000511738.b3lyp_6-31g(d).qchem.inp (generated)

000511738.b3lyp_6-31g(d).gjf (generated)

000511738.b3lyp_6-31g(d).firefly.inp (generated)

000511738.b3lyp_6-31g(d).smash.inp (generated)

000511738.b3lyp_6-31g(d).nwchem.inp (generated) 000511738.b3lyp_6-31g(d).log.xz 000511738.td-b3lyp_6-31g+(d).inp 000511738.td-b3lyp_6-31g+(d).log.xz

000511738.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511738.td-b3lyp_6-31+g(d).gjf (generated)

000511738.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511738.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511738.mol 000511738.PUBCHEM 000511738.mol (via Jmol)
000511741.b3lyp_6-31g(d).inp

000511741.b3lyp_6-31g(d).qchem.inp (generated)

000511741.b3lyp_6-31g(d).gjf (generated)

000511741.b3lyp_6-31g(d).firefly.inp (generated)

000511741.b3lyp_6-31g(d).smash.inp (generated)

000511741.b3lyp_6-31g(d).nwchem.inp (generated) 000511741.b3lyp_6-31g(d).log.xz 000511741.td-b3lyp_6-31g+(d).inp 000511741.td-b3lyp_6-31g+(d).log.xz

000511741.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511741.td-b3lyp_6-31+g(d).gjf (generated)

000511741.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511741.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511741.mol 000511741.PUBCHEM 000511741.mol (via Jmol)
000511742.b3lyp_6-31g(d).inp

000511742.b3lyp_6-31g(d).qchem.inp (generated)

000511742.b3lyp_6-31g(d).gjf (generated)

000511742.b3lyp_6-31g(d).firefly.inp (generated)

000511742.b3lyp_6-31g(d).smash.inp (generated)

000511742.b3lyp_6-31g(d).nwchem.inp (generated) 000511742.b3lyp_6-31g(d).log.xz 000511742.td-b3lyp_6-31g+(d).inp 000511742.td-b3lyp_6-31g+(d).log.xz

000511742.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511742.td-b3lyp_6-31+g(d).gjf (generated)

000511742.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511742.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511742.mol 000511742.PUBCHEM 000511742.mol (via Jmol)
000511743.b3lyp_6-31g(d).inp

000511743.b3lyp_6-31g(d).qchem.inp (generated)

000511743.b3lyp_6-31g(d).gjf (generated)

000511743.b3lyp_6-31g(d).firefly.inp (generated)

000511743.b3lyp_6-31g(d).smash.inp (generated)

000511743.b3lyp_6-31g(d).nwchem.inp (generated) 000511743.b3lyp_6-31g(d).log.xz 000511743.td-b3lyp_6-31g+(d).inp 000511743.td-b3lyp_6-31g+(d).log.xz

000511743.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511743.td-b3lyp_6-31+g(d).gjf (generated)

000511743.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511743.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511743.mol 000511743.PUBCHEM 000511743.mol (via Jmol)
000511746.b3lyp_6-31g(d).inp

000511746.b3lyp_6-31g(d).qchem.inp (generated)

000511746.b3lyp_6-31g(d).gjf (generated)

000511746.b3lyp_6-31g(d).firefly.inp (generated)

000511746.b3lyp_6-31g(d).smash.inp (generated)

000511746.b3lyp_6-31g(d).nwchem.inp (generated) 000511746.b3lyp_6-31g(d).log.xz 000511746.td-b3lyp_6-31g+(d).inp 000511746.td-b3lyp_6-31g+(d).log.xz

000511746.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511746.td-b3lyp_6-31+g(d).gjf (generated)

000511746.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511746.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511746.mol 000511746.PUBCHEM 000511746.mol (via Jmol)
000511748.b3lyp_6-31g(d).inp

000511748.b3lyp_6-31g(d).qchem.inp (generated)

000511748.b3lyp_6-31g(d).gjf (generated)

000511748.b3lyp_6-31g(d).firefly.inp (generated)

000511748.b3lyp_6-31g(d).smash.inp (generated)

000511748.b3lyp_6-31g(d).nwchem.inp (generated) 000511748.b3lyp_6-31g(d).log.xz 000511748.td-b3lyp_6-31g+(d).inp 000511748.td-b3lyp_6-31g+(d).log.xz

000511748.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511748.td-b3lyp_6-31+g(d).gjf (generated)

000511748.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511748.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511748.mol 000511748.PUBCHEM 000511748.mol (via Jmol)
000511749.b3lyp_6-31g(d).inp

000511749.b3lyp_6-31g(d).qchem.inp (generated)

000511749.b3lyp_6-31g(d).gjf (generated)

000511749.b3lyp_6-31g(d).firefly.inp (generated)

000511749.b3lyp_6-31g(d).smash.inp (generated)

000511749.b3lyp_6-31g(d).nwchem.inp (generated) 000511749.b3lyp_6-31g(d).log.xz 000511749.td-b3lyp_6-31g+(d).inp 000511749.td-b3lyp_6-31g+(d).log.xz

000511749.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511749.td-b3lyp_6-31+g(d).gjf (generated)

000511749.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511749.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511749.mol 000511749.PUBCHEM 000511749.mol (via Jmol)
000511756.b3lyp_6-31g(d).inp

000511756.b3lyp_6-31g(d).qchem.inp (generated)

000511756.b3lyp_6-31g(d).gjf (generated)

000511756.b3lyp_6-31g(d).firefly.inp (generated)

000511756.b3lyp_6-31g(d).smash.inp (generated)

000511756.b3lyp_6-31g(d).nwchem.inp (generated) 000511756.b3lyp_6-31g(d).log.xz 000511756.td-b3lyp_6-31g+(d).inp 000511756.td-b3lyp_6-31g+(d).log.xz

000511756.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511756.td-b3lyp_6-31+g(d).gjf (generated)

000511756.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511756.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511756.mol 000511756.PUBCHEM 000511756.mol (via Jmol)
000511758.b3lyp_6-31g(d).inp

000511758.b3lyp_6-31g(d).qchem.inp (generated)

000511758.b3lyp_6-31g(d).gjf (generated)

000511758.b3lyp_6-31g(d).firefly.inp (generated)

000511758.b3lyp_6-31g(d).smash.inp (generated)

000511758.b3lyp_6-31g(d).nwchem.inp (generated) 000511758.b3lyp_6-31g(d).log.xz 000511758.td-b3lyp_6-31g+(d).inp 000511758.td-b3lyp_6-31g+(d).log.xz

000511758.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511758.td-b3lyp_6-31+g(d).gjf (generated)

000511758.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511758.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511758.mol 000511758.PUBCHEM 000511758.mol (via Jmol)
000511792.b3lyp_6-31g(d).inp

000511792.b3lyp_6-31g(d).qchem.inp (generated)

000511792.b3lyp_6-31g(d).gjf (generated)

000511792.b3lyp_6-31g(d).firefly.inp (generated)

000511792.b3lyp_6-31g(d).smash.inp (generated)

000511792.b3lyp_6-31g(d).nwchem.inp (generated) 000511792.b3lyp_6-31g(d).log.xz 000511792.td-b3lyp_6-31g+(d).inp 000511792.td-b3lyp_6-31g+(d).log.xz

000511792.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511792.td-b3lyp_6-31+g(d).gjf (generated)

000511792.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511792.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511792.mol 000511792.PUBCHEM 000511792.mol (via Jmol)
000511793.b3lyp_6-31g(d).inp

000511793.b3lyp_6-31g(d).qchem.inp (generated)

000511793.b3lyp_6-31g(d).gjf (generated)

000511793.b3lyp_6-31g(d).firefly.inp (generated)

000511793.b3lyp_6-31g(d).smash.inp (generated)

000511793.b3lyp_6-31g(d).nwchem.inp (generated) 000511793.b3lyp_6-31g(d).log.xz 000511793.td-b3lyp_6-31g+(d).inp 000511793.td-b3lyp_6-31g+(d).log.xz

000511793.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511793.td-b3lyp_6-31+g(d).gjf (generated)

000511793.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511793.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511793.mol 000511793.PUBCHEM 000511793.mol (via Jmol)
000511811.b3lyp_6-31g(d).inp

000511811.b3lyp_6-31g(d).qchem.inp (generated)

000511811.b3lyp_6-31g(d).gjf (generated)

000511811.b3lyp_6-31g(d).firefly.inp (generated)

000511811.b3lyp_6-31g(d).smash.inp (generated)

000511811.b3lyp_6-31g(d).nwchem.inp (generated) 000511811.b3lyp_6-31g(d).log.xz 000511811.td-b3lyp_6-31g+(d).inp 000511811.td-b3lyp_6-31g+(d).log.xz

000511811.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511811.td-b3lyp_6-31+g(d).gjf (generated)

000511811.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511811.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511811.mol 000511811.PUBCHEM 000511811.mol (via Jmol)
000511812.b3lyp_6-31g(d).inp

000511812.b3lyp_6-31g(d).qchem.inp (generated)

000511812.b3lyp_6-31g(d).gjf (generated)

000511812.b3lyp_6-31g(d).firefly.inp (generated)

000511812.b3lyp_6-31g(d).smash.inp (generated)

000511812.b3lyp_6-31g(d).nwchem.inp (generated) 000511812.b3lyp_6-31g(d).log.xz 000511812.td-b3lyp_6-31g+(d).inp 000511812.td-b3lyp_6-31g+(d).log.xz

000511812.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511812.td-b3lyp_6-31+g(d).gjf (generated)

000511812.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511812.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511812.mol 000511812.PUBCHEM 000511812.mol (via Jmol)
000511854.b3lyp_6-31g(d).inp

000511854.b3lyp_6-31g(d).qchem.inp (generated)

000511854.b3lyp_6-31g(d).gjf (generated)

000511854.b3lyp_6-31g(d).firefly.inp (generated)

000511854.b3lyp_6-31g(d).smash.inp (generated)

000511854.b3lyp_6-31g(d).nwchem.inp (generated) 000511854.b3lyp_6-31g(d).log.xz 000511854.td-b3lyp_6-31g+(d).inp 000511854.td-b3lyp_6-31g+(d).log.xz

000511854.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511854.td-b3lyp_6-31+g(d).gjf (generated)

000511854.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511854.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511854.mol 000511854.PUBCHEM 000511854.mol (via Jmol)
000511856.b3lyp_6-31g(d).inp

000511856.b3lyp_6-31g(d).qchem.inp (generated)

000511856.b3lyp_6-31g(d).gjf (generated)

000511856.b3lyp_6-31g(d).firefly.inp (generated)

000511856.b3lyp_6-31g(d).smash.inp (generated)

000511856.b3lyp_6-31g(d).nwchem.inp (generated) 000511856.b3lyp_6-31g(d).log.xz 000511856.td-b3lyp_6-31g+(d).inp 000511856.td-b3lyp_6-31g+(d).log.xz

000511856.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511856.td-b3lyp_6-31+g(d).gjf (generated)

000511856.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511856.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511856.mol 000511856.PUBCHEM 000511856.mol (via Jmol)
000511879.b3lyp_6-31g(d).inp

000511879.b3lyp_6-31g(d).qchem.inp (generated)

000511879.b3lyp_6-31g(d).gjf (generated)

000511879.b3lyp_6-31g(d).firefly.inp (generated)

000511879.b3lyp_6-31g(d).smash.inp (generated)

000511879.b3lyp_6-31g(d).nwchem.inp (generated) 000511879.b3lyp_6-31g(d).log.xz 000511879.td-b3lyp_6-31g+(d).inp 000511879.td-b3lyp_6-31g+(d).log.xz

000511879.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511879.td-b3lyp_6-31+g(d).gjf (generated)

000511879.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511879.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511879.mol 000511879.PUBCHEM 000511879.mol (via Jmol)
000511881.b3lyp_6-31g(d).inp

000511881.b3lyp_6-31g(d).qchem.inp (generated)

000511881.b3lyp_6-31g(d).gjf (generated)

000511881.b3lyp_6-31g(d).firefly.inp (generated)

000511881.b3lyp_6-31g(d).smash.inp (generated)

000511881.b3lyp_6-31g(d).nwchem.inp (generated) 000511881.b3lyp_6-31g(d).log.xz 000511881.td-b3lyp_6-31g+(d).inp 000511881.td-b3lyp_6-31g+(d).log.xz

000511881.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511881.td-b3lyp_6-31+g(d).gjf (generated)

000511881.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511881.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511881.mol 000511881.PUBCHEM 000511881.mol (via Jmol)
000511919.b3lyp_6-31g(d).inp

000511919.b3lyp_6-31g(d).qchem.inp (generated)

000511919.b3lyp_6-31g(d).gjf (generated)

000511919.b3lyp_6-31g(d).firefly.inp (generated)

000511919.b3lyp_6-31g(d).smash.inp (generated)

000511919.b3lyp_6-31g(d).nwchem.inp (generated) 000511919.b3lyp_6-31g(d).log.xz 000511919.td-b3lyp_6-31g+(d).inp 000511919.td-b3lyp_6-31g+(d).log.xz

000511919.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511919.td-b3lyp_6-31+g(d).gjf (generated)

000511919.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511919.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511919.mol 000511919.PUBCHEM 000511919.mol (via Jmol)
000511920.b3lyp_6-31g(d).inp

000511920.b3lyp_6-31g(d).qchem.inp (generated)

000511920.b3lyp_6-31g(d).gjf (generated)

000511920.b3lyp_6-31g(d).firefly.inp (generated)

000511920.b3lyp_6-31g(d).smash.inp (generated)

000511920.b3lyp_6-31g(d).nwchem.inp (generated) 000511920.b3lyp_6-31g(d).log.xz 000511920.td-b3lyp_6-31g+(d).inp 000511920.td-b3lyp_6-31g+(d).log.xz

000511920.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511920.td-b3lyp_6-31+g(d).gjf (generated)

000511920.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511920.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511920.mol 000511920.PUBCHEM 000511920.mol (via Jmol)
000511978.b3lyp_6-31g(d).inp

000511978.b3lyp_6-31g(d).qchem.inp (generated)

000511978.b3lyp_6-31g(d).gjf (generated)

000511978.b3lyp_6-31g(d).firefly.inp (generated)

000511978.b3lyp_6-31g(d).smash.inp (generated)

000511978.b3lyp_6-31g(d).nwchem.inp (generated) 000511978.b3lyp_6-31g(d).log.xz 000511978.td-b3lyp_6-31g+(d).inp 000511978.td-b3lyp_6-31g+(d).log.xz

000511978.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511978.td-b3lyp_6-31+g(d).gjf (generated)

000511978.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511978.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511978.mol 000511978.PUBCHEM 000511978.mol (via Jmol)
000511979.b3lyp_6-31g(d).inp

000511979.b3lyp_6-31g(d).qchem.inp (generated)

000511979.b3lyp_6-31g(d).gjf (generated)

000511979.b3lyp_6-31g(d).firefly.inp (generated)

000511979.b3lyp_6-31g(d).smash.inp (generated)

000511979.b3lyp_6-31g(d).nwchem.inp (generated) 000511979.b3lyp_6-31g(d).log.xz 000511979.td-b3lyp_6-31g+(d).inp 000511979.td-b3lyp_6-31g+(d).log.xz

000511979.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511979.td-b3lyp_6-31+g(d).gjf (generated)

000511979.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511979.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511979.mol 000511979.PUBCHEM 000511979.mol (via Jmol)
000511981.b3lyp_6-31g(d).inp

000511981.b3lyp_6-31g(d).qchem.inp (generated)

000511981.b3lyp_6-31g(d).gjf (generated)

000511981.b3lyp_6-31g(d).firefly.inp (generated)

000511981.b3lyp_6-31g(d).smash.inp (generated)

000511981.b3lyp_6-31g(d).nwchem.inp (generated) 000511981.b3lyp_6-31g(d).log.xz 000511981.td-b3lyp_6-31g+(d).inp 000511981.td-b3lyp_6-31g+(d).log.xz

000511981.td-b3lyp_6-31+g(d).qchem.inp (generated)

000511981.td-b3lyp_6-31+g(d).gjf (generated)

000511981.td-b3lyp_6-31+g(d).firefly.inp (generated)

000511981.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000511981.mol 000511981.PUBCHEM 000511981.mol (via Jmol)
000512016.b3lyp_6-31g(d).inp

000512016.b3lyp_6-31g(d).qchem.inp (generated)

000512016.b3lyp_6-31g(d).gjf (generated)

000512016.b3lyp_6-31g(d).firefly.inp (generated)

000512016.b3lyp_6-31g(d).smash.inp (generated)

000512016.b3lyp_6-31g(d).nwchem.inp (generated) 000512016.b3lyp_6-31g(d).log.xz 000512016.td-b3lyp_6-31g+(d).inp 000512016.td-b3lyp_6-31g+(d).log.xz

000512016.td-b3lyp_6-31+g(d).qchem.inp (generated)

000512016.td-b3lyp_6-31+g(d).gjf (generated)

000512016.td-b3lyp_6-31+g(d).firefly.inp (generated)

000512016.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000512016.mol 000512016.PUBCHEM 000512016.mol (via Jmol)
000512019.b3lyp_6-31g(d).inp

000512019.b3lyp_6-31g(d).qchem.inp (generated)

000512019.b3lyp_6-31g(d).gjf (generated)

000512019.b3lyp_6-31g(d).firefly.inp (generated)

000512019.b3lyp_6-31g(d).smash.inp (generated)

000512019.b3lyp_6-31g(d).nwchem.inp (generated) 000512019.b3lyp_6-31g(d).log.xz 000512019.td-b3lyp_6-31g+(d).inp 000512019.td-b3lyp_6-31g+(d).log.xz

000512019.td-b3lyp_6-31+g(d).qchem.inp (generated)

000512019.td-b3lyp_6-31+g(d).gjf (generated)

000512019.td-b3lyp_6-31+g(d).firefly.inp (generated)

000512019.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000512019.mol 000512019.PUBCHEM 000512019.mol (via Jmol)
000512021.b3lyp_6-31g(d).inp

000512021.b3lyp_6-31g(d).qchem.inp (generated)

000512021.b3lyp_6-31g(d).gjf (generated)

000512021.b3lyp_6-31g(d).firefly.inp (generated)

000512021.b3lyp_6-31g(d).smash.inp (generated)

000512021.b3lyp_6-31g(d).nwchem.inp (generated) 000512021.b3lyp_6-31g(d).log.xz 000512021.td-b3lyp_6-31g+(d).inp 000512021.td-b3lyp_6-31g+(d).log.xz

000512021.td-b3lyp_6-31+g(d).qchem.inp (generated)

000512021.td-b3lyp_6-31+g(d).gjf (generated)

000512021.td-b3lyp_6-31+g(d).firefly.inp (generated)

000512021.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000512021.mol 000512021.PUBCHEM 000512021.mol (via Jmol)
000512026.b3lyp_6-31g(d).inp

000512026.b3lyp_6-31g(d).qchem.inp (generated)

000512026.b3lyp_6-31g(d).gjf (generated)

000512026.b3lyp_6-31g(d).firefly.inp (generated)

000512026.b3lyp_6-31g(d).smash.inp (generated)

000512026.b3lyp_6-31g(d).nwchem.inp (generated) 000512026.b3lyp_6-31g(d).log.xz 000512026.td-b3lyp_6-31g+(d).inp 000512026.td-b3lyp_6-31g+(d).log.xz

000512026.td-b3lyp_6-31+g(d).qchem.inp (generated)

000512026.td-b3lyp_6-31+g(d).gjf (generated)

000512026.td-b3lyp_6-31+g(d).firefly.inp (generated)

000512026.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000512026.mol 000512026.PUBCHEM 000512026.mol (via Jmol)
000512031.b3lyp_6-31g(d).inp

000512031.b3lyp_6-31g(d).qchem.inp (generated)

000512031.b3lyp_6-31g(d).gjf (generated)

000512031.b3lyp_6-31g(d).firefly.inp (generated)

000512031.b3lyp_6-31g(d).smash.inp (generated)

000512031.b3lyp_6-31g(d).nwchem.inp (generated) 000512031.b3lyp_6-31g(d).log.xz 000512031.td-b3lyp_6-31g+(d).inp 000512031.td-b3lyp_6-31g+(d).log.xz

000512031.td-b3lyp_6-31+g(d).qchem.inp (generated)

000512031.td-b3lyp_6-31+g(d).gjf (generated)

000512031.td-b3lyp_6-31+g(d).firefly.inp (generated)

000512031.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000512031.mol 000512031.PUBCHEM 000512031.mol (via Jmol)
000512042.b3lyp_6-31g(d).inp

000512042.b3lyp_6-31g(d).qchem.inp (generated)

000512042.b3lyp_6-31g(d).gjf (generated)

000512042.b3lyp_6-31g(d).firefly.inp (generated)

000512042.b3lyp_6-31g(d).smash.inp (generated)

000512042.b3lyp_6-31g(d).nwchem.inp (generated) 000512042.b3lyp_6-31g(d).log.xz 000512042.td-b3lyp_6-31g+(d).inp 000512042.td-b3lyp_6-31g+(d).log.xz

000512042.td-b3lyp_6-31+g(d).qchem.inp (generated)

000512042.td-b3lyp_6-31+g(d).gjf (generated)

000512042.td-b3lyp_6-31+g(d).firefly.inp (generated)

000512042.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000512042.mol 000512042.PUBCHEM 000512042.mol (via Jmol)
000512077.b3lyp_6-31g(d).inp

000512077.b3lyp_6-31g(d).qchem.inp (generated)

000512077.b3lyp_6-31g(d).gjf (generated)

000512077.b3lyp_6-31g(d).firefly.inp (generated)

000512077.b3lyp_6-31g(d).smash.inp (generated)

000512077.b3lyp_6-31g(d).nwchem.inp (generated) 000512077.b3lyp_6-31g(d).log.xz 000512077.td-b3lyp_6-31g+(d).inp 000512077.td-b3lyp_6-31g+(d).log.xz

000512077.td-b3lyp_6-31+g(d).qchem.inp (generated)

000512077.td-b3lyp_6-31+g(d).gjf (generated)

000512077.td-b3lyp_6-31+g(d).firefly.inp (generated)

000512077.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000512077.mol 000512077.PUBCHEM 000512077.mol (via Jmol)
000512080.b3lyp_6-31g(d).inp

000512080.b3lyp_6-31g(d).qchem.inp (generated)

000512080.b3lyp_6-31g(d).gjf (generated)

000512080.b3lyp_6-31g(d).firefly.inp (generated)

000512080.b3lyp_6-31g(d).smash.inp (generated)

000512080.b3lyp_6-31g(d).nwchem.inp (generated) 000512080.b3lyp_6-31g(d).log.xz 000512080.td-b3lyp_6-31g+(d).inp 000512080.td-b3lyp_6-31g+(d).log.xz

000512080.td-b3lyp_6-31+g(d).qchem.inp (generated)

000512080.td-b3lyp_6-31+g(d).gjf (generated)

000512080.td-b3lyp_6-31+g(d).firefly.inp (generated)

000512080.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000512080.mol 000512080.PUBCHEM 000512080.mol (via Jmol)
000512082.b3lyp_6-31g(d).inp

000512082.b3lyp_6-31g(d).qchem.inp (generated)

000512082.b3lyp_6-31g(d).gjf (generated)

000512082.b3lyp_6-31g(d).firefly.inp (generated)

000512082.b3lyp_6-31g(d).smash.inp (generated)

000512082.b3lyp_6-31g(d).nwchem.inp (generated) 000512082.b3lyp_6-31g(d).log.xz 000512082.td-b3lyp_6-31g+(d).inp 000512082.td-b3lyp_6-31g+(d).log.xz

000512082.td-b3lyp_6-31+g(d).qchem.inp (generated)

000512082.td-b3lyp_6-31+g(d).gjf (generated)

000512082.td-b3lyp_6-31+g(d).firefly.inp (generated)

000512082.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000512082.mol 000512082.PUBCHEM 000512082.mol (via Jmol)
000512084.b3lyp_6-31g(d).inp

000512084.b3lyp_6-31g(d).qchem.inp (generated)

000512084.b3lyp_6-31g(d).gjf (generated)

000512084.b3lyp_6-31g(d).firefly.inp (generated)

000512084.b3lyp_6-31g(d).smash.inp (generated)

000512084.b3lyp_6-31g(d).nwchem.inp (generated) 000512084.b3lyp_6-31g(d).log.xz 000512084.td-b3lyp_6-31g+(d).inp 000512084.td-b3lyp_6-31g+(d).log.xz

000512084.td-b3lyp_6-31+g(d).qchem.inp (generated)

000512084.td-b3lyp_6-31+g(d).gjf (generated)

000512084.td-b3lyp_6-31+g(d).firefly.inp (generated)

000512084.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000512084.mol 000512084.PUBCHEM 000512084.mol (via Jmol)
000512085.b3lyp_6-31g(d).inp

000512085.b3lyp_6-31g(d).qchem.inp (generated)

000512085.b3lyp_6-31g(d).gjf (generated)

000512085.b3lyp_6-31g(d).firefly.inp (generated)

000512085.b3lyp_6-31g(d).smash.inp (generated)

000512085.b3lyp_6-31g(d).nwchem.inp (generated) 000512085.b3lyp_6-31g(d).log.xz 000512085.td-b3lyp_6-31g+(d).inp 000512085.td-b3lyp_6-31g+(d).log.xz

000512085.td-b3lyp_6-31+g(d).qchem.inp (generated)

000512085.td-b3lyp_6-31+g(d).gjf (generated)

000512085.td-b3lyp_6-31+g(d).firefly.inp (generated)

000512085.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000512085.mol 000512085.PUBCHEM 000512085.mol (via Jmol)