Index of

Last updated : Thu Aug 17 01:52:36 JST 2017
Total : 134 (121) in this page
052500117.b3lyp_6-31g(d).inp

052500117.b3lyp_6-31g(d).qchem.inp (generated)

052500117.b3lyp_6-31g(d).gjf (generated)

052500117.b3lyp_6-31g(d).firefly.inp (generated)

052500117.b3lyp_6-31g(d).smash.inp (generated)

052500117.b3lyp_6-31g(d).nwchem.inp (generated) 052500117.b3lyp_6-31g(d).log.xz 052500117.td-b3lyp_6-31g+(d).inp 052500117.td-b3lyp_6-31g+(d).log.xz

052500117.td-b3lyp_6-31+g(d).qchem.inp (generated)

052500117.td-b3lyp_6-31+g(d).gjf (generated)

052500117.td-b3lyp_6-31+g(d).firefly.inp (generated)

052500117.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052500117.mol 052500117.PUBCHEM 052500117.mol (via Jmol)
052500118.b3lyp_6-31g(d).inp

052500118.b3lyp_6-31g(d).qchem.inp (generated)

052500118.b3lyp_6-31g(d).gjf (generated)

052500118.b3lyp_6-31g(d).firefly.inp (generated)

052500118.b3lyp_6-31g(d).smash.inp (generated)

052500118.b3lyp_6-31g(d).nwchem.inp (generated) 052500118.b3lyp_6-31g(d).log.xz 052500118.td-b3lyp_6-31g+(d).inp 052500118.td-b3lyp_6-31g+(d).log.xz

052500118.td-b3lyp_6-31+g(d).qchem.inp (generated)

052500118.td-b3lyp_6-31+g(d).gjf (generated)

052500118.td-b3lyp_6-31+g(d).firefly.inp (generated)

052500118.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052500118.mol 052500118.PUBCHEM 052500118.mol (via Jmol)
052500266.b3lyp_6-31g(d).inp

052500266.b3lyp_6-31g(d).qchem.inp (generated)

052500266.b3lyp_6-31g(d).gjf (generated)

052500266.b3lyp_6-31g(d).firefly.inp (generated)

052500266.b3lyp_6-31g(d).smash.inp (generated)

052500266.b3lyp_6-31g(d).nwchem.inp (generated) 052500266.b3lyp_6-31g(d).log.xz 052500266.td-b3lyp_6-31g+(d).inp 052500266.td-b3lyp_6-31g+(d).log.xz

052500266.td-b3lyp_6-31+g(d).qchem.inp (generated)

052500266.td-b3lyp_6-31+g(d).gjf (generated)

052500266.td-b3lyp_6-31+g(d).firefly.inp (generated)

052500266.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052500266.mol 052500266.PUBCHEM 052500266.mol (via Jmol)
052501230.b3lyp_6-31g(d).inp

052501230.b3lyp_6-31g(d).qchem.inp (generated)

052501230.b3lyp_6-31g(d).gjf (generated)

052501230.b3lyp_6-31g(d).firefly.inp (generated)

052501230.b3lyp_6-31g(d).smash.inp (generated)

052501230.b3lyp_6-31g(d).nwchem.inp (generated) 052501230.b3lyp_6-31g(d).log.xz 052501230.td-b3lyp_6-31g+(d).inp 052501230.td-b3lyp_6-31g+(d).log.xz

052501230.td-b3lyp_6-31+g(d).qchem.inp (generated)

052501230.td-b3lyp_6-31+g(d).gjf (generated)

052501230.td-b3lyp_6-31+g(d).firefly.inp (generated)

052501230.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052501230.mol 052501230.PUBCHEM 052501230.mol (via Jmol)
052501411.b3lyp_6-31g(d).inp

052501411.b3lyp_6-31g(d).qchem.inp (generated)

052501411.b3lyp_6-31g(d).gjf (generated)

052501411.b3lyp_6-31g(d).firefly.inp (generated)

052501411.b3lyp_6-31g(d).smash.inp (generated)

052501411.b3lyp_6-31g(d).nwchem.inp (generated) 052501411.b3lyp_6-31g(d).log.xz 052501411.td-b3lyp_6-31g+(d).inp 052501411.td-b3lyp_6-31g+(d).log.xz

052501411.td-b3lyp_6-31+g(d).qchem.inp (generated)

052501411.td-b3lyp_6-31+g(d).gjf (generated)

052501411.td-b3lyp_6-31+g(d).firefly.inp (generated)

052501411.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052501411.mol 052501411.PUBCHEM 052501411.mol (via Jmol)
052501418.b3lyp_6-31g(d).inp

052501418.b3lyp_6-31g(d).qchem.inp (generated)

052501418.b3lyp_6-31g(d).gjf (generated)

052501418.b3lyp_6-31g(d).firefly.inp (generated)

052501418.b3lyp_6-31g(d).smash.inp (generated)

052501418.b3lyp_6-31g(d).nwchem.inp (generated) 052501418.b3lyp_6-31g(d).log.xz 052501418.td-b3lyp_6-31g+(d).inp 052501418.td-b3lyp_6-31g+(d).log.xz

052501418.td-b3lyp_6-31+g(d).qchem.inp (generated)

052501418.td-b3lyp_6-31+g(d).gjf (generated)

052501418.td-b3lyp_6-31+g(d).firefly.inp (generated)

052501418.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052501418.mol 052501418.PUBCHEM 052501418.mol (via Jmol)
052501433.b3lyp_6-31g(d).inp

052501433.b3lyp_6-31g(d).qchem.inp (generated)

052501433.b3lyp_6-31g(d).gjf (generated)

052501433.b3lyp_6-31g(d).firefly.inp (generated)

052501433.b3lyp_6-31g(d).smash.inp (generated)

052501433.b3lyp_6-31g(d).nwchem.inp (generated) 052501433.b3lyp_6-31g(d).log.xz 052501433.td-b3lyp_6-31g+(d).inp 052501433.td-b3lyp_6-31g+(d).log.xz

052501433.td-b3lyp_6-31+g(d).qchem.inp (generated)

052501433.td-b3lyp_6-31+g(d).gjf (generated)

052501433.td-b3lyp_6-31+g(d).firefly.inp (generated)

052501433.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052501433.mol 052501433.PUBCHEM 052501433.mol (via Jmol)
052501434.b3lyp_6-31g(d).inp

052501434.b3lyp_6-31g(d).qchem.inp (generated)

052501434.b3lyp_6-31g(d).gjf (generated)

052501434.b3lyp_6-31g(d).firefly.inp (generated)

052501434.b3lyp_6-31g(d).smash.inp (generated)

052501434.b3lyp_6-31g(d).nwchem.inp (generated) 052501434.b3lyp_6-31g(d).log.xz 052501434.td-b3lyp_6-31g+(d).inp 052501434.td-b3lyp_6-31g+(d).log.xz

052501434.td-b3lyp_6-31+g(d).qchem.inp (generated)

052501434.td-b3lyp_6-31+g(d).gjf (generated)

052501434.td-b3lyp_6-31+g(d).firefly.inp (generated)

052501434.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052501434.mol 052501434.PUBCHEM 052501434.mol (via Jmol)
052501435.b3lyp_6-31g(d).inp

052501435.b3lyp_6-31g(d).qchem.inp (generated)

052501435.b3lyp_6-31g(d).gjf (generated)

052501435.b3lyp_6-31g(d).firefly.inp (generated)

052501435.b3lyp_6-31g(d).smash.inp (generated)

052501435.b3lyp_6-31g(d).nwchem.inp (generated) 052501435.b3lyp_6-31g(d).log.xz 052501435.td-b3lyp_6-31g+(d).inp 052501435.td-b3lyp_6-31g+(d).log.xz

052501435.td-b3lyp_6-31+g(d).qchem.inp (generated)

052501435.td-b3lyp_6-31+g(d).gjf (generated)

052501435.td-b3lyp_6-31+g(d).firefly.inp (generated)

052501435.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052501435.mol 052501435.PUBCHEM 052501435.mol (via Jmol)
052501443.b3lyp_6-31g(d).inp

052501443.b3lyp_6-31g(d).qchem.inp (generated)

052501443.b3lyp_6-31g(d).gjf (generated)

052501443.b3lyp_6-31g(d).firefly.inp (generated)

052501443.b3lyp_6-31g(d).smash.inp (generated)

052501443.b3lyp_6-31g(d).nwchem.inp (generated) 052501443.b3lyp_6-31g(d).log.xz 052501443.td-b3lyp_6-31g+(d).inp 052501443.td-b3lyp_6-31g+(d).log.xz

052501443.td-b3lyp_6-31+g(d).qchem.inp (generated)

052501443.td-b3lyp_6-31+g(d).gjf (generated)

052501443.td-b3lyp_6-31+g(d).firefly.inp (generated)

052501443.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052501443.mol 052501443.PUBCHEM 052501443.mol (via Jmol)
052501444.b3lyp_6-31g(d).inp

052501444.b3lyp_6-31g(d).qchem.inp (generated)

052501444.b3lyp_6-31g(d).gjf (generated)

052501444.b3lyp_6-31g(d).firefly.inp (generated)

052501444.b3lyp_6-31g(d).smash.inp (generated)

052501444.b3lyp_6-31g(d).nwchem.inp (generated) 052501444.b3lyp_6-31g(d).log.xz 052501444.td-b3lyp_6-31g+(d).inp 052501444.td-b3lyp_6-31g+(d).log.xz

052501444.td-b3lyp_6-31+g(d).qchem.inp (generated)

052501444.td-b3lyp_6-31+g(d).gjf (generated)

052501444.td-b3lyp_6-31+g(d).firefly.inp (generated)

052501444.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052501444.mol 052501444.PUBCHEM 052501444.mol (via Jmol)
052501445.b3lyp_6-31g(d).inp

052501445.b3lyp_6-31g(d).qchem.inp (generated)

052501445.b3lyp_6-31g(d).gjf (generated)

052501445.b3lyp_6-31g(d).firefly.inp (generated)

052501445.b3lyp_6-31g(d).smash.inp (generated)

052501445.b3lyp_6-31g(d).nwchem.inp (generated) 052501445.b3lyp_6-31g(d).log.xz 052501445.td-b3lyp_6-31g+(d).inp 052501445.td-b3lyp_6-31g+(d).log.xz

052501445.td-b3lyp_6-31+g(d).qchem.inp (generated)

052501445.td-b3lyp_6-31+g(d).gjf (generated)

052501445.td-b3lyp_6-31+g(d).firefly.inp (generated)

052501445.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052501445.mol 052501445.PUBCHEM 052501445.mol (via Jmol)
052501455.b3lyp_6-31g(d).inp

052501455.b3lyp_6-31g(d).qchem.inp (generated)

052501455.b3lyp_6-31g(d).gjf (generated)

052501455.b3lyp_6-31g(d).firefly.inp (generated)

052501455.b3lyp_6-31g(d).smash.inp (generated)

052501455.b3lyp_6-31g(d).nwchem.inp (generated) 052501455.b3lyp_6-31g(d).log.xz 052501455.td-b3lyp_6-31g+(d).inp 052501455.td-b3lyp_6-31g+(d).log.xz

052501455.td-b3lyp_6-31+g(d).qchem.inp (generated)

052501455.td-b3lyp_6-31+g(d).gjf (generated)

052501455.td-b3lyp_6-31+g(d).firefly.inp (generated)

052501455.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052501455.mol 052501455.PUBCHEM 052501455.mol (via Jmol)
052501458.b3lyp_6-31g(d).inp

052501458.b3lyp_6-31g(d).qchem.inp (generated)

052501458.b3lyp_6-31g(d).gjf (generated)

052501458.b3lyp_6-31g(d).firefly.inp (generated)

052501458.b3lyp_6-31g(d).smash.inp (generated)

052501458.b3lyp_6-31g(d).nwchem.inp (generated) 052501458.b3lyp_6-31g(d).log.xz 052501458.td-b3lyp_6-31g+(d).inp 052501458.td-b3lyp_6-31g+(d).log.xz

052501458.td-b3lyp_6-31+g(d).qchem.inp (generated)

052501458.td-b3lyp_6-31+g(d).gjf (generated)

052501458.td-b3lyp_6-31+g(d).firefly.inp (generated)

052501458.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052501458.mol 052501458.PUBCHEM 052501458.mol (via Jmol)
052501918.b3lyp_6-31g(d).inp

052501918.b3lyp_6-31g(d).qchem.inp (generated)

052501918.b3lyp_6-31g(d).gjf (generated)

052501918.b3lyp_6-31g(d).firefly.inp (generated)

052501918.b3lyp_6-31g(d).smash.inp (generated)

052501918.b3lyp_6-31g(d).nwchem.inp (generated) 052501918.b3lyp_6-31g(d).log.xz 052501918.td-b3lyp_6-31g+(d).inp 052501918.td-b3lyp_6-31g+(d).log.xz

052501918.td-b3lyp_6-31+g(d).qchem.inp (generated)

052501918.td-b3lyp_6-31+g(d).gjf (generated)

052501918.td-b3lyp_6-31+g(d).firefly.inp (generated)

052501918.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052501918.mol 052501918.PUBCHEM 052501918.mol (via Jmol)
052501919.b3lyp_6-31g(d).inp

052501919.b3lyp_6-31g(d).qchem.inp (generated)

052501919.b3lyp_6-31g(d).gjf (generated)

052501919.b3lyp_6-31g(d).firefly.inp (generated)

052501919.b3lyp_6-31g(d).smash.inp (generated)

052501919.b3lyp_6-31g(d).nwchem.inp (generated) 052501919.b3lyp_6-31g(d).log.xz 052501919.td-b3lyp_6-31g+(d).inp 052501919.td-b3lyp_6-31g+(d).log.xz

052501919.td-b3lyp_6-31+g(d).qchem.inp (generated)

052501919.td-b3lyp_6-31+g(d).gjf (generated)

052501919.td-b3lyp_6-31+g(d).firefly.inp (generated)

052501919.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052501919.mol 052501919.PUBCHEM 052501919.mol (via Jmol)
052501920.b3lyp_6-31g(d).inp

052501920.b3lyp_6-31g(d).qchem.inp (generated)

052501920.b3lyp_6-31g(d).gjf (generated)

052501920.b3lyp_6-31g(d).firefly.inp (generated)

052501920.b3lyp_6-31g(d).smash.inp (generated)

052501920.b3lyp_6-31g(d).nwchem.inp (generated) 052501920.b3lyp_6-31g(d).log.xz 052501920.td-b3lyp_6-31g+(d).inp 052501920.td-b3lyp_6-31g+(d).log.xz

052501920.td-b3lyp_6-31+g(d).qchem.inp (generated)

052501920.td-b3lyp_6-31+g(d).gjf (generated)

052501920.td-b3lyp_6-31+g(d).firefly.inp (generated)

052501920.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052501920.mol 052501920.PUBCHEM 052501920.mol (via Jmol)
052501922.b3lyp_6-31g(d).inp

052501922.b3lyp_6-31g(d).qchem.inp (generated)

052501922.b3lyp_6-31g(d).gjf (generated)

052501922.b3lyp_6-31g(d).firefly.inp (generated)

052501922.b3lyp_6-31g(d).smash.inp (generated)

052501922.b3lyp_6-31g(d).nwchem.inp (generated) 052501922.b3lyp_6-31g(d).log.xz 052501922.td-b3lyp_6-31g+(d).inp 052501922.td-b3lyp_6-31g+(d).log.xz

052501922.td-b3lyp_6-31+g(d).qchem.inp (generated)

052501922.td-b3lyp_6-31+g(d).gjf (generated)

052501922.td-b3lyp_6-31+g(d).firefly.inp (generated)

052501922.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052501922.mol 052501922.PUBCHEM 052501922.mol (via Jmol)
052502116.b3lyp_6-31g(d).inp

052502116.b3lyp_6-31g(d).qchem.inp (generated)

052502116.b3lyp_6-31g(d).gjf (generated)

052502116.b3lyp_6-31g(d).firefly.inp (generated)

052502116.b3lyp_6-31g(d).smash.inp (generated)

052502116.b3lyp_6-31g(d).nwchem.inp (generated) 052502116.b3lyp_6-31g(d).log.xz 052502116.td-b3lyp_6-31g+(d).inp 052502116.td-b3lyp_6-31g+(d).log.xz

052502116.td-b3lyp_6-31+g(d).qchem.inp (generated)

052502116.td-b3lyp_6-31+g(d).gjf (generated)

052502116.td-b3lyp_6-31+g(d).firefly.inp (generated)

052502116.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052502116.mol 052502116.PUBCHEM 052502116.mol (via Jmol)
052502126.b3lyp_6-31g(d).inp

052502126.b3lyp_6-31g(d).qchem.inp (generated)

052502126.b3lyp_6-31g(d).gjf (generated)

052502126.b3lyp_6-31g(d).firefly.inp (generated)

052502126.b3lyp_6-31g(d).smash.inp (generated)

052502126.b3lyp_6-31g(d).nwchem.inp (generated) 052502126.b3lyp_6-31g(d).log.xz 052502126.td-b3lyp_6-31g+(d).inp 052502126.td-b3lyp_6-31g+(d).log.xz

052502126.td-b3lyp_6-31+g(d).qchem.inp (generated)

052502126.td-b3lyp_6-31+g(d).gjf (generated)

052502126.td-b3lyp_6-31+g(d).firefly.inp (generated)

052502126.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052502126.mol 052502126.PUBCHEM 052502126.mol (via Jmol)
052502127.b3lyp_6-31g(d).inp

052502127.b3lyp_6-31g(d).qchem.inp (generated)

052502127.b3lyp_6-31g(d).gjf (generated)

052502127.b3lyp_6-31g(d).firefly.inp (generated)

052502127.b3lyp_6-31g(d).smash.inp (generated)

052502127.b3lyp_6-31g(d).nwchem.inp (generated) 052502127.b3lyp_6-31g(d).log.xz 052502127.td-b3lyp_6-31g+(d).inp 052502127.td-b3lyp_6-31g+(d).log.xz

052502127.td-b3lyp_6-31+g(d).qchem.inp (generated)

052502127.td-b3lyp_6-31+g(d).gjf (generated)

052502127.td-b3lyp_6-31+g(d).firefly.inp (generated)

052502127.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052502127.mol 052502127.PUBCHEM 052502127.mol (via Jmol)
052502164.b3lyp_6-31g(d).inp

052502164.b3lyp_6-31g(d).qchem.inp (generated)

052502164.b3lyp_6-31g(d).gjf (generated)

052502164.b3lyp_6-31g(d).firefly.inp (generated)

052502164.b3lyp_6-31g(d).smash.inp (generated)

052502164.b3lyp_6-31g(d).nwchem.inp (generated) 052502164.b3lyp_6-31g(d).log.xz 052502164.td-b3lyp_6-31g+(d).inp 052502164.td-b3lyp_6-31g+(d).log.xz

052502164.td-b3lyp_6-31+g(d).qchem.inp (generated)

052502164.td-b3lyp_6-31+g(d).gjf (generated)

052502164.td-b3lyp_6-31+g(d).firefly.inp (generated)

052502164.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052502164.mol 052502164.PUBCHEM 052502164.mol (via Jmol)
052502165.b3lyp_6-31g(d).inp

052502165.b3lyp_6-31g(d).qchem.inp (generated)

052502165.b3lyp_6-31g(d).gjf (generated)

052502165.b3lyp_6-31g(d).firefly.inp (generated)

052502165.b3lyp_6-31g(d).smash.inp (generated)

052502165.b3lyp_6-31g(d).nwchem.inp (generated) 052502165.b3lyp_6-31g(d).log.xz 052502165.td-b3lyp_6-31g+(d).inp 052502165.td-b3lyp_6-31g+(d).log.xz

052502165.td-b3lyp_6-31+g(d).qchem.inp (generated)

052502165.td-b3lyp_6-31+g(d).gjf (generated)

052502165.td-b3lyp_6-31+g(d).firefly.inp (generated)

052502165.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052502165.mol 052502165.PUBCHEM 052502165.mol (via Jmol)
052502166.b3lyp_6-31g(d).inp

052502166.b3lyp_6-31g(d).qchem.inp (generated)

052502166.b3lyp_6-31g(d).gjf (generated)

052502166.b3lyp_6-31g(d).firefly.inp (generated)

052502166.b3lyp_6-31g(d).smash.inp (generated)

052502166.b3lyp_6-31g(d).nwchem.inp (generated) 052502166.b3lyp_6-31g(d).log.xz 052502166.td-b3lyp_6-31g+(d).inp 052502166.td-b3lyp_6-31g+(d).log.xz

052502166.td-b3lyp_6-31+g(d).qchem.inp (generated)

052502166.td-b3lyp_6-31+g(d).gjf (generated)

052502166.td-b3lyp_6-31+g(d).firefly.inp (generated)

052502166.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052502166.mol 052502166.PUBCHEM 052502166.mol (via Jmol)
052503161.b3lyp_6-31g(d).inp

052503161.b3lyp_6-31g(d).qchem.inp (generated)

052503161.b3lyp_6-31g(d).gjf (generated)

052503161.b3lyp_6-31g(d).firefly.inp (generated)

052503161.b3lyp_6-31g(d).smash.inp (generated)

052503161.b3lyp_6-31g(d).nwchem.inp (generated) 052503161.b3lyp_6-31g(d).log.xz 052503161.td-b3lyp_6-31g+(d).inp 052503161.td-b3lyp_6-31g+(d).log.xz

052503161.td-b3lyp_6-31+g(d).qchem.inp (generated)

052503161.td-b3lyp_6-31+g(d).gjf (generated)

052503161.td-b3lyp_6-31+g(d).firefly.inp (generated)

052503161.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052503161.mol 052503161.PUBCHEM 052503161.mol (via Jmol)
052503613.b3lyp_6-31g(d).inp

052503613.b3lyp_6-31g(d).qchem.inp (generated)

052503613.b3lyp_6-31g(d).gjf (generated)

052503613.b3lyp_6-31g(d).firefly.inp (generated)

052503613.b3lyp_6-31g(d).smash.inp (generated)

052503613.b3lyp_6-31g(d).nwchem.inp (generated) 052503613.b3lyp_6-31g(d).log.xz 052503613.td-b3lyp_6-31g+(d).inp 052503613.td-b3lyp_6-31g+(d).log.xz

052503613.td-b3lyp_6-31+g(d).qchem.inp (generated)

052503613.td-b3lyp_6-31+g(d).gjf (generated)

052503613.td-b3lyp_6-31+g(d).firefly.inp (generated)

052503613.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052503613.mol 052503613.PUBCHEM 052503613.mol (via Jmol)
052503614.b3lyp_6-31g(d).inp

052503614.b3lyp_6-31g(d).qchem.inp (generated)

052503614.b3lyp_6-31g(d).gjf (generated)

052503614.b3lyp_6-31g(d).firefly.inp (generated)

052503614.b3lyp_6-31g(d).smash.inp (generated)

052503614.b3lyp_6-31g(d).nwchem.inp (generated) 052503614.b3lyp_6-31g(d).log.xz 052503614.td-b3lyp_6-31g+(d).inp 052503614.td-b3lyp_6-31g+(d).log.xz

052503614.td-b3lyp_6-31+g(d).qchem.inp (generated)

052503614.td-b3lyp_6-31+g(d).gjf (generated)

052503614.td-b3lyp_6-31+g(d).firefly.inp (generated)

052503614.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052503614.mol 052503614.PUBCHEM 052503614.mol (via Jmol)
052503944.b3lyp_6-31g(d).inp

052503944.b3lyp_6-31g(d).qchem.inp (generated)

052503944.b3lyp_6-31g(d).gjf (generated)

052503944.b3lyp_6-31g(d).firefly.inp (generated)

052503944.b3lyp_6-31g(d).smash.inp (generated)

052503944.b3lyp_6-31g(d).nwchem.inp (generated) 052503944.b3lyp_6-31g(d).log.xz 052503944.td-b3lyp_6-31g+(d).inp 052503944.td-b3lyp_6-31g+(d).log.xz

052503944.td-b3lyp_6-31+g(d).qchem.inp (generated)

052503944.td-b3lyp_6-31+g(d).gjf (generated)

052503944.td-b3lyp_6-31+g(d).firefly.inp (generated)

052503944.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052503944.mol 052503944.PUBCHEM 052503944.mol (via Jmol)
052503945.b3lyp_6-31g(d).inp

052503945.b3lyp_6-31g(d).qchem.inp (generated)

052503945.b3lyp_6-31g(d).gjf (generated)

052503945.b3lyp_6-31g(d).firefly.inp (generated)

052503945.b3lyp_6-31g(d).smash.inp (generated)

052503945.b3lyp_6-31g(d).nwchem.inp (generated) 052503945.b3lyp_6-31g(d).log.xz 052503945.td-b3lyp_6-31g+(d).inp 052503945.td-b3lyp_6-31g+(d).log.xz

052503945.td-b3lyp_6-31+g(d).qchem.inp (generated)

052503945.td-b3lyp_6-31+g(d).gjf (generated)

052503945.td-b3lyp_6-31+g(d).firefly.inp (generated)

052503945.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052503945.mol 052503945.PUBCHEM 052503945.mol (via Jmol)
052503946.b3lyp_6-31g(d).inp

052503946.b3lyp_6-31g(d).qchem.inp (generated)

052503946.b3lyp_6-31g(d).gjf (generated)

052503946.b3lyp_6-31g(d).firefly.inp (generated)

052503946.b3lyp_6-31g(d).smash.inp (generated)

052503946.b3lyp_6-31g(d).nwchem.inp (generated) 052503946.b3lyp_6-31g(d).log.xz 052503946.td-b3lyp_6-31g+(d).inp 052503946.td-b3lyp_6-31g+(d).log.xz

052503946.td-b3lyp_6-31+g(d).qchem.inp (generated)

052503946.td-b3lyp_6-31+g(d).gjf (generated)

052503946.td-b3lyp_6-31+g(d).firefly.inp (generated)

052503946.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052503946.mol 052503946.PUBCHEM 052503946.mol (via Jmol)
052504105.b3lyp_6-31g(d).inp

052504105.b3lyp_6-31g(d).qchem.inp (generated)

052504105.b3lyp_6-31g(d).gjf (generated)

052504105.b3lyp_6-31g(d).firefly.inp (generated)

052504105.b3lyp_6-31g(d).smash.inp (generated)

052504105.b3lyp_6-31g(d).nwchem.inp (generated) 052504105.b3lyp_6-31g(d).log.xz 052504105.td-b3lyp_6-31g+(d).inp 052504105.td-b3lyp_6-31g+(d).log.xz

052504105.td-b3lyp_6-31+g(d).qchem.inp (generated)

052504105.td-b3lyp_6-31+g(d).gjf (generated)

052504105.td-b3lyp_6-31+g(d).firefly.inp (generated)

052504105.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052504105.mol 052504105.PUBCHEM 052504105.mol (via Jmol)
052504120.b3lyp_6-31g(d).inp

052504120.b3lyp_6-31g(d).qchem.inp (generated)

052504120.b3lyp_6-31g(d).gjf (generated)

052504120.b3lyp_6-31g(d).firefly.inp (generated)

052504120.b3lyp_6-31g(d).smash.inp (generated)

052504120.b3lyp_6-31g(d).nwchem.inp (generated) 052504120.b3lyp_6-31g(d).log.xz 052504120.td-b3lyp_6-31g+(d).inp 052504120.td-b3lyp_6-31g+(d).log.xz

052504120.td-b3lyp_6-31+g(d).qchem.inp (generated)

052504120.td-b3lyp_6-31+g(d).gjf (generated)

052504120.td-b3lyp_6-31+g(d).firefly.inp (generated)

052504120.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052504120.mol 052504120.PUBCHEM 052504120.mol (via Jmol)
052504121.b3lyp_6-31g(d).inp

052504121.b3lyp_6-31g(d).qchem.inp (generated)

052504121.b3lyp_6-31g(d).gjf (generated)

052504121.b3lyp_6-31g(d).firefly.inp (generated)

052504121.b3lyp_6-31g(d).smash.inp (generated)

052504121.b3lyp_6-31g(d).nwchem.inp (generated) 052504121.b3lyp_6-31g(d).log.xz 052504121.td-b3lyp_6-31g+(d).inp 052504121.td-b3lyp_6-31g+(d).log.xz

052504121.td-b3lyp_6-31+g(d).qchem.inp (generated)

052504121.td-b3lyp_6-31+g(d).gjf (generated)

052504121.td-b3lyp_6-31+g(d).firefly.inp (generated)

052504121.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052504121.mol 052504121.PUBCHEM 052504121.mol (via Jmol)
052504482.b3lyp_6-31g(d).inp

052504482.b3lyp_6-31g(d).qchem.inp (generated)

052504482.b3lyp_6-31g(d).gjf (generated)

052504482.b3lyp_6-31g(d).firefly.inp (generated)

052504482.b3lyp_6-31g(d).smash.inp (generated)

052504482.b3lyp_6-31g(d).nwchem.inp (generated) 052504482.b3lyp_6-31g(d).log.xz 052504482.td-b3lyp_6-31g+(d).inp 052504482.td-b3lyp_6-31g+(d).log.xz

052504482.td-b3lyp_6-31+g(d).qchem.inp (generated)

052504482.td-b3lyp_6-31+g(d).gjf (generated)

052504482.td-b3lyp_6-31+g(d).firefly.inp (generated)

052504482.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052504482.mol 052504482.PUBCHEM 052504482.mol (via Jmol)
052505286.b3lyp_6-31g(d).inp

052505286.b3lyp_6-31g(d).qchem.inp (generated)

052505286.b3lyp_6-31g(d).gjf (generated)

052505286.b3lyp_6-31g(d).firefly.inp (generated)

052505286.b3lyp_6-31g(d).smash.inp (generated)

052505286.b3lyp_6-31g(d).nwchem.inp (generated) 052505286.b3lyp_6-31g(d).log.xz 052505286.td-b3lyp_6-31g+(d).inp 052505286.td-b3lyp_6-31g+(d).log.xz

052505286.td-b3lyp_6-31+g(d).qchem.inp (generated)

052505286.td-b3lyp_6-31+g(d).gjf (generated)

052505286.td-b3lyp_6-31+g(d).firefly.inp (generated)

052505286.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052505286.mol 052505286.PUBCHEM 052505286.mol (via Jmol)
052505304.b3lyp_6-31g(d).inp

052505304.b3lyp_6-31g(d).qchem.inp (generated)

052505304.b3lyp_6-31g(d).gjf (generated)

052505304.b3lyp_6-31g(d).firefly.inp (generated)

052505304.b3lyp_6-31g(d).smash.inp (generated)

052505304.b3lyp_6-31g(d).nwchem.inp (generated) 052505304.b3lyp_6-31g(d).log.xz 052505304.mol 052505304.PUBCHEM 052505304.mol (via Jmol)
052505306.b3lyp_6-31g(d).inp

052505306.b3lyp_6-31g(d).qchem.inp (generated)

052505306.b3lyp_6-31g(d).gjf (generated)

052505306.b3lyp_6-31g(d).firefly.inp (generated)

052505306.b3lyp_6-31g(d).smash.inp (generated)

052505306.b3lyp_6-31g(d).nwchem.inp (generated) 052505306.b3lyp_6-31g(d).log.xz 052505306.mol 052505306.PUBCHEM 052505306.mol (via Jmol)
052505495.b3lyp_6-31g(d).inp

052505495.b3lyp_6-31g(d).qchem.inp (generated)

052505495.b3lyp_6-31g(d).gjf (generated)

052505495.b3lyp_6-31g(d).firefly.inp (generated)

052505495.b3lyp_6-31g(d).smash.inp (generated)

052505495.b3lyp_6-31g(d).nwchem.inp (generated) 052505495.b3lyp_6-31g(d).log.xz 052505495.td-b3lyp_6-31g+(d).inp 052505495.td-b3lyp_6-31g+(d).log.xz

052505495.td-b3lyp_6-31+g(d).qchem.inp (generated)

052505495.td-b3lyp_6-31+g(d).gjf (generated)

052505495.td-b3lyp_6-31+g(d).firefly.inp (generated)

052505495.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052505495.mol 052505495.PUBCHEM 052505495.mol (via Jmol)
052505957.b3lyp_6-31g(d).inp

052505957.b3lyp_6-31g(d).qchem.inp (generated)

052505957.b3lyp_6-31g(d).gjf (generated)

052505957.b3lyp_6-31g(d).firefly.inp (generated)

052505957.b3lyp_6-31g(d).smash.inp (generated)

052505957.b3lyp_6-31g(d).nwchem.inp (generated) 052505957.b3lyp_6-31g(d).log.xz 052505957.td-b3lyp_6-31g+(d).inp 052505957.td-b3lyp_6-31g+(d).log.xz

052505957.td-b3lyp_6-31+g(d).qchem.inp (generated)

052505957.td-b3lyp_6-31+g(d).gjf (generated)

052505957.td-b3lyp_6-31+g(d).firefly.inp (generated)

052505957.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052505957.mol 052505957.PUBCHEM 052505957.mol (via Jmol)
052505958.b3lyp_6-31g(d).inp

052505958.b3lyp_6-31g(d).qchem.inp (generated)

052505958.b3lyp_6-31g(d).gjf (generated)

052505958.b3lyp_6-31g(d).firefly.inp (generated)

052505958.b3lyp_6-31g(d).smash.inp (generated)

052505958.b3lyp_6-31g(d).nwchem.inp (generated) 052505958.b3lyp_6-31g(d).log.xz 052505958.td-b3lyp_6-31g+(d).inp 052505958.td-b3lyp_6-31g+(d).log.xz

052505958.td-b3lyp_6-31+g(d).qchem.inp (generated)

052505958.td-b3lyp_6-31+g(d).gjf (generated)

052505958.td-b3lyp_6-31+g(d).firefly.inp (generated)

052505958.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052505958.mol 052505958.PUBCHEM 052505958.mol (via Jmol)
052506006.b3lyp_6-31g(d).inp

052506006.b3lyp_6-31g(d).qchem.inp (generated)

052506006.b3lyp_6-31g(d).gjf (generated)

052506006.b3lyp_6-31g(d).firefly.inp (generated)

052506006.b3lyp_6-31g(d).smash.inp (generated)

052506006.b3lyp_6-31g(d).nwchem.inp (generated) 052506006.b3lyp_6-31g(d).log.xz 052506006.td-b3lyp_6-31g+(d).inp 052506006.td-b3lyp_6-31g+(d).log.xz

052506006.td-b3lyp_6-31+g(d).qchem.inp (generated)

052506006.td-b3lyp_6-31+g(d).gjf (generated)

052506006.td-b3lyp_6-31+g(d).firefly.inp (generated)

052506006.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052506006.mol 052506006.PUBCHEM 052506006.mol (via Jmol)
052507829.b3lyp_6-31g(d).inp

052507829.b3lyp_6-31g(d).qchem.inp (generated)

052507829.b3lyp_6-31g(d).gjf (generated)

052507829.b3lyp_6-31g(d).firefly.inp (generated)

052507829.b3lyp_6-31g(d).smash.inp (generated)

052507829.b3lyp_6-31g(d).nwchem.inp (generated) 052507829.b3lyp_6-31g(d).log.xz 052507829.td-b3lyp_6-31g+(d).inp 052507829.td-b3lyp_6-31g+(d).log.xz

052507829.td-b3lyp_6-31+g(d).qchem.inp (generated)

052507829.td-b3lyp_6-31+g(d).gjf (generated)

052507829.td-b3lyp_6-31+g(d).firefly.inp (generated)

052507829.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052507829.mol 052507829.PUBCHEM 052507829.mol (via Jmol)
052508083.b3lyp_6-31g(d).inp

052508083.b3lyp_6-31g(d).qchem.inp (generated)

052508083.b3lyp_6-31g(d).gjf (generated)

052508083.b3lyp_6-31g(d).firefly.inp (generated)

052508083.b3lyp_6-31g(d).smash.inp (generated)

052508083.b3lyp_6-31g(d).nwchem.inp (generated) 052508083.b3lyp_6-31g(d).log.xz 052508083.td-b3lyp_6-31g+(d).inp 052508083.td-b3lyp_6-31g+(d).log.xz

052508083.td-b3lyp_6-31+g(d).qchem.inp (generated)

052508083.td-b3lyp_6-31+g(d).gjf (generated)

052508083.td-b3lyp_6-31+g(d).firefly.inp (generated)

052508083.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052508083.mol 052508083.PUBCHEM 052508083.mol (via Jmol)
052508094.b3lyp_6-31g(d).inp

052508094.b3lyp_6-31g(d).qchem.inp (generated)

052508094.b3lyp_6-31g(d).gjf (generated)

052508094.b3lyp_6-31g(d).firefly.inp (generated)

052508094.b3lyp_6-31g(d).smash.inp (generated)

052508094.b3lyp_6-31g(d).nwchem.inp (generated) 052508094.b3lyp_6-31g(d).log.xz 052508094.td-b3lyp_6-31g+(d).inp 052508094.td-b3lyp_6-31g+(d).log.xz

052508094.td-b3lyp_6-31+g(d).qchem.inp (generated)

052508094.td-b3lyp_6-31+g(d).gjf (generated)

052508094.td-b3lyp_6-31+g(d).firefly.inp (generated)

052508094.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052508094.mol 052508094.PUBCHEM 052508094.mol (via Jmol)
052508123.b3lyp_6-31g(d).inp

052508123.b3lyp_6-31g(d).qchem.inp (generated)

052508123.b3lyp_6-31g(d).gjf (generated)

052508123.b3lyp_6-31g(d).firefly.inp (generated)

052508123.b3lyp_6-31g(d).smash.inp (generated)

052508123.b3lyp_6-31g(d).nwchem.inp (generated) 052508123.b3lyp_6-31g(d).log.xz 052508123.td-b3lyp_6-31g+(d).inp 052508123.td-b3lyp_6-31g+(d).log.xz

052508123.td-b3lyp_6-31+g(d).qchem.inp (generated)

052508123.td-b3lyp_6-31+g(d).gjf (generated)

052508123.td-b3lyp_6-31+g(d).firefly.inp (generated)

052508123.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052508123.mol 052508123.PUBCHEM 052508123.mol (via Jmol)
052508135.b3lyp_6-31g(d).inp

052508135.b3lyp_6-31g(d).qchem.inp (generated)

052508135.b3lyp_6-31g(d).gjf (generated)

052508135.b3lyp_6-31g(d).firefly.inp (generated)

052508135.b3lyp_6-31g(d).smash.inp (generated)

052508135.b3lyp_6-31g(d).nwchem.inp (generated) 052508135.b3lyp_6-31g(d).log.xz 052508135.td-b3lyp_6-31g+(d).inp 052508135.td-b3lyp_6-31g+(d).log.xz

052508135.td-b3lyp_6-31+g(d).qchem.inp (generated)

052508135.td-b3lyp_6-31+g(d).gjf (generated)

052508135.td-b3lyp_6-31+g(d).firefly.inp (generated)

052508135.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052508135.mol 052508135.PUBCHEM 052508135.mol (via Jmol)
052508137.b3lyp_6-31g(d).inp

052508137.b3lyp_6-31g(d).qchem.inp (generated)

052508137.b3lyp_6-31g(d).gjf (generated)

052508137.b3lyp_6-31g(d).firefly.inp (generated)

052508137.b3lyp_6-31g(d).smash.inp (generated)

052508137.b3lyp_6-31g(d).nwchem.inp (generated) 052508137.b3lyp_6-31g(d).log.xz 052508137.td-b3lyp_6-31g+(d).inp 052508137.td-b3lyp_6-31g+(d).log.xz

052508137.td-b3lyp_6-31+g(d).qchem.inp (generated)

052508137.td-b3lyp_6-31+g(d).gjf (generated)

052508137.td-b3lyp_6-31+g(d).firefly.inp (generated)

052508137.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052508137.mol 052508137.PUBCHEM 052508137.mol (via Jmol)
052508964.b3lyp_6-31g(d).inp

052508964.b3lyp_6-31g(d).qchem.inp (generated)

052508964.b3lyp_6-31g(d).gjf (generated)

052508964.b3lyp_6-31g(d).firefly.inp (generated)

052508964.b3lyp_6-31g(d).smash.inp (generated)

052508964.b3lyp_6-31g(d).nwchem.inp (generated) 052508964.b3lyp_6-31g(d).log.xz 052508964.td-b3lyp_6-31g+(d).inp 052508964.td-b3lyp_6-31g+(d).log.xz

052508964.td-b3lyp_6-31+g(d).qchem.inp (generated)

052508964.td-b3lyp_6-31+g(d).gjf (generated)

052508964.td-b3lyp_6-31+g(d).firefly.inp (generated)

052508964.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052508964.mol 052508964.PUBCHEM 052508964.mol (via Jmol)
052508965.b3lyp_6-31g(d).inp

052508965.b3lyp_6-31g(d).qchem.inp (generated)

052508965.b3lyp_6-31g(d).gjf (generated)

052508965.b3lyp_6-31g(d).firefly.inp (generated)

052508965.b3lyp_6-31g(d).smash.inp (generated)

052508965.b3lyp_6-31g(d).nwchem.inp (generated) 052508965.b3lyp_6-31g(d).log.xz 052508965.td-b3lyp_6-31g+(d).inp 052508965.td-b3lyp_6-31g+(d).log.xz

052508965.td-b3lyp_6-31+g(d).qchem.inp (generated)

052508965.td-b3lyp_6-31+g(d).gjf (generated)

052508965.td-b3lyp_6-31+g(d).firefly.inp (generated)

052508965.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052508965.mol 052508965.PUBCHEM 052508965.mol (via Jmol)
052508966.b3lyp_6-31g(d).inp

052508966.b3lyp_6-31g(d).qchem.inp (generated)

052508966.b3lyp_6-31g(d).gjf (generated)

052508966.b3lyp_6-31g(d).firefly.inp (generated)

052508966.b3lyp_6-31g(d).smash.inp (generated)

052508966.b3lyp_6-31g(d).nwchem.inp (generated) 052508966.b3lyp_6-31g(d).log.xz 052508966.td-b3lyp_6-31g+(d).inp 052508966.td-b3lyp_6-31g+(d).log.xz

052508966.td-b3lyp_6-31+g(d).qchem.inp (generated)

052508966.td-b3lyp_6-31+g(d).gjf (generated)

052508966.td-b3lyp_6-31+g(d).firefly.inp (generated)

052508966.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052508966.mol 052508966.PUBCHEM 052508966.mol (via Jmol)
052508967.b3lyp_6-31g(d).inp

052508967.b3lyp_6-31g(d).qchem.inp (generated)

052508967.b3lyp_6-31g(d).gjf (generated)

052508967.b3lyp_6-31g(d).firefly.inp (generated)

052508967.b3lyp_6-31g(d).smash.inp (generated)

052508967.b3lyp_6-31g(d).nwchem.inp (generated) 052508967.b3lyp_6-31g(d).log.xz 052508967.td-b3lyp_6-31g+(d).inp 052508967.td-b3lyp_6-31g+(d).log.xz

052508967.td-b3lyp_6-31+g(d).qchem.inp (generated)

052508967.td-b3lyp_6-31+g(d).gjf (generated)

052508967.td-b3lyp_6-31+g(d).firefly.inp (generated)

052508967.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052508967.mol 052508967.PUBCHEM 052508967.mol (via Jmol)
052509376.b3lyp_6-31g(d).inp

052509376.b3lyp_6-31g(d).qchem.inp (generated)

052509376.b3lyp_6-31g(d).gjf (generated)

052509376.b3lyp_6-31g(d).firefly.inp (generated)

052509376.b3lyp_6-31g(d).smash.inp (generated)

052509376.b3lyp_6-31g(d).nwchem.inp (generated) 052509376.b3lyp_6-31g(d).log.xz 052509376.td-b3lyp_6-31g+(d).inp 052509376.td-b3lyp_6-31g+(d).log.xz

052509376.td-b3lyp_6-31+g(d).qchem.inp (generated)

052509376.td-b3lyp_6-31+g(d).gjf (generated)

052509376.td-b3lyp_6-31+g(d).firefly.inp (generated)

052509376.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052509376.mol 052509376.PUBCHEM 052509376.mol (via Jmol)
052509411.b3lyp_6-31g(d).inp

052509411.b3lyp_6-31g(d).qchem.inp (generated)

052509411.b3lyp_6-31g(d).gjf (generated)

052509411.b3lyp_6-31g(d).firefly.inp (generated)

052509411.b3lyp_6-31g(d).smash.inp (generated)

052509411.b3lyp_6-31g(d).nwchem.inp (generated) 052509411.b3lyp_6-31g(d).log.xz 052509411.td-b3lyp_6-31g+(d).inp 052509411.td-b3lyp_6-31g+(d).log.xz

052509411.td-b3lyp_6-31+g(d).qchem.inp (generated)

052509411.td-b3lyp_6-31+g(d).gjf (generated)

052509411.td-b3lyp_6-31+g(d).firefly.inp (generated)

052509411.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052509411.mol 052509411.PUBCHEM 052509411.mol (via Jmol)
052509438.b3lyp_6-31g(d).inp

052509438.b3lyp_6-31g(d).qchem.inp (generated)

052509438.b3lyp_6-31g(d).gjf (generated)

052509438.b3lyp_6-31g(d).firefly.inp (generated)

052509438.b3lyp_6-31g(d).smash.inp (generated)

052509438.b3lyp_6-31g(d).nwchem.inp (generated) 052509438.b3lyp_6-31g(d).log.xz 052509438.td-b3lyp_6-31g+(d).inp 052509438.td-b3lyp_6-31g+(d).log.xz

052509438.td-b3lyp_6-31+g(d).qchem.inp (generated)

052509438.td-b3lyp_6-31+g(d).gjf (generated)

052509438.td-b3lyp_6-31+g(d).firefly.inp (generated)

052509438.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052509438.mol 052509438.PUBCHEM 052509438.mol (via Jmol)
052509439.b3lyp_6-31g(d).inp

052509439.b3lyp_6-31g(d).qchem.inp (generated)

052509439.b3lyp_6-31g(d).gjf (generated)

052509439.b3lyp_6-31g(d).firefly.inp (generated)

052509439.b3lyp_6-31g(d).smash.inp (generated)

052509439.b3lyp_6-31g(d).nwchem.inp (generated) 052509439.b3lyp_6-31g(d).log.xz 052509439.td-b3lyp_6-31g+(d).inp 052509439.td-b3lyp_6-31g+(d).log.xz

052509439.td-b3lyp_6-31+g(d).qchem.inp (generated)

052509439.td-b3lyp_6-31+g(d).gjf (generated)

052509439.td-b3lyp_6-31+g(d).firefly.inp (generated)

052509439.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052509439.mol 052509439.PUBCHEM 052509439.mol (via Jmol)
052509796.b3lyp_6-31g(d).inp

052509796.b3lyp_6-31g(d).qchem.inp (generated)

052509796.b3lyp_6-31g(d).gjf (generated)

052509796.b3lyp_6-31g(d).firefly.inp (generated)

052509796.b3lyp_6-31g(d).smash.inp (generated)

052509796.b3lyp_6-31g(d).nwchem.inp (generated) 052509796.b3lyp_6-31g(d).log.xz 052509796.td-b3lyp_6-31g+(d).inp 052509796.td-b3lyp_6-31g+(d).log.xz

052509796.td-b3lyp_6-31+g(d).qchem.inp (generated)

052509796.td-b3lyp_6-31+g(d).gjf (generated)

052509796.td-b3lyp_6-31+g(d).firefly.inp (generated)

052509796.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052509796.mol 052509796.PUBCHEM 052509796.mol (via Jmol)
052509811.b3lyp_6-31g(d).inp

052509811.b3lyp_6-31g(d).qchem.inp (generated)

052509811.b3lyp_6-31g(d).gjf (generated)

052509811.b3lyp_6-31g(d).firefly.inp (generated)

052509811.b3lyp_6-31g(d).smash.inp (generated)

052509811.b3lyp_6-31g(d).nwchem.inp (generated) 052509811.b3lyp_6-31g(d).log.xz 052509811.td-b3lyp_6-31g+(d).inp 052509811.td-b3lyp_6-31g+(d).log.xz

052509811.td-b3lyp_6-31+g(d).qchem.inp (generated)

052509811.td-b3lyp_6-31+g(d).gjf (generated)

052509811.td-b3lyp_6-31+g(d).firefly.inp (generated)

052509811.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052509811.mol 052509811.PUBCHEM 052509811.mol (via Jmol)
052509812.b3lyp_6-31g(d).inp

052509812.b3lyp_6-31g(d).qchem.inp (generated)

052509812.b3lyp_6-31g(d).gjf (generated)

052509812.b3lyp_6-31g(d).firefly.inp (generated)

052509812.b3lyp_6-31g(d).smash.inp (generated)

052509812.b3lyp_6-31g(d).nwchem.inp (generated) 052509812.b3lyp_6-31g(d).log.xz 052509812.td-b3lyp_6-31g+(d).inp 052509812.td-b3lyp_6-31g+(d).log.xz

052509812.td-b3lyp_6-31+g(d).qchem.inp (generated)

052509812.td-b3lyp_6-31+g(d).gjf (generated)

052509812.td-b3lyp_6-31+g(d).firefly.inp (generated)

052509812.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052509812.mol 052509812.PUBCHEM 052509812.mol (via Jmol)
052509813.b3lyp_6-31g(d).inp

052509813.b3lyp_6-31g(d).qchem.inp (generated)

052509813.b3lyp_6-31g(d).gjf (generated)

052509813.b3lyp_6-31g(d).firefly.inp (generated)

052509813.b3lyp_6-31g(d).smash.inp (generated)

052509813.b3lyp_6-31g(d).nwchem.inp (generated) 052509813.b3lyp_6-31g(d).log.xz 052509813.td-b3lyp_6-31g+(d).inp 052509813.td-b3lyp_6-31g+(d).log.xz

052509813.td-b3lyp_6-31+g(d).qchem.inp (generated)

052509813.td-b3lyp_6-31+g(d).gjf (generated)

052509813.td-b3lyp_6-31+g(d).firefly.inp (generated)

052509813.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052509813.mol 052509813.PUBCHEM 052509813.mol (via Jmol)
052511147.b3lyp_6-31g(d).inp

052511147.b3lyp_6-31g(d).qchem.inp (generated)

052511147.b3lyp_6-31g(d).gjf (generated)

052511147.b3lyp_6-31g(d).firefly.inp (generated)

052511147.b3lyp_6-31g(d).smash.inp (generated)

052511147.b3lyp_6-31g(d).nwchem.inp (generated) 052511147.b3lyp_6-31g(d).log.xz 052511147.td-b3lyp_6-31g+(d).inp 052511147.td-b3lyp_6-31g+(d).log.xz

052511147.td-b3lyp_6-31+g(d).qchem.inp (generated)

052511147.td-b3lyp_6-31+g(d).gjf (generated)

052511147.td-b3lyp_6-31+g(d).firefly.inp (generated)

052511147.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052511147.mol 052511147.PUBCHEM 052511147.mol (via Jmol)
052511164.b3lyp_6-31g(d).inp

052511164.b3lyp_6-31g(d).qchem.inp (generated)

052511164.b3lyp_6-31g(d).gjf (generated)

052511164.b3lyp_6-31g(d).firefly.inp (generated)

052511164.b3lyp_6-31g(d).smash.inp (generated)

052511164.b3lyp_6-31g(d).nwchem.inp (generated) 052511164.b3lyp_6-31g(d).log.xz 052511164.td-b3lyp_6-31g+(d).inp 052511164.td-b3lyp_6-31g+(d).log.xz

052511164.td-b3lyp_6-31+g(d).qchem.inp (generated)

052511164.td-b3lyp_6-31+g(d).gjf (generated)

052511164.td-b3lyp_6-31+g(d).firefly.inp (generated)

052511164.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052511164.mol 052511164.PUBCHEM 052511164.mol (via Jmol)
052513243.b3lyp_6-31g(d).inp

052513243.b3lyp_6-31g(d).qchem.inp (generated)

052513243.b3lyp_6-31g(d).gjf (generated)

052513243.b3lyp_6-31g(d).firefly.inp (generated)

052513243.b3lyp_6-31g(d).smash.inp (generated)

052513243.b3lyp_6-31g(d).nwchem.inp (generated) 052513243.b3lyp_6-31g(d).log.xz 052513243.td-b3lyp_6-31g+(d).inp 052513243.td-b3lyp_6-31g+(d).log.xz

052513243.td-b3lyp_6-31+g(d).qchem.inp (generated)

052513243.td-b3lyp_6-31+g(d).gjf (generated)

052513243.td-b3lyp_6-31+g(d).firefly.inp (generated)

052513243.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052513243.mol 052513243.PUBCHEM 052513243.mol (via Jmol)
052515476.b3lyp_6-31g(d).inp

052515476.b3lyp_6-31g(d).qchem.inp (generated)

052515476.b3lyp_6-31g(d).gjf (generated)

052515476.b3lyp_6-31g(d).firefly.inp (generated)

052515476.b3lyp_6-31g(d).smash.inp (generated)

052515476.b3lyp_6-31g(d).nwchem.inp (generated) 052515476.b3lyp_6-31g(d).log.xz 052515476.td-b3lyp_6-31g+(d).inp 052515476.td-b3lyp_6-31g+(d).log.xz

052515476.td-b3lyp_6-31+g(d).qchem.inp (generated)

052515476.td-b3lyp_6-31+g(d).gjf (generated)

052515476.td-b3lyp_6-31+g(d).firefly.inp (generated)

052515476.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052515476.mol 052515476.PUBCHEM 052515476.mol (via Jmol)
052515535.b3lyp_6-31g(d).inp

052515535.b3lyp_6-31g(d).qchem.inp (generated)

052515535.b3lyp_6-31g(d).gjf (generated)

052515535.b3lyp_6-31g(d).firefly.inp (generated)

052515535.b3lyp_6-31g(d).smash.inp (generated)

052515535.b3lyp_6-31g(d).nwchem.inp (generated) 052515535.b3lyp_6-31g(d).log.xz 052515535.mol 052515535.PUBCHEM 052515535.mol (via Jmol)
052515684.b3lyp_6-31g(d).inp

052515684.b3lyp_6-31g(d).qchem.inp (generated)

052515684.b3lyp_6-31g(d).gjf (generated)

052515684.b3lyp_6-31g(d).firefly.inp (generated)

052515684.b3lyp_6-31g(d).smash.inp (generated)

052515684.b3lyp_6-31g(d).nwchem.inp (generated) 052515684.b3lyp_6-31g(d).log.xz 052515684.td-b3lyp_6-31g+(d).inp 052515684.td-b3lyp_6-31g+(d).log.xz

052515684.td-b3lyp_6-31+g(d).qchem.inp (generated)

052515684.td-b3lyp_6-31+g(d).gjf (generated)

052515684.td-b3lyp_6-31+g(d).firefly.inp (generated)

052515684.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052515684.mol 052515684.PUBCHEM 052515684.mol (via Jmol)
052516227.b3lyp_6-31g(d).inp

052516227.b3lyp_6-31g(d).qchem.inp (generated)

052516227.b3lyp_6-31g(d).gjf (generated)

052516227.b3lyp_6-31g(d).firefly.inp (generated)

052516227.b3lyp_6-31g(d).smash.inp (generated)

052516227.b3lyp_6-31g(d).nwchem.inp (generated) 052516227.b3lyp_6-31g(d).log.xz 052516227.td-b3lyp_6-31g+(d).inp 052516227.td-b3lyp_6-31g+(d).log.xz

052516227.td-b3lyp_6-31+g(d).qchem.inp (generated)

052516227.td-b3lyp_6-31+g(d).gjf (generated)

052516227.td-b3lyp_6-31+g(d).firefly.inp (generated)

052516227.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052516227.mol 052516227.PUBCHEM 052516227.mol (via Jmol)
052516540.b3lyp_6-31g(d).inp

052516540.b3lyp_6-31g(d).qchem.inp (generated)

052516540.b3lyp_6-31g(d).gjf (generated)

052516540.b3lyp_6-31g(d).firefly.inp (generated)

052516540.b3lyp_6-31g(d).smash.inp (generated)

052516540.b3lyp_6-31g(d).nwchem.inp (generated) 052516540.b3lyp_6-31g(d).log.xz 052516540.td-b3lyp_6-31g+(d).inp 052516540.td-b3lyp_6-31g+(d).log.xz

052516540.td-b3lyp_6-31+g(d).qchem.inp (generated)

052516540.td-b3lyp_6-31+g(d).gjf (generated)

052516540.td-b3lyp_6-31+g(d).firefly.inp (generated)

052516540.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052516540.mol 052516540.PUBCHEM 052516540.mol (via Jmol)
052516541.b3lyp_6-31g(d).inp

052516541.b3lyp_6-31g(d).qchem.inp (generated)

052516541.b3lyp_6-31g(d).gjf (generated)

052516541.b3lyp_6-31g(d).firefly.inp (generated)

052516541.b3lyp_6-31g(d).smash.inp (generated)

052516541.b3lyp_6-31g(d).nwchem.inp (generated) 052516541.b3lyp_6-31g(d).log.xz 052516541.td-b3lyp_6-31g+(d).inp 052516541.td-b3lyp_6-31g+(d).log.xz

052516541.td-b3lyp_6-31+g(d).qchem.inp (generated)

052516541.td-b3lyp_6-31+g(d).gjf (generated)

052516541.td-b3lyp_6-31+g(d).firefly.inp (generated)

052516541.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052516541.mol 052516541.PUBCHEM 052516541.mol (via Jmol)
052516542.b3lyp_6-31g(d).inp

052516542.b3lyp_6-31g(d).qchem.inp (generated)

052516542.b3lyp_6-31g(d).gjf (generated)

052516542.b3lyp_6-31g(d).firefly.inp (generated)

052516542.b3lyp_6-31g(d).smash.inp (generated)

052516542.b3lyp_6-31g(d).nwchem.inp (generated) 052516542.b3lyp_6-31g(d).log.xz 052516542.td-b3lyp_6-31g+(d).inp 052516542.td-b3lyp_6-31g+(d).log.xz

052516542.td-b3lyp_6-31+g(d).qchem.inp (generated)

052516542.td-b3lyp_6-31+g(d).gjf (generated)

052516542.td-b3lyp_6-31+g(d).firefly.inp (generated)

052516542.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052516542.mol 052516542.PUBCHEM 052516542.mol (via Jmol)
052516544.b3lyp_6-31g(d).inp

052516544.b3lyp_6-31g(d).qchem.inp (generated)

052516544.b3lyp_6-31g(d).gjf (generated)

052516544.b3lyp_6-31g(d).firefly.inp (generated)

052516544.b3lyp_6-31g(d).smash.inp (generated)

052516544.b3lyp_6-31g(d).nwchem.inp (generated) 052516544.b3lyp_6-31g(d).log.xz 052516544.td-b3lyp_6-31g+(d).inp 052516544.td-b3lyp_6-31g+(d).log.xz

052516544.td-b3lyp_6-31+g(d).qchem.inp (generated)

052516544.td-b3lyp_6-31+g(d).gjf (generated)

052516544.td-b3lyp_6-31+g(d).firefly.inp (generated)

052516544.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052516544.mol 052516544.PUBCHEM 052516544.mol (via Jmol)
052516546.b3lyp_6-31g(d).inp

052516546.b3lyp_6-31g(d).qchem.inp (generated)

052516546.b3lyp_6-31g(d).gjf (generated)

052516546.b3lyp_6-31g(d).firefly.inp (generated)

052516546.b3lyp_6-31g(d).smash.inp (generated)

052516546.b3lyp_6-31g(d).nwchem.inp (generated) 052516546.b3lyp_6-31g(d).log.xz 052516546.td-b3lyp_6-31g+(d).inp 052516546.td-b3lyp_6-31g+(d).log.xz

052516546.td-b3lyp_6-31+g(d).qchem.inp (generated)

052516546.td-b3lyp_6-31+g(d).gjf (generated)

052516546.td-b3lyp_6-31+g(d).firefly.inp (generated)

052516546.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052516546.mol 052516546.PUBCHEM 052516546.mol (via Jmol)
052516547.b3lyp_6-31g(d).inp

052516547.b3lyp_6-31g(d).qchem.inp (generated)

052516547.b3lyp_6-31g(d).gjf (generated)

052516547.b3lyp_6-31g(d).firefly.inp (generated)

052516547.b3lyp_6-31g(d).smash.inp (generated)

052516547.b3lyp_6-31g(d).nwchem.inp (generated) 052516547.b3lyp_6-31g(d).log.xz 052516547.td-b3lyp_6-31g+(d).inp 052516547.td-b3lyp_6-31g+(d).log.xz

052516547.td-b3lyp_6-31+g(d).qchem.inp (generated)

052516547.td-b3lyp_6-31+g(d).gjf (generated)

052516547.td-b3lyp_6-31+g(d).firefly.inp (generated)

052516547.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052516547.mol 052516547.PUBCHEM 052516547.mol (via Jmol)
052516733.b3lyp_6-31g(d).inp

052516733.b3lyp_6-31g(d).qchem.inp (generated)

052516733.b3lyp_6-31g(d).gjf (generated)

052516733.b3lyp_6-31g(d).firefly.inp (generated)

052516733.b3lyp_6-31g(d).smash.inp (generated)

052516733.b3lyp_6-31g(d).nwchem.inp (generated) 052516733.b3lyp_6-31g(d).log.xz 052516733.td-b3lyp_6-31g+(d).inp 052516733.td-b3lyp_6-31g+(d).log.xz

052516733.td-b3lyp_6-31+g(d).qchem.inp (generated)

052516733.td-b3lyp_6-31+g(d).gjf (generated)

052516733.td-b3lyp_6-31+g(d).firefly.inp (generated)

052516733.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052516733.mol 052516733.PUBCHEM 052516733.mol (via Jmol)
052516775.b3lyp_6-31g(d).inp

052516775.b3lyp_6-31g(d).qchem.inp (generated)

052516775.b3lyp_6-31g(d).gjf (generated)

052516775.b3lyp_6-31g(d).firefly.inp (generated)

052516775.b3lyp_6-31g(d).smash.inp (generated)

052516775.b3lyp_6-31g(d).nwchem.inp (generated) 052516775.b3lyp_6-31g(d).log.xz 052516775.td-b3lyp_6-31g+(d).inp 052516775.td-b3lyp_6-31g+(d).log.xz

052516775.td-b3lyp_6-31+g(d).qchem.inp (generated)

052516775.td-b3lyp_6-31+g(d).gjf (generated)

052516775.td-b3lyp_6-31+g(d).firefly.inp (generated)

052516775.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052516775.mol 052516775.PUBCHEM 052516775.mol (via Jmol)
052516870.b3lyp_6-31g(d).inp

052516870.b3lyp_6-31g(d).qchem.inp (generated)

052516870.b3lyp_6-31g(d).gjf (generated)

052516870.b3lyp_6-31g(d).firefly.inp (generated)

052516870.b3lyp_6-31g(d).smash.inp (generated)

052516870.b3lyp_6-31g(d).nwchem.inp (generated) 052516870.b3lyp_6-31g(d).log.xz 052516870.td-b3lyp_6-31g+(d).inp 052516870.td-b3lyp_6-31g+(d).log.xz

052516870.td-b3lyp_6-31+g(d).qchem.inp (generated)

052516870.td-b3lyp_6-31+g(d).gjf (generated)

052516870.td-b3lyp_6-31+g(d).firefly.inp (generated)

052516870.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052516870.mol 052516870.PUBCHEM 052516870.mol (via Jmol)
052516876.b3lyp_6-31g(d).inp

052516876.b3lyp_6-31g(d).qchem.inp (generated)

052516876.b3lyp_6-31g(d).gjf (generated)

052516876.b3lyp_6-31g(d).firefly.inp (generated)

052516876.b3lyp_6-31g(d).smash.inp (generated)

052516876.b3lyp_6-31g(d).nwchem.inp (generated) 052516876.b3lyp_6-31g(d).log.xz 052516876.td-b3lyp_6-31g+(d).inp 052516876.td-b3lyp_6-31g+(d).log.xz

052516876.td-b3lyp_6-31+g(d).qchem.inp (generated)

052516876.td-b3lyp_6-31+g(d).gjf (generated)

052516876.td-b3lyp_6-31+g(d).firefly.inp (generated)

052516876.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052516876.mol 052516876.PUBCHEM 052516876.mol (via Jmol)
052516881.b3lyp_6-31g(d).inp

052516881.b3lyp_6-31g(d).qchem.inp (generated)

052516881.b3lyp_6-31g(d).gjf (generated)

052516881.b3lyp_6-31g(d).firefly.inp (generated)

052516881.b3lyp_6-31g(d).smash.inp (generated)

052516881.b3lyp_6-31g(d).nwchem.inp (generated) 052516881.b3lyp_6-31g(d).log.xz 052516881.td-b3lyp_6-31g+(d).inp 052516881.td-b3lyp_6-31g+(d).log.xz

052516881.td-b3lyp_6-31+g(d).qchem.inp (generated)

052516881.td-b3lyp_6-31+g(d).gjf (generated)

052516881.td-b3lyp_6-31+g(d).firefly.inp (generated)

052516881.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052516881.mol 052516881.PUBCHEM 052516881.mol (via Jmol)
052516896.b3lyp_6-31g(d).inp

052516896.b3lyp_6-31g(d).qchem.inp (generated)

052516896.b3lyp_6-31g(d).gjf (generated)

052516896.b3lyp_6-31g(d).firefly.inp (generated)

052516896.b3lyp_6-31g(d).smash.inp (generated)

052516896.b3lyp_6-31g(d).nwchem.inp (generated) 052516896.b3lyp_6-31g(d).log.xz 052516896.td-b3lyp_6-31g+(d).inp 052516896.td-b3lyp_6-31g+(d).log.xz

052516896.td-b3lyp_6-31+g(d).qchem.inp (generated)

052516896.td-b3lyp_6-31+g(d).gjf (generated)

052516896.td-b3lyp_6-31+g(d).firefly.inp (generated)

052516896.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052516896.mol 052516896.PUBCHEM 052516896.mol (via Jmol)
052516905.b3lyp_6-31g(d).inp

052516905.b3lyp_6-31g(d).qchem.inp (generated)

052516905.b3lyp_6-31g(d).gjf (generated)

052516905.b3lyp_6-31g(d).firefly.inp (generated)

052516905.b3lyp_6-31g(d).smash.inp (generated)

052516905.b3lyp_6-31g(d).nwchem.inp (generated) 052516905.b3lyp_6-31g(d).log.xz 052516905.td-b3lyp_6-31g+(d).inp 052516905.td-b3lyp_6-31g+(d).log.xz

052516905.td-b3lyp_6-31+g(d).qchem.inp (generated)

052516905.td-b3lyp_6-31+g(d).gjf (generated)

052516905.td-b3lyp_6-31+g(d).firefly.inp (generated)

052516905.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052516905.mol 052516905.PUBCHEM 052516905.mol (via Jmol)
052517770.b3lyp_6-31g(d).inp

052517770.b3lyp_6-31g(d).qchem.inp (generated)

052517770.b3lyp_6-31g(d).gjf (generated)

052517770.b3lyp_6-31g(d).firefly.inp (generated)

052517770.b3lyp_6-31g(d).smash.inp (generated)

052517770.b3lyp_6-31g(d).nwchem.inp (generated) 052517770.b3lyp_6-31g(d).log.xz 052517770.td-b3lyp_6-31g+(d).inp 052517770.td-b3lyp_6-31g+(d).log.xz

052517770.td-b3lyp_6-31+g(d).qchem.inp (generated)

052517770.td-b3lyp_6-31+g(d).gjf (generated)

052517770.td-b3lyp_6-31+g(d).firefly.inp (generated)

052517770.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052517770.mol 052517770.PUBCHEM 052517770.mol (via Jmol)
052517921.b3lyp_6-31g(d).inp

052517921.b3lyp_6-31g(d).qchem.inp (generated)

052517921.b3lyp_6-31g(d).gjf (generated)

052517921.b3lyp_6-31g(d).firefly.inp (generated)

052517921.b3lyp_6-31g(d).smash.inp (generated)

052517921.b3lyp_6-31g(d).nwchem.inp (generated) 052517921.b3lyp_6-31g(d).log.xz 052517921.td-b3lyp_6-31g+(d).inp 052517921.td-b3lyp_6-31g+(d).log.xz

052517921.td-b3lyp_6-31+g(d).qchem.inp (generated)

052517921.td-b3lyp_6-31+g(d).gjf (generated)

052517921.td-b3lyp_6-31+g(d).firefly.inp (generated)

052517921.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052517921.mol 052517921.PUBCHEM 052517921.mol (via Jmol)
052518227.b3lyp_6-31g(d).inp

052518227.b3lyp_6-31g(d).qchem.inp (generated)

052518227.b3lyp_6-31g(d).gjf (generated)

052518227.b3lyp_6-31g(d).firefly.inp (generated)

052518227.b3lyp_6-31g(d).smash.inp (generated)

052518227.b3lyp_6-31g(d).nwchem.inp (generated) 052518227.b3lyp_6-31g(d).log.xz 052518227.td-b3lyp_6-31g+(d).inp 052518227.td-b3lyp_6-31g+(d).log.xz

052518227.td-b3lyp_6-31+g(d).qchem.inp (generated)

052518227.td-b3lyp_6-31+g(d).gjf (generated)

052518227.td-b3lyp_6-31+g(d).firefly.inp (generated)

052518227.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052518227.mol 052518227.PUBCHEM 052518227.mol (via Jmol)
052518229.b3lyp_6-31g(d).inp

052518229.b3lyp_6-31g(d).qchem.inp (generated)

052518229.b3lyp_6-31g(d).gjf (generated)

052518229.b3lyp_6-31g(d).firefly.inp (generated)

052518229.b3lyp_6-31g(d).smash.inp (generated)

052518229.b3lyp_6-31g(d).nwchem.inp (generated) 052518229.b3lyp_6-31g(d).log.xz 052518229.td-b3lyp_6-31g+(d).inp 052518229.td-b3lyp_6-31g+(d).log.xz

052518229.td-b3lyp_6-31+g(d).qchem.inp (generated)

052518229.td-b3lyp_6-31+g(d).gjf (generated)

052518229.td-b3lyp_6-31+g(d).firefly.inp (generated)

052518229.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052518229.mol 052518229.PUBCHEM 052518229.mol (via Jmol)
052518712.b3lyp_6-31g(d).inp

052518712.b3lyp_6-31g(d).qchem.inp (generated)

052518712.b3lyp_6-31g(d).gjf (generated)

052518712.b3lyp_6-31g(d).firefly.inp (generated)

052518712.b3lyp_6-31g(d).smash.inp (generated)

052518712.b3lyp_6-31g(d).nwchem.inp (generated) 052518712.b3lyp_6-31g(d).log.xz 052518712.td-b3lyp_6-31g+(d).inp 052518712.td-b3lyp_6-31g+(d).log.xz

052518712.td-b3lyp_6-31+g(d).qchem.inp (generated)

052518712.td-b3lyp_6-31+g(d).gjf (generated)

052518712.td-b3lyp_6-31+g(d).firefly.inp (generated)

052518712.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052518712.mol 052518712.PUBCHEM 052518712.mol (via Jmol)
052518713.b3lyp_6-31g(d).inp

052518713.b3lyp_6-31g(d).qchem.inp (generated)

052518713.b3lyp_6-31g(d).gjf (generated)

052518713.b3lyp_6-31g(d).firefly.inp (generated)

052518713.b3lyp_6-31g(d).smash.inp (generated)

052518713.b3lyp_6-31g(d).nwchem.inp (generated) 052518713.b3lyp_6-31g(d).log.xz 052518713.td-b3lyp_6-31g+(d).inp 052518713.td-b3lyp_6-31g+(d).log.xz

052518713.td-b3lyp_6-31+g(d).qchem.inp (generated)

052518713.td-b3lyp_6-31+g(d).gjf (generated)

052518713.td-b3lyp_6-31+g(d).firefly.inp (generated)

052518713.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052518713.mol 052518713.PUBCHEM 052518713.mol (via Jmol)
052519093.b3lyp_6-31g(d).inp

052519093.b3lyp_6-31g(d).qchem.inp (generated)

052519093.b3lyp_6-31g(d).gjf (generated)

052519093.b3lyp_6-31g(d).firefly.inp (generated)

052519093.b3lyp_6-31g(d).smash.inp (generated)

052519093.b3lyp_6-31g(d).nwchem.inp (generated) 052519093.b3lyp_6-31g(d).log.xz 052519093.td-b3lyp_6-31g+(d).inp 052519093.td-b3lyp_6-31g+(d).log.xz

052519093.td-b3lyp_6-31+g(d).qchem.inp (generated)

052519093.td-b3lyp_6-31+g(d).gjf (generated)

052519093.td-b3lyp_6-31+g(d).firefly.inp (generated)

052519093.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052519093.mol 052519093.PUBCHEM 052519093.mol (via Jmol)
052519262.b3lyp_6-31g(d).inp

052519262.b3lyp_6-31g(d).qchem.inp (generated)

052519262.b3lyp_6-31g(d).gjf (generated)

052519262.b3lyp_6-31g(d).firefly.inp (generated)

052519262.b3lyp_6-31g(d).smash.inp (generated)

052519262.b3lyp_6-31g(d).nwchem.inp (generated) 052519262.b3lyp_6-31g(d).log.xz 052519262.td-b3lyp_6-31g+(d).inp 052519262.td-b3lyp_6-31g+(d).log.xz

052519262.td-b3lyp_6-31+g(d).qchem.inp (generated)

052519262.td-b3lyp_6-31+g(d).gjf (generated)

052519262.td-b3lyp_6-31+g(d).firefly.inp (generated)

052519262.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052519262.mol 052519262.PUBCHEM 052519262.mol (via Jmol)
052519333.b3lyp_6-31g(d).inp

052519333.b3lyp_6-31g(d).qchem.inp (generated)

052519333.b3lyp_6-31g(d).gjf (generated)

052519333.b3lyp_6-31g(d).firefly.inp (generated)

052519333.b3lyp_6-31g(d).smash.inp (generated)

052519333.b3lyp_6-31g(d).nwchem.inp (generated) 052519333.b3lyp_6-31g(d).log.xz 052519333.td-b3lyp_6-31g+(d).inp 052519333.td-b3lyp_6-31g+(d).log.xz

052519333.td-b3lyp_6-31+g(d).qchem.inp (generated)

052519333.td-b3lyp_6-31+g(d).gjf (generated)

052519333.td-b3lyp_6-31+g(d).firefly.inp (generated)

052519333.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052519333.mol 052519333.PUBCHEM 052519333.mol (via Jmol)
052519334.b3lyp_6-31g(d).inp

052519334.b3lyp_6-31g(d).qchem.inp (generated)

052519334.b3lyp_6-31g(d).gjf (generated)

052519334.b3lyp_6-31g(d).firefly.inp (generated)

052519334.b3lyp_6-31g(d).smash.inp (generated)

052519334.b3lyp_6-31g(d).nwchem.inp (generated) 052519334.b3lyp_6-31g(d).log.xz 052519334.td-b3lyp_6-31g+(d).inp 052519334.td-b3lyp_6-31g+(d).log.xz

052519334.td-b3lyp_6-31+g(d).qchem.inp (generated)

052519334.td-b3lyp_6-31+g(d).gjf (generated)

052519334.td-b3lyp_6-31+g(d).firefly.inp (generated)

052519334.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052519334.mol 052519334.PUBCHEM 052519334.mol (via Jmol)
052519480.b3lyp_6-31g(d).inp

052519480.b3lyp_6-31g(d).qchem.inp (generated)

052519480.b3lyp_6-31g(d).gjf (generated)

052519480.b3lyp_6-31g(d).firefly.inp (generated)

052519480.b3lyp_6-31g(d).smash.inp (generated)

052519480.b3lyp_6-31g(d).nwchem.inp (generated) 052519480.b3lyp_6-31g(d).log.xz 052519480.td-b3lyp_6-31g+(d).inp 052519480.td-b3lyp_6-31g+(d).log.xz

052519480.td-b3lyp_6-31+g(d).qchem.inp (generated)

052519480.td-b3lyp_6-31+g(d).gjf (generated)

052519480.td-b3lyp_6-31+g(d).firefly.inp (generated)

052519480.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052519480.mol 052519480.PUBCHEM 052519480.mol (via Jmol)
052519524.b3lyp_6-31g(d).inp

052519524.b3lyp_6-31g(d).qchem.inp (generated)

052519524.b3lyp_6-31g(d).gjf (generated)

052519524.b3lyp_6-31g(d).firefly.inp (generated)

052519524.b3lyp_6-31g(d).smash.inp (generated)

052519524.b3lyp_6-31g(d).nwchem.inp (generated) 052519524.b3lyp_6-31g(d).log.xz 052519524.td-b3lyp_6-31g+(d).inp 052519524.td-b3lyp_6-31g+(d).log.xz

052519524.td-b3lyp_6-31+g(d).qchem.inp (generated)

052519524.td-b3lyp_6-31+g(d).gjf (generated)

052519524.td-b3lyp_6-31+g(d).firefly.inp (generated)

052519524.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052519524.mol 052519524.PUBCHEM 052519524.mol (via Jmol)
052519616.b3lyp_6-31g(d).inp

052519616.b3lyp_6-31g(d).qchem.inp (generated)

052519616.b3lyp_6-31g(d).gjf (generated)

052519616.b3lyp_6-31g(d).firefly.inp (generated)

052519616.b3lyp_6-31g(d).smash.inp (generated)

052519616.b3lyp_6-31g(d).nwchem.inp (generated) 052519616.b3lyp_6-31g(d).log.xz 052519616.td-b3lyp_6-31g+(d).inp 052519616.td-b3lyp_6-31g+(d).log.xz

052519616.td-b3lyp_6-31+g(d).qchem.inp (generated)

052519616.td-b3lyp_6-31+g(d).gjf (generated)

052519616.td-b3lyp_6-31+g(d).firefly.inp (generated)

052519616.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052519616.mol 052519616.PUBCHEM 052519616.mol (via Jmol)
052519617.b3lyp_6-31g(d).inp

052519617.b3lyp_6-31g(d).qchem.inp (generated)

052519617.b3lyp_6-31g(d).gjf (generated)

052519617.b3lyp_6-31g(d).firefly.inp (generated)

052519617.b3lyp_6-31g(d).smash.inp (generated)

052519617.b3lyp_6-31g(d).nwchem.inp (generated) 052519617.b3lyp_6-31g(d).log.xz 052519617.td-b3lyp_6-31g+(d).inp 052519617.td-b3lyp_6-31g+(d).log.xz

052519617.td-b3lyp_6-31+g(d).qchem.inp (generated)

052519617.td-b3lyp_6-31+g(d).gjf (generated)

052519617.td-b3lyp_6-31+g(d).firefly.inp (generated)

052519617.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052519617.mol 052519617.PUBCHEM 052519617.mol (via Jmol)
052519743.b3lyp_6-31g(d).inp

052519743.b3lyp_6-31g(d).qchem.inp (generated)

052519743.b3lyp_6-31g(d).gjf (generated)

052519743.b3lyp_6-31g(d).firefly.inp (generated)

052519743.b3lyp_6-31g(d).smash.inp (generated)

052519743.b3lyp_6-31g(d).nwchem.inp (generated) 052519743.b3lyp_6-31g(d).log.xz 052519743.td-b3lyp_6-31g+(d).inp 052519743.td-b3lyp_6-31g+(d).log.xz

052519743.td-b3lyp_6-31+g(d).qchem.inp (generated)

052519743.td-b3lyp_6-31+g(d).gjf (generated)

052519743.td-b3lyp_6-31+g(d).firefly.inp (generated)

052519743.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052519743.mol 052519743.PUBCHEM 052519743.mol (via Jmol)
052519744.b3lyp_6-31g(d).inp

052519744.b3lyp_6-31g(d).qchem.inp (generated)

052519744.b3lyp_6-31g(d).gjf (generated)

052519744.b3lyp_6-31g(d).firefly.inp (generated)

052519744.b3lyp_6-31g(d).smash.inp (generated)

052519744.b3lyp_6-31g(d).nwchem.inp (generated) 052519744.b3lyp_6-31g(d).log.xz 052519744.td-b3lyp_6-31g+(d).inp 052519744.td-b3lyp_6-31g+(d).log.xz

052519744.td-b3lyp_6-31+g(d).qchem.inp (generated)

052519744.td-b3lyp_6-31+g(d).gjf (generated)

052519744.td-b3lyp_6-31+g(d).firefly.inp (generated)

052519744.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052519744.mol 052519744.PUBCHEM 052519744.mol (via Jmol)
052519811.b3lyp_6-31g(d).inp

052519811.b3lyp_6-31g(d).qchem.inp (generated)

052519811.b3lyp_6-31g(d).gjf (generated)

052519811.b3lyp_6-31g(d).firefly.inp (generated)

052519811.b3lyp_6-31g(d).smash.inp (generated)

052519811.b3lyp_6-31g(d).nwchem.inp (generated) 052519811.b3lyp_6-31g(d).log.xz 052519811.td-b3lyp_6-31g+(d).inp 052519811.td-b3lyp_6-31g+(d).log.xz

052519811.td-b3lyp_6-31+g(d).qchem.inp (generated)

052519811.td-b3lyp_6-31+g(d).gjf (generated)

052519811.td-b3lyp_6-31+g(d).firefly.inp (generated)

052519811.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052519811.mol 052519811.PUBCHEM 052519811.mol (via Jmol)
052519812.b3lyp_6-31g(d).inp

052519812.b3lyp_6-31g(d).qchem.inp (generated)

052519812.b3lyp_6-31g(d).gjf (generated)

052519812.b3lyp_6-31g(d).firefly.inp (generated)

052519812.b3lyp_6-31g(d).smash.inp (generated)

052519812.b3lyp_6-31g(d).nwchem.inp (generated) 052519812.b3lyp_6-31g(d).log.xz 052519812.td-b3lyp_6-31g+(d).inp 052519812.td-b3lyp_6-31g+(d).log.xz

052519812.td-b3lyp_6-31+g(d).qchem.inp (generated)

052519812.td-b3lyp_6-31+g(d).gjf (generated)

052519812.td-b3lyp_6-31+g(d).firefly.inp (generated)

052519812.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052519812.mol 052519812.PUBCHEM 052519812.mol (via Jmol)
052519815.b3lyp_6-31g(d).inp

052519815.b3lyp_6-31g(d).qchem.inp (generated)

052519815.b3lyp_6-31g(d).gjf (generated)

052519815.b3lyp_6-31g(d).firefly.inp (generated)

052519815.b3lyp_6-31g(d).smash.inp (generated)

052519815.b3lyp_6-31g(d).nwchem.inp (generated) 052519815.b3lyp_6-31g(d).log.xz 052519815.td-b3lyp_6-31g+(d).inp 052519815.td-b3lyp_6-31g+(d).log.xz

052519815.td-b3lyp_6-31+g(d).qchem.inp (generated)

052519815.td-b3lyp_6-31+g(d).gjf (generated)

052519815.td-b3lyp_6-31+g(d).firefly.inp (generated)

052519815.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052519815.mol 052519815.PUBCHEM 052519815.mol (via Jmol)
052519816.b3lyp_6-31g(d).inp

052519816.b3lyp_6-31g(d).qchem.inp (generated)

052519816.b3lyp_6-31g(d).gjf (generated)

052519816.b3lyp_6-31g(d).firefly.inp (generated)

052519816.b3lyp_6-31g(d).smash.inp (generated)

052519816.b3lyp_6-31g(d).nwchem.inp (generated) 052519816.b3lyp_6-31g(d).log.xz 052519816.td-b3lyp_6-31g+(d).inp 052519816.td-b3lyp_6-31g+(d).log.xz

052519816.td-b3lyp_6-31+g(d).qchem.inp (generated)

052519816.td-b3lyp_6-31+g(d).gjf (generated)

052519816.td-b3lyp_6-31+g(d).firefly.inp (generated)

052519816.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052519816.mol 052519816.PUBCHEM 052519816.mol (via Jmol)
052519819.b3lyp_6-31g(d).inp

052519819.b3lyp_6-31g(d).qchem.inp (generated)

052519819.b3lyp_6-31g(d).gjf (generated)

052519819.b3lyp_6-31g(d).firefly.inp (generated)

052519819.b3lyp_6-31g(d).smash.inp (generated)

052519819.b3lyp_6-31g(d).nwchem.inp (generated) 052519819.b3lyp_6-31g(d).log.xz 052519819.td-b3lyp_6-31g+(d).inp 052519819.td-b3lyp_6-31g+(d).log.xz

052519819.td-b3lyp_6-31+g(d).qchem.inp (generated)

052519819.td-b3lyp_6-31+g(d).gjf (generated)

052519819.td-b3lyp_6-31+g(d).firefly.inp (generated)

052519819.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052519819.mol 052519819.PUBCHEM 052519819.mol (via Jmol)
052519885.b3lyp_6-31g(d).inp

052519885.b3lyp_6-31g(d).qchem.inp (generated)

052519885.b3lyp_6-31g(d).gjf (generated)

052519885.b3lyp_6-31g(d).firefly.inp (generated)

052519885.b3lyp_6-31g(d).smash.inp (generated)

052519885.b3lyp_6-31g(d).nwchem.inp (generated) 052519885.b3lyp_6-31g(d).log.xz 052519885.td-b3lyp_6-31g+(d).inp 052519885.td-b3lyp_6-31g+(d).log.xz

052519885.td-b3lyp_6-31+g(d).qchem.inp (generated)

052519885.td-b3lyp_6-31+g(d).gjf (generated)

052519885.td-b3lyp_6-31+g(d).firefly.inp (generated)

052519885.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052519885.mol 052519885.PUBCHEM 052519885.mol (via Jmol)
052519886.b3lyp_6-31g(d).inp

052519886.b3lyp_6-31g(d).qchem.inp (generated)

052519886.b3lyp_6-31g(d).gjf (generated)

052519886.b3lyp_6-31g(d).firefly.inp (generated)

052519886.b3lyp_6-31g(d).smash.inp (generated)

052519886.b3lyp_6-31g(d).nwchem.inp (generated) 052519886.b3lyp_6-31g(d).log.xz 052519886.td-b3lyp_6-31g+(d).inp 052519886.td-b3lyp_6-31g+(d).log.xz

052519886.td-b3lyp_6-31+g(d).qchem.inp (generated)

052519886.td-b3lyp_6-31+g(d).gjf (generated)

052519886.td-b3lyp_6-31+g(d).firefly.inp (generated)

052519886.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052519886.mol 052519886.PUBCHEM 052519886.mol (via Jmol)
052520988.b3lyp_6-31g(d).inp

052520988.b3lyp_6-31g(d).qchem.inp (generated)

052520988.b3lyp_6-31g(d).gjf (generated)

052520988.b3lyp_6-31g(d).firefly.inp (generated)

052520988.b3lyp_6-31g(d).smash.inp (generated)

052520988.b3lyp_6-31g(d).nwchem.inp (generated) 052520988.b3lyp_6-31g(d).log.xz 052520988.td-b3lyp_6-31g+(d).inp 052520988.td-b3lyp_6-31g+(d).log.xz

052520988.td-b3lyp_6-31+g(d).qchem.inp (generated)

052520988.td-b3lyp_6-31+g(d).gjf (generated)

052520988.td-b3lyp_6-31+g(d).firefly.inp (generated)

052520988.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052520988.mol 052520988.PUBCHEM 052520988.mol (via Jmol)
052520989.b3lyp_6-31g(d).inp

052520989.b3lyp_6-31g(d).qchem.inp (generated)

052520989.b3lyp_6-31g(d).gjf (generated)

052520989.b3lyp_6-31g(d).firefly.inp (generated)

052520989.b3lyp_6-31g(d).smash.inp (generated)

052520989.b3lyp_6-31g(d).nwchem.inp (generated) 052520989.b3lyp_6-31g(d).log.xz 052520989.td-b3lyp_6-31g+(d).inp 052520989.td-b3lyp_6-31g+(d).log.xz

052520989.td-b3lyp_6-31+g(d).qchem.inp (generated)

052520989.td-b3lyp_6-31+g(d).gjf (generated)

052520989.td-b3lyp_6-31+g(d).firefly.inp (generated)

052520989.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052520989.mol 052520989.PUBCHEM 052520989.mol (via Jmol)
052521025.b3lyp_6-31g(d).inp

052521025.b3lyp_6-31g(d).qchem.inp (generated)

052521025.b3lyp_6-31g(d).gjf (generated)

052521025.b3lyp_6-31g(d).firefly.inp (generated)

052521025.b3lyp_6-31g(d).smash.inp (generated)

052521025.b3lyp_6-31g(d).nwchem.inp (generated) 052521025.b3lyp_6-31g(d).log.xz 052521025.mol 052521025.PUBCHEM 052521025.mol (via Jmol)
052521188.b3lyp_6-31g(d).inp

052521188.b3lyp_6-31g(d).qchem.inp (generated)

052521188.b3lyp_6-31g(d).gjf (generated)

052521188.b3lyp_6-31g(d).firefly.inp (generated)

052521188.b3lyp_6-31g(d).smash.inp (generated)

052521188.b3lyp_6-31g(d).nwchem.inp (generated) 052521188.b3lyp_6-31g(d).log.xz 052521188.td-b3lyp_6-31g+(d).inp 052521188.td-b3lyp_6-31g+(d).log.xz

052521188.td-b3lyp_6-31+g(d).qchem.inp (generated)

052521188.td-b3lyp_6-31+g(d).gjf (generated)

052521188.td-b3lyp_6-31+g(d).firefly.inp (generated)

052521188.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052521188.mol 052521188.PUBCHEM 052521188.mol (via Jmol)
052521189.b3lyp_6-31g(d).inp

052521189.b3lyp_6-31g(d).qchem.inp (generated)

052521189.b3lyp_6-31g(d).gjf (generated)

052521189.b3lyp_6-31g(d).firefly.inp (generated)

052521189.b3lyp_6-31g(d).smash.inp (generated)

052521189.b3lyp_6-31g(d).nwchem.inp (generated) 052521189.b3lyp_6-31g(d).log.xz 052521189.td-b3lyp_6-31g+(d).inp 052521189.td-b3lyp_6-31g+(d).log.xz

052521189.td-b3lyp_6-31+g(d).qchem.inp (generated)

052521189.td-b3lyp_6-31+g(d).gjf (generated)

052521189.td-b3lyp_6-31+g(d).firefly.inp (generated)

052521189.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052521189.mol 052521189.PUBCHEM 052521189.mol (via Jmol)
052521242.b3lyp_6-31g(d).inp

052521242.b3lyp_6-31g(d).qchem.inp (generated)

052521242.b3lyp_6-31g(d).gjf (generated)

052521242.b3lyp_6-31g(d).firefly.inp (generated)

052521242.b3lyp_6-31g(d).smash.inp (generated)

052521242.b3lyp_6-31g(d).nwchem.inp (generated) 052521242.b3lyp_6-31g(d).log.xz 052521242.td-b3lyp_6-31g+(d).inp 052521242.td-b3lyp_6-31g+(d).log.xz

052521242.td-b3lyp_6-31+g(d).qchem.inp (generated)

052521242.td-b3lyp_6-31+g(d).gjf (generated)

052521242.td-b3lyp_6-31+g(d).firefly.inp (generated)

052521242.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052521242.mol 052521242.PUBCHEM 052521242.mol (via Jmol)
052521243.b3lyp_6-31g(d).inp

052521243.b3lyp_6-31g(d).qchem.inp (generated)

052521243.b3lyp_6-31g(d).gjf (generated)

052521243.b3lyp_6-31g(d).firefly.inp (generated)

052521243.b3lyp_6-31g(d).smash.inp (generated)

052521243.b3lyp_6-31g(d).nwchem.inp (generated) 052521243.b3lyp_6-31g(d).log.xz 052521243.td-b3lyp_6-31g+(d).inp 052521243.td-b3lyp_6-31g+(d).log.xz

052521243.td-b3lyp_6-31+g(d).qchem.inp (generated)

052521243.td-b3lyp_6-31+g(d).gjf (generated)

052521243.td-b3lyp_6-31+g(d).firefly.inp (generated)

052521243.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052521243.mol 052521243.PUBCHEM 052521243.mol (via Jmol)
052521853.b3lyp_6-31g(d).inp

052521853.b3lyp_6-31g(d).qchem.inp (generated)

052521853.b3lyp_6-31g(d).gjf (generated)

052521853.b3lyp_6-31g(d).firefly.inp (generated)

052521853.b3lyp_6-31g(d).smash.inp (generated)

052521853.b3lyp_6-31g(d).nwchem.inp (generated) 052521853.b3lyp_6-31g(d).log.xz 052521853.td-b3lyp_6-31g+(d).inp 052521853.td-b3lyp_6-31g+(d).log.xz

052521853.td-b3lyp_6-31+g(d).qchem.inp (generated)

052521853.td-b3lyp_6-31+g(d).gjf (generated)

052521853.td-b3lyp_6-31+g(d).firefly.inp (generated)

052521853.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052521853.mol 052521853.PUBCHEM 052521853.mol (via Jmol)
052521865.b3lyp_6-31g(d).inp

052521865.b3lyp_6-31g(d).qchem.inp (generated)

052521865.b3lyp_6-31g(d).gjf (generated)

052521865.b3lyp_6-31g(d).firefly.inp (generated)

052521865.b3lyp_6-31g(d).smash.inp (generated)

052521865.b3lyp_6-31g(d).nwchem.inp (generated) 052521865.b3lyp_6-31g(d).log.xz 052521865.td-b3lyp_6-31g+(d).inp 052521865.td-b3lyp_6-31g+(d).log.xz

052521865.td-b3lyp_6-31+g(d).qchem.inp (generated)

052521865.td-b3lyp_6-31+g(d).gjf (generated)

052521865.td-b3lyp_6-31+g(d).firefly.inp (generated)

052521865.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052521865.mol 052521865.PUBCHEM 052521865.mol (via Jmol)
052522203.b3lyp_6-31g(d).inp

052522203.b3lyp_6-31g(d).qchem.inp (generated)

052522203.b3lyp_6-31g(d).gjf (generated)

052522203.b3lyp_6-31g(d).firefly.inp (generated)

052522203.b3lyp_6-31g(d).smash.inp (generated)

052522203.b3lyp_6-31g(d).nwchem.inp (generated) 052522203.b3lyp_6-31g(d).log.xz 052522203.td-b3lyp_6-31g+(d).inp 052522203.td-b3lyp_6-31g+(d).log.xz

052522203.td-b3lyp_6-31+g(d).qchem.inp (generated)

052522203.td-b3lyp_6-31+g(d).gjf (generated)

052522203.td-b3lyp_6-31+g(d).firefly.inp (generated)

052522203.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052522203.mol 052522203.PUBCHEM 052522203.mol (via Jmol)
052522208.b3lyp_6-31g(d).inp

052522208.b3lyp_6-31g(d).qchem.inp (generated)

052522208.b3lyp_6-31g(d).gjf (generated)

052522208.b3lyp_6-31g(d).firefly.inp (generated)

052522208.b3lyp_6-31g(d).smash.inp (generated)

052522208.b3lyp_6-31g(d).nwchem.inp (generated) 052522208.b3lyp_6-31g(d).log.xz 052522208.td-b3lyp_6-31g+(d).inp 052522208.td-b3lyp_6-31g+(d).log.xz

052522208.td-b3lyp_6-31+g(d).qchem.inp (generated)

052522208.td-b3lyp_6-31+g(d).gjf (generated)

052522208.td-b3lyp_6-31+g(d).firefly.inp (generated)

052522208.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052522208.mol 052522208.PUBCHEM 052522208.mol (via Jmol)
052522244.b3lyp_6-31g(d).inp

052522244.b3lyp_6-31g(d).qchem.inp (generated)

052522244.b3lyp_6-31g(d).gjf (generated)

052522244.b3lyp_6-31g(d).firefly.inp (generated)

052522244.b3lyp_6-31g(d).smash.inp (generated)

052522244.b3lyp_6-31g(d).nwchem.inp (generated) 052522244.b3lyp_6-31g(d).log.xz 052522244.td-b3lyp_6-31g+(d).inp 052522244.td-b3lyp_6-31g+(d).log.xz

052522244.td-b3lyp_6-31+g(d).qchem.inp (generated)

052522244.td-b3lyp_6-31+g(d).gjf (generated)

052522244.td-b3lyp_6-31+g(d).firefly.inp (generated)

052522244.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052522244.mol 052522244.PUBCHEM 052522244.mol (via Jmol)
052522583.b3lyp_6-31g(d).inp

052522583.b3lyp_6-31g(d).qchem.inp (generated)

052522583.b3lyp_6-31g(d).gjf (generated)

052522583.b3lyp_6-31g(d).firefly.inp (generated)

052522583.b3lyp_6-31g(d).smash.inp (generated)

052522583.b3lyp_6-31g(d).nwchem.inp (generated) 052522583.b3lyp_6-31g(d).log.xz 052522583.td-b3lyp_6-31g+(d).inp 052522583.td-b3lyp_6-31g+(d).log.xz

052522583.td-b3lyp_6-31+g(d).qchem.inp (generated)

052522583.td-b3lyp_6-31+g(d).gjf (generated)

052522583.td-b3lyp_6-31+g(d).firefly.inp (generated)

052522583.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052522583.mol 052522583.PUBCHEM 052522583.mol (via Jmol)
052522584.b3lyp_6-31g(d).inp

052522584.b3lyp_6-31g(d).qchem.inp (generated)

052522584.b3lyp_6-31g(d).gjf (generated)

052522584.b3lyp_6-31g(d).firefly.inp (generated)

052522584.b3lyp_6-31g(d).smash.inp (generated)

052522584.b3lyp_6-31g(d).nwchem.inp (generated) 052522584.b3lyp_6-31g(d).log.xz 052522584.td-b3lyp_6-31g+(d).inp 052522584.td-b3lyp_6-31g+(d).log.xz

052522584.td-b3lyp_6-31+g(d).qchem.inp (generated)

052522584.td-b3lyp_6-31+g(d).gjf (generated)

052522584.td-b3lyp_6-31+g(d).firefly.inp (generated)

052522584.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052522584.mol 052522584.PUBCHEM 052522584.mol (via Jmol)
052522891.b3lyp_6-31g(d).inp

052522891.b3lyp_6-31g(d).qchem.inp (generated)

052522891.b3lyp_6-31g(d).gjf (generated)

052522891.b3lyp_6-31g(d).firefly.inp (generated)

052522891.b3lyp_6-31g(d).smash.inp (generated)

052522891.b3lyp_6-31g(d).nwchem.inp (generated) 052522891.b3lyp_6-31g(d).log.xz 052522891.td-b3lyp_6-31g+(d).inp 052522891.td-b3lyp_6-31g+(d).log.xz

052522891.td-b3lyp_6-31+g(d).qchem.inp (generated)

052522891.td-b3lyp_6-31+g(d).gjf (generated)

052522891.td-b3lyp_6-31+g(d).firefly.inp (generated)

052522891.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052522891.mol 052522891.PUBCHEM 052522891.mol (via Jmol)
052522892.b3lyp_6-31g(d).inp

052522892.b3lyp_6-31g(d).qchem.inp (generated)

052522892.b3lyp_6-31g(d).gjf (generated)

052522892.b3lyp_6-31g(d).firefly.inp (generated)

052522892.b3lyp_6-31g(d).smash.inp (generated)

052522892.b3lyp_6-31g(d).nwchem.inp (generated) 052522892.b3lyp_6-31g(d).log.xz 052522892.td-b3lyp_6-31g+(d).inp 052522892.td-b3lyp_6-31g+(d).log.xz

052522892.td-b3lyp_6-31+g(d).qchem.inp (generated)

052522892.td-b3lyp_6-31+g(d).gjf (generated)

052522892.td-b3lyp_6-31+g(d).firefly.inp (generated)

052522892.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052522892.mol 052522892.PUBCHEM 052522892.mol (via Jmol)
052522990.b3lyp_6-31g(d).inp

052522990.b3lyp_6-31g(d).qchem.inp (generated)

052522990.b3lyp_6-31g(d).gjf (generated)

052522990.b3lyp_6-31g(d).firefly.inp (generated)

052522990.b3lyp_6-31g(d).smash.inp (generated)

052522990.b3lyp_6-31g(d).nwchem.inp (generated) 052522990.b3lyp_6-31g(d).log.xz 052522990.mol 052522990.PUBCHEM 052522990.mol (via Jmol)
052522993.b3lyp_6-31g(d).inp

052522993.b3lyp_6-31g(d).qchem.inp (generated)

052522993.b3lyp_6-31g(d).gjf (generated)

052522993.b3lyp_6-31g(d).firefly.inp (generated)

052522993.b3lyp_6-31g(d).smash.inp (generated)

052522993.b3lyp_6-31g(d).nwchem.inp (generated) 052522993.b3lyp_6-31g(d).log.xz 052522993.td-b3lyp_6-31g+(d).inp 052522993.td-b3lyp_6-31g+(d).log.xz

052522993.td-b3lyp_6-31+g(d).qchem.inp (generated)

052522993.td-b3lyp_6-31+g(d).gjf (generated)

052522993.td-b3lyp_6-31+g(d).firefly.inp (generated)

052522993.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052522993.mol 052522993.PUBCHEM 052522993.mol (via Jmol)
052524282.b3lyp_6-31g(d).inp

052524282.b3lyp_6-31g(d).qchem.inp (generated)

052524282.b3lyp_6-31g(d).gjf (generated)

052524282.b3lyp_6-31g(d).firefly.inp (generated)

052524282.b3lyp_6-31g(d).smash.inp (generated)

052524282.b3lyp_6-31g(d).nwchem.inp (generated) 052524282.b3lyp_6-31g(d).log.xz 052524282.td-b3lyp_6-31g+(d).inp 052524282.td-b3lyp_6-31g+(d).log.xz

052524282.td-b3lyp_6-31+g(d).qchem.inp (generated)

052524282.td-b3lyp_6-31+g(d).gjf (generated)

052524282.td-b3lyp_6-31+g(d).firefly.inp (generated)

052524282.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052524282.mol 052524282.PUBCHEM 052524282.mol (via Jmol)
052524313.b3lyp_6-31g(d).inp

052524313.b3lyp_6-31g(d).qchem.inp (generated)

052524313.b3lyp_6-31g(d).gjf (generated)

052524313.b3lyp_6-31g(d).firefly.inp (generated)

052524313.b3lyp_6-31g(d).smash.inp (generated)

052524313.b3lyp_6-31g(d).nwchem.inp (generated) 052524313.b3lyp_6-31g(d).log.xz 052524313.mol 052524313.PUBCHEM 052524313.mol (via Jmol)
052524314.b3lyp_6-31g(d).inp

052524314.b3lyp_6-31g(d).qchem.inp (generated)

052524314.b3lyp_6-31g(d).gjf (generated)

052524314.b3lyp_6-31g(d).firefly.inp (generated)

052524314.b3lyp_6-31g(d).smash.inp (generated)

052524314.b3lyp_6-31g(d).nwchem.inp (generated) 052524314.b3lyp_6-31g(d).log.xz 052524314.mol 052524314.PUBCHEM 052524314.mol (via Jmol)
052524329.b3lyp_6-31g(d).inp

052524329.b3lyp_6-31g(d).qchem.inp (generated)

052524329.b3lyp_6-31g(d).gjf (generated)

052524329.b3lyp_6-31g(d).firefly.inp (generated)

052524329.b3lyp_6-31g(d).smash.inp (generated)

052524329.b3lyp_6-31g(d).nwchem.inp (generated) 052524329.b3lyp_6-31g(d).log.xz 052524329.mol 052524329.PUBCHEM 052524329.mol (via Jmol)
052524343.b3lyp_6-31g(d).inp

052524343.b3lyp_6-31g(d).qchem.inp (generated)

052524343.b3lyp_6-31g(d).gjf (generated)

052524343.b3lyp_6-31g(d).firefly.inp (generated)

052524343.b3lyp_6-31g(d).smash.inp (generated)

052524343.b3lyp_6-31g(d).nwchem.inp (generated) 052524343.b3lyp_6-31g(d).log.xz 052524343.mol 052524343.PUBCHEM 052524343.mol (via Jmol)
052524344.b3lyp_6-31g(d).inp

052524344.b3lyp_6-31g(d).qchem.inp (generated)

052524344.b3lyp_6-31g(d).gjf (generated)

052524344.b3lyp_6-31g(d).firefly.inp (generated)

052524344.b3lyp_6-31g(d).smash.inp (generated)

052524344.b3lyp_6-31g(d).nwchem.inp (generated) 052524344.b3lyp_6-31g(d).log.xz 052524344.mol 052524344.PUBCHEM 052524344.mol (via Jmol)
052524345.b3lyp_6-31g(d).inp

052524345.b3lyp_6-31g(d).qchem.inp (generated)

052524345.b3lyp_6-31g(d).gjf (generated)

052524345.b3lyp_6-31g(d).firefly.inp (generated)

052524345.b3lyp_6-31g(d).smash.inp (generated)

052524345.b3lyp_6-31g(d).nwchem.inp (generated) 052524345.b3lyp_6-31g(d).log.xz 052524345.td-b3lyp_6-31g+(d).inp 052524345.td-b3lyp_6-31g+(d).log.xz

052524345.td-b3lyp_6-31+g(d).qchem.inp (generated)

052524345.td-b3lyp_6-31+g(d).gjf (generated)

052524345.td-b3lyp_6-31+g(d).firefly.inp (generated)

052524345.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052524345.mol 052524345.PUBCHEM 052524345.mol (via Jmol)
052524347.b3lyp_6-31g(d).inp

052524347.b3lyp_6-31g(d).qchem.inp (generated)

052524347.b3lyp_6-31g(d).gjf (generated)

052524347.b3lyp_6-31g(d).firefly.inp (generated)

052524347.b3lyp_6-31g(d).smash.inp (generated)

052524347.b3lyp_6-31g(d).nwchem.inp (generated) 052524347.b3lyp_6-31g(d).log.xz 052524347.mol 052524347.PUBCHEM 052524347.mol (via Jmol)
052524348.b3lyp_6-31g(d).inp

052524348.b3lyp_6-31g(d).qchem.inp (generated)

052524348.b3lyp_6-31g(d).gjf (generated)

052524348.b3lyp_6-31g(d).firefly.inp (generated)

052524348.b3lyp_6-31g(d).smash.inp (generated)

052524348.b3lyp_6-31g(d).nwchem.inp (generated) 052524348.b3lyp_6-31g(d).log.xz 052524348.mol 052524348.PUBCHEM 052524348.mol (via Jmol)
052524349.b3lyp_6-31g(d).inp

052524349.b3lyp_6-31g(d).qchem.inp (generated)

052524349.b3lyp_6-31g(d).gjf (generated)

052524349.b3lyp_6-31g(d).firefly.inp (generated)

052524349.b3lyp_6-31g(d).smash.inp (generated)

052524349.b3lyp_6-31g(d).nwchem.inp (generated) 052524349.b3lyp_6-31g(d).log.xz 052524349.mol 052524349.PUBCHEM 052524349.mol (via Jmol)
052524353.b3lyp_6-31g(d).inp

052524353.b3lyp_6-31g(d).qchem.inp (generated)

052524353.b3lyp_6-31g(d).gjf (generated)

052524353.b3lyp_6-31g(d).firefly.inp (generated)

052524353.b3lyp_6-31g(d).smash.inp (generated)

052524353.b3lyp_6-31g(d).nwchem.inp (generated) 052524353.b3lyp_6-31g(d).log.xz 052524353.td-b3lyp_6-31g+(d).inp 052524353.td-b3lyp_6-31g+(d).log.xz

052524353.td-b3lyp_6-31+g(d).qchem.inp (generated)

052524353.td-b3lyp_6-31+g(d).gjf (generated)

052524353.td-b3lyp_6-31+g(d).firefly.inp (generated)

052524353.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052524353.mol 052524353.PUBCHEM 052524353.mol (via Jmol)
052524364.b3lyp_6-31g(d).inp

052524364.b3lyp_6-31g(d).qchem.inp (generated)

052524364.b3lyp_6-31g(d).gjf (generated)

052524364.b3lyp_6-31g(d).firefly.inp (generated)

052524364.b3lyp_6-31g(d).smash.inp (generated)

052524364.b3lyp_6-31g(d).nwchem.inp (generated) 052524364.b3lyp_6-31g(d).log.xz 052524364.td-b3lyp_6-31g+(d).inp 052524364.td-b3lyp_6-31g+(d).log.xz

052524364.td-b3lyp_6-31+g(d).qchem.inp (generated)

052524364.td-b3lyp_6-31+g(d).gjf (generated)

052524364.td-b3lyp_6-31+g(d).firefly.inp (generated)

052524364.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052524364.mol 052524364.PUBCHEM 052524364.mol (via Jmol)
052524762.b3lyp_6-31g(d).inp

052524762.b3lyp_6-31g(d).qchem.inp (generated)

052524762.b3lyp_6-31g(d).gjf (generated)

052524762.b3lyp_6-31g(d).firefly.inp (generated)

052524762.b3lyp_6-31g(d).smash.inp (generated)

052524762.b3lyp_6-31g(d).nwchem.inp (generated) 052524762.b3lyp_6-31g(d).log.xz 052524762.td-b3lyp_6-31g+(d).inp 052524762.td-b3lyp_6-31g+(d).log.xz

052524762.td-b3lyp_6-31+g(d).qchem.inp (generated)

052524762.td-b3lyp_6-31+g(d).gjf (generated)

052524762.td-b3lyp_6-31+g(d).firefly.inp (generated)

052524762.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052524762.mol 052524762.PUBCHEM 052524762.mol (via Jmol)
052524994.b3lyp_6-31g(d).inp

052524994.b3lyp_6-31g(d).qchem.inp (generated)

052524994.b3lyp_6-31g(d).gjf (generated)

052524994.b3lyp_6-31g(d).firefly.inp (generated)

052524994.b3lyp_6-31g(d).smash.inp (generated)

052524994.b3lyp_6-31g(d).nwchem.inp (generated) 052524994.b3lyp_6-31g(d).log.xz 052524994.td-b3lyp_6-31g+(d).inp 052524994.td-b3lyp_6-31g+(d).log.xz

052524994.td-b3lyp_6-31+g(d).qchem.inp (generated)

052524994.td-b3lyp_6-31+g(d).gjf (generated)

052524994.td-b3lyp_6-31+g(d).firefly.inp (generated)

052524994.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052524994.mol 052524994.PUBCHEM 052524994.mol (via Jmol)


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