Index of

Last updated : Thu Apr 27 02:27:22 JST 2017
Total : 219 (190) in this page
045375986.b3lyp_6-31g(d).inp

045375986.b3lyp_6-31g(d).qchem.inp (generated)

045375986.b3lyp_6-31g(d).gjf (generated)

045375986.b3lyp_6-31g(d).firefly.inp (generated)

045375986.b3lyp_6-31g(d).smash.inp (generated)

045375986.b3lyp_6-31g(d).nwchem.inp (generated) 045375986.b3lyp_6-31g(d).log.xz 045375986.td-b3lyp_6-31g+(d).inp 045375986.td-b3lyp_6-31g+(d).log.xz

045375986.td-b3lyp_6-31+g(d).qchem.inp (generated)

045375986.td-b3lyp_6-31+g(d).gjf (generated)

045375986.td-b3lyp_6-31+g(d).firefly.inp (generated)

045375986.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045375986.mol 045375986.PUBCHEM 045375986.mol (via Jmol)
045375991.b3lyp_6-31g(d).inp

045375991.b3lyp_6-31g(d).qchem.inp (generated)

045375991.b3lyp_6-31g(d).gjf (generated)

045375991.b3lyp_6-31g(d).firefly.inp (generated)

045375991.b3lyp_6-31g(d).smash.inp (generated)

045375991.b3lyp_6-31g(d).nwchem.inp (generated) 045375991.b3lyp_6-31g(d).log.xz 045375991.td-b3lyp_6-31g+(d).inp 045375991.td-b3lyp_6-31g+(d).log.xz

045375991.td-b3lyp_6-31+g(d).qchem.inp (generated)

045375991.td-b3lyp_6-31+g(d).gjf (generated)

045375991.td-b3lyp_6-31+g(d).firefly.inp (generated)

045375991.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045375991.mol 045375991.PUBCHEM 045375991.mol (via Jmol)
045376165.b3lyp_6-31g(d).inp

045376165.b3lyp_6-31g(d).qchem.inp (generated)

045376165.b3lyp_6-31g(d).gjf (generated)

045376165.b3lyp_6-31g(d).firefly.inp (generated)

045376165.b3lyp_6-31g(d).smash.inp (generated)

045376165.b3lyp_6-31g(d).nwchem.inp (generated) 045376165.b3lyp_6-31g(d).log.xz 045376165.mol 045376165.PUBCHEM 045376165.mol (via Jmol)
045376166.b3lyp_6-31g(d).inp

045376166.b3lyp_6-31g(d).qchem.inp (generated)

045376166.b3lyp_6-31g(d).gjf (generated)

045376166.b3lyp_6-31g(d).firefly.inp (generated)

045376166.b3lyp_6-31g(d).smash.inp (generated)

045376166.b3lyp_6-31g(d).nwchem.inp (generated) 045376166.b3lyp_6-31g(d).log.xz 045376166.td-b3lyp_6-31g+(d).inp 045376166.td-b3lyp_6-31g+(d).log.xz

045376166.td-b3lyp_6-31+g(d).qchem.inp (generated)

045376166.td-b3lyp_6-31+g(d).gjf (generated)

045376166.td-b3lyp_6-31+g(d).firefly.inp (generated)

045376166.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045376166.mol 045376166.PUBCHEM 045376166.mol (via Jmol)
045376192.b3lyp_6-31g(d).inp

045376192.b3lyp_6-31g(d).qchem.inp (generated)

045376192.b3lyp_6-31g(d).gjf (generated)

045376192.b3lyp_6-31g(d).firefly.inp (generated)

045376192.b3lyp_6-31g(d).smash.inp (generated)

045376192.b3lyp_6-31g(d).nwchem.inp (generated) 045376192.b3lyp_6-31g(d).log.xz 045376192.td-b3lyp_6-31g+(d).inp 045376192.td-b3lyp_6-31g+(d).log.xz

045376192.td-b3lyp_6-31+g(d).qchem.inp (generated)

045376192.td-b3lyp_6-31+g(d).gjf (generated)

045376192.td-b3lyp_6-31+g(d).firefly.inp (generated)

045376192.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045376192.mol 045376192.PUBCHEM 045376192.mol (via Jmol)
045376318.b3lyp_6-31g(d).inp

045376318.b3lyp_6-31g(d).qchem.inp (generated)

045376318.b3lyp_6-31g(d).gjf (generated)

045376318.b3lyp_6-31g(d).firefly.inp (generated)

045376318.b3lyp_6-31g(d).smash.inp (generated)

045376318.b3lyp_6-31g(d).nwchem.inp (generated) 045376318.b3lyp_6-31g(d).log.xz 045376318.td-b3lyp_6-31g+(d).inp 045376318.td-b3lyp_6-31g+(d).log.xz

045376318.td-b3lyp_6-31+g(d).qchem.inp (generated)

045376318.td-b3lyp_6-31+g(d).gjf (generated)

045376318.td-b3lyp_6-31+g(d).firefly.inp (generated)

045376318.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045376318.mol 045376318.PUBCHEM 045376318.mol (via Jmol)
045376492.b3lyp_6-31g(d).inp

045376492.b3lyp_6-31g(d).qchem.inp (generated)

045376492.b3lyp_6-31g(d).gjf (generated)

045376492.b3lyp_6-31g(d).firefly.inp (generated)

045376492.b3lyp_6-31g(d).smash.inp (generated)

045376492.b3lyp_6-31g(d).nwchem.inp (generated) 045376492.b3lyp_6-31g(d).log.xz 045376492.td-b3lyp_6-31g+(d).inp 045376492.td-b3lyp_6-31g+(d).log.xz

045376492.td-b3lyp_6-31+g(d).qchem.inp (generated)

045376492.td-b3lyp_6-31+g(d).gjf (generated)

045376492.td-b3lyp_6-31+g(d).firefly.inp (generated)

045376492.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045376492.mol 045376492.PUBCHEM 045376492.mol (via Jmol)
045376493.b3lyp_6-31g(d).inp

045376493.b3lyp_6-31g(d).qchem.inp (generated)

045376493.b3lyp_6-31g(d).gjf (generated)

045376493.b3lyp_6-31g(d).firefly.inp (generated)

045376493.b3lyp_6-31g(d).smash.inp (generated)

045376493.b3lyp_6-31g(d).nwchem.inp (generated) 045376493.b3lyp_6-31g(d).log.xz 045376493.td-b3lyp_6-31g+(d).inp 045376493.td-b3lyp_6-31g+(d).log.xz

045376493.td-b3lyp_6-31+g(d).qchem.inp (generated)

045376493.td-b3lyp_6-31+g(d).gjf (generated)

045376493.td-b3lyp_6-31+g(d).firefly.inp (generated)

045376493.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045376493.mol 045376493.PUBCHEM 045376493.mol (via Jmol)
045376874.b3lyp_6-31g(d).inp

045376874.b3lyp_6-31g(d).qchem.inp (generated)

045376874.b3lyp_6-31g(d).gjf (generated)

045376874.b3lyp_6-31g(d).firefly.inp (generated)

045376874.b3lyp_6-31g(d).smash.inp (generated)

045376874.b3lyp_6-31g(d).nwchem.inp (generated) 045376874.b3lyp_6-31g(d).log.xz 045376874.td-b3lyp_6-31g+(d).inp 045376874.td-b3lyp_6-31g+(d).log.xz

045376874.td-b3lyp_6-31+g(d).qchem.inp (generated)

045376874.td-b3lyp_6-31+g(d).gjf (generated)

045376874.td-b3lyp_6-31+g(d).firefly.inp (generated)

045376874.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045376874.mol 045376874.PUBCHEM 045376874.mol (via Jmol)
045377143.b3lyp_6-31g(d).inp

045377143.b3lyp_6-31g(d).qchem.inp (generated)

045377143.b3lyp_6-31g(d).gjf (generated)

045377143.b3lyp_6-31g(d).firefly.inp (generated)

045377143.b3lyp_6-31g(d).smash.inp (generated)

045377143.b3lyp_6-31g(d).nwchem.inp (generated) 045377143.b3lyp_6-31g(d).log.xz 045377143.mol 045377143.PUBCHEM 045377143.mol (via Jmol)
045377175.b3lyp_6-31g(d).inp

045377175.b3lyp_6-31g(d).qchem.inp (generated)

045377175.b3lyp_6-31g(d).gjf (generated)

045377175.b3lyp_6-31g(d).firefly.inp (generated)

045377175.b3lyp_6-31g(d).smash.inp (generated)

045377175.b3lyp_6-31g(d).nwchem.inp (generated) 045377175.b3lyp_6-31g(d).log.xz 045377175.td-b3lyp_6-31g+(d).inp 045377175.td-b3lyp_6-31g+(d).log.xz

045377175.td-b3lyp_6-31+g(d).qchem.inp (generated)

045377175.td-b3lyp_6-31+g(d).gjf (generated)

045377175.td-b3lyp_6-31+g(d).firefly.inp (generated)

045377175.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045377175.mol 045377175.PUBCHEM 045377175.mol (via Jmol)
045377881.b3lyp_6-31g(d).inp

045377881.b3lyp_6-31g(d).qchem.inp (generated)

045377881.b3lyp_6-31g(d).gjf (generated)

045377881.b3lyp_6-31g(d).firefly.inp (generated)

045377881.b3lyp_6-31g(d).smash.inp (generated)

045377881.b3lyp_6-31g(d).nwchem.inp (generated) 045377881.b3lyp_6-31g(d).log.xz 045377881.td-b3lyp_6-31g+(d).inp 045377881.td-b3lyp_6-31g+(d).log.xz

045377881.td-b3lyp_6-31+g(d).qchem.inp (generated)

045377881.td-b3lyp_6-31+g(d).gjf (generated)

045377881.td-b3lyp_6-31+g(d).firefly.inp (generated)

045377881.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045377881.mol 045377881.PUBCHEM 045377881.mol (via Jmol)
045377882.b3lyp_6-31g(d).inp

045377882.b3lyp_6-31g(d).qchem.inp (generated)

045377882.b3lyp_6-31g(d).gjf (generated)

045377882.b3lyp_6-31g(d).firefly.inp (generated)

045377882.b3lyp_6-31g(d).smash.inp (generated)

045377882.b3lyp_6-31g(d).nwchem.inp (generated) 045377882.b3lyp_6-31g(d).log.xz 045377882.mol 045377882.PUBCHEM 045377882.mol (via Jmol)
045377965.b3lyp_6-31g(d).inp

045377965.b3lyp_6-31g(d).qchem.inp (generated)

045377965.b3lyp_6-31g(d).gjf (generated)

045377965.b3lyp_6-31g(d).firefly.inp (generated)

045377965.b3lyp_6-31g(d).smash.inp (generated)

045377965.b3lyp_6-31g(d).nwchem.inp (generated) 045377965.b3lyp_6-31g(d).log.xz 045377965.mol 045377965.PUBCHEM 045377965.mol (via Jmol)
045378059.b3lyp_6-31g(d).inp

045378059.b3lyp_6-31g(d).qchem.inp (generated)

045378059.b3lyp_6-31g(d).gjf (generated)

045378059.b3lyp_6-31g(d).firefly.inp (generated)

045378059.b3lyp_6-31g(d).smash.inp (generated)

045378059.b3lyp_6-31g(d).nwchem.inp (generated) 045378059.b3lyp_6-31g(d).log.xz 045378059.td-b3lyp_6-31g+(d).inp 045378059.td-b3lyp_6-31g+(d).log.xz

045378059.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378059.td-b3lyp_6-31+g(d).gjf (generated)

045378059.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378059.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378059.mol 045378059.PUBCHEM 045378059.mol (via Jmol)
045378143.b3lyp_6-31g(d).inp

045378143.b3lyp_6-31g(d).qchem.inp (generated)

045378143.b3lyp_6-31g(d).gjf (generated)

045378143.b3lyp_6-31g(d).firefly.inp (generated)

045378143.b3lyp_6-31g(d).smash.inp (generated)

045378143.b3lyp_6-31g(d).nwchem.inp (generated) 045378143.b3lyp_6-31g(d).log.xz 045378143.td-b3lyp_6-31g+(d).inp 045378143.td-b3lyp_6-31g+(d).log.xz

045378143.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378143.td-b3lyp_6-31+g(d).gjf (generated)

045378143.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378143.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378143.mol 045378143.PUBCHEM 045378143.mol (via Jmol)
045378200.b3lyp_6-31g(d).inp

045378200.b3lyp_6-31g(d).qchem.inp (generated)

045378200.b3lyp_6-31g(d).gjf (generated)

045378200.b3lyp_6-31g(d).firefly.inp (generated)

045378200.b3lyp_6-31g(d).smash.inp (generated)

045378200.b3lyp_6-31g(d).nwchem.inp (generated) 045378200.b3lyp_6-31g(d).log.xz 045378200.td-b3lyp_6-31g+(d).inp 045378200.td-b3lyp_6-31g+(d).log.xz

045378200.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378200.td-b3lyp_6-31+g(d).gjf (generated)

045378200.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378200.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378200.mol 045378200.PUBCHEM 045378200.mol (via Jmol)
045378203.b3lyp_6-31g(d).inp

045378203.b3lyp_6-31g(d).qchem.inp (generated)

045378203.b3lyp_6-31g(d).gjf (generated)

045378203.b3lyp_6-31g(d).firefly.inp (generated)

045378203.b3lyp_6-31g(d).smash.inp (generated)

045378203.b3lyp_6-31g(d).nwchem.inp (generated) 045378203.b3lyp_6-31g(d).log.xz 045378203.td-b3lyp_6-31g+(d).inp 045378203.td-b3lyp_6-31g+(d).log.xz

045378203.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378203.td-b3lyp_6-31+g(d).gjf (generated)

045378203.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378203.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378203.mol 045378203.PUBCHEM 045378203.mol (via Jmol)
045378205.b3lyp_6-31g(d).inp

045378205.b3lyp_6-31g(d).qchem.inp (generated)

045378205.b3lyp_6-31g(d).gjf (generated)

045378205.b3lyp_6-31g(d).firefly.inp (generated)

045378205.b3lyp_6-31g(d).smash.inp (generated)

045378205.b3lyp_6-31g(d).nwchem.inp (generated) 045378205.b3lyp_6-31g(d).log.xz 045378205.td-b3lyp_6-31g+(d).inp 045378205.td-b3lyp_6-31g+(d).log.xz

045378205.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378205.td-b3lyp_6-31+g(d).gjf (generated)

045378205.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378205.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378205.mol 045378205.PUBCHEM 045378205.mol (via Jmol)
045378207.b3lyp_6-31g(d).inp

045378207.b3lyp_6-31g(d).qchem.inp (generated)

045378207.b3lyp_6-31g(d).gjf (generated)

045378207.b3lyp_6-31g(d).firefly.inp (generated)

045378207.b3lyp_6-31g(d).smash.inp (generated)

045378207.b3lyp_6-31g(d).nwchem.inp (generated) 045378207.b3lyp_6-31g(d).log.xz 045378207.td-b3lyp_6-31g+(d).inp 045378207.td-b3lyp_6-31g+(d).log.xz

045378207.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378207.td-b3lyp_6-31+g(d).gjf (generated)

045378207.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378207.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378207.mol 045378207.PUBCHEM 045378207.mol (via Jmol)
045378209.b3lyp_6-31g(d).inp

045378209.b3lyp_6-31g(d).qchem.inp (generated)

045378209.b3lyp_6-31g(d).gjf (generated)

045378209.b3lyp_6-31g(d).firefly.inp (generated)

045378209.b3lyp_6-31g(d).smash.inp (generated)

045378209.b3lyp_6-31g(d).nwchem.inp (generated) 045378209.b3lyp_6-31g(d).log.xz 045378209.td-b3lyp_6-31g+(d).inp 045378209.td-b3lyp_6-31g+(d).log.xz

045378209.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378209.td-b3lyp_6-31+g(d).gjf (generated)

045378209.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378209.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378209.mol 045378209.PUBCHEM 045378209.mol (via Jmol)
045378211.b3lyp_6-31g(d).inp

045378211.b3lyp_6-31g(d).qchem.inp (generated)

045378211.b3lyp_6-31g(d).gjf (generated)

045378211.b3lyp_6-31g(d).firefly.inp (generated)

045378211.b3lyp_6-31g(d).smash.inp (generated)

045378211.b3lyp_6-31g(d).nwchem.inp (generated) 045378211.b3lyp_6-31g(d).log.xz 045378211.td-b3lyp_6-31g+(d).inp 045378211.td-b3lyp_6-31g+(d).log.xz

045378211.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378211.td-b3lyp_6-31+g(d).gjf (generated)

045378211.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378211.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378211.mol 045378211.PUBCHEM 045378211.mol (via Jmol)
045378214.b3lyp_6-31g(d).inp

045378214.b3lyp_6-31g(d).qchem.inp (generated)

045378214.b3lyp_6-31g(d).gjf (generated)

045378214.b3lyp_6-31g(d).firefly.inp (generated)

045378214.b3lyp_6-31g(d).smash.inp (generated)

045378214.b3lyp_6-31g(d).nwchem.inp (generated) 045378214.b3lyp_6-31g(d).log.xz 045378214.td-b3lyp_6-31g+(d).inp 045378214.td-b3lyp_6-31g+(d).log.xz

045378214.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378214.td-b3lyp_6-31+g(d).gjf (generated)

045378214.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378214.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378214.mol 045378214.PUBCHEM 045378214.mol (via Jmol)
045378216.b3lyp_6-31g(d).inp

045378216.b3lyp_6-31g(d).qchem.inp (generated)

045378216.b3lyp_6-31g(d).gjf (generated)

045378216.b3lyp_6-31g(d).firefly.inp (generated)

045378216.b3lyp_6-31g(d).smash.inp (generated)

045378216.b3lyp_6-31g(d).nwchem.inp (generated) 045378216.b3lyp_6-31g(d).log.xz 045378216.td-b3lyp_6-31g+(d).inp 045378216.td-b3lyp_6-31g+(d).log.xz

045378216.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378216.td-b3lyp_6-31+g(d).gjf (generated)

045378216.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378216.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378216.mol 045378216.PUBCHEM 045378216.mol (via Jmol)
045378218.b3lyp_6-31g(d).inp

045378218.b3lyp_6-31g(d).qchem.inp (generated)

045378218.b3lyp_6-31g(d).gjf (generated)

045378218.b3lyp_6-31g(d).firefly.inp (generated)

045378218.b3lyp_6-31g(d).smash.inp (generated)

045378218.b3lyp_6-31g(d).nwchem.inp (generated) 045378218.b3lyp_6-31g(d).log.xz 045378218.td-b3lyp_6-31g+(d).inp 045378218.td-b3lyp_6-31g+(d).log.xz

045378218.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378218.td-b3lyp_6-31+g(d).gjf (generated)

045378218.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378218.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378218.mol 045378218.PUBCHEM 045378218.mol (via Jmol)
045378224.b3lyp_6-31g(d).inp

045378224.b3lyp_6-31g(d).qchem.inp (generated)

045378224.b3lyp_6-31g(d).gjf (generated)

045378224.b3lyp_6-31g(d).firefly.inp (generated)

045378224.b3lyp_6-31g(d).smash.inp (generated)

045378224.b3lyp_6-31g(d).nwchem.inp (generated) 045378224.b3lyp_6-31g(d).log.xz 045378224.td-b3lyp_6-31g+(d).inp 045378224.td-b3lyp_6-31g+(d).log.xz

045378224.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378224.td-b3lyp_6-31+g(d).gjf (generated)

045378224.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378224.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378224.mol 045378224.PUBCHEM 045378224.mol (via Jmol)
045378279.b3lyp_6-31g(d).inp

045378279.b3lyp_6-31g(d).qchem.inp (generated)

045378279.b3lyp_6-31g(d).gjf (generated)

045378279.b3lyp_6-31g(d).firefly.inp (generated)

045378279.b3lyp_6-31g(d).smash.inp (generated)

045378279.b3lyp_6-31g(d).nwchem.inp (generated) 045378279.b3lyp_6-31g(d).log.xz 045378279.td-b3lyp_6-31g+(d).inp 045378279.td-b3lyp_6-31g+(d).log.xz

045378279.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378279.td-b3lyp_6-31+g(d).gjf (generated)

045378279.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378279.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378279.mol 045378279.PUBCHEM 045378279.mol (via Jmol)
045378305.b3lyp_6-31g(d).inp

045378305.b3lyp_6-31g(d).qchem.inp (generated)

045378305.b3lyp_6-31g(d).gjf (generated)

045378305.b3lyp_6-31g(d).firefly.inp (generated)

045378305.b3lyp_6-31g(d).smash.inp (generated)

045378305.b3lyp_6-31g(d).nwchem.inp (generated) 045378305.b3lyp_6-31g(d).log.xz 045378305.td-b3lyp_6-31g+(d).inp 045378305.td-b3lyp_6-31g+(d).log.xz

045378305.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378305.td-b3lyp_6-31+g(d).gjf (generated)

045378305.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378305.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378305.mol 045378305.PUBCHEM 045378305.mol (via Jmol)
045378323.b3lyp_6-31g(d).inp

045378323.b3lyp_6-31g(d).qchem.inp (generated)

045378323.b3lyp_6-31g(d).gjf (generated)

045378323.b3lyp_6-31g(d).firefly.inp (generated)

045378323.b3lyp_6-31g(d).smash.inp (generated)

045378323.b3lyp_6-31g(d).nwchem.inp (generated) 045378323.b3lyp_6-31g(d).log.xz 045378323.td-b3lyp_6-31g+(d).inp 045378323.td-b3lyp_6-31g+(d).log.xz

045378323.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378323.td-b3lyp_6-31+g(d).gjf (generated)

045378323.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378323.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378323.mol 045378323.PUBCHEM 045378323.mol (via Jmol)
045378339.b3lyp_6-31g(d).inp

045378339.b3lyp_6-31g(d).qchem.inp (generated)

045378339.b3lyp_6-31g(d).gjf (generated)

045378339.b3lyp_6-31g(d).firefly.inp (generated)

045378339.b3lyp_6-31g(d).smash.inp (generated)

045378339.b3lyp_6-31g(d).nwchem.inp (generated) 045378339.b3lyp_6-31g(d).log.xz 045378339.td-b3lyp_6-31g+(d).inp 045378339.td-b3lyp_6-31g+(d).log.xz

045378339.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378339.td-b3lyp_6-31+g(d).gjf (generated)

045378339.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378339.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378339.mol 045378339.PUBCHEM 045378339.mol (via Jmol)
045378346.b3lyp_6-31g(d).inp

045378346.b3lyp_6-31g(d).qchem.inp (generated)

045378346.b3lyp_6-31g(d).gjf (generated)

045378346.b3lyp_6-31g(d).firefly.inp (generated)

045378346.b3lyp_6-31g(d).smash.inp (generated)

045378346.b3lyp_6-31g(d).nwchem.inp (generated) 045378346.b3lyp_6-31g(d).log.xz 045378346.td-b3lyp_6-31g+(d).inp 045378346.td-b3lyp_6-31g+(d).log.xz

045378346.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378346.td-b3lyp_6-31+g(d).gjf (generated)

045378346.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378346.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378346.mol 045378346.PUBCHEM 045378346.mol (via Jmol)
045378353.b3lyp_6-31g(d).inp

045378353.b3lyp_6-31g(d).qchem.inp (generated)

045378353.b3lyp_6-31g(d).gjf (generated)

045378353.b3lyp_6-31g(d).firefly.inp (generated)

045378353.b3lyp_6-31g(d).smash.inp (generated)

045378353.b3lyp_6-31g(d).nwchem.inp (generated) 045378353.b3lyp_6-31g(d).log.xz 045378353.td-b3lyp_6-31g+(d).inp 045378353.td-b3lyp_6-31g+(d).log.xz

045378353.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378353.td-b3lyp_6-31+g(d).gjf (generated)

045378353.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378353.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378353.mol 045378353.PUBCHEM 045378353.mol (via Jmol)
045378356.b3lyp_6-31g(d).inp

045378356.b3lyp_6-31g(d).qchem.inp (generated)

045378356.b3lyp_6-31g(d).gjf (generated)

045378356.b3lyp_6-31g(d).firefly.inp (generated)

045378356.b3lyp_6-31g(d).smash.inp (generated)

045378356.b3lyp_6-31g(d).nwchem.inp (generated) 045378356.b3lyp_6-31g(d).log.xz 045378356.mol 045378356.PUBCHEM 045378356.mol (via Jmol)
045378358.b3lyp_6-31g(d).inp

045378358.b3lyp_6-31g(d).qchem.inp (generated)

045378358.b3lyp_6-31g(d).gjf (generated)

045378358.b3lyp_6-31g(d).firefly.inp (generated)

045378358.b3lyp_6-31g(d).smash.inp (generated)

045378358.b3lyp_6-31g(d).nwchem.inp (generated) 045378358.b3lyp_6-31g(d).log.xz 045378358.mol 045378358.PUBCHEM 045378358.mol (via Jmol)
045378364.b3lyp_6-31g(d).inp

045378364.b3lyp_6-31g(d).qchem.inp (generated)

045378364.b3lyp_6-31g(d).gjf (generated)

045378364.b3lyp_6-31g(d).firefly.inp (generated)

045378364.b3lyp_6-31g(d).smash.inp (generated)

045378364.b3lyp_6-31g(d).nwchem.inp (generated) 045378364.b3lyp_6-31g(d).log.xz 045378364.td-b3lyp_6-31g+(d).inp 045378364.td-b3lyp_6-31g+(d).log.xz

045378364.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378364.td-b3lyp_6-31+g(d).gjf (generated)

045378364.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378364.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378364.mol 045378364.PUBCHEM 045378364.mol (via Jmol)
045378365.b3lyp_6-31g(d).inp

045378365.b3lyp_6-31g(d).qchem.inp (generated)

045378365.b3lyp_6-31g(d).gjf (generated)

045378365.b3lyp_6-31g(d).firefly.inp (generated)

045378365.b3lyp_6-31g(d).smash.inp (generated)

045378365.b3lyp_6-31g(d).nwchem.inp (generated) 045378365.b3lyp_6-31g(d).log.xz 045378365.mol 045378365.PUBCHEM 045378365.mol (via Jmol)
045378366.b3lyp_6-31g(d).inp

045378366.b3lyp_6-31g(d).qchem.inp (generated)

045378366.b3lyp_6-31g(d).gjf (generated)

045378366.b3lyp_6-31g(d).firefly.inp (generated)

045378366.b3lyp_6-31g(d).smash.inp (generated)

045378366.b3lyp_6-31g(d).nwchem.inp (generated) 045378366.b3lyp_6-31g(d).log.xz 045378366.td-b3lyp_6-31g+(d).inp 045378366.td-b3lyp_6-31g+(d).log.xz

045378366.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378366.td-b3lyp_6-31+g(d).gjf (generated)

045378366.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378366.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378366.mol 045378366.PUBCHEM 045378366.mol (via Jmol)
045378367.b3lyp_6-31g(d).inp

045378367.b3lyp_6-31g(d).qchem.inp (generated)

045378367.b3lyp_6-31g(d).gjf (generated)

045378367.b3lyp_6-31g(d).firefly.inp (generated)

045378367.b3lyp_6-31g(d).smash.inp (generated)

045378367.b3lyp_6-31g(d).nwchem.inp (generated) 045378367.b3lyp_6-31g(d).log.xz 045378367.td-b3lyp_6-31g+(d).inp 045378367.td-b3lyp_6-31g+(d).log.xz

045378367.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378367.td-b3lyp_6-31+g(d).gjf (generated)

045378367.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378367.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378367.mol 045378367.PUBCHEM 045378367.mol (via Jmol)
045378377.b3lyp_6-31g(d).inp

045378377.b3lyp_6-31g(d).qchem.inp (generated)

045378377.b3lyp_6-31g(d).gjf (generated)

045378377.b3lyp_6-31g(d).firefly.inp (generated)

045378377.b3lyp_6-31g(d).smash.inp (generated)

045378377.b3lyp_6-31g(d).nwchem.inp (generated) 045378377.b3lyp_6-31g(d).log.xz 045378377.td-b3lyp_6-31g+(d).inp 045378377.td-b3lyp_6-31g+(d).log.xz

045378377.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378377.td-b3lyp_6-31+g(d).gjf (generated)

045378377.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378377.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378377.mol 045378377.PUBCHEM 045378377.mol (via Jmol)
045378378.b3lyp_6-31g(d).inp

045378378.b3lyp_6-31g(d).qchem.inp (generated)

045378378.b3lyp_6-31g(d).gjf (generated)

045378378.b3lyp_6-31g(d).firefly.inp (generated)

045378378.b3lyp_6-31g(d).smash.inp (generated)

045378378.b3lyp_6-31g(d).nwchem.inp (generated) 045378378.b3lyp_6-31g(d).log.xz 045378378.td-b3lyp_6-31g+(d).inp 045378378.td-b3lyp_6-31g+(d).log.xz

045378378.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378378.td-b3lyp_6-31+g(d).gjf (generated)

045378378.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378378.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378378.mol 045378378.PUBCHEM 045378378.mol (via Jmol)
045378401.b3lyp_6-31g(d).inp

045378401.b3lyp_6-31g(d).qchem.inp (generated)

045378401.b3lyp_6-31g(d).gjf (generated)

045378401.b3lyp_6-31g(d).firefly.inp (generated)

045378401.b3lyp_6-31g(d).smash.inp (generated)

045378401.b3lyp_6-31g(d).nwchem.inp (generated) 045378401.b3lyp_6-31g(d).log.xz 045378401.td-b3lyp_6-31g+(d).inp 045378401.td-b3lyp_6-31g+(d).log.xz

045378401.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378401.td-b3lyp_6-31+g(d).gjf (generated)

045378401.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378401.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378401.mol 045378401.PUBCHEM 045378401.mol (via Jmol)
045378402.b3lyp_6-31g(d).inp

045378402.b3lyp_6-31g(d).qchem.inp (generated)

045378402.b3lyp_6-31g(d).gjf (generated)

045378402.b3lyp_6-31g(d).firefly.inp (generated)

045378402.b3lyp_6-31g(d).smash.inp (generated)

045378402.b3lyp_6-31g(d).nwchem.inp (generated) 045378402.b3lyp_6-31g(d).log.xz 045378402.td-b3lyp_6-31g+(d).inp 045378402.td-b3lyp_6-31g+(d).log.xz

045378402.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378402.td-b3lyp_6-31+g(d).gjf (generated)

045378402.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378402.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378402.mol 045378402.PUBCHEM 045378402.mol (via Jmol)
045378403.b3lyp_6-31g(d).inp

045378403.b3lyp_6-31g(d).qchem.inp (generated)

045378403.b3lyp_6-31g(d).gjf (generated)

045378403.b3lyp_6-31g(d).firefly.inp (generated)

045378403.b3lyp_6-31g(d).smash.inp (generated)

045378403.b3lyp_6-31g(d).nwchem.inp (generated) 045378403.b3lyp_6-31g(d).log.xz 045378403.td-b3lyp_6-31g+(d).inp 045378403.td-b3lyp_6-31g+(d).log.xz

045378403.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378403.td-b3lyp_6-31+g(d).gjf (generated)

045378403.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378403.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378403.mol 045378403.PUBCHEM 045378403.mol (via Jmol)
045378435.b3lyp_6-31g(d).inp

045378435.b3lyp_6-31g(d).qchem.inp (generated)

045378435.b3lyp_6-31g(d).gjf (generated)

045378435.b3lyp_6-31g(d).firefly.inp (generated)

045378435.b3lyp_6-31g(d).smash.inp (generated)

045378435.b3lyp_6-31g(d).nwchem.inp (generated) 045378435.b3lyp_6-31g(d).log.xz 045378435.td-b3lyp_6-31g+(d).inp 045378435.td-b3lyp_6-31g+(d).log.xz

045378435.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378435.td-b3lyp_6-31+g(d).gjf (generated)

045378435.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378435.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378435.mol 045378435.PUBCHEM 045378435.mol (via Jmol)
045378439.b3lyp_6-31g(d).inp

045378439.b3lyp_6-31g(d).qchem.inp (generated)

045378439.b3lyp_6-31g(d).gjf (generated)

045378439.b3lyp_6-31g(d).firefly.inp (generated)

045378439.b3lyp_6-31g(d).smash.inp (generated)

045378439.b3lyp_6-31g(d).nwchem.inp (generated) 045378439.b3lyp_6-31g(d).log.xz 045378439.td-b3lyp_6-31g+(d).inp 045378439.td-b3lyp_6-31g+(d).log.xz

045378439.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378439.td-b3lyp_6-31+g(d).gjf (generated)

045378439.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378439.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378439.mol 045378439.PUBCHEM 045378439.mol (via Jmol)
045378445.b3lyp_6-31g(d).inp

045378445.b3lyp_6-31g(d).qchem.inp (generated)

045378445.b3lyp_6-31g(d).gjf (generated)

045378445.b3lyp_6-31g(d).firefly.inp (generated)

045378445.b3lyp_6-31g(d).smash.inp (generated)

045378445.b3lyp_6-31g(d).nwchem.inp (generated) 045378445.b3lyp_6-31g(d).log.xz 045378445.td-b3lyp_6-31g+(d).inp 045378445.td-b3lyp_6-31g+(d).log.xz

045378445.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378445.td-b3lyp_6-31+g(d).gjf (generated)

045378445.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378445.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378445.mol 045378445.PUBCHEM 045378445.mol (via Jmol)
045378449.b3lyp_6-31g(d).inp

045378449.b3lyp_6-31g(d).qchem.inp (generated)

045378449.b3lyp_6-31g(d).gjf (generated)

045378449.b3lyp_6-31g(d).firefly.inp (generated)

045378449.b3lyp_6-31g(d).smash.inp (generated)

045378449.b3lyp_6-31g(d).nwchem.inp (generated) 045378449.b3lyp_6-31g(d).log.xz 045378449.mol 045378449.PUBCHEM 045378449.mol (via Jmol)
045378479.b3lyp_6-31g(d).inp

045378479.b3lyp_6-31g(d).qchem.inp (generated)

045378479.b3lyp_6-31g(d).gjf (generated)

045378479.b3lyp_6-31g(d).firefly.inp (generated)

045378479.b3lyp_6-31g(d).smash.inp (generated)

045378479.b3lyp_6-31g(d).nwchem.inp (generated) 045378479.b3lyp_6-31g(d).log.xz 045378479.td-b3lyp_6-31g+(d).inp 045378479.td-b3lyp_6-31g+(d).log.xz

045378479.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378479.td-b3lyp_6-31+g(d).gjf (generated)

045378479.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378479.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378479.mol 045378479.PUBCHEM 045378479.mol (via Jmol)
045378488.b3lyp_6-31g(d).inp

045378488.b3lyp_6-31g(d).qchem.inp (generated)

045378488.b3lyp_6-31g(d).gjf (generated)

045378488.b3lyp_6-31g(d).firefly.inp (generated)

045378488.b3lyp_6-31g(d).smash.inp (generated)

045378488.b3lyp_6-31g(d).nwchem.inp (generated) 045378488.b3lyp_6-31g(d).log.xz 045378488.td-b3lyp_6-31g+(d).inp 045378488.td-b3lyp_6-31g+(d).log.xz

045378488.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378488.td-b3lyp_6-31+g(d).gjf (generated)

045378488.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378488.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378488.mol 045378488.PUBCHEM 045378488.mol (via Jmol)
045378489.b3lyp_6-31g(d).inp

045378489.b3lyp_6-31g(d).qchem.inp (generated)

045378489.b3lyp_6-31g(d).gjf (generated)

045378489.b3lyp_6-31g(d).firefly.inp (generated)

045378489.b3lyp_6-31g(d).smash.inp (generated)

045378489.b3lyp_6-31g(d).nwchem.inp (generated) 045378489.b3lyp_6-31g(d).log.xz 045378489.td-b3lyp_6-31g+(d).inp 045378489.td-b3lyp_6-31g+(d).log.xz

045378489.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378489.td-b3lyp_6-31+g(d).gjf (generated)

045378489.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378489.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378489.mol 045378489.PUBCHEM 045378489.mol (via Jmol)
045378503.b3lyp_6-31g(d).inp

045378503.b3lyp_6-31g(d).qchem.inp (generated)

045378503.b3lyp_6-31g(d).gjf (generated)

045378503.b3lyp_6-31g(d).firefly.inp (generated)

045378503.b3lyp_6-31g(d).smash.inp (generated)

045378503.b3lyp_6-31g(d).nwchem.inp (generated) 045378503.b3lyp_6-31g(d).log.xz 045378503.td-b3lyp_6-31g+(d).inp 045378503.td-b3lyp_6-31g+(d).log.xz

045378503.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378503.td-b3lyp_6-31+g(d).gjf (generated)

045378503.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378503.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378503.mol 045378503.PUBCHEM 045378503.mol (via Jmol)
045378565.b3lyp_6-31g(d).inp

045378565.b3lyp_6-31g(d).qchem.inp (generated)

045378565.b3lyp_6-31g(d).gjf (generated)

045378565.b3lyp_6-31g(d).firefly.inp (generated)

045378565.b3lyp_6-31g(d).smash.inp (generated)

045378565.b3lyp_6-31g(d).nwchem.inp (generated) 045378565.b3lyp_6-31g(d).log.xz 045378565.td-b3lyp_6-31g+(d).inp 045378565.td-b3lyp_6-31g+(d).log.xz

045378565.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378565.td-b3lyp_6-31+g(d).gjf (generated)

045378565.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378565.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378565.mol 045378565.PUBCHEM 045378565.mol (via Jmol)
045378612.b3lyp_6-31g(d).inp

045378612.b3lyp_6-31g(d).qchem.inp (generated)

045378612.b3lyp_6-31g(d).gjf (generated)

045378612.b3lyp_6-31g(d).firefly.inp (generated)

045378612.b3lyp_6-31g(d).smash.inp (generated)

045378612.b3lyp_6-31g(d).nwchem.inp (generated) 045378612.b3lyp_6-31g(d).log.xz 045378612.mol 045378612.PUBCHEM 045378612.mol (via Jmol)
045378633.b3lyp_6-31g(d).inp

045378633.b3lyp_6-31g(d).qchem.inp (generated)

045378633.b3lyp_6-31g(d).gjf (generated)

045378633.b3lyp_6-31g(d).firefly.inp (generated)

045378633.b3lyp_6-31g(d).smash.inp (generated)

045378633.b3lyp_6-31g(d).nwchem.inp (generated) 045378633.b3lyp_6-31g(d).log.xz 045378633.td-b3lyp_6-31g+(d).inp 045378633.td-b3lyp_6-31g+(d).log.xz

045378633.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378633.td-b3lyp_6-31+g(d).gjf (generated)

045378633.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378633.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378633.mol 045378633.PUBCHEM 045378633.mol (via Jmol)
045378634.b3lyp_6-31g(d).inp

045378634.b3lyp_6-31g(d).qchem.inp (generated)

045378634.b3lyp_6-31g(d).gjf (generated)

045378634.b3lyp_6-31g(d).firefly.inp (generated)

045378634.b3lyp_6-31g(d).smash.inp (generated)

045378634.b3lyp_6-31g(d).nwchem.inp (generated) 045378634.b3lyp_6-31g(d).log.xz 045378634.td-b3lyp_6-31g+(d).inp 045378634.td-b3lyp_6-31g+(d).log.xz

045378634.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378634.td-b3lyp_6-31+g(d).gjf (generated)

045378634.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378634.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378634.mol 045378634.PUBCHEM 045378634.mol (via Jmol)
045378636.b3lyp_6-31g(d).inp

045378636.b3lyp_6-31g(d).qchem.inp (generated)

045378636.b3lyp_6-31g(d).gjf (generated)

045378636.b3lyp_6-31g(d).firefly.inp (generated)

045378636.b3lyp_6-31g(d).smash.inp (generated)

045378636.b3lyp_6-31g(d).nwchem.inp (generated) 045378636.b3lyp_6-31g(d).log.xz 045378636.td-b3lyp_6-31g+(d).inp 045378636.td-b3lyp_6-31g+(d).log.xz

045378636.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378636.td-b3lyp_6-31+g(d).gjf (generated)

045378636.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378636.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378636.mol 045378636.PUBCHEM 045378636.mol (via Jmol)
045378694.b3lyp_6-31g(d).inp

045378694.b3lyp_6-31g(d).qchem.inp (generated)

045378694.b3lyp_6-31g(d).gjf (generated)

045378694.b3lyp_6-31g(d).firefly.inp (generated)

045378694.b3lyp_6-31g(d).smash.inp (generated)

045378694.b3lyp_6-31g(d).nwchem.inp (generated) 045378694.b3lyp_6-31g(d).log.xz 045378694.td-b3lyp_6-31g+(d).inp 045378694.td-b3lyp_6-31g+(d).log.xz

045378694.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378694.td-b3lyp_6-31+g(d).gjf (generated)

045378694.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378694.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378694.mol 045378694.PUBCHEM 045378694.mol (via Jmol)
045378697.b3lyp_6-31g(d).inp

045378697.b3lyp_6-31g(d).qchem.inp (generated)

045378697.b3lyp_6-31g(d).gjf (generated)

045378697.b3lyp_6-31g(d).firefly.inp (generated)

045378697.b3lyp_6-31g(d).smash.inp (generated)

045378697.b3lyp_6-31g(d).nwchem.inp (generated) 045378697.b3lyp_6-31g(d).log.xz 045378697.mol 045378697.PUBCHEM 045378697.mol (via Jmol)
045378700.b3lyp_6-31g(d).inp

045378700.b3lyp_6-31g(d).qchem.inp (generated)

045378700.b3lyp_6-31g(d).gjf (generated)

045378700.b3lyp_6-31g(d).firefly.inp (generated)

045378700.b3lyp_6-31g(d).smash.inp (generated)

045378700.b3lyp_6-31g(d).nwchem.inp (generated) 045378700.b3lyp_6-31g(d).log.xz 045378700.td-b3lyp_6-31g+(d).inp 045378700.td-b3lyp_6-31g+(d).log.xz

045378700.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378700.td-b3lyp_6-31+g(d).gjf (generated)

045378700.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378700.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378700.mol 045378700.PUBCHEM 045378700.mol (via Jmol)
045378706.b3lyp_6-31g(d).inp

045378706.b3lyp_6-31g(d).qchem.inp (generated)

045378706.b3lyp_6-31g(d).gjf (generated)

045378706.b3lyp_6-31g(d).firefly.inp (generated)

045378706.b3lyp_6-31g(d).smash.inp (generated)

045378706.b3lyp_6-31g(d).nwchem.inp (generated) 045378706.b3lyp_6-31g(d).log.xz 045378706.td-b3lyp_6-31g+(d).inp 045378706.td-b3lyp_6-31g+(d).log.xz

045378706.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378706.td-b3lyp_6-31+g(d).gjf (generated)

045378706.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378706.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378706.mol 045378706.PUBCHEM 045378706.mol (via Jmol)
045378709.b3lyp_6-31g(d).inp

045378709.b3lyp_6-31g(d).qchem.inp (generated)

045378709.b3lyp_6-31g(d).gjf (generated)

045378709.b3lyp_6-31g(d).firefly.inp (generated)

045378709.b3lyp_6-31g(d).smash.inp (generated)

045378709.b3lyp_6-31g(d).nwchem.inp (generated) 045378709.b3lyp_6-31g(d).log.xz 045378709.td-b3lyp_6-31g+(d).inp 045378709.td-b3lyp_6-31g+(d).log.xz

045378709.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378709.td-b3lyp_6-31+g(d).gjf (generated)

045378709.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378709.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378709.mol 045378709.PUBCHEM 045378709.mol (via Jmol)
045378710.b3lyp_6-31g(d).inp

045378710.b3lyp_6-31g(d).qchem.inp (generated)

045378710.b3lyp_6-31g(d).gjf (generated)

045378710.b3lyp_6-31g(d).firefly.inp (generated)

045378710.b3lyp_6-31g(d).smash.inp (generated)

045378710.b3lyp_6-31g(d).nwchem.inp (generated) 045378710.b3lyp_6-31g(d).log.xz 045378710.td-b3lyp_6-31g+(d).inp 045378710.td-b3lyp_6-31g+(d).log.xz

045378710.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378710.td-b3lyp_6-31+g(d).gjf (generated)

045378710.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378710.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378710.mol 045378710.PUBCHEM 045378710.mol (via Jmol)
045378712.b3lyp_6-31g(d).inp

045378712.b3lyp_6-31g(d).qchem.inp (generated)

045378712.b3lyp_6-31g(d).gjf (generated)

045378712.b3lyp_6-31g(d).firefly.inp (generated)

045378712.b3lyp_6-31g(d).smash.inp (generated)

045378712.b3lyp_6-31g(d).nwchem.inp (generated) 045378712.b3lyp_6-31g(d).log.xz 045378712.td-b3lyp_6-31g+(d).inp 045378712.td-b3lyp_6-31g+(d).log.xz

045378712.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378712.td-b3lyp_6-31+g(d).gjf (generated)

045378712.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378712.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378712.mol 045378712.PUBCHEM 045378712.mol (via Jmol)
045378713.b3lyp_6-31g(d).inp

045378713.b3lyp_6-31g(d).qchem.inp (generated)

045378713.b3lyp_6-31g(d).gjf (generated)

045378713.b3lyp_6-31g(d).firefly.inp (generated)

045378713.b3lyp_6-31g(d).smash.inp (generated)

045378713.b3lyp_6-31g(d).nwchem.inp (generated) 045378713.b3lyp_6-31g(d).log.xz 045378713.td-b3lyp_6-31g+(d).inp 045378713.td-b3lyp_6-31g+(d).log.xz

045378713.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378713.td-b3lyp_6-31+g(d).gjf (generated)

045378713.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378713.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378713.mol 045378713.PUBCHEM 045378713.mol (via Jmol)
045378717.b3lyp_6-31g(d).inp

045378717.b3lyp_6-31g(d).qchem.inp (generated)

045378717.b3lyp_6-31g(d).gjf (generated)

045378717.b3lyp_6-31g(d).firefly.inp (generated)

045378717.b3lyp_6-31g(d).smash.inp (generated)

045378717.b3lyp_6-31g(d).nwchem.inp (generated) 045378717.b3lyp_6-31g(d).log.xz 045378717.td-b3lyp_6-31g+(d).inp 045378717.td-b3lyp_6-31g+(d).log.xz

045378717.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378717.td-b3lyp_6-31+g(d).gjf (generated)

045378717.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378717.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378717.mol 045378717.PUBCHEM 045378717.mol (via Jmol)
045378729.b3lyp_6-31g(d).inp

045378729.b3lyp_6-31g(d).qchem.inp (generated)

045378729.b3lyp_6-31g(d).gjf (generated)

045378729.b3lyp_6-31g(d).firefly.inp (generated)

045378729.b3lyp_6-31g(d).smash.inp (generated)

045378729.b3lyp_6-31g(d).nwchem.inp (generated) 045378729.b3lyp_6-31g(d).log.xz 045378729.td-b3lyp_6-31g+(d).inp 045378729.td-b3lyp_6-31g+(d).log.xz

045378729.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378729.td-b3lyp_6-31+g(d).gjf (generated)

045378729.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378729.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378729.mol 045378729.PUBCHEM 045378729.mol (via Jmol)
045378730.b3lyp_6-31g(d).inp

045378730.b3lyp_6-31g(d).qchem.inp (generated)

045378730.b3lyp_6-31g(d).gjf (generated)

045378730.b3lyp_6-31g(d).firefly.inp (generated)

045378730.b3lyp_6-31g(d).smash.inp (generated)

045378730.b3lyp_6-31g(d).nwchem.inp (generated) 045378730.b3lyp_6-31g(d).log.xz 045378730.mol 045378730.PUBCHEM 045378730.mol (via Jmol)
045378731.b3lyp_6-31g(d).inp

045378731.b3lyp_6-31g(d).qchem.inp (generated)

045378731.b3lyp_6-31g(d).gjf (generated)

045378731.b3lyp_6-31g(d).firefly.inp (generated)

045378731.b3lyp_6-31g(d).smash.inp (generated)

045378731.b3lyp_6-31g(d).nwchem.inp (generated) 045378731.b3lyp_6-31g(d).log.xz 045378731.td-b3lyp_6-31g+(d).inp 045378731.td-b3lyp_6-31g+(d).log.xz

045378731.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378731.td-b3lyp_6-31+g(d).gjf (generated)

045378731.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378731.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378731.mol 045378731.PUBCHEM 045378731.mol (via Jmol)
045378748.b3lyp_6-31g(d).inp

045378748.b3lyp_6-31g(d).qchem.inp (generated)

045378748.b3lyp_6-31g(d).gjf (generated)

045378748.b3lyp_6-31g(d).firefly.inp (generated)

045378748.b3lyp_6-31g(d).smash.inp (generated)

045378748.b3lyp_6-31g(d).nwchem.inp (generated) 045378748.b3lyp_6-31g(d).log.xz 045378748.td-b3lyp_6-31g+(d).inp 045378748.td-b3lyp_6-31g+(d).log.xz

045378748.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378748.td-b3lyp_6-31+g(d).gjf (generated)

045378748.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378748.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378748.mol 045378748.PUBCHEM 045378748.mol (via Jmol)
045378749.b3lyp_6-31g(d).inp

045378749.b3lyp_6-31g(d).qchem.inp (generated)

045378749.b3lyp_6-31g(d).gjf (generated)

045378749.b3lyp_6-31g(d).firefly.inp (generated)

045378749.b3lyp_6-31g(d).smash.inp (generated)

045378749.b3lyp_6-31g(d).nwchem.inp (generated) 045378749.b3lyp_6-31g(d).log.xz 045378749.td-b3lyp_6-31g+(d).inp 045378749.td-b3lyp_6-31g+(d).log.xz

045378749.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378749.td-b3lyp_6-31+g(d).gjf (generated)

045378749.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378749.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378749.mol 045378749.PUBCHEM 045378749.mol (via Jmol)
045378753.b3lyp_6-31g(d).inp

045378753.b3lyp_6-31g(d).qchem.inp (generated)

045378753.b3lyp_6-31g(d).gjf (generated)

045378753.b3lyp_6-31g(d).firefly.inp (generated)

045378753.b3lyp_6-31g(d).smash.inp (generated)

045378753.b3lyp_6-31g(d).nwchem.inp (generated) 045378753.b3lyp_6-31g(d).log.xz 045378753.td-b3lyp_6-31g+(d).inp 045378753.td-b3lyp_6-31g+(d).log.xz

045378753.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378753.td-b3lyp_6-31+g(d).gjf (generated)

045378753.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378753.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378753.mol 045378753.PUBCHEM 045378753.mol (via Jmol)
045378833.b3lyp_6-31g(d).inp

045378833.b3lyp_6-31g(d).qchem.inp (generated)

045378833.b3lyp_6-31g(d).gjf (generated)

045378833.b3lyp_6-31g(d).firefly.inp (generated)

045378833.b3lyp_6-31g(d).smash.inp (generated)

045378833.b3lyp_6-31g(d).nwchem.inp (generated) 045378833.b3lyp_6-31g(d).log.xz 045378833.td-b3lyp_6-31g+(d).inp 045378833.td-b3lyp_6-31g+(d).log.xz

045378833.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378833.td-b3lyp_6-31+g(d).gjf (generated)

045378833.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378833.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378833.mol 045378833.PUBCHEM 045378833.mol (via Jmol)
045378845.b3lyp_6-31g(d).inp

045378845.b3lyp_6-31g(d).qchem.inp (generated)

045378845.b3lyp_6-31g(d).gjf (generated)

045378845.b3lyp_6-31g(d).firefly.inp (generated)

045378845.b3lyp_6-31g(d).smash.inp (generated)

045378845.b3lyp_6-31g(d).nwchem.inp (generated) 045378845.b3lyp_6-31g(d).log.xz 045378845.td-b3lyp_6-31g+(d).inp 045378845.td-b3lyp_6-31g+(d).log.xz

045378845.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378845.td-b3lyp_6-31+g(d).gjf (generated)

045378845.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378845.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378845.mol 045378845.PUBCHEM 045378845.mol (via Jmol)
045378846.b3lyp_6-31g(d).inp

045378846.b3lyp_6-31g(d).qchem.inp (generated)

045378846.b3lyp_6-31g(d).gjf (generated)

045378846.b3lyp_6-31g(d).firefly.inp (generated)

045378846.b3lyp_6-31g(d).smash.inp (generated)

045378846.b3lyp_6-31g(d).nwchem.inp (generated) 045378846.b3lyp_6-31g(d).log.xz 045378846.td-b3lyp_6-31g+(d).inp 045378846.td-b3lyp_6-31g+(d).log.xz

045378846.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378846.td-b3lyp_6-31+g(d).gjf (generated)

045378846.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378846.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378846.mol 045378846.PUBCHEM 045378846.mol (via Jmol)
045378847.b3lyp_6-31g(d).inp

045378847.b3lyp_6-31g(d).qchem.inp (generated)

045378847.b3lyp_6-31g(d).gjf (generated)

045378847.b3lyp_6-31g(d).firefly.inp (generated)

045378847.b3lyp_6-31g(d).smash.inp (generated)

045378847.b3lyp_6-31g(d).nwchem.inp (generated) 045378847.b3lyp_6-31g(d).log.xz 045378847.td-b3lyp_6-31g+(d).inp 045378847.td-b3lyp_6-31g+(d).log.xz

045378847.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378847.td-b3lyp_6-31+g(d).gjf (generated)

045378847.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378847.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378847.mol 045378847.PUBCHEM 045378847.mol (via Jmol)
045378856.b3lyp_6-31g(d).inp

045378856.b3lyp_6-31g(d).qchem.inp (generated)

045378856.b3lyp_6-31g(d).gjf (generated)

045378856.b3lyp_6-31g(d).firefly.inp (generated)

045378856.b3lyp_6-31g(d).smash.inp (generated)

045378856.b3lyp_6-31g(d).nwchem.inp (generated) 045378856.b3lyp_6-31g(d).log.xz 045378856.td-b3lyp_6-31g+(d).inp 045378856.td-b3lyp_6-31g+(d).log.xz

045378856.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378856.td-b3lyp_6-31+g(d).gjf (generated)

045378856.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378856.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378856.mol 045378856.PUBCHEM 045378856.mol (via Jmol)
045378921.b3lyp_6-31g(d).inp

045378921.b3lyp_6-31g(d).qchem.inp (generated)

045378921.b3lyp_6-31g(d).gjf (generated)

045378921.b3lyp_6-31g(d).firefly.inp (generated)

045378921.b3lyp_6-31g(d).smash.inp (generated)

045378921.b3lyp_6-31g(d).nwchem.inp (generated) 045378921.b3lyp_6-31g(d).log.xz 045378921.td-b3lyp_6-31g+(d).inp 045378921.td-b3lyp_6-31g+(d).log.xz

045378921.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378921.td-b3lyp_6-31+g(d).gjf (generated)

045378921.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378921.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378921.mol 045378921.PUBCHEM 045378921.mol (via Jmol)
045378972.b3lyp_6-31g(d).inp

045378972.b3lyp_6-31g(d).qchem.inp (generated)

045378972.b3lyp_6-31g(d).gjf (generated)

045378972.b3lyp_6-31g(d).firefly.inp (generated)

045378972.b3lyp_6-31g(d).smash.inp (generated)

045378972.b3lyp_6-31g(d).nwchem.inp (generated) 045378972.b3lyp_6-31g(d).log.xz 045378972.td-b3lyp_6-31g+(d).inp 045378972.td-b3lyp_6-31g+(d).log.xz

045378972.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378972.td-b3lyp_6-31+g(d).gjf (generated)

045378972.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378972.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378972.mol 045378972.PUBCHEM 045378972.mol (via Jmol)
045378978.b3lyp_6-31g(d).inp

045378978.b3lyp_6-31g(d).qchem.inp (generated)

045378978.b3lyp_6-31g(d).gjf (generated)

045378978.b3lyp_6-31g(d).firefly.inp (generated)

045378978.b3lyp_6-31g(d).smash.inp (generated)

045378978.b3lyp_6-31g(d).nwchem.inp (generated) 045378978.b3lyp_6-31g(d).log.xz 045378978.td-b3lyp_6-31g+(d).inp 045378978.td-b3lyp_6-31g+(d).log.xz

045378978.td-b3lyp_6-31+g(d).qchem.inp (generated)

045378978.td-b3lyp_6-31+g(d).gjf (generated)

045378978.td-b3lyp_6-31+g(d).firefly.inp (generated)

045378978.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045378978.mol 045378978.PUBCHEM 045378978.mol (via Jmol)
045378993.b3lyp_6-31g(d).inp

045378993.b3lyp_6-31g(d).qchem.inp (generated)

045378993.b3lyp_6-31g(d).gjf (generated)

045378993.b3lyp_6-31g(d).firefly.inp (generated)

045378993.b3lyp_6-31g(d).smash.inp (generated)

045378993.b3lyp_6-31g(d).nwchem.inp (generated) 045378993.b3lyp_6-31g(d).log.xz 045378993.mol 045378993.PUBCHEM 045378993.mol (via Jmol)
045378994.b3lyp_6-31g(d).inp

045378994.b3lyp_6-31g(d).qchem.inp (generated)

045378994.b3lyp_6-31g(d).gjf (generated)

045378994.b3lyp_6-31g(d).firefly.inp (generated)

045378994.b3lyp_6-31g(d).smash.inp (generated)

045378994.b3lyp_6-31g(d).nwchem.inp (generated) 045378994.b3lyp_6-31g(d).log.xz 045378994.mol 045378994.PUBCHEM 045378994.mol (via Jmol)
045379003.b3lyp_6-31g(d).inp

045379003.b3lyp_6-31g(d).qchem.inp (generated)

045379003.b3lyp_6-31g(d).gjf (generated)

045379003.b3lyp_6-31g(d).firefly.inp (generated)

045379003.b3lyp_6-31g(d).smash.inp (generated)

045379003.b3lyp_6-31g(d).nwchem.inp (generated) 045379003.b3lyp_6-31g(d).log.xz 045379003.td-b3lyp_6-31g+(d).inp 045379003.td-b3lyp_6-31g+(d).log.xz

045379003.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379003.td-b3lyp_6-31+g(d).gjf (generated)

045379003.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379003.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379003.mol 045379003.PUBCHEM 045379003.mol (via Jmol)
045379040.b3lyp_6-31g(d).inp

045379040.b3lyp_6-31g(d).qchem.inp (generated)

045379040.b3lyp_6-31g(d).gjf (generated)

045379040.b3lyp_6-31g(d).firefly.inp (generated)

045379040.b3lyp_6-31g(d).smash.inp (generated)

045379040.b3lyp_6-31g(d).nwchem.inp (generated) 045379040.b3lyp_6-31g(d).log.xz 045379040.td-b3lyp_6-31g+(d).inp 045379040.td-b3lyp_6-31g+(d).log.xz

045379040.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379040.td-b3lyp_6-31+g(d).gjf (generated)

045379040.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379040.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379040.mol 045379040.PUBCHEM 045379040.mol (via Jmol)
045379057.b3lyp_6-31g(d).inp

045379057.b3lyp_6-31g(d).qchem.inp (generated)

045379057.b3lyp_6-31g(d).gjf (generated)

045379057.b3lyp_6-31g(d).firefly.inp (generated)

045379057.b3lyp_6-31g(d).smash.inp (generated)

045379057.b3lyp_6-31g(d).nwchem.inp (generated) 045379057.b3lyp_6-31g(d).log.xz 045379057.td-b3lyp_6-31g+(d).inp 045379057.td-b3lyp_6-31g+(d).log.xz

045379057.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379057.td-b3lyp_6-31+g(d).gjf (generated)

045379057.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379057.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379057.mol 045379057.PUBCHEM 045379057.mol (via Jmol)
045379070.b3lyp_6-31g(d).inp

045379070.b3lyp_6-31g(d).qchem.inp (generated)

045379070.b3lyp_6-31g(d).gjf (generated)

045379070.b3lyp_6-31g(d).firefly.inp (generated)

045379070.b3lyp_6-31g(d).smash.inp (generated)

045379070.b3lyp_6-31g(d).nwchem.inp (generated) 045379070.b3lyp_6-31g(d).log.xz 045379070.td-b3lyp_6-31g+(d).inp 045379070.td-b3lyp_6-31g+(d).log.xz

045379070.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379070.td-b3lyp_6-31+g(d).gjf (generated)

045379070.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379070.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379070.mol 045379070.PUBCHEM 045379070.mol (via Jmol)
045379093.b3lyp_6-31g(d).inp

045379093.b3lyp_6-31g(d).qchem.inp (generated)

045379093.b3lyp_6-31g(d).gjf (generated)

045379093.b3lyp_6-31g(d).firefly.inp (generated)

045379093.b3lyp_6-31g(d).smash.inp (generated)

045379093.b3lyp_6-31g(d).nwchem.inp (generated) 045379093.b3lyp_6-31g(d).log.xz 045379093.mol 045379093.PUBCHEM 045379093.mol (via Jmol)
045379094.b3lyp_6-31g(d).inp

045379094.b3lyp_6-31g(d).qchem.inp (generated)

045379094.b3lyp_6-31g(d).gjf (generated)

045379094.b3lyp_6-31g(d).firefly.inp (generated)

045379094.b3lyp_6-31g(d).smash.inp (generated)

045379094.b3lyp_6-31g(d).nwchem.inp (generated) 045379094.b3lyp_6-31g(d).log.xz 045379094.td-b3lyp_6-31g+(d).inp 045379094.td-b3lyp_6-31g+(d).log.xz

045379094.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379094.td-b3lyp_6-31+g(d).gjf (generated)

045379094.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379094.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379094.mol 045379094.PUBCHEM 045379094.mol (via Jmol)
045379113.b3lyp_6-31g(d).inp

045379113.b3lyp_6-31g(d).qchem.inp (generated)

045379113.b3lyp_6-31g(d).gjf (generated)

045379113.b3lyp_6-31g(d).firefly.inp (generated)

045379113.b3lyp_6-31g(d).smash.inp (generated)

045379113.b3lyp_6-31g(d).nwchem.inp (generated) 045379113.b3lyp_6-31g(d).log.xz 045379113.td-b3lyp_6-31g+(d).inp 045379113.td-b3lyp_6-31g+(d).log.xz

045379113.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379113.td-b3lyp_6-31+g(d).gjf (generated)

045379113.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379113.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379113.mol 045379113.PUBCHEM 045379113.mol (via Jmol)
045379139.b3lyp_6-31g(d).inp

045379139.b3lyp_6-31g(d).qchem.inp (generated)

045379139.b3lyp_6-31g(d).gjf (generated)

045379139.b3lyp_6-31g(d).firefly.inp (generated)

045379139.b3lyp_6-31g(d).smash.inp (generated)

045379139.b3lyp_6-31g(d).nwchem.inp (generated) 045379139.b3lyp_6-31g(d).log.xz 045379139.td-b3lyp_6-31g+(d).inp 045379139.td-b3lyp_6-31g+(d).log.xz

045379139.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379139.td-b3lyp_6-31+g(d).gjf (generated)

045379139.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379139.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379139.mol 045379139.PUBCHEM 045379139.mol (via Jmol)
045379168.b3lyp_6-31g(d).inp

045379168.b3lyp_6-31g(d).qchem.inp (generated)

045379168.b3lyp_6-31g(d).gjf (generated)

045379168.b3lyp_6-31g(d).firefly.inp (generated)

045379168.b3lyp_6-31g(d).smash.inp (generated)

045379168.b3lyp_6-31g(d).nwchem.inp (generated) 045379168.b3lyp_6-31g(d).log.xz 045379168.mol 045379168.PUBCHEM 045379168.mol (via Jmol)
045379169.b3lyp_6-31g(d).inp

045379169.b3lyp_6-31g(d).qchem.inp (generated)

045379169.b3lyp_6-31g(d).gjf (generated)

045379169.b3lyp_6-31g(d).firefly.inp (generated)

045379169.b3lyp_6-31g(d).smash.inp (generated)

045379169.b3lyp_6-31g(d).nwchem.inp (generated) 045379169.b3lyp_6-31g(d).log.xz 045379169.mol 045379169.PUBCHEM 045379169.mol (via Jmol)
045379170.b3lyp_6-31g(d).inp

045379170.b3lyp_6-31g(d).qchem.inp (generated)

045379170.b3lyp_6-31g(d).gjf (generated)

045379170.b3lyp_6-31g(d).firefly.inp (generated)

045379170.b3lyp_6-31g(d).smash.inp (generated)

045379170.b3lyp_6-31g(d).nwchem.inp (generated) 045379170.b3lyp_6-31g(d).log.xz 045379170.td-b3lyp_6-31g+(d).inp 045379170.td-b3lyp_6-31g+(d).log.xz

045379170.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379170.td-b3lyp_6-31+g(d).gjf (generated)

045379170.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379170.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379170.mol 045379170.PUBCHEM 045379170.mol (via Jmol)
045379171.b3lyp_6-31g(d).inp

045379171.b3lyp_6-31g(d).qchem.inp (generated)

045379171.b3lyp_6-31g(d).gjf (generated)

045379171.b3lyp_6-31g(d).firefly.inp (generated)

045379171.b3lyp_6-31g(d).smash.inp (generated)

045379171.b3lyp_6-31g(d).nwchem.inp (generated) 045379171.b3lyp_6-31g(d).log.xz 045379171.td-b3lyp_6-31g+(d).inp 045379171.td-b3lyp_6-31g+(d).log.xz

045379171.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379171.td-b3lyp_6-31+g(d).gjf (generated)

045379171.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379171.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379171.mol 045379171.PUBCHEM 045379171.mol (via Jmol)
045379176.b3lyp_6-31g(d).inp

045379176.b3lyp_6-31g(d).qchem.inp (generated)

045379176.b3lyp_6-31g(d).gjf (generated)

045379176.b3lyp_6-31g(d).firefly.inp (generated)

045379176.b3lyp_6-31g(d).smash.inp (generated)

045379176.b3lyp_6-31g(d).nwchem.inp (generated) 045379176.b3lyp_6-31g(d).log.xz 045379176.td-b3lyp_6-31g+(d).inp 045379176.td-b3lyp_6-31g+(d).log.xz

045379176.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379176.td-b3lyp_6-31+g(d).gjf (generated)

045379176.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379176.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379176.mol 045379176.PUBCHEM 045379176.mol (via Jmol)
045379255.b3lyp_6-31g(d).inp

045379255.b3lyp_6-31g(d).qchem.inp (generated)

045379255.b3lyp_6-31g(d).gjf (generated)

045379255.b3lyp_6-31g(d).firefly.inp (generated)

045379255.b3lyp_6-31g(d).smash.inp (generated)

045379255.b3lyp_6-31g(d).nwchem.inp (generated) 045379255.b3lyp_6-31g(d).log.xz 045379255.mol 045379255.PUBCHEM 045379255.mol (via Jmol)
045379282.b3lyp_6-31g(d).inp

045379282.b3lyp_6-31g(d).qchem.inp (generated)

045379282.b3lyp_6-31g(d).gjf (generated)

045379282.b3lyp_6-31g(d).firefly.inp (generated)

045379282.b3lyp_6-31g(d).smash.inp (generated)

045379282.b3lyp_6-31g(d).nwchem.inp (generated) 045379282.b3lyp_6-31g(d).log.xz 045379282.td-b3lyp_6-31g+(d).inp 045379282.td-b3lyp_6-31g+(d).log.xz

045379282.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379282.td-b3lyp_6-31+g(d).gjf (generated)

045379282.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379282.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379282.mol 045379282.PUBCHEM 045379282.mol (via Jmol)
045379302.b3lyp_6-31g(d).inp

045379302.b3lyp_6-31g(d).qchem.inp (generated)

045379302.b3lyp_6-31g(d).gjf (generated)

045379302.b3lyp_6-31g(d).firefly.inp (generated)

045379302.b3lyp_6-31g(d).smash.inp (generated)

045379302.b3lyp_6-31g(d).nwchem.inp (generated) 045379302.b3lyp_6-31g(d).log.xz 045379302.td-b3lyp_6-31g+(d).inp 045379302.td-b3lyp_6-31g+(d).log.xz

045379302.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379302.td-b3lyp_6-31+g(d).gjf (generated)

045379302.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379302.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379302.mol 045379302.PUBCHEM 045379302.mol (via Jmol)
045379312.b3lyp_6-31g(d).inp

045379312.b3lyp_6-31g(d).qchem.inp (generated)

045379312.b3lyp_6-31g(d).gjf (generated)

045379312.b3lyp_6-31g(d).firefly.inp (generated)

045379312.b3lyp_6-31g(d).smash.inp (generated)

045379312.b3lyp_6-31g(d).nwchem.inp (generated) 045379312.b3lyp_6-31g(d).log.xz 045379312.mol 045379312.PUBCHEM 045379312.mol (via Jmol)
045379314.b3lyp_6-31g(d).inp

045379314.b3lyp_6-31g(d).qchem.inp (generated)

045379314.b3lyp_6-31g(d).gjf (generated)

045379314.b3lyp_6-31g(d).firefly.inp (generated)

045379314.b3lyp_6-31g(d).smash.inp (generated)

045379314.b3lyp_6-31g(d).nwchem.inp (generated) 045379314.b3lyp_6-31g(d).log.xz 045379314.td-b3lyp_6-31g+(d).inp 045379314.td-b3lyp_6-31g+(d).log.xz

045379314.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379314.td-b3lyp_6-31+g(d).gjf (generated)

045379314.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379314.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379314.mol 045379314.PUBCHEM 045379314.mol (via Jmol)
045379394.b3lyp_6-31g(d).inp

045379394.b3lyp_6-31g(d).qchem.inp (generated)

045379394.b3lyp_6-31g(d).gjf (generated)

045379394.b3lyp_6-31g(d).firefly.inp (generated)

045379394.b3lyp_6-31g(d).smash.inp (generated)

045379394.b3lyp_6-31g(d).nwchem.inp (generated) 045379394.b3lyp_6-31g(d).log.xz 045379394.td-b3lyp_6-31g+(d).inp 045379394.td-b3lyp_6-31g+(d).log.xz

045379394.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379394.td-b3lyp_6-31+g(d).gjf (generated)

045379394.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379394.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379394.mol 045379394.PUBCHEM 045379394.mol (via Jmol)
045379409.b3lyp_6-31g(d).inp

045379409.b3lyp_6-31g(d).qchem.inp (generated)

045379409.b3lyp_6-31g(d).gjf (generated)

045379409.b3lyp_6-31g(d).firefly.inp (generated)

045379409.b3lyp_6-31g(d).smash.inp (generated)

045379409.b3lyp_6-31g(d).nwchem.inp (generated) 045379409.b3lyp_6-31g(d).log.xz 045379409.td-b3lyp_6-31g+(d).inp 045379409.td-b3lyp_6-31g+(d).log.xz

045379409.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379409.td-b3lyp_6-31+g(d).gjf (generated)

045379409.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379409.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379409.mol 045379409.PUBCHEM 045379409.mol (via Jmol)
045379423.b3lyp_6-31g(d).inp

045379423.b3lyp_6-31g(d).qchem.inp (generated)

045379423.b3lyp_6-31g(d).gjf (generated)

045379423.b3lyp_6-31g(d).firefly.inp (generated)

045379423.b3lyp_6-31g(d).smash.inp (generated)

045379423.b3lyp_6-31g(d).nwchem.inp (generated) 045379423.b3lyp_6-31g(d).log.xz 045379423.td-b3lyp_6-31g+(d).inp 045379423.td-b3lyp_6-31g+(d).log.xz

045379423.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379423.td-b3lyp_6-31+g(d).gjf (generated)

045379423.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379423.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379423.mol 045379423.PUBCHEM 045379423.mol (via Jmol)
045379461.b3lyp_6-31g(d).inp

045379461.b3lyp_6-31g(d).qchem.inp (generated)

045379461.b3lyp_6-31g(d).gjf (generated)

045379461.b3lyp_6-31g(d).firefly.inp (generated)

045379461.b3lyp_6-31g(d).smash.inp (generated)

045379461.b3lyp_6-31g(d).nwchem.inp (generated) 045379461.b3lyp_6-31g(d).log.xz 045379461.td-b3lyp_6-31g+(d).inp 045379461.td-b3lyp_6-31g+(d).log.xz

045379461.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379461.td-b3lyp_6-31+g(d).gjf (generated)

045379461.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379461.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379461.mol 045379461.PUBCHEM 045379461.mol (via Jmol)
045379462.b3lyp_6-31g(d).inp

045379462.b3lyp_6-31g(d).qchem.inp (generated)

045379462.b3lyp_6-31g(d).gjf (generated)

045379462.b3lyp_6-31g(d).firefly.inp (generated)

045379462.b3lyp_6-31g(d).smash.inp (generated)

045379462.b3lyp_6-31g(d).nwchem.inp (generated) 045379462.b3lyp_6-31g(d).log.xz 045379462.td-b3lyp_6-31g+(d).inp 045379462.td-b3lyp_6-31g+(d).log.xz

045379462.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379462.td-b3lyp_6-31+g(d).gjf (generated)

045379462.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379462.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379462.mol 045379462.PUBCHEM 045379462.mol (via Jmol)
045379464.b3lyp_6-31g(d).inp

045379464.b3lyp_6-31g(d).qchem.inp (generated)

045379464.b3lyp_6-31g(d).gjf (generated)

045379464.b3lyp_6-31g(d).firefly.inp (generated)

045379464.b3lyp_6-31g(d).smash.inp (generated)

045379464.b3lyp_6-31g(d).nwchem.inp (generated) 045379464.b3lyp_6-31g(d).log.xz 045379464.td-b3lyp_6-31g+(d).inp 045379464.td-b3lyp_6-31g+(d).log.xz

045379464.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379464.td-b3lyp_6-31+g(d).gjf (generated)

045379464.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379464.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379464.mol 045379464.PUBCHEM 045379464.mol (via Jmol)
045379471.b3lyp_6-31g(d).inp

045379471.b3lyp_6-31g(d).qchem.inp (generated)

045379471.b3lyp_6-31g(d).gjf (generated)

045379471.b3lyp_6-31g(d).firefly.inp (generated)

045379471.b3lyp_6-31g(d).smash.inp (generated)

045379471.b3lyp_6-31g(d).nwchem.inp (generated) 045379471.b3lyp_6-31g(d).log.xz 045379471.td-b3lyp_6-31g+(d).inp 045379471.td-b3lyp_6-31g+(d).log.xz

045379471.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379471.td-b3lyp_6-31+g(d).gjf (generated)

045379471.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379471.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379471.mol 045379471.PUBCHEM 045379471.mol (via Jmol)
045379476.b3lyp_6-31g(d).inp

045379476.b3lyp_6-31g(d).qchem.inp (generated)

045379476.b3lyp_6-31g(d).gjf (generated)

045379476.b3lyp_6-31g(d).firefly.inp (generated)

045379476.b3lyp_6-31g(d).smash.inp (generated)

045379476.b3lyp_6-31g(d).nwchem.inp (generated) 045379476.b3lyp_6-31g(d).log.xz 045379476.td-b3lyp_6-31g+(d).inp 045379476.td-b3lyp_6-31g+(d).log.xz

045379476.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379476.td-b3lyp_6-31+g(d).gjf (generated)

045379476.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379476.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379476.mol 045379476.PUBCHEM 045379476.mol (via Jmol)
045379481.b3lyp_6-31g(d).inp

045379481.b3lyp_6-31g(d).qchem.inp (generated)

045379481.b3lyp_6-31g(d).gjf (generated)

045379481.b3lyp_6-31g(d).firefly.inp (generated)

045379481.b3lyp_6-31g(d).smash.inp (generated)

045379481.b3lyp_6-31g(d).nwchem.inp (generated) 045379481.b3lyp_6-31g(d).log.xz 045379481.td-b3lyp_6-31g+(d).inp 045379481.td-b3lyp_6-31g+(d).log.xz

045379481.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379481.td-b3lyp_6-31+g(d).gjf (generated)

045379481.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379481.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379481.mol 045379481.PUBCHEM 045379481.mol (via Jmol)
045379482.b3lyp_6-31g(d).inp

045379482.b3lyp_6-31g(d).qchem.inp (generated)

045379482.b3lyp_6-31g(d).gjf (generated)

045379482.b3lyp_6-31g(d).firefly.inp (generated)

045379482.b3lyp_6-31g(d).smash.inp (generated)

045379482.b3lyp_6-31g(d).nwchem.inp (generated) 045379482.b3lyp_6-31g(d).log.xz 045379482.td-b3lyp_6-31g+(d).inp 045379482.td-b3lyp_6-31g+(d).log.xz

045379482.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379482.td-b3lyp_6-31+g(d).gjf (generated)

045379482.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379482.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379482.mol 045379482.PUBCHEM 045379482.mol (via Jmol)
045379498.b3lyp_6-31g(d).inp

045379498.b3lyp_6-31g(d).qchem.inp (generated)

045379498.b3lyp_6-31g(d).gjf (generated)

045379498.b3lyp_6-31g(d).firefly.inp (generated)

045379498.b3lyp_6-31g(d).smash.inp (generated)

045379498.b3lyp_6-31g(d).nwchem.inp (generated) 045379498.b3lyp_6-31g(d).log.xz 045379498.td-b3lyp_6-31g+(d).inp 045379498.td-b3lyp_6-31g+(d).log.xz

045379498.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379498.td-b3lyp_6-31+g(d).gjf (generated)

045379498.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379498.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379498.mol 045379498.PUBCHEM 045379498.mol (via Jmol)
045379591.b3lyp_6-31g(d).inp

045379591.b3lyp_6-31g(d).qchem.inp (generated)

045379591.b3lyp_6-31g(d).gjf (generated)

045379591.b3lyp_6-31g(d).firefly.inp (generated)

045379591.b3lyp_6-31g(d).smash.inp (generated)

045379591.b3lyp_6-31g(d).nwchem.inp (generated) 045379591.b3lyp_6-31g(d).log.xz 045379591.td-b3lyp_6-31g+(d).inp 045379591.td-b3lyp_6-31g+(d).log.xz

045379591.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379591.td-b3lyp_6-31+g(d).gjf (generated)

045379591.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379591.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379591.mol 045379591.PUBCHEM 045379591.mol (via Jmol)
045379594.b3lyp_6-31g(d).inp

045379594.b3lyp_6-31g(d).qchem.inp (generated)

045379594.b3lyp_6-31g(d).gjf (generated)

045379594.b3lyp_6-31g(d).firefly.inp (generated)

045379594.b3lyp_6-31g(d).smash.inp (generated)

045379594.b3lyp_6-31g(d).nwchem.inp (generated) 045379594.b3lyp_6-31g(d).log.xz 045379594.td-b3lyp_6-31g+(d).inp 045379594.td-b3lyp_6-31g+(d).log.xz

045379594.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379594.td-b3lyp_6-31+g(d).gjf (generated)

045379594.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379594.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379594.mol 045379594.PUBCHEM 045379594.mol (via Jmol)
045379595.b3lyp_6-31g(d).inp

045379595.b3lyp_6-31g(d).qchem.inp (generated)

045379595.b3lyp_6-31g(d).gjf (generated)

045379595.b3lyp_6-31g(d).firefly.inp (generated)

045379595.b3lyp_6-31g(d).smash.inp (generated)

045379595.b3lyp_6-31g(d).nwchem.inp (generated) 045379595.b3lyp_6-31g(d).log.xz 045379595.td-b3lyp_6-31g+(d).inp 045379595.td-b3lyp_6-31g+(d).log.xz

045379595.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379595.td-b3lyp_6-31+g(d).gjf (generated)

045379595.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379595.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379595.mol 045379595.PUBCHEM 045379595.mol (via Jmol)
045379747.b3lyp_6-31g(d).inp

045379747.b3lyp_6-31g(d).qchem.inp (generated)

045379747.b3lyp_6-31g(d).gjf (generated)

045379747.b3lyp_6-31g(d).firefly.inp (generated)

045379747.b3lyp_6-31g(d).smash.inp (generated)

045379747.b3lyp_6-31g(d).nwchem.inp (generated) 045379747.b3lyp_6-31g(d).log.xz 045379747.mol 045379747.PUBCHEM 045379747.mol (via Jmol)
045379748.b3lyp_6-31g(d).inp

045379748.b3lyp_6-31g(d).qchem.inp (generated)

045379748.b3lyp_6-31g(d).gjf (generated)

045379748.b3lyp_6-31g(d).firefly.inp (generated)

045379748.b3lyp_6-31g(d).smash.inp (generated)

045379748.b3lyp_6-31g(d).nwchem.inp (generated) 045379748.b3lyp_6-31g(d).log.xz 045379748.mol 045379748.PUBCHEM 045379748.mol (via Jmol)
045379848.b3lyp_6-31g(d).inp

045379848.b3lyp_6-31g(d).qchem.inp (generated)

045379848.b3lyp_6-31g(d).gjf (generated)

045379848.b3lyp_6-31g(d).firefly.inp (generated)

045379848.b3lyp_6-31g(d).smash.inp (generated)

045379848.b3lyp_6-31g(d).nwchem.inp (generated) 045379848.b3lyp_6-31g(d).log.xz 045379848.td-b3lyp_6-31g+(d).inp 045379848.td-b3lyp_6-31g+(d).log.xz

045379848.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379848.td-b3lyp_6-31+g(d).gjf (generated)

045379848.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379848.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379848.mol 045379848.PUBCHEM 045379848.mol (via Jmol)
045379849.b3lyp_6-31g(d).inp

045379849.b3lyp_6-31g(d).qchem.inp (generated)

045379849.b3lyp_6-31g(d).gjf (generated)

045379849.b3lyp_6-31g(d).firefly.inp (generated)

045379849.b3lyp_6-31g(d).smash.inp (generated)

045379849.b3lyp_6-31g(d).nwchem.inp (generated) 045379849.b3lyp_6-31g(d).log.xz 045379849.td-b3lyp_6-31g+(d).inp 045379849.td-b3lyp_6-31g+(d).log.xz

045379849.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379849.td-b3lyp_6-31+g(d).gjf (generated)

045379849.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379849.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379849.mol 045379849.PUBCHEM 045379849.mol (via Jmol)
045379851.b3lyp_6-31g(d).inp

045379851.b3lyp_6-31g(d).qchem.inp (generated)

045379851.b3lyp_6-31g(d).gjf (generated)

045379851.b3lyp_6-31g(d).firefly.inp (generated)

045379851.b3lyp_6-31g(d).smash.inp (generated)

045379851.b3lyp_6-31g(d).nwchem.inp (generated) 045379851.b3lyp_6-31g(d).log.xz 045379851.td-b3lyp_6-31g+(d).inp 045379851.td-b3lyp_6-31g+(d).log.xz

045379851.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379851.td-b3lyp_6-31+g(d).gjf (generated)

045379851.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379851.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379851.mol 045379851.PUBCHEM 045379851.mol (via Jmol)
045379857.b3lyp_6-31g(d).inp

045379857.b3lyp_6-31g(d).qchem.inp (generated)

045379857.b3lyp_6-31g(d).gjf (generated)

045379857.b3lyp_6-31g(d).firefly.inp (generated)

045379857.b3lyp_6-31g(d).smash.inp (generated)

045379857.b3lyp_6-31g(d).nwchem.inp (generated) 045379857.b3lyp_6-31g(d).log.xz 045379857.mol 045379857.PUBCHEM 045379857.mol (via Jmol)
045379869.b3lyp_6-31g(d).inp

045379869.b3lyp_6-31g(d).qchem.inp (generated)

045379869.b3lyp_6-31g(d).gjf (generated)

045379869.b3lyp_6-31g(d).firefly.inp (generated)

045379869.b3lyp_6-31g(d).smash.inp (generated)

045379869.b3lyp_6-31g(d).nwchem.inp (generated) 045379869.b3lyp_6-31g(d).log.xz 045379869.td-b3lyp_6-31g+(d).inp 045379869.td-b3lyp_6-31g+(d).log.xz

045379869.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379869.td-b3lyp_6-31+g(d).gjf (generated)

045379869.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379869.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379869.mol 045379869.PUBCHEM 045379869.mol (via Jmol)
045379887.b3lyp_6-31g(d).inp

045379887.b3lyp_6-31g(d).qchem.inp (generated)

045379887.b3lyp_6-31g(d).gjf (generated)

045379887.b3lyp_6-31g(d).firefly.inp (generated)

045379887.b3lyp_6-31g(d).smash.inp (generated)

045379887.b3lyp_6-31g(d).nwchem.inp (generated) 045379887.b3lyp_6-31g(d).log.xz 045379887.mol 045379887.PUBCHEM 045379887.mol (via Jmol)
045379990.b3lyp_6-31g(d).inp

045379990.b3lyp_6-31g(d).qchem.inp (generated)

045379990.b3lyp_6-31g(d).gjf (generated)

045379990.b3lyp_6-31g(d).firefly.inp (generated)

045379990.b3lyp_6-31g(d).smash.inp (generated)

045379990.b3lyp_6-31g(d).nwchem.inp (generated) 045379990.b3lyp_6-31g(d).log.xz 045379990.td-b3lyp_6-31g+(d).inp 045379990.td-b3lyp_6-31g+(d).log.xz

045379990.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379990.td-b3lyp_6-31+g(d).gjf (generated)

045379990.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379990.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379990.mol 045379990.PUBCHEM 045379990.mol (via Jmol)
045379993.b3lyp_6-31g(d).inp

045379993.b3lyp_6-31g(d).qchem.inp (generated)

045379993.b3lyp_6-31g(d).gjf (generated)

045379993.b3lyp_6-31g(d).firefly.inp (generated)

045379993.b3lyp_6-31g(d).smash.inp (generated)

045379993.b3lyp_6-31g(d).nwchem.inp (generated) 045379993.b3lyp_6-31g(d).log.xz 045379993.td-b3lyp_6-31g+(d).inp 045379993.td-b3lyp_6-31g+(d).log.xz

045379993.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379993.td-b3lyp_6-31+g(d).gjf (generated)

045379993.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379993.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379993.mol 045379993.PUBCHEM 045379993.mol (via Jmol)
045379998.b3lyp_6-31g(d).inp

045379998.b3lyp_6-31g(d).qchem.inp (generated)

045379998.b3lyp_6-31g(d).gjf (generated)

045379998.b3lyp_6-31g(d).firefly.inp (generated)

045379998.b3lyp_6-31g(d).smash.inp (generated)

045379998.b3lyp_6-31g(d).nwchem.inp (generated) 045379998.b3lyp_6-31g(d).log.xz 045379998.td-b3lyp_6-31g+(d).inp 045379998.td-b3lyp_6-31g+(d).log.xz

045379998.td-b3lyp_6-31+g(d).qchem.inp (generated)

045379998.td-b3lyp_6-31+g(d).gjf (generated)

045379998.td-b3lyp_6-31+g(d).firefly.inp (generated)

045379998.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045379998.mol 045379998.PUBCHEM 045379998.mol (via Jmol)
045380084.b3lyp_6-31g(d).inp

045380084.b3lyp_6-31g(d).qchem.inp (generated)

045380084.b3lyp_6-31g(d).gjf (generated)

045380084.b3lyp_6-31g(d).firefly.inp (generated)

045380084.b3lyp_6-31g(d).smash.inp (generated)

045380084.b3lyp_6-31g(d).nwchem.inp (generated) 045380084.b3lyp_6-31g(d).log.xz 045380084.td-b3lyp_6-31g+(d).inp 045380084.td-b3lyp_6-31g+(d).log.xz

045380084.td-b3lyp_6-31+g(d).qchem.inp (generated)

045380084.td-b3lyp_6-31+g(d).gjf (generated)

045380084.td-b3lyp_6-31+g(d).firefly.inp (generated)

045380084.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045380084.mol 045380084.PUBCHEM 045380084.mol (via Jmol)
045380116.b3lyp_6-31g(d).inp

045380116.b3lyp_6-31g(d).qchem.inp (generated)

045380116.b3lyp_6-31g(d).gjf (generated)

045380116.b3lyp_6-31g(d).firefly.inp (generated)

045380116.b3lyp_6-31g(d).smash.inp (generated)

045380116.b3lyp_6-31g(d).nwchem.inp (generated) 045380116.b3lyp_6-31g(d).log.xz 045380116.td-b3lyp_6-31g+(d).inp 045380116.td-b3lyp_6-31g+(d).log.xz

045380116.td-b3lyp_6-31+g(d).qchem.inp (generated)

045380116.td-b3lyp_6-31+g(d).gjf (generated)

045380116.td-b3lyp_6-31+g(d).firefly.inp (generated)

045380116.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045380116.mol 045380116.PUBCHEM 045380116.mol (via Jmol)
045380117.b3lyp_6-31g(d).inp

045380117.b3lyp_6-31g(d).qchem.inp (generated)

045380117.b3lyp_6-31g(d).gjf (generated)

045380117.b3lyp_6-31g(d).firefly.inp (generated)

045380117.b3lyp_6-31g(d).smash.inp (generated)

045380117.b3lyp_6-31g(d).nwchem.inp (generated) 045380117.b3lyp_6-31g(d).log.xz 045380117.td-b3lyp_6-31g+(d).inp 045380117.td-b3lyp_6-31g+(d).log.xz

045380117.td-b3lyp_6-31+g(d).qchem.inp (generated)

045380117.td-b3lyp_6-31+g(d).gjf (generated)

045380117.td-b3lyp_6-31+g(d).firefly.inp (generated)

045380117.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045380117.mol 045380117.PUBCHEM 045380117.mol (via Jmol)
045380155.b3lyp_6-31g(d).inp

045380155.b3lyp_6-31g(d).qchem.inp (generated)

045380155.b3lyp_6-31g(d).gjf (generated)

045380155.b3lyp_6-31g(d).firefly.inp (generated)

045380155.b3lyp_6-31g(d).smash.inp (generated)

045380155.b3lyp_6-31g(d).nwchem.inp (generated) 045380155.b3lyp_6-31g(d).log.xz 045380155.td-b3lyp_6-31g+(d).inp 045380155.td-b3lyp_6-31g+(d).log.xz

045380155.td-b3lyp_6-31+g(d).qchem.inp (generated)

045380155.td-b3lyp_6-31+g(d).gjf (generated)

045380155.td-b3lyp_6-31+g(d).firefly.inp (generated)

045380155.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045380155.mol 045380155.PUBCHEM 045380155.mol (via Jmol)
045380196.b3lyp_6-31g(d).inp

045380196.b3lyp_6-31g(d).qchem.inp (generated)

045380196.b3lyp_6-31g(d).gjf (generated)

045380196.b3lyp_6-31g(d).firefly.inp (generated)

045380196.b3lyp_6-31g(d).smash.inp (generated)

045380196.b3lyp_6-31g(d).nwchem.inp (generated) 045380196.b3lyp_6-31g(d).log.xz 045380196.td-b3lyp_6-31g+(d).inp 045380196.td-b3lyp_6-31g+(d).log.xz

045380196.td-b3lyp_6-31+g(d).qchem.inp (generated)

045380196.td-b3lyp_6-31+g(d).gjf (generated)

045380196.td-b3lyp_6-31+g(d).firefly.inp (generated)

045380196.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045380196.mol 045380196.PUBCHEM 045380196.mol (via Jmol)
045380205.b3lyp_6-31g(d).inp

045380205.b3lyp_6-31g(d).qchem.inp (generated)

045380205.b3lyp_6-31g(d).gjf (generated)

045380205.b3lyp_6-31g(d).firefly.inp (generated)

045380205.b3lyp_6-31g(d).smash.inp (generated)

045380205.b3lyp_6-31g(d).nwchem.inp (generated) 045380205.b3lyp_6-31g(d).log.xz 045380205.td-b3lyp_6-31g+(d).inp 045380205.td-b3lyp_6-31g+(d).log.xz

045380205.td-b3lyp_6-31+g(d).qchem.inp (generated)

045380205.td-b3lyp_6-31+g(d).gjf (generated)

045380205.td-b3lyp_6-31+g(d).firefly.inp (generated)

045380205.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045380205.mol 045380205.PUBCHEM 045380205.mol (via Jmol)
045380206.b3lyp_6-31g(d).inp

045380206.b3lyp_6-31g(d).qchem.inp (generated)

045380206.b3lyp_6-31g(d).gjf (generated)

045380206.b3lyp_6-31g(d).firefly.inp (generated)

045380206.b3lyp_6-31g(d).smash.inp (generated)

045380206.b3lyp_6-31g(d).nwchem.inp (generated) 045380206.b3lyp_6-31g(d).log.xz 045380206.td-b3lyp_6-31g+(d).inp 045380206.td-b3lyp_6-31g+(d).log.xz

045380206.td-b3lyp_6-31+g(d).qchem.inp (generated)

045380206.td-b3lyp_6-31+g(d).gjf (generated)

045380206.td-b3lyp_6-31+g(d).firefly.inp (generated)

045380206.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045380206.mol 045380206.PUBCHEM 045380206.mol (via Jmol)
045380236.b3lyp_6-31g(d).inp

045380236.b3lyp_6-31g(d).qchem.inp (generated)

045380236.b3lyp_6-31g(d).gjf (generated)

045380236.b3lyp_6-31g(d).firefly.inp (generated)

045380236.b3lyp_6-31g(d).smash.inp (generated)

045380236.b3lyp_6-31g(d).nwchem.inp (generated) 045380236.b3lyp_6-31g(d).log.xz 045380236.mol 045380236.PUBCHEM 045380236.mol (via Jmol)
045380239.b3lyp_6-31g(d).inp

045380239.b3lyp_6-31g(d).qchem.inp (generated)

045380239.b3lyp_6-31g(d).gjf (generated)

045380239.b3lyp_6-31g(d).firefly.inp (generated)

045380239.b3lyp_6-31g(d).smash.inp (generated)

045380239.b3lyp_6-31g(d).nwchem.inp (generated) 045380239.b3lyp_6-31g(d).log.xz 045380239.td-b3lyp_6-31g+(d).inp 045380239.td-b3lyp_6-31g+(d).log.xz

045380239.td-b3lyp_6-31+g(d).qchem.inp (generated)

045380239.td-b3lyp_6-31+g(d).gjf (generated)

045380239.td-b3lyp_6-31+g(d).firefly.inp (generated)

045380239.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045380239.mol 045380239.PUBCHEM 045380239.mol (via Jmol)
045380263.b3lyp_6-31g(d).inp

045380263.b3lyp_6-31g(d).qchem.inp (generated)

045380263.b3lyp_6-31g(d).gjf (generated)

045380263.b3lyp_6-31g(d).firefly.inp (generated)

045380263.b3lyp_6-31g(d).smash.inp (generated)

045380263.b3lyp_6-31g(d).nwchem.inp (generated) 045380263.b3lyp_6-31g(d).log.xz 045380263.td-b3lyp_6-31g+(d).inp 045380263.td-b3lyp_6-31g+(d).log.xz

045380263.td-b3lyp_6-31+g(d).qchem.inp (generated)

045380263.td-b3lyp_6-31+g(d).gjf (generated)

045380263.td-b3lyp_6-31+g(d).firefly.inp (generated)

045380263.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045380263.mol 045380263.PUBCHEM 045380263.mol (via Jmol)
045380264.b3lyp_6-31g(d).inp

045380264.b3lyp_6-31g(d).qchem.inp (generated)

045380264.b3lyp_6-31g(d).gjf (generated)

045380264.b3lyp_6-31g(d).firefly.inp (generated)

045380264.b3lyp_6-31g(d).smash.inp (generated)

045380264.b3lyp_6-31g(d).nwchem.inp (generated) 045380264.b3lyp_6-31g(d).log.xz 045380264.td-b3lyp_6-31g+(d).inp 045380264.td-b3lyp_6-31g+(d).log.xz

045380264.td-b3lyp_6-31+g(d).qchem.inp (generated)

045380264.td-b3lyp_6-31+g(d).gjf (generated)

045380264.td-b3lyp_6-31+g(d).firefly.inp (generated)

045380264.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045380264.mol 045380264.PUBCHEM 045380264.mol (via Jmol)
045380265.b3lyp_6-31g(d).inp

045380265.b3lyp_6-31g(d).qchem.inp (generated)

045380265.b3lyp_6-31g(d).gjf (generated)

045380265.b3lyp_6-31g(d).firefly.inp (generated)

045380265.b3lyp_6-31g(d).smash.inp (generated)

045380265.b3lyp_6-31g(d).nwchem.inp (generated) 045380265.b3lyp_6-31g(d).log.xz 045380265.td-b3lyp_6-31g+(d).inp 045380265.td-b3lyp_6-31g+(d).log.xz

045380265.td-b3lyp_6-31+g(d).qchem.inp (generated)

045380265.td-b3lyp_6-31+g(d).gjf (generated)

045380265.td-b3lyp_6-31+g(d).firefly.inp (generated)

045380265.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045380265.mol 045380265.PUBCHEM 045380265.mol (via Jmol)
045380268.b3lyp_6-31g(d).inp

045380268.b3lyp_6-31g(d).qchem.inp (generated)

045380268.b3lyp_6-31g(d).gjf (generated)

045380268.b3lyp_6-31g(d).firefly.inp (generated)

045380268.b3lyp_6-31g(d).smash.inp (generated)

045380268.b3lyp_6-31g(d).nwchem.inp (generated) 045380268.b3lyp_6-31g(d).log.xz 045380268.td-b3lyp_6-31g+(d).inp 045380268.td-b3lyp_6-31g+(d).log.xz

045380268.td-b3lyp_6-31+g(d).qchem.inp (generated)

045380268.td-b3lyp_6-31+g(d).gjf (generated)

045380268.td-b3lyp_6-31+g(d).firefly.inp (generated)

045380268.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045380268.mol 045380268.PUBCHEM 045380268.mol (via Jmol)
045380269.b3lyp_6-31g(d).inp

045380269.b3lyp_6-31g(d).qchem.inp (generated)

045380269.b3lyp_6-31g(d).gjf (generated)

045380269.b3lyp_6-31g(d).firefly.inp (generated)

045380269.b3lyp_6-31g(d).smash.inp (generated)

045380269.b3lyp_6-31g(d).nwchem.inp (generated) 045380269.b3lyp_6-31g(d).log.xz 045380269.td-b3lyp_6-31g+(d).inp 045380269.td-b3lyp_6-31g+(d).log.xz

045380269.td-b3lyp_6-31+g(d).qchem.inp (generated)

045380269.td-b3lyp_6-31+g(d).gjf (generated)

045380269.td-b3lyp_6-31+g(d).firefly.inp (generated)

045380269.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045380269.mol 045380269.PUBCHEM 045380269.mol (via Jmol)
045380271.b3lyp_6-31g(d).inp

045380271.b3lyp_6-31g(d).qchem.inp (generated)

045380271.b3lyp_6-31g(d).gjf (generated)

045380271.b3lyp_6-31g(d).firefly.inp (generated)

045380271.b3lyp_6-31g(d).smash.inp (generated)

045380271.b3lyp_6-31g(d).nwchem.inp (generated) 045380271.b3lyp_6-31g(d).log.xz 045380271.td-b3lyp_6-31g+(d).inp 045380271.td-b3lyp_6-31g+(d).log.xz

045380271.td-b3lyp_6-31+g(d).qchem.inp (generated)

045380271.td-b3lyp_6-31+g(d).gjf (generated)

045380271.td-b3lyp_6-31+g(d).firefly.inp (generated)

045380271.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045380271.mol 045380271.PUBCHEM 045380271.mol (via Jmol)
045380272.b3lyp_6-31g(d).inp

045380272.b3lyp_6-31g(d).qchem.inp (generated)

045380272.b3lyp_6-31g(d).gjf (generated)

045380272.b3lyp_6-31g(d).firefly.inp (generated)

045380272.b3lyp_6-31g(d).smash.inp (generated)

045380272.b3lyp_6-31g(d).nwchem.inp (generated) 045380272.b3lyp_6-31g(d).log.xz 045380272.td-b3lyp_6-31g+(d).inp 045380272.td-b3lyp_6-31g+(d).log.xz

045380272.td-b3lyp_6-31+g(d).qchem.inp (generated)

045380272.td-b3lyp_6-31+g(d).gjf (generated)

045380272.td-b3lyp_6-31+g(d).firefly.inp (generated)

045380272.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045380272.mol 045380272.PUBCHEM 045380272.mol (via Jmol)
045380274.b3lyp_6-31g(d).inp

045380274.b3lyp_6-31g(d).qchem.inp (generated)

045380274.b3lyp_6-31g(d).gjf (generated)

045380274.b3lyp_6-31g(d).firefly.inp (generated)

045380274.b3lyp_6-31g(d).smash.inp (generated)

045380274.b3lyp_6-31g(d).nwchem.inp (generated) 045380274.b3lyp_6-31g(d).log.xz 045380274.td-b3lyp_6-31g+(d).inp 045380274.td-b3lyp_6-31g+(d).log.xz

045380274.td-b3lyp_6-31+g(d).qchem.inp (generated)

045380274.td-b3lyp_6-31+g(d).gjf (generated)

045380274.td-b3lyp_6-31+g(d).firefly.inp (generated)

045380274.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045380274.mol 045380274.PUBCHEM 045380274.mol (via Jmol)
045380284.b3lyp_6-31g(d).inp

045380284.b3lyp_6-31g(d).qchem.inp (generated)

045380284.b3lyp_6-31g(d).gjf (generated)

045380284.b3lyp_6-31g(d).firefly.inp (generated)

045380284.b3lyp_6-31g(d).smash.inp (generated)

045380284.b3lyp_6-31g(d).nwchem.inp (generated) 045380284.b3lyp_6-31g(d).log.xz 045380284.td-b3lyp_6-31g+(d).inp 045380284.td-b3lyp_6-31g+(d).log.xz

045380284.td-b3lyp_6-31+g(d).qchem.inp (generated)

045380284.td-b3lyp_6-31+g(d).gjf (generated)

045380284.td-b3lyp_6-31+g(d).firefly.inp (generated)

045380284.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045380284.mol 045380284.PUBCHEM 045380284.mol (via Jmol)
045380531.b3lyp_6-31g(d).inp

045380531.b3lyp_6-31g(d).qchem.inp (generated)

045380531.b3lyp_6-31g(d).gjf (generated)

045380531.b3lyp_6-31g(d).firefly.inp (generated)

045380531.b3lyp_6-31g(d).smash.inp (generated)

045380531.b3lyp_6-31g(d).nwchem.inp (generated) 045380531.b3lyp_6-31g(d).log.xz 045380531.mol 045380531.PUBCHEM 045380531.mol (via Jmol)
045380622.b3lyp_6-31g(d).inp

045380622.b3lyp_6-31g(d).qchem.inp (generated)

045380622.b3lyp_6-31g(d).gjf (generated)

045380622.b3lyp_6-31g(d).firefly.inp (generated)

045380622.b3lyp_6-31g(d).smash.inp (generated)

045380622.b3lyp_6-31g(d).nwchem.inp (generated) 045380622.b3lyp_6-31g(d).log.xz 045380622.td-b3lyp_6-31g+(d).inp 045380622.td-b3lyp_6-31g+(d).log.xz

045380622.td-b3lyp_6-31+g(d).qchem.inp (generated)

045380622.td-b3lyp_6-31+g(d).gjf (generated)

045380622.td-b3lyp_6-31+g(d).firefly.inp (generated)

045380622.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045380622.mol 045380622.PUBCHEM 045380622.mol (via Jmol)
045381065.b3lyp_6-31g(d).inp

045381065.b3lyp_6-31g(d).qchem.inp (generated)

045381065.b3lyp_6-31g(d).gjf (generated)

045381065.b3lyp_6-31g(d).firefly.inp (generated)

045381065.b3lyp_6-31g(d).smash.inp (generated)

045381065.b3lyp_6-31g(d).nwchem.inp (generated) 045381065.b3lyp_6-31g(d).log.xz 045381065.td-b3lyp_6-31g+(d).inp 045381065.td-b3lyp_6-31g+(d).log.xz

045381065.td-b3lyp_6-31+g(d).qchem.inp (generated)

045381065.td-b3lyp_6-31+g(d).gjf (generated)

045381065.td-b3lyp_6-31+g(d).firefly.inp (generated)

045381065.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045381065.mol 045381065.PUBCHEM 045381065.mol (via Jmol)
045381068.b3lyp_6-31g(d).inp

045381068.b3lyp_6-31g(d).qchem.inp (generated)

045381068.b3lyp_6-31g(d).gjf (generated)

045381068.b3lyp_6-31g(d).firefly.inp (generated)

045381068.b3lyp_6-31g(d).smash.inp (generated)

045381068.b3lyp_6-31g(d).nwchem.inp (generated) 045381068.b3lyp_6-31g(d).log.xz 045381068.td-b3lyp_6-31g+(d).inp 045381068.td-b3lyp_6-31g+(d).log.xz

045381068.td-b3lyp_6-31+g(d).qchem.inp (generated)

045381068.td-b3lyp_6-31+g(d).gjf (generated)

045381068.td-b3lyp_6-31+g(d).firefly.inp (generated)

045381068.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045381068.mol 045381068.PUBCHEM 045381068.mol (via Jmol)
045381070.b3lyp_6-31g(d).inp

045381070.b3lyp_6-31g(d).qchem.inp (generated)

045381070.b3lyp_6-31g(d).gjf (generated)

045381070.b3lyp_6-31g(d).firefly.inp (generated)

045381070.b3lyp_6-31g(d).smash.inp (generated)

045381070.b3lyp_6-31g(d).nwchem.inp (generated) 045381070.b3lyp_6-31g(d).log.xz 045381070.td-b3lyp_6-31g+(d).inp 045381070.td-b3lyp_6-31g+(d).log.xz

045381070.td-b3lyp_6-31+g(d).qchem.inp (generated)

045381070.td-b3lyp_6-31+g(d).gjf (generated)

045381070.td-b3lyp_6-31+g(d).firefly.inp (generated)

045381070.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045381070.mol 045381070.PUBCHEM 045381070.mol (via Jmol)
045381170.b3lyp_6-31g(d).inp

045381170.b3lyp_6-31g(d).qchem.inp (generated)

045381170.b3lyp_6-31g(d).gjf (generated)

045381170.b3lyp_6-31g(d).firefly.inp (generated)

045381170.b3lyp_6-31g(d).smash.inp (generated)

045381170.b3lyp_6-31g(d).nwchem.inp (generated) 045381170.b3lyp_6-31g(d).log.xz 045381170.td-b3lyp_6-31g+(d).inp 045381170.td-b3lyp_6-31g+(d).log.xz

045381170.td-b3lyp_6-31+g(d).qchem.inp (generated)

045381170.td-b3lyp_6-31+g(d).gjf (generated)

045381170.td-b3lyp_6-31+g(d).firefly.inp (generated)

045381170.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045381170.mol 045381170.PUBCHEM 045381170.mol (via Jmol)
045381173.b3lyp_6-31g(d).inp

045381173.b3lyp_6-31g(d).qchem.inp (generated)

045381173.b3lyp_6-31g(d).gjf (generated)

045381173.b3lyp_6-31g(d).firefly.inp (generated)

045381173.b3lyp_6-31g(d).smash.inp (generated)

045381173.b3lyp_6-31g(d).nwchem.inp (generated) 045381173.b3lyp_6-31g(d).log.xz 045381173.td-b3lyp_6-31g+(d).inp 045381173.td-b3lyp_6-31g+(d).log.xz

045381173.td-b3lyp_6-31+g(d).qchem.inp (generated)

045381173.td-b3lyp_6-31+g(d).gjf (generated)

045381173.td-b3lyp_6-31+g(d).firefly.inp (generated)

045381173.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045381173.mol 045381173.PUBCHEM 045381173.mol (via Jmol)
045381176.b3lyp_6-31g(d).inp

045381176.b3lyp_6-31g(d).qchem.inp (generated)

045381176.b3lyp_6-31g(d).gjf (generated)

045381176.b3lyp_6-31g(d).firefly.inp (generated)

045381176.b3lyp_6-31g(d).smash.inp (generated)

045381176.b3lyp_6-31g(d).nwchem.inp (generated) 045381176.b3lyp_6-31g(d).log.xz 045381176.td-b3lyp_6-31g+(d).inp 045381176.td-b3lyp_6-31g+(d).log.xz

045381176.td-b3lyp_6-31+g(d).qchem.inp (generated)

045381176.td-b3lyp_6-31+g(d).gjf (generated)

045381176.td-b3lyp_6-31+g(d).firefly.inp (generated)

045381176.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045381176.mol 045381176.PUBCHEM 045381176.mol (via Jmol)
045381177.b3lyp_6-31g(d).inp

045381177.b3lyp_6-31g(d).qchem.inp (generated)

045381177.b3lyp_6-31g(d).gjf (generated)

045381177.b3lyp_6-31g(d).firefly.inp (generated)

045381177.b3lyp_6-31g(d).smash.inp (generated)

045381177.b3lyp_6-31g(d).nwchem.inp (generated) 045381177.b3lyp_6-31g(d).log.xz 045381177.td-b3lyp_6-31g+(d).inp 045381177.td-b3lyp_6-31g+(d).log.xz

045381177.td-b3lyp_6-31+g(d).qchem.inp (generated)

045381177.td-b3lyp_6-31+g(d).gjf (generated)

045381177.td-b3lyp_6-31+g(d).firefly.inp (generated)

045381177.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045381177.mol 045381177.PUBCHEM 045381177.mol (via Jmol)
045381178.b3lyp_6-31g(d).inp

045381178.b3lyp_6-31g(d).qchem.inp (generated)

045381178.b3lyp_6-31g(d).gjf (generated)

045381178.b3lyp_6-31g(d).firefly.inp (generated)

045381178.b3lyp_6-31g(d).smash.inp (generated)

045381178.b3lyp_6-31g(d).nwchem.inp (generated) 045381178.b3lyp_6-31g(d).log.xz 045381178.td-b3lyp_6-31g+(d).inp 045381178.td-b3lyp_6-31g+(d).log.xz

045381178.td-b3lyp_6-31+g(d).qchem.inp (generated)

045381178.td-b3lyp_6-31+g(d).gjf (generated)

045381178.td-b3lyp_6-31+g(d).firefly.inp (generated)

045381178.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045381178.mol 045381178.PUBCHEM 045381178.mol (via Jmol)
045381179.b3lyp_6-31g(d).inp

045381179.b3lyp_6-31g(d).qchem.inp (generated)

045381179.b3lyp_6-31g(d).gjf (generated)

045381179.b3lyp_6-31g(d).firefly.inp (generated)

045381179.b3lyp_6-31g(d).smash.inp (generated)

045381179.b3lyp_6-31g(d).nwchem.inp (generated) 045381179.b3lyp_6-31g(d).log.xz 045381179.td-b3lyp_6-31g+(d).inp 045381179.td-b3lyp_6-31g+(d).log.xz

045381179.td-b3lyp_6-31+g(d).qchem.inp (generated)

045381179.td-b3lyp_6-31+g(d).gjf (generated)

045381179.td-b3lyp_6-31+g(d).firefly.inp (generated)

045381179.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045381179.mol 045381179.PUBCHEM 045381179.mol (via Jmol)
045381180.b3lyp_6-31g(d).inp

045381180.b3lyp_6-31g(d).qchem.inp (generated)

045381180.b3lyp_6-31g(d).gjf (generated)

045381180.b3lyp_6-31g(d).firefly.inp (generated)

045381180.b3lyp_6-31g(d).smash.inp (generated)

045381180.b3lyp_6-31g(d).nwchem.inp (generated) 045381180.b3lyp_6-31g(d).log.xz 045381180.td-b3lyp_6-31g+(d).inp 045381180.td-b3lyp_6-31g+(d).log.xz

045381180.td-b3lyp_6-31+g(d).qchem.inp (generated)

045381180.td-b3lyp_6-31+g(d).gjf (generated)

045381180.td-b3lyp_6-31+g(d).firefly.inp (generated)

045381180.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045381180.mol 045381180.PUBCHEM 045381180.mol (via Jmol)
045381421.b3lyp_6-31g(d).inp

045381421.b3lyp_6-31g(d).qchem.inp (generated)

045381421.b3lyp_6-31g(d).gjf (generated)

045381421.b3lyp_6-31g(d).firefly.inp (generated)

045381421.b3lyp_6-31g(d).smash.inp (generated)

045381421.b3lyp_6-31g(d).nwchem.inp (generated) 045381421.b3lyp_6-31g(d).log.xz 045381421.td-b3lyp_6-31g+(d).inp 045381421.td-b3lyp_6-31g+(d).log.xz

045381421.td-b3lyp_6-31+g(d).qchem.inp (generated)

045381421.td-b3lyp_6-31+g(d).gjf (generated)

045381421.td-b3lyp_6-31+g(d).firefly.inp (generated)

045381421.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045381421.mol 045381421.PUBCHEM 045381421.mol (via Jmol)
045381423.b3lyp_6-31g(d).inp

045381423.b3lyp_6-31g(d).qchem.inp (generated)

045381423.b3lyp_6-31g(d).gjf (generated)

045381423.b3lyp_6-31g(d).firefly.inp (generated)

045381423.b3lyp_6-31g(d).smash.inp (generated)

045381423.b3lyp_6-31g(d).nwchem.inp (generated) 045381423.b3lyp_6-31g(d).log.xz 045381423.td-b3lyp_6-31g+(d).inp 045381423.td-b3lyp_6-31g+(d).log.xz

045381423.td-b3lyp_6-31+g(d).qchem.inp (generated)

045381423.td-b3lyp_6-31+g(d).gjf (generated)

045381423.td-b3lyp_6-31+g(d).firefly.inp (generated)

045381423.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045381423.mol 045381423.PUBCHEM 045381423.mol (via Jmol)
045381529.b3lyp_6-31g(d).inp

045381529.b3lyp_6-31g(d).qchem.inp (generated)

045381529.b3lyp_6-31g(d).gjf (generated)

045381529.b3lyp_6-31g(d).firefly.inp (generated)

045381529.b3lyp_6-31g(d).smash.inp (generated)

045381529.b3lyp_6-31g(d).nwchem.inp (generated) 045381529.b3lyp_6-31g(d).log.xz 045381529.td-b3lyp_6-31g+(d).inp 045381529.td-b3lyp_6-31g+(d).log.xz

045381529.td-b3lyp_6-31+g(d).qchem.inp (generated)

045381529.td-b3lyp_6-31+g(d).gjf (generated)

045381529.td-b3lyp_6-31+g(d).firefly.inp (generated)

045381529.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045381529.mol 045381529.PUBCHEM 045381529.mol (via Jmol)
045381618.b3lyp_6-31g(d).inp

045381618.b3lyp_6-31g(d).qchem.inp (generated)

045381618.b3lyp_6-31g(d).gjf (generated)

045381618.b3lyp_6-31g(d).firefly.inp (generated)

045381618.b3lyp_6-31g(d).smash.inp (generated)

045381618.b3lyp_6-31g(d).nwchem.inp (generated) 045381618.b3lyp_6-31g(d).log.xz 045381618.td-b3lyp_6-31g+(d).inp 045381618.td-b3lyp_6-31g+(d).log.xz

045381618.td-b3lyp_6-31+g(d).qchem.inp (generated)

045381618.td-b3lyp_6-31+g(d).gjf (generated)

045381618.td-b3lyp_6-31+g(d).firefly.inp (generated)

045381618.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045381618.mol 045381618.PUBCHEM 045381618.mol (via Jmol)
045381619.b3lyp_6-31g(d).inp

045381619.b3lyp_6-31g(d).qchem.inp (generated)

045381619.b3lyp_6-31g(d).gjf (generated)

045381619.b3lyp_6-31g(d).firefly.inp (generated)

045381619.b3lyp_6-31g(d).smash.inp (generated)

045381619.b3lyp_6-31g(d).nwchem.inp (generated) 045381619.b3lyp_6-31g(d).log.xz 045381619.mol 045381619.PUBCHEM 045381619.mol (via Jmol)
045381635.b3lyp_6-31g(d).inp

045381635.b3lyp_6-31g(d).qchem.inp (generated)

045381635.b3lyp_6-31g(d).gjf (generated)

045381635.b3lyp_6-31g(d).firefly.inp (generated)

045381635.b3lyp_6-31g(d).smash.inp (generated)

045381635.b3lyp_6-31g(d).nwchem.inp (generated) 045381635.b3lyp_6-31g(d).log.xz 045381635.td-b3lyp_6-31g+(d).inp 045381635.td-b3lyp_6-31g+(d).log.xz

045381635.td-b3lyp_6-31+g(d).qchem.inp (generated)

045381635.td-b3lyp_6-31+g(d).gjf (generated)

045381635.td-b3lyp_6-31+g(d).firefly.inp (generated)

045381635.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045381635.mol 045381635.PUBCHEM 045381635.mol (via Jmol)
045381636.b3lyp_6-31g(d).inp

045381636.b3lyp_6-31g(d).qchem.inp (generated)

045381636.b3lyp_6-31g(d).gjf (generated)

045381636.b3lyp_6-31g(d).firefly.inp (generated)

045381636.b3lyp_6-31g(d).smash.inp (generated)

045381636.b3lyp_6-31g(d).nwchem.inp (generated) 045381636.b3lyp_6-31g(d).log.xz 045381636.td-b3lyp_6-31g+(d).inp 045381636.td-b3lyp_6-31g+(d).log.xz

045381636.td-b3lyp_6-31+g(d).qchem.inp (generated)

045381636.td-b3lyp_6-31+g(d).gjf (generated)

045381636.td-b3lyp_6-31+g(d).firefly.inp (generated)

045381636.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045381636.mol 045381636.PUBCHEM 045381636.mol (via Jmol)
045381637.b3lyp_6-31g(d).inp

045381637.b3lyp_6-31g(d).qchem.inp (generated)

045381637.b3lyp_6-31g(d).gjf (generated)

045381637.b3lyp_6-31g(d).firefly.inp (generated)

045381637.b3lyp_6-31g(d).smash.inp (generated)

045381637.b3lyp_6-31g(d).nwchem.inp (generated) 045381637.b3lyp_6-31g(d).log.xz 045381637.td-b3lyp_6-31g+(d).inp 045381637.td-b3lyp_6-31g+(d).log.xz

045381637.td-b3lyp_6-31+g(d).qchem.inp (generated)

045381637.td-b3lyp_6-31+g(d).gjf (generated)

045381637.td-b3lyp_6-31+g(d).firefly.inp (generated)

045381637.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045381637.mol 045381637.PUBCHEM 045381637.mol (via Jmol)
045381699.b3lyp_6-31g(d).inp

045381699.b3lyp_6-31g(d).qchem.inp (generated)

045381699.b3lyp_6-31g(d).gjf (generated)

045381699.b3lyp_6-31g(d).firefly.inp (generated)

045381699.b3lyp_6-31g(d).smash.inp (generated)

045381699.b3lyp_6-31g(d).nwchem.inp (generated) 045381699.b3lyp_6-31g(d).log.xz 045381699.mol 045381699.PUBCHEM 045381699.mol (via Jmol)
045381700.b3lyp_6-31g(d).inp

045381700.b3lyp_6-31g(d).qchem.inp (generated)

045381700.b3lyp_6-31g(d).gjf (generated)

045381700.b3lyp_6-31g(d).firefly.inp (generated)

045381700.b3lyp_6-31g(d).smash.inp (generated)

045381700.b3lyp_6-31g(d).nwchem.inp (generated) 045381700.b3lyp_6-31g(d).log.xz 045381700.td-b3lyp_6-31g+(d).inp 045381700.td-b3lyp_6-31g+(d).log.xz

045381700.td-b3lyp_6-31+g(d).qchem.inp (generated)

045381700.td-b3lyp_6-31+g(d).gjf (generated)

045381700.td-b3lyp_6-31+g(d).firefly.inp (generated)

045381700.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045381700.mol 045381700.PUBCHEM 045381700.mol (via Jmol)
045381701.b3lyp_6-31g(d).inp

045381701.b3lyp_6-31g(d).qchem.inp (generated)

045381701.b3lyp_6-31g(d).gjf (generated)

045381701.b3lyp_6-31g(d).firefly.inp (generated)

045381701.b3lyp_6-31g(d).smash.inp (generated)

045381701.b3lyp_6-31g(d).nwchem.inp (generated) 045381701.b3lyp_6-31g(d).log.xz 045381701.mol 045381701.PUBCHEM 045381701.mol (via Jmol)
045381702.b3lyp_6-31g(d).inp

045381702.b3lyp_6-31g(d).qchem.inp (generated)

045381702.b3lyp_6-31g(d).gjf (generated)

045381702.b3lyp_6-31g(d).firefly.inp (generated)

045381702.b3lyp_6-31g(d).smash.inp (generated)

045381702.b3lyp_6-31g(d).nwchem.inp (generated) 045381702.b3lyp_6-31g(d).log.xz 045381702.td-b3lyp_6-31g+(d).inp 045381702.td-b3lyp_6-31g+(d).log.xz

045381702.td-b3lyp_6-31+g(d).qchem.inp (generated)

045381702.td-b3lyp_6-31+g(d).gjf (generated)

045381702.td-b3lyp_6-31+g(d).firefly.inp (generated)

045381702.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045381702.mol 045381702.PUBCHEM 045381702.mol (via Jmol)
045381759.b3lyp_6-31g(d).inp

045381759.b3lyp_6-31g(d).qchem.inp (generated)

045381759.b3lyp_6-31g(d).gjf (generated)

045381759.b3lyp_6-31g(d).firefly.inp (generated)

045381759.b3lyp_6-31g(d).smash.inp (generated)

045381759.b3lyp_6-31g(d).nwchem.inp (generated) 045381759.b3lyp_6-31g(d).log.xz 045381759.td-b3lyp_6-31g+(d).inp 045381759.td-b3lyp_6-31g+(d).log.xz

045381759.td-b3lyp_6-31+g(d).qchem.inp (generated)

045381759.td-b3lyp_6-31+g(d).gjf (generated)

045381759.td-b3lyp_6-31+g(d).firefly.inp (generated)

045381759.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045381759.mol 045381759.PUBCHEM 045381759.mol (via Jmol)
045381845.b3lyp_6-31g(d).inp

045381845.b3lyp_6-31g(d).qchem.inp (generated)

045381845.b3lyp_6-31g(d).gjf (generated)

045381845.b3lyp_6-31g(d).firefly.inp (generated)

045381845.b3lyp_6-31g(d).smash.inp (generated)

045381845.b3lyp_6-31g(d).nwchem.inp (generated) 045381845.b3lyp_6-31g(d).log.xz 045381845.td-b3lyp_6-31g+(d).inp 045381845.td-b3lyp_6-31g+(d).log.xz

045381845.td-b3lyp_6-31+g(d).qchem.inp (generated)

045381845.td-b3lyp_6-31+g(d).gjf (generated)

045381845.td-b3lyp_6-31+g(d).firefly.inp (generated)

045381845.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045381845.mol 045381845.PUBCHEM 045381845.mol (via Jmol)
045382013.b3lyp_6-31g(d).inp

045382013.b3lyp_6-31g(d).qchem.inp (generated)

045382013.b3lyp_6-31g(d).gjf (generated)

045382013.b3lyp_6-31g(d).firefly.inp (generated)

045382013.b3lyp_6-31g(d).smash.inp (generated)

045382013.b3lyp_6-31g(d).nwchem.inp (generated) 045382013.b3lyp_6-31g(d).log.xz 045382013.td-b3lyp_6-31g+(d).inp 045382013.td-b3lyp_6-31g+(d).log.xz

045382013.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382013.td-b3lyp_6-31+g(d).gjf (generated)

045382013.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382013.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382013.mol 045382013.PUBCHEM 045382013.mol (via Jmol)
045382014.b3lyp_6-31g(d).inp

045382014.b3lyp_6-31g(d).qchem.inp (generated)

045382014.b3lyp_6-31g(d).gjf (generated)

045382014.b3lyp_6-31g(d).firefly.inp (generated)

045382014.b3lyp_6-31g(d).smash.inp (generated)

045382014.b3lyp_6-31g(d).nwchem.inp (generated) 045382014.b3lyp_6-31g(d).log.xz 045382014.td-b3lyp_6-31g+(d).inp 045382014.td-b3lyp_6-31g+(d).log.xz

045382014.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382014.td-b3lyp_6-31+g(d).gjf (generated)

045382014.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382014.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382014.mol 045382014.PUBCHEM 045382014.mol (via Jmol)
045382056.b3lyp_6-31g(d).inp

045382056.b3lyp_6-31g(d).qchem.inp (generated)

045382056.b3lyp_6-31g(d).gjf (generated)

045382056.b3lyp_6-31g(d).firefly.inp (generated)

045382056.b3lyp_6-31g(d).smash.inp (generated)

045382056.b3lyp_6-31g(d).nwchem.inp (generated) 045382056.b3lyp_6-31g(d).log.xz 045382056.td-b3lyp_6-31g+(d).inp 045382056.td-b3lyp_6-31g+(d).log.xz

045382056.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382056.td-b3lyp_6-31+g(d).gjf (generated)

045382056.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382056.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382056.mol 045382056.PUBCHEM 045382056.mol (via Jmol)
045382075.b3lyp_6-31g(d).inp

045382075.b3lyp_6-31g(d).qchem.inp (generated)

045382075.b3lyp_6-31g(d).gjf (generated)

045382075.b3lyp_6-31g(d).firefly.inp (generated)

045382075.b3lyp_6-31g(d).smash.inp (generated)

045382075.b3lyp_6-31g(d).nwchem.inp (generated) 045382075.b3lyp_6-31g(d).log.xz 045382075.td-b3lyp_6-31g+(d).inp 045382075.td-b3lyp_6-31g+(d).log.xz

045382075.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382075.td-b3lyp_6-31+g(d).gjf (generated)

045382075.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382075.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382075.mol 045382075.PUBCHEM 045382075.mol (via Jmol)
045382077.b3lyp_6-31g(d).inp

045382077.b3lyp_6-31g(d).qchem.inp (generated)

045382077.b3lyp_6-31g(d).gjf (generated)

045382077.b3lyp_6-31g(d).firefly.inp (generated)

045382077.b3lyp_6-31g(d).smash.inp (generated)

045382077.b3lyp_6-31g(d).nwchem.inp (generated) 045382077.b3lyp_6-31g(d).log.xz 045382077.td-b3lyp_6-31g+(d).inp 045382077.td-b3lyp_6-31g+(d).log.xz

045382077.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382077.td-b3lyp_6-31+g(d).gjf (generated)

045382077.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382077.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382077.mol 045382077.PUBCHEM 045382077.mol (via Jmol)
045382082.b3lyp_6-31g(d).inp

045382082.b3lyp_6-31g(d).qchem.inp (generated)

045382082.b3lyp_6-31g(d).gjf (generated)

045382082.b3lyp_6-31g(d).firefly.inp (generated)

045382082.b3lyp_6-31g(d).smash.inp (generated)

045382082.b3lyp_6-31g(d).nwchem.inp (generated) 045382082.b3lyp_6-31g(d).log.xz 045382082.td-b3lyp_6-31g+(d).inp 045382082.td-b3lyp_6-31g+(d).log.xz

045382082.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382082.td-b3lyp_6-31+g(d).gjf (generated)

045382082.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382082.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382082.mol 045382082.PUBCHEM 045382082.mol (via Jmol)
045382083.b3lyp_6-31g(d).inp

045382083.b3lyp_6-31g(d).qchem.inp (generated)

045382083.b3lyp_6-31g(d).gjf (generated)

045382083.b3lyp_6-31g(d).firefly.inp (generated)

045382083.b3lyp_6-31g(d).smash.inp (generated)

045382083.b3lyp_6-31g(d).nwchem.inp (generated) 045382083.b3lyp_6-31g(d).log.xz 045382083.td-b3lyp_6-31g+(d).inp 045382083.td-b3lyp_6-31g+(d).log.xz

045382083.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382083.td-b3lyp_6-31+g(d).gjf (generated)

045382083.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382083.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382083.mol 045382083.PUBCHEM 045382083.mol (via Jmol)
045382084.b3lyp_6-31g(d).inp

045382084.b3lyp_6-31g(d).qchem.inp (generated)

045382084.b3lyp_6-31g(d).gjf (generated)

045382084.b3lyp_6-31g(d).firefly.inp (generated)

045382084.b3lyp_6-31g(d).smash.inp (generated)

045382084.b3lyp_6-31g(d).nwchem.inp (generated) 045382084.b3lyp_6-31g(d).log.xz 045382084.td-b3lyp_6-31g+(d).inp 045382084.td-b3lyp_6-31g+(d).log.xz

045382084.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382084.td-b3lyp_6-31+g(d).gjf (generated)

045382084.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382084.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382084.mol 045382084.PUBCHEM 045382084.mol (via Jmol)
045382086.b3lyp_6-31g(d).inp

045382086.b3lyp_6-31g(d).qchem.inp (generated)

045382086.b3lyp_6-31g(d).gjf (generated)

045382086.b3lyp_6-31g(d).firefly.inp (generated)

045382086.b3lyp_6-31g(d).smash.inp (generated)

045382086.b3lyp_6-31g(d).nwchem.inp (generated) 045382086.b3lyp_6-31g(d).log.xz 045382086.td-b3lyp_6-31g+(d).inp 045382086.td-b3lyp_6-31g+(d).log.xz

045382086.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382086.td-b3lyp_6-31+g(d).gjf (generated)

045382086.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382086.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382086.mol 045382086.PUBCHEM 045382086.mol (via Jmol)
045382091.b3lyp_6-31g(d).inp

045382091.b3lyp_6-31g(d).qchem.inp (generated)

045382091.b3lyp_6-31g(d).gjf (generated)

045382091.b3lyp_6-31g(d).firefly.inp (generated)

045382091.b3lyp_6-31g(d).smash.inp (generated)

045382091.b3lyp_6-31g(d).nwchem.inp (generated) 045382091.b3lyp_6-31g(d).log.xz 045382091.td-b3lyp_6-31g+(d).inp 045382091.td-b3lyp_6-31g+(d).log.xz

045382091.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382091.td-b3lyp_6-31+g(d).gjf (generated)

045382091.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382091.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382091.mol 045382091.PUBCHEM 045382091.mol (via Jmol)
045382092.b3lyp_6-31g(d).inp

045382092.b3lyp_6-31g(d).qchem.inp (generated)

045382092.b3lyp_6-31g(d).gjf (generated)

045382092.b3lyp_6-31g(d).firefly.inp (generated)

045382092.b3lyp_6-31g(d).smash.inp (generated)

045382092.b3lyp_6-31g(d).nwchem.inp (generated) 045382092.b3lyp_6-31g(d).log.xz 045382092.td-b3lyp_6-31g+(d).inp 045382092.td-b3lyp_6-31g+(d).log.xz

045382092.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382092.td-b3lyp_6-31+g(d).gjf (generated)

045382092.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382092.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382092.mol 045382092.PUBCHEM 045382092.mol (via Jmol)
045382093.b3lyp_6-31g(d).inp

045382093.b3lyp_6-31g(d).qchem.inp (generated)

045382093.b3lyp_6-31g(d).gjf (generated)

045382093.b3lyp_6-31g(d).firefly.inp (generated)

045382093.b3lyp_6-31g(d).smash.inp (generated)

045382093.b3lyp_6-31g(d).nwchem.inp (generated) 045382093.b3lyp_6-31g(d).log.xz 045382093.td-b3lyp_6-31g+(d).inp 045382093.td-b3lyp_6-31g+(d).log.xz

045382093.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382093.td-b3lyp_6-31+g(d).gjf (generated)

045382093.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382093.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382093.mol 045382093.PUBCHEM 045382093.mol (via Jmol)
045382094.b3lyp_6-31g(d).inp

045382094.b3lyp_6-31g(d).qchem.inp (generated)

045382094.b3lyp_6-31g(d).gjf (generated)

045382094.b3lyp_6-31g(d).firefly.inp (generated)

045382094.b3lyp_6-31g(d).smash.inp (generated)

045382094.b3lyp_6-31g(d).nwchem.inp (generated) 045382094.b3lyp_6-31g(d).log.xz 045382094.td-b3lyp_6-31g+(d).inp 045382094.td-b3lyp_6-31g+(d).log.xz

045382094.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382094.td-b3lyp_6-31+g(d).gjf (generated)

045382094.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382094.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382094.mol 045382094.PUBCHEM 045382094.mol (via Jmol)
045382095.b3lyp_6-31g(d).inp

045382095.b3lyp_6-31g(d).qchem.inp (generated)

045382095.b3lyp_6-31g(d).gjf (generated)

045382095.b3lyp_6-31g(d).firefly.inp (generated)

045382095.b3lyp_6-31g(d).smash.inp (generated)

045382095.b3lyp_6-31g(d).nwchem.inp (generated) 045382095.b3lyp_6-31g(d).log.xz 045382095.td-b3lyp_6-31g+(d).inp 045382095.td-b3lyp_6-31g+(d).log.xz

045382095.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382095.td-b3lyp_6-31+g(d).gjf (generated)

045382095.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382095.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382095.mol 045382095.PUBCHEM 045382095.mol (via Jmol)
045382096.b3lyp_6-31g(d).inp

045382096.b3lyp_6-31g(d).qchem.inp (generated)

045382096.b3lyp_6-31g(d).gjf (generated)

045382096.b3lyp_6-31g(d).firefly.inp (generated)

045382096.b3lyp_6-31g(d).smash.inp (generated)

045382096.b3lyp_6-31g(d).nwchem.inp (generated) 045382096.b3lyp_6-31g(d).log.xz 045382096.td-b3lyp_6-31g+(d).inp 045382096.td-b3lyp_6-31g+(d).log.xz

045382096.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382096.td-b3lyp_6-31+g(d).gjf (generated)

045382096.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382096.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382096.mol 045382096.PUBCHEM 045382096.mol (via Jmol)
045382124.b3lyp_6-31g(d).inp

045382124.b3lyp_6-31g(d).qchem.inp (generated)

045382124.b3lyp_6-31g(d).gjf (generated)

045382124.b3lyp_6-31g(d).firefly.inp (generated)

045382124.b3lyp_6-31g(d).smash.inp (generated)

045382124.b3lyp_6-31g(d).nwchem.inp (generated) 045382124.b3lyp_6-31g(d).log.xz 045382124.td-b3lyp_6-31g+(d).inp 045382124.td-b3lyp_6-31g+(d).log.xz

045382124.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382124.td-b3lyp_6-31+g(d).gjf (generated)

045382124.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382124.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382124.mol 045382124.PUBCHEM 045382124.mol (via Jmol)
045382125.b3lyp_6-31g(d).inp

045382125.b3lyp_6-31g(d).qchem.inp (generated)

045382125.b3lyp_6-31g(d).gjf (generated)

045382125.b3lyp_6-31g(d).firefly.inp (generated)

045382125.b3lyp_6-31g(d).smash.inp (generated)

045382125.b3lyp_6-31g(d).nwchem.inp (generated) 045382125.b3lyp_6-31g(d).log.xz 045382125.mol 045382125.PUBCHEM 045382125.mol (via Jmol)
045382127.b3lyp_6-31g(d).inp

045382127.b3lyp_6-31g(d).qchem.inp (generated)

045382127.b3lyp_6-31g(d).gjf (generated)

045382127.b3lyp_6-31g(d).firefly.inp (generated)

045382127.b3lyp_6-31g(d).smash.inp (generated)

045382127.b3lyp_6-31g(d).nwchem.inp (generated) 045382127.b3lyp_6-31g(d).log.xz 045382127.td-b3lyp_6-31g+(d).inp 045382127.td-b3lyp_6-31g+(d).log.xz

045382127.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382127.td-b3lyp_6-31+g(d).gjf (generated)

045382127.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382127.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382127.mol 045382127.PUBCHEM 045382127.mol (via Jmol)
045382133.b3lyp_6-31g(d).inp

045382133.b3lyp_6-31g(d).qchem.inp (generated)

045382133.b3lyp_6-31g(d).gjf (generated)

045382133.b3lyp_6-31g(d).firefly.inp (generated)

045382133.b3lyp_6-31g(d).smash.inp (generated)

045382133.b3lyp_6-31g(d).nwchem.inp (generated) 045382133.b3lyp_6-31g(d).log.xz 045382133.td-b3lyp_6-31g+(d).inp 045382133.td-b3lyp_6-31g+(d).log.xz

045382133.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382133.td-b3lyp_6-31+g(d).gjf (generated)

045382133.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382133.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382133.mol 045382133.PUBCHEM 045382133.mol (via Jmol)
045382135.b3lyp_6-31g(d).inp

045382135.b3lyp_6-31g(d).qchem.inp (generated)

045382135.b3lyp_6-31g(d).gjf (generated)

045382135.b3lyp_6-31g(d).firefly.inp (generated)

045382135.b3lyp_6-31g(d).smash.inp (generated)

045382135.b3lyp_6-31g(d).nwchem.inp (generated) 045382135.b3lyp_6-31g(d).log.xz 045382135.td-b3lyp_6-31g+(d).inp 045382135.td-b3lyp_6-31g+(d).log.xz

045382135.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382135.td-b3lyp_6-31+g(d).gjf (generated)

045382135.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382135.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382135.mol 045382135.PUBCHEM 045382135.mol (via Jmol)
045382138.b3lyp_6-31g(d).inp

045382138.b3lyp_6-31g(d).qchem.inp (generated)

045382138.b3lyp_6-31g(d).gjf (generated)

045382138.b3lyp_6-31g(d).firefly.inp (generated)

045382138.b3lyp_6-31g(d).smash.inp (generated)

045382138.b3lyp_6-31g(d).nwchem.inp (generated) 045382138.b3lyp_6-31g(d).log.xz 045382138.td-b3lyp_6-31g+(d).inp 045382138.td-b3lyp_6-31g+(d).log.xz

045382138.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382138.td-b3lyp_6-31+g(d).gjf (generated)

045382138.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382138.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382138.mol 045382138.PUBCHEM 045382138.mol (via Jmol)
045382143.b3lyp_6-31g(d).inp

045382143.b3lyp_6-31g(d).qchem.inp (generated)

045382143.b3lyp_6-31g(d).gjf (generated)

045382143.b3lyp_6-31g(d).firefly.inp (generated)

045382143.b3lyp_6-31g(d).smash.inp (generated)

045382143.b3lyp_6-31g(d).nwchem.inp (generated) 045382143.b3lyp_6-31g(d).log.xz 045382143.td-b3lyp_6-31g+(d).inp 045382143.td-b3lyp_6-31g+(d).log.xz

045382143.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382143.td-b3lyp_6-31+g(d).gjf (generated)

045382143.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382143.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382143.mol 045382143.PUBCHEM 045382143.mol (via Jmol)
045382144.b3lyp_6-31g(d).inp

045382144.b3lyp_6-31g(d).qchem.inp (generated)

045382144.b3lyp_6-31g(d).gjf (generated)

045382144.b3lyp_6-31g(d).firefly.inp (generated)

045382144.b3lyp_6-31g(d).smash.inp (generated)

045382144.b3lyp_6-31g(d).nwchem.inp (generated) 045382144.b3lyp_6-31g(d).log.xz 045382144.td-b3lyp_6-31g+(d).inp 045382144.td-b3lyp_6-31g+(d).log.xz

045382144.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382144.td-b3lyp_6-31+g(d).gjf (generated)

045382144.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382144.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382144.mol 045382144.PUBCHEM 045382144.mol (via Jmol)
045382147.b3lyp_6-31g(d).inp

045382147.b3lyp_6-31g(d).qchem.inp (generated)

045382147.b3lyp_6-31g(d).gjf (generated)

045382147.b3lyp_6-31g(d).firefly.inp (generated)

045382147.b3lyp_6-31g(d).smash.inp (generated)

045382147.b3lyp_6-31g(d).nwchem.inp (generated) 045382147.b3lyp_6-31g(d).log.xz 045382147.td-b3lyp_6-31g+(d).inp 045382147.td-b3lyp_6-31g+(d).log.xz

045382147.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382147.td-b3lyp_6-31+g(d).gjf (generated)

045382147.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382147.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382147.mol 045382147.PUBCHEM 045382147.mol (via Jmol)
045382149.b3lyp_6-31g(d).inp

045382149.b3lyp_6-31g(d).qchem.inp (generated)

045382149.b3lyp_6-31g(d).gjf (generated)

045382149.b3lyp_6-31g(d).firefly.inp (generated)

045382149.b3lyp_6-31g(d).smash.inp (generated)

045382149.b3lyp_6-31g(d).nwchem.inp (generated) 045382149.b3lyp_6-31g(d).log.xz 045382149.td-b3lyp_6-31g+(d).inp 045382149.td-b3lyp_6-31g+(d).log.xz

045382149.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382149.td-b3lyp_6-31+g(d).gjf (generated)

045382149.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382149.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382149.mol 045382149.PUBCHEM 045382149.mol (via Jmol)
045382151.b3lyp_6-31g(d).inp

045382151.b3lyp_6-31g(d).qchem.inp (generated)

045382151.b3lyp_6-31g(d).gjf (generated)

045382151.b3lyp_6-31g(d).firefly.inp (generated)

045382151.b3lyp_6-31g(d).smash.inp (generated)

045382151.b3lyp_6-31g(d).nwchem.inp (generated) 045382151.b3lyp_6-31g(d).log.xz 045382151.td-b3lyp_6-31g+(d).inp 045382151.td-b3lyp_6-31g+(d).log.xz

045382151.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382151.td-b3lyp_6-31+g(d).gjf (generated)

045382151.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382151.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382151.mol 045382151.PUBCHEM 045382151.mol (via Jmol)
045382157.b3lyp_6-31g(d).inp

045382157.b3lyp_6-31g(d).qchem.inp (generated)

045382157.b3lyp_6-31g(d).gjf (generated)

045382157.b3lyp_6-31g(d).firefly.inp (generated)

045382157.b3lyp_6-31g(d).smash.inp (generated)

045382157.b3lyp_6-31g(d).nwchem.inp (generated) 045382157.b3lyp_6-31g(d).log.xz 045382157.td-b3lyp_6-31g+(d).inp 045382157.td-b3lyp_6-31g+(d).log.xz

045382157.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382157.td-b3lyp_6-31+g(d).gjf (generated)

045382157.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382157.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382157.mol 045382157.PUBCHEM 045382157.mol (via Jmol)
045382158.b3lyp_6-31g(d).inp

045382158.b3lyp_6-31g(d).qchem.inp (generated)

045382158.b3lyp_6-31g(d).gjf (generated)

045382158.b3lyp_6-31g(d).firefly.inp (generated)

045382158.b3lyp_6-31g(d).smash.inp (generated)

045382158.b3lyp_6-31g(d).nwchem.inp (generated) 045382158.b3lyp_6-31g(d).log.xz 045382158.td-b3lyp_6-31g+(d).inp 045382158.td-b3lyp_6-31g+(d).log.xz

045382158.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382158.td-b3lyp_6-31+g(d).gjf (generated)

045382158.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382158.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382158.mol 045382158.PUBCHEM 045382158.mol (via Jmol)
045382159.b3lyp_6-31g(d).inp

045382159.b3lyp_6-31g(d).qchem.inp (generated)

045382159.b3lyp_6-31g(d).gjf (generated)

045382159.b3lyp_6-31g(d).firefly.inp (generated)

045382159.b3lyp_6-31g(d).smash.inp (generated)

045382159.b3lyp_6-31g(d).nwchem.inp (generated) 045382159.b3lyp_6-31g(d).log.xz 045382159.td-b3lyp_6-31g+(d).inp 045382159.td-b3lyp_6-31g+(d).log.xz

045382159.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382159.td-b3lyp_6-31+g(d).gjf (generated)

045382159.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382159.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382159.mol 045382159.PUBCHEM 045382159.mol (via Jmol)
045382160.b3lyp_6-31g(d).inp

045382160.b3lyp_6-31g(d).qchem.inp (generated)

045382160.b3lyp_6-31g(d).gjf (generated)

045382160.b3lyp_6-31g(d).firefly.inp (generated)

045382160.b3lyp_6-31g(d).smash.inp (generated)

045382160.b3lyp_6-31g(d).nwchem.inp (generated) 045382160.b3lyp_6-31g(d).log.xz 045382160.td-b3lyp_6-31g+(d).inp 045382160.td-b3lyp_6-31g+(d).log.xz

045382160.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382160.td-b3lyp_6-31+g(d).gjf (generated)

045382160.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382160.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382160.mol 045382160.PUBCHEM 045382160.mol (via Jmol)
045382167.b3lyp_6-31g(d).inp

045382167.b3lyp_6-31g(d).qchem.inp (generated)

045382167.b3lyp_6-31g(d).gjf (generated)

045382167.b3lyp_6-31g(d).firefly.inp (generated)

045382167.b3lyp_6-31g(d).smash.inp (generated)

045382167.b3lyp_6-31g(d).nwchem.inp (generated) 045382167.b3lyp_6-31g(d).log.xz 045382167.td-b3lyp_6-31g+(d).inp 045382167.td-b3lyp_6-31g+(d).log.xz

045382167.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382167.td-b3lyp_6-31+g(d).gjf (generated)

045382167.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382167.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382167.mol 045382167.PUBCHEM 045382167.mol (via Jmol)
045382178.b3lyp_6-31g(d).inp

045382178.b3lyp_6-31g(d).qchem.inp (generated)

045382178.b3lyp_6-31g(d).gjf (generated)

045382178.b3lyp_6-31g(d).firefly.inp (generated)

045382178.b3lyp_6-31g(d).smash.inp (generated)

045382178.b3lyp_6-31g(d).nwchem.inp (generated) 045382178.b3lyp_6-31g(d).log.xz 045382178.td-b3lyp_6-31g+(d).inp 045382178.td-b3lyp_6-31g+(d).log.xz

045382178.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382178.td-b3lyp_6-31+g(d).gjf (generated)

045382178.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382178.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382178.mol 045382178.PUBCHEM 045382178.mol (via Jmol)
045382196.b3lyp_6-31g(d).inp

045382196.b3lyp_6-31g(d).qchem.inp (generated)

045382196.b3lyp_6-31g(d).gjf (generated)

045382196.b3lyp_6-31g(d).firefly.inp (generated)

045382196.b3lyp_6-31g(d).smash.inp (generated)

045382196.b3lyp_6-31g(d).nwchem.inp (generated) 045382196.b3lyp_6-31g(d).log.xz 045382196.td-b3lyp_6-31g+(d).inp 045382196.td-b3lyp_6-31g+(d).log.xz

045382196.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382196.td-b3lyp_6-31+g(d).gjf (generated)

045382196.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382196.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382196.mol 045382196.PUBCHEM 045382196.mol (via Jmol)
045382197.b3lyp_6-31g(d).inp

045382197.b3lyp_6-31g(d).qchem.inp (generated)

045382197.b3lyp_6-31g(d).gjf (generated)

045382197.b3lyp_6-31g(d).firefly.inp (generated)

045382197.b3lyp_6-31g(d).smash.inp (generated)

045382197.b3lyp_6-31g(d).nwchem.inp (generated) 045382197.b3lyp_6-31g(d).log.xz 045382197.td-b3lyp_6-31g+(d).inp 045382197.td-b3lyp_6-31g+(d).log.xz

045382197.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382197.td-b3lyp_6-31+g(d).gjf (generated)

045382197.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382197.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382197.mol 045382197.PUBCHEM 045382197.mol (via Jmol)
045382198.b3lyp_6-31g(d).inp

045382198.b3lyp_6-31g(d).qchem.inp (generated)

045382198.b3lyp_6-31g(d).gjf (generated)

045382198.b3lyp_6-31g(d).firefly.inp (generated)

045382198.b3lyp_6-31g(d).smash.inp (generated)

045382198.b3lyp_6-31g(d).nwchem.inp (generated) 045382198.b3lyp_6-31g(d).log.xz 045382198.td-b3lyp_6-31g+(d).inp 045382198.td-b3lyp_6-31g+(d).log.xz

045382198.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382198.td-b3lyp_6-31+g(d).gjf (generated)

045382198.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382198.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382198.mol 045382198.PUBCHEM 045382198.mol (via Jmol)
045382199.b3lyp_6-31g(d).inp

045382199.b3lyp_6-31g(d).qchem.inp (generated)

045382199.b3lyp_6-31g(d).gjf (generated)

045382199.b3lyp_6-31g(d).firefly.inp (generated)

045382199.b3lyp_6-31g(d).smash.inp (generated)

045382199.b3lyp_6-31g(d).nwchem.inp (generated) 045382199.b3lyp_6-31g(d).log.xz 045382199.td-b3lyp_6-31g+(d).inp 045382199.td-b3lyp_6-31g+(d).log.xz

045382199.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382199.td-b3lyp_6-31+g(d).gjf (generated)

045382199.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382199.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382199.mol 045382199.PUBCHEM 045382199.mol (via Jmol)
045382202.b3lyp_6-31g(d).inp

045382202.b3lyp_6-31g(d).qchem.inp (generated)

045382202.b3lyp_6-31g(d).gjf (generated)

045382202.b3lyp_6-31g(d).firefly.inp (generated)

045382202.b3lyp_6-31g(d).smash.inp (generated)

045382202.b3lyp_6-31g(d).nwchem.inp (generated) 045382202.b3lyp_6-31g(d).log.xz 045382202.td-b3lyp_6-31g+(d).inp 045382202.td-b3lyp_6-31g+(d).log.xz

045382202.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382202.td-b3lyp_6-31+g(d).gjf (generated)

045382202.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382202.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382202.mol 045382202.PUBCHEM 045382202.mol (via Jmol)
045382204.b3lyp_6-31g(d).inp

045382204.b3lyp_6-31g(d).qchem.inp (generated)

045382204.b3lyp_6-31g(d).gjf (generated)

045382204.b3lyp_6-31g(d).firefly.inp (generated)

045382204.b3lyp_6-31g(d).smash.inp (generated)

045382204.b3lyp_6-31g(d).nwchem.inp (generated) 045382204.b3lyp_6-31g(d).log.xz 045382204.td-b3lyp_6-31g+(d).inp 045382204.td-b3lyp_6-31g+(d).log.xz

045382204.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382204.td-b3lyp_6-31+g(d).gjf (generated)

045382204.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382204.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382204.mol 045382204.PUBCHEM 045382204.mol (via Jmol)
045382219.b3lyp_6-31g(d).inp

045382219.b3lyp_6-31g(d).qchem.inp (generated)

045382219.b3lyp_6-31g(d).gjf (generated)

045382219.b3lyp_6-31g(d).firefly.inp (generated)

045382219.b3lyp_6-31g(d).smash.inp (generated)

045382219.b3lyp_6-31g(d).nwchem.inp (generated) 045382219.b3lyp_6-31g(d).log.xz 045382219.td-b3lyp_6-31g+(d).inp 045382219.td-b3lyp_6-31g+(d).log.xz

045382219.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382219.td-b3lyp_6-31+g(d).gjf (generated)

045382219.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382219.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382219.mol 045382219.PUBCHEM 045382219.mol (via Jmol)
045382220.b3lyp_6-31g(d).inp

045382220.b3lyp_6-31g(d).qchem.inp (generated)

045382220.b3lyp_6-31g(d).gjf (generated)

045382220.b3lyp_6-31g(d).firefly.inp (generated)

045382220.b3lyp_6-31g(d).smash.inp (generated)

045382220.b3lyp_6-31g(d).nwchem.inp (generated) 045382220.b3lyp_6-31g(d).log.xz 045382220.td-b3lyp_6-31g+(d).inp 045382220.td-b3lyp_6-31g+(d).log.xz

045382220.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382220.td-b3lyp_6-31+g(d).gjf (generated)

045382220.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382220.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382220.mol 045382220.PUBCHEM 045382220.mol (via Jmol)
045382222.b3lyp_6-31g(d).inp

045382222.b3lyp_6-31g(d).qchem.inp (generated)

045382222.b3lyp_6-31g(d).gjf (generated)

045382222.b3lyp_6-31g(d).firefly.inp (generated)

045382222.b3lyp_6-31g(d).smash.inp (generated)

045382222.b3lyp_6-31g(d).nwchem.inp (generated) 045382222.b3lyp_6-31g(d).log.xz 045382222.mol 045382222.PUBCHEM 045382222.mol (via Jmol)
045382225.b3lyp_6-31g(d).inp

045382225.b3lyp_6-31g(d).qchem.inp (generated)

045382225.b3lyp_6-31g(d).gjf (generated)

045382225.b3lyp_6-31g(d).firefly.inp (generated)

045382225.b3lyp_6-31g(d).smash.inp (generated)

045382225.b3lyp_6-31g(d).nwchem.inp (generated) 045382225.b3lyp_6-31g(d).log.xz 045382225.td-b3lyp_6-31g+(d).inp 045382225.td-b3lyp_6-31g+(d).log.xz

045382225.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382225.td-b3lyp_6-31+g(d).gjf (generated)

045382225.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382225.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382225.mol 045382225.PUBCHEM 045382225.mol (via Jmol)
045382246.b3lyp_6-31g(d).inp

045382246.b3lyp_6-31g(d).qchem.inp (generated)

045382246.b3lyp_6-31g(d).gjf (generated)

045382246.b3lyp_6-31g(d).firefly.inp (generated)

045382246.b3lyp_6-31g(d).smash.inp (generated)

045382246.b3lyp_6-31g(d).nwchem.inp (generated) 045382246.b3lyp_6-31g(d).log.xz 045382246.td-b3lyp_6-31g+(d).inp 045382246.td-b3lyp_6-31g+(d).log.xz

045382246.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382246.td-b3lyp_6-31+g(d).gjf (generated)

045382246.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382246.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382246.mol 045382246.PUBCHEM 045382246.mol (via Jmol)
045382247.b3lyp_6-31g(d).inp

045382247.b3lyp_6-31g(d).qchem.inp (generated)

045382247.b3lyp_6-31g(d).gjf (generated)

045382247.b3lyp_6-31g(d).firefly.inp (generated)

045382247.b3lyp_6-31g(d).smash.inp (generated)

045382247.b3lyp_6-31g(d).nwchem.inp (generated) 045382247.b3lyp_6-31g(d).log.xz 045382247.td-b3lyp_6-31g+(d).inp 045382247.td-b3lyp_6-31g+(d).log.xz

045382247.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382247.td-b3lyp_6-31+g(d).gjf (generated)

045382247.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382247.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382247.mol 045382247.PUBCHEM 045382247.mol (via Jmol)
045382254.b3lyp_6-31g(d).inp

045382254.b3lyp_6-31g(d).qchem.inp (generated)

045382254.b3lyp_6-31g(d).gjf (generated)

045382254.b3lyp_6-31g(d).firefly.inp (generated)

045382254.b3lyp_6-31g(d).smash.inp (generated)

045382254.b3lyp_6-31g(d).nwchem.inp (generated) 045382254.b3lyp_6-31g(d).log.xz 045382254.td-b3lyp_6-31g+(d).inp 045382254.td-b3lyp_6-31g+(d).log.xz

045382254.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382254.td-b3lyp_6-31+g(d).gjf (generated)

045382254.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382254.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382254.mol 045382254.PUBCHEM 045382254.mol (via Jmol)
045382262.b3lyp_6-31g(d).inp

045382262.b3lyp_6-31g(d).qchem.inp (generated)

045382262.b3lyp_6-31g(d).gjf (generated)

045382262.b3lyp_6-31g(d).firefly.inp (generated)

045382262.b3lyp_6-31g(d).smash.inp (generated)

045382262.b3lyp_6-31g(d).nwchem.inp (generated) 045382262.b3lyp_6-31g(d).log.xz 045382262.td-b3lyp_6-31g+(d).inp 045382262.td-b3lyp_6-31g+(d).log.xz

045382262.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382262.td-b3lyp_6-31+g(d).gjf (generated)

045382262.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382262.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382262.mol 045382262.PUBCHEM 045382262.mol (via Jmol)
045382263.b3lyp_6-31g(d).inp

045382263.b3lyp_6-31g(d).qchem.inp (generated)

045382263.b3lyp_6-31g(d).gjf (generated)

045382263.b3lyp_6-31g(d).firefly.inp (generated)

045382263.b3lyp_6-31g(d).smash.inp (generated)

045382263.b3lyp_6-31g(d).nwchem.inp (generated) 045382263.b3lyp_6-31g(d).log.xz 045382263.td-b3lyp_6-31g+(d).inp 045382263.td-b3lyp_6-31g+(d).log.xz

045382263.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382263.td-b3lyp_6-31+g(d).gjf (generated)

045382263.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382263.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382263.mol 045382263.PUBCHEM 045382263.mol (via Jmol)
045382264.b3lyp_6-31g(d).inp

045382264.b3lyp_6-31g(d).qchem.inp (generated)

045382264.b3lyp_6-31g(d).gjf (generated)

045382264.b3lyp_6-31g(d).firefly.inp (generated)

045382264.b3lyp_6-31g(d).smash.inp (generated)

045382264.b3lyp_6-31g(d).nwchem.inp (generated) 045382264.b3lyp_6-31g(d).log.xz 045382264.td-b3lyp_6-31g+(d).inp 045382264.td-b3lyp_6-31g+(d).log.xz

045382264.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382264.td-b3lyp_6-31+g(d).gjf (generated)

045382264.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382264.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382264.mol 045382264.PUBCHEM 045382264.mol (via Jmol)
045382302.b3lyp_6-31g(d).inp

045382302.b3lyp_6-31g(d).qchem.inp (generated)

045382302.b3lyp_6-31g(d).gjf (generated)

045382302.b3lyp_6-31g(d).firefly.inp (generated)

045382302.b3lyp_6-31g(d).smash.inp (generated)

045382302.b3lyp_6-31g(d).nwchem.inp (generated) 045382302.b3lyp_6-31g(d).log.xz 045382302.td-b3lyp_6-31g+(d).inp 045382302.td-b3lyp_6-31g+(d).log.xz

045382302.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382302.td-b3lyp_6-31+g(d).gjf (generated)

045382302.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382302.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382302.mol 045382302.PUBCHEM 045382302.mol (via Jmol)
045382303.b3lyp_6-31g(d).inp

045382303.b3lyp_6-31g(d).qchem.inp (generated)

045382303.b3lyp_6-31g(d).gjf (generated)

045382303.b3lyp_6-31g(d).firefly.inp (generated)

045382303.b3lyp_6-31g(d).smash.inp (generated)

045382303.b3lyp_6-31g(d).nwchem.inp (generated) 045382303.b3lyp_6-31g(d).log.xz 045382303.td-b3lyp_6-31g+(d).inp 045382303.td-b3lyp_6-31g+(d).log.xz

045382303.td-b3lyp_6-31+g(d).qchem.inp (generated)

045382303.td-b3lyp_6-31+g(d).gjf (generated)

045382303.td-b3lyp_6-31+g(d).firefly.inp (generated)

045382303.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045382303.mol 045382303.PUBCHEM 045382303.mol (via Jmol)
045383800.b3lyp_6-31g(d).inp

045383800.b3lyp_6-31g(d).qchem.inp (generated)

045383800.b3lyp_6-31g(d).gjf (generated)

045383800.b3lyp_6-31g(d).firefly.inp (generated)

045383800.b3lyp_6-31g(d).smash.inp (generated)

045383800.b3lyp_6-31g(d).nwchem.inp (generated) 045383800.b3lyp_6-31g(d).log.xz 045383800.td-b3lyp_6-31g+(d).inp 045383800.td-b3lyp_6-31g+(d).log.xz

045383800.td-b3lyp_6-31+g(d).qchem.inp (generated)

045383800.td-b3lyp_6-31+g(d).gjf (generated)

045383800.td-b3lyp_6-31+g(d).firefly.inp (generated)

045383800.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045383800.mol 045383800.PUBCHEM 045383800.mol (via Jmol)


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