Index of

Last updated : Thu Aug 17 01:52:36 JST 2017
Total : 2093 (1662) in this page
000700009.b3lyp_6-31g(d).inp

000700009.b3lyp_6-31g(d).qchem.inp (generated)

000700009.b3lyp_6-31g(d).gjf (generated)

000700009.b3lyp_6-31g(d).firefly.inp (generated)

000700009.b3lyp_6-31g(d).smash.inp (generated)

000700009.b3lyp_6-31g(d).nwchem.inp (generated) 000700009.b3lyp_6-31g(d).log.xz 000700009.td-b3lyp_6-31g+(d).inp 000700009.td-b3lyp_6-31g+(d).log.xz

000700009.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700009.td-b3lyp_6-31+g(d).gjf (generated)

000700009.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700009.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700009.mol 000700009.PUBCHEM 000700009.mol (via Jmol)
000700012.b3lyp_6-31g(d).inp

000700012.b3lyp_6-31g(d).qchem.inp (generated)

000700012.b3lyp_6-31g(d).gjf (generated)

000700012.b3lyp_6-31g(d).firefly.inp (generated)

000700012.b3lyp_6-31g(d).smash.inp (generated)

000700012.b3lyp_6-31g(d).nwchem.inp (generated) 000700012.b3lyp_6-31g(d).log.xz 000700012.td-b3lyp_6-31g+(d).inp 000700012.td-b3lyp_6-31g+(d).log.xz

000700012.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700012.td-b3lyp_6-31+g(d).gjf (generated)

000700012.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700012.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700012.mol 000700012.PUBCHEM 000700012.mol (via Jmol)
000700015.b3lyp_6-31g(d).inp

000700015.b3lyp_6-31g(d).qchem.inp (generated)

000700015.b3lyp_6-31g(d).gjf (generated)

000700015.b3lyp_6-31g(d).firefly.inp (generated)

000700015.b3lyp_6-31g(d).smash.inp (generated)

000700015.b3lyp_6-31g(d).nwchem.inp (generated) 000700015.b3lyp_6-31g(d).log.xz 000700015.td-b3lyp_6-31g+(d).inp 000700015.td-b3lyp_6-31g+(d).log.xz

000700015.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700015.td-b3lyp_6-31+g(d).gjf (generated)

000700015.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700015.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700015.mol 000700015.PUBCHEM 000700015.mol (via Jmol)
000700074.b3lyp_6-31g(d).inp

000700074.b3lyp_6-31g(d).qchem.inp (generated)

000700074.b3lyp_6-31g(d).gjf (generated)

000700074.b3lyp_6-31g(d).firefly.inp (generated)

000700074.b3lyp_6-31g(d).smash.inp (generated)

000700074.b3lyp_6-31g(d).nwchem.inp (generated) 000700074.b3lyp_6-31g(d).log.xz 000700074.td-b3lyp_6-31g+(d).inp 000700074.td-b3lyp_6-31g+(d).log.xz

000700074.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700074.td-b3lyp_6-31+g(d).gjf (generated)

000700074.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700074.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700074.mol 000700074.PUBCHEM 000700074.mol (via Jmol)
000700090.b3lyp_6-31g(d).inp

000700090.b3lyp_6-31g(d).qchem.inp (generated)

000700090.b3lyp_6-31g(d).gjf (generated)

000700090.b3lyp_6-31g(d).firefly.inp (generated)

000700090.b3lyp_6-31g(d).smash.inp (generated)

000700090.b3lyp_6-31g(d).nwchem.inp (generated) 000700090.b3lyp_6-31g(d).log.xz 000700090.td-b3lyp_6-31g+(d).inp 000700090.td-b3lyp_6-31g+(d).log.xz

000700090.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700090.td-b3lyp_6-31+g(d).gjf (generated)

000700090.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700090.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700090.mol 000700090.PUBCHEM 000700090.mol (via Jmol)
000700092.b3lyp_6-31g(d).inp

000700092.b3lyp_6-31g(d).qchem.inp (generated)

000700092.b3lyp_6-31g(d).gjf (generated)

000700092.b3lyp_6-31g(d).firefly.inp (generated)

000700092.b3lyp_6-31g(d).smash.inp (generated)

000700092.b3lyp_6-31g(d).nwchem.inp (generated) 000700092.b3lyp_6-31g(d).log.xz 000700092.td-b3lyp_6-31g+(d).inp 000700092.td-b3lyp_6-31g+(d).log.xz

000700092.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700092.td-b3lyp_6-31+g(d).gjf (generated)

000700092.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700092.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700092.mol 000700092.PUBCHEM 000700092.mol (via Jmol)
000700124.b3lyp_6-31g(d).inp

000700124.b3lyp_6-31g(d).qchem.inp (generated)

000700124.b3lyp_6-31g(d).gjf (generated)

000700124.b3lyp_6-31g(d).firefly.inp (generated)

000700124.b3lyp_6-31g(d).smash.inp (generated)

000700124.b3lyp_6-31g(d).nwchem.inp (generated) 000700124.b3lyp_6-31g(d).log.xz 000700124.td-b3lyp_6-31g+(d).inp 000700124.td-b3lyp_6-31g+(d).log.xz

000700124.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700124.td-b3lyp_6-31+g(d).gjf (generated)

000700124.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700124.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700124.mol 000700124.PUBCHEM 000700124.mol (via Jmol)
000700133.b3lyp_6-31g(d).inp

000700133.b3lyp_6-31g(d).qchem.inp (generated)

000700133.b3lyp_6-31g(d).gjf (generated)

000700133.b3lyp_6-31g(d).firefly.inp (generated)

000700133.b3lyp_6-31g(d).smash.inp (generated)

000700133.b3lyp_6-31g(d).nwchem.inp (generated) 000700133.b3lyp_6-31g(d).log.xz 000700133.mol 000700133.PUBCHEM 000700133.mol (via Jmol)
000700139.b3lyp_6-31g(d).inp

000700139.b3lyp_6-31g(d).qchem.inp (generated)

000700139.b3lyp_6-31g(d).gjf (generated)

000700139.b3lyp_6-31g(d).firefly.inp (generated)

000700139.b3lyp_6-31g(d).smash.inp (generated)

000700139.b3lyp_6-31g(d).nwchem.inp (generated) 000700139.b3lyp_6-31g(d).log.xz 000700139.td-b3lyp_6-31g+(d).inp 000700139.td-b3lyp_6-31g+(d).log.xz

000700139.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700139.td-b3lyp_6-31+g(d).gjf (generated)

000700139.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700139.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700139.mol 000700139.PUBCHEM 000700139.mol (via Jmol)
000700159.b3lyp_6-31g(d).inp

000700159.b3lyp_6-31g(d).qchem.inp (generated)

000700159.b3lyp_6-31g(d).gjf (generated)

000700159.b3lyp_6-31g(d).firefly.inp (generated)

000700159.b3lyp_6-31g(d).smash.inp (generated)

000700159.b3lyp_6-31g(d).nwchem.inp (generated) 000700159.b3lyp_6-31g(d).log.xz 000700159.td-b3lyp_6-31g+(d).inp 000700159.td-b3lyp_6-31g+(d).log.xz

000700159.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700159.td-b3lyp_6-31+g(d).gjf (generated)

000700159.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700159.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700159.mol 000700159.PUBCHEM 000700159.mol (via Jmol)
000700172.b3lyp_6-31g(d).inp

000700172.b3lyp_6-31g(d).qchem.inp (generated)

000700172.b3lyp_6-31g(d).gjf (generated)

000700172.b3lyp_6-31g(d).firefly.inp (generated)

000700172.b3lyp_6-31g(d).smash.inp (generated)

000700172.b3lyp_6-31g(d).nwchem.inp (generated) 000700172.b3lyp_6-31g(d).log.xz 000700172.mol 000700172.PUBCHEM 000700172.mol (via Jmol)
000700182.b3lyp_6-31g(d).inp

000700182.b3lyp_6-31g(d).qchem.inp (generated)

000700182.b3lyp_6-31g(d).gjf (generated)

000700182.b3lyp_6-31g(d).firefly.inp (generated)

000700182.b3lyp_6-31g(d).smash.inp (generated)

000700182.b3lyp_6-31g(d).nwchem.inp (generated) 000700182.b3lyp_6-31g(d).log.xz 000700182.mol 000700182.PUBCHEM 000700182.mol (via Jmol)
000700196.b3lyp_6-31g(d).inp

000700196.b3lyp_6-31g(d).qchem.inp (generated)

000700196.b3lyp_6-31g(d).gjf (generated)

000700196.b3lyp_6-31g(d).firefly.inp (generated)

000700196.b3lyp_6-31g(d).smash.inp (generated)

000700196.b3lyp_6-31g(d).nwchem.inp (generated) 000700196.b3lyp_6-31g(d).log.xz 000700196.mol 000700196.PUBCHEM 000700196.mol (via Jmol)
000700197.b3lyp_6-31g(d).inp

000700197.b3lyp_6-31g(d).qchem.inp (generated)

000700197.b3lyp_6-31g(d).gjf (generated)

000700197.b3lyp_6-31g(d).firefly.inp (generated)

000700197.b3lyp_6-31g(d).smash.inp (generated)

000700197.b3lyp_6-31g(d).nwchem.inp (generated) 000700197.b3lyp_6-31g(d).log.xz 000700197.mol 000700197.PUBCHEM 000700197.mol (via Jmol)
000700200.b3lyp_6-31g(d).inp

000700200.b3lyp_6-31g(d).qchem.inp (generated)

000700200.b3lyp_6-31g(d).gjf (generated)

000700200.b3lyp_6-31g(d).firefly.inp (generated)

000700200.b3lyp_6-31g(d).smash.inp (generated)

000700200.b3lyp_6-31g(d).nwchem.inp (generated) 000700200.b3lyp_6-31g(d).log.xz 000700200.td-b3lyp_6-31g+(d).inp 000700200.td-b3lyp_6-31g+(d).log.xz

000700200.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700200.td-b3lyp_6-31+g(d).gjf (generated)

000700200.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700200.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700200.mol 000700200.PUBCHEM 000700200.mol (via Jmol)
000700219.b3lyp_6-31g(d).inp

000700219.b3lyp_6-31g(d).qchem.inp (generated)

000700219.b3lyp_6-31g(d).gjf (generated)

000700219.b3lyp_6-31g(d).firefly.inp (generated)

000700219.b3lyp_6-31g(d).smash.inp (generated)

000700219.b3lyp_6-31g(d).nwchem.inp (generated) 000700219.b3lyp_6-31g(d).log.xz 000700219.td-b3lyp_6-31g+(d).inp 000700219.td-b3lyp_6-31g+(d).log.xz

000700219.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700219.td-b3lyp_6-31+g(d).gjf (generated)

000700219.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700219.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700219.mol 000700219.PUBCHEM 000700219.mol (via Jmol)
000700258.b3lyp_6-31g(d).inp

000700258.b3lyp_6-31g(d).qchem.inp (generated)

000700258.b3lyp_6-31g(d).gjf (generated)

000700258.b3lyp_6-31g(d).firefly.inp (generated)

000700258.b3lyp_6-31g(d).smash.inp (generated)

000700258.b3lyp_6-31g(d).nwchem.inp (generated) 000700258.b3lyp_6-31g(d).log.xz 000700258.td-b3lyp_6-31g+(d).inp 000700258.td-b3lyp_6-31g+(d).log.xz

000700258.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700258.td-b3lyp_6-31+g(d).gjf (generated)

000700258.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700258.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700258.mol 000700258.PUBCHEM 000700258.mol (via Jmol)
000700274.b3lyp_6-31g(d).inp

000700274.b3lyp_6-31g(d).qchem.inp (generated)

000700274.b3lyp_6-31g(d).gjf (generated)

000700274.b3lyp_6-31g(d).firefly.inp (generated)

000700274.b3lyp_6-31g(d).smash.inp (generated)

000700274.b3lyp_6-31g(d).nwchem.inp (generated) 000700274.b3lyp_6-31g(d).log.xz 000700274.td-b3lyp_6-31g+(d).inp 000700274.td-b3lyp_6-31g+(d).log.xz

000700274.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700274.td-b3lyp_6-31+g(d).gjf (generated)

000700274.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700274.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700274.mol 000700274.PUBCHEM 000700274.mol (via Jmol)
000700280.b3lyp_6-31g(d).inp

000700280.b3lyp_6-31g(d).qchem.inp (generated)

000700280.b3lyp_6-31g(d).gjf (generated)

000700280.b3lyp_6-31g(d).firefly.inp (generated)

000700280.b3lyp_6-31g(d).smash.inp (generated)

000700280.b3lyp_6-31g(d).nwchem.inp (generated) 000700280.b3lyp_6-31g(d).log.xz 000700280.mol 000700280.PUBCHEM 000700280.mol (via Jmol)
000700289.b3lyp_6-31g(d).inp

000700289.b3lyp_6-31g(d).qchem.inp (generated)

000700289.b3lyp_6-31g(d).gjf (generated)

000700289.b3lyp_6-31g(d).firefly.inp (generated)

000700289.b3lyp_6-31g(d).smash.inp (generated)

000700289.b3lyp_6-31g(d).nwchem.inp (generated) 000700289.b3lyp_6-31g(d).log.xz 000700289.td-b3lyp_6-31g+(d).inp 000700289.td-b3lyp_6-31g+(d).log.xz

000700289.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700289.td-b3lyp_6-31+g(d).gjf (generated)

000700289.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700289.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700289.mol 000700289.PUBCHEM 000700289.mol (via Jmol)
000700302.b3lyp_6-31g(d).inp

000700302.b3lyp_6-31g(d).qchem.inp (generated)

000700302.b3lyp_6-31g(d).gjf (generated)

000700302.b3lyp_6-31g(d).firefly.inp (generated)

000700302.b3lyp_6-31g(d).smash.inp (generated)

000700302.b3lyp_6-31g(d).nwchem.inp (generated) 000700302.b3lyp_6-31g(d).log.xz 000700302.td-b3lyp_6-31g+(d).inp 000700302.td-b3lyp_6-31g+(d).log.xz

000700302.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700302.td-b3lyp_6-31+g(d).gjf (generated)

000700302.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700302.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700302.mol 000700302.PUBCHEM 000700302.mol (via Jmol)
000700303.b3lyp_6-31g(d).inp

000700303.b3lyp_6-31g(d).qchem.inp (generated)

000700303.b3lyp_6-31g(d).gjf (generated)

000700303.b3lyp_6-31g(d).firefly.inp (generated)

000700303.b3lyp_6-31g(d).smash.inp (generated)

000700303.b3lyp_6-31g(d).nwchem.inp (generated) 000700303.b3lyp_6-31g(d).log.xz 000700303.td-b3lyp_6-31g+(d).inp 000700303.td-b3lyp_6-31g+(d).log.xz

000700303.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700303.td-b3lyp_6-31+g(d).gjf (generated)

000700303.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700303.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700303.mol 000700303.PUBCHEM 000700303.mol (via Jmol)
000700305.b3lyp_6-31g(d).inp

000700305.b3lyp_6-31g(d).qchem.inp (generated)

000700305.b3lyp_6-31g(d).gjf (generated)

000700305.b3lyp_6-31g(d).firefly.inp (generated)

000700305.b3lyp_6-31g(d).smash.inp (generated)

000700305.b3lyp_6-31g(d).nwchem.inp (generated) 000700305.b3lyp_6-31g(d).log.xz 000700305.mol 000700305.PUBCHEM 000700305.mol (via Jmol)
000700343.b3lyp_6-31g(d).inp

000700343.b3lyp_6-31g(d).qchem.inp (generated)

000700343.b3lyp_6-31g(d).gjf (generated)

000700343.b3lyp_6-31g(d).firefly.inp (generated)

000700343.b3lyp_6-31g(d).smash.inp (generated)

000700343.b3lyp_6-31g(d).nwchem.inp (generated) 000700343.b3lyp_6-31g(d).log.xz 000700343.td-b3lyp_6-31g+(d).inp 000700343.td-b3lyp_6-31g+(d).log.xz

000700343.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700343.td-b3lyp_6-31+g(d).gjf (generated)

000700343.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700343.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700343.mol 000700343.PUBCHEM 000700343.mol (via Jmol)
000700347.b3lyp_6-31g(d).inp

000700347.b3lyp_6-31g(d).qchem.inp (generated)

000700347.b3lyp_6-31g(d).gjf (generated)

000700347.b3lyp_6-31g(d).firefly.inp (generated)

000700347.b3lyp_6-31g(d).smash.inp (generated)

000700347.b3lyp_6-31g(d).nwchem.inp (generated) 000700347.b3lyp_6-31g(d).log.xz 000700347.td-b3lyp_6-31g+(d).inp 000700347.td-b3lyp_6-31g+(d).log.xz

000700347.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700347.td-b3lyp_6-31+g(d).gjf (generated)

000700347.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700347.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700347.mol 000700347.PUBCHEM 000700347.mol (via Jmol)
000700360.b3lyp_6-31g(d).inp

000700360.b3lyp_6-31g(d).qchem.inp (generated)

000700360.b3lyp_6-31g(d).gjf (generated)

000700360.b3lyp_6-31g(d).firefly.inp (generated)

000700360.b3lyp_6-31g(d).smash.inp (generated)

000700360.b3lyp_6-31g(d).nwchem.inp (generated) 000700360.b3lyp_6-31g(d).log.xz 000700360.mol 000700360.PUBCHEM 000700360.mol (via Jmol)
000700388.b3lyp_6-31g(d).inp

000700388.b3lyp_6-31g(d).qchem.inp (generated)

000700388.b3lyp_6-31g(d).gjf (generated)

000700388.b3lyp_6-31g(d).firefly.inp (generated)

000700388.b3lyp_6-31g(d).smash.inp (generated)

000700388.b3lyp_6-31g(d).nwchem.inp (generated) 000700388.b3lyp_6-31g(d).log.xz 000700388.td-b3lyp_6-31g+(d).inp 000700388.td-b3lyp_6-31g+(d).log.xz

000700388.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700388.td-b3lyp_6-31+g(d).gjf (generated)

000700388.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700388.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700388.mol 000700388.PUBCHEM 000700388.mol (via Jmol)
000700447.b3lyp_6-31g(d).inp

000700447.b3lyp_6-31g(d).qchem.inp (generated)

000700447.b3lyp_6-31g(d).gjf (generated)

000700447.b3lyp_6-31g(d).firefly.inp (generated)

000700447.b3lyp_6-31g(d).smash.inp (generated)

000700447.b3lyp_6-31g(d).nwchem.inp (generated) 000700447.b3lyp_6-31g(d).log.xz 000700447.td-b3lyp_6-31g+(d).inp 000700447.td-b3lyp_6-31g+(d).log.xz

000700447.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700447.td-b3lyp_6-31+g(d).gjf (generated)

000700447.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700447.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700447.mol 000700447.PUBCHEM 000700447.mol (via Jmol)
000700457.b3lyp_6-31g(d).inp

000700457.b3lyp_6-31g(d).qchem.inp (generated)

000700457.b3lyp_6-31g(d).gjf (generated)

000700457.b3lyp_6-31g(d).firefly.inp (generated)

000700457.b3lyp_6-31g(d).smash.inp (generated)

000700457.b3lyp_6-31g(d).nwchem.inp (generated) 000700457.b3lyp_6-31g(d).log.xz 000700457.td-b3lyp_6-31g+(d).inp 000700457.td-b3lyp_6-31g+(d).log.xz

000700457.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700457.td-b3lyp_6-31+g(d).gjf (generated)

000700457.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700457.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700457.mol 000700457.PUBCHEM 000700457.mol (via Jmol)
000700459.b3lyp_6-31g(d).inp

000700459.b3lyp_6-31g(d).qchem.inp (generated)

000700459.b3lyp_6-31g(d).gjf (generated)

000700459.b3lyp_6-31g(d).firefly.inp (generated)

000700459.b3lyp_6-31g(d).smash.inp (generated)

000700459.b3lyp_6-31g(d).nwchem.inp (generated) 000700459.b3lyp_6-31g(d).log.xz 000700459.td-b3lyp_6-31g+(d).inp 000700459.td-b3lyp_6-31g+(d).log.xz

000700459.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700459.td-b3lyp_6-31+g(d).gjf (generated)

000700459.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700459.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700459.mol 000700459.PUBCHEM 000700459.mol (via Jmol)
000700477.b3lyp_6-31g(d).inp

000700477.b3lyp_6-31g(d).qchem.inp (generated)

000700477.b3lyp_6-31g(d).gjf (generated)

000700477.b3lyp_6-31g(d).firefly.inp (generated)

000700477.b3lyp_6-31g(d).smash.inp (generated)

000700477.b3lyp_6-31g(d).nwchem.inp (generated) 000700477.b3lyp_6-31g(d).log.xz 000700477.td-b3lyp_6-31g+(d).inp 000700477.td-b3lyp_6-31g+(d).log.xz

000700477.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700477.td-b3lyp_6-31+g(d).gjf (generated)

000700477.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700477.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700477.mol 000700477.PUBCHEM 000700477.mol (via Jmol)
000700493.b3lyp_6-31g(d).inp

000700493.b3lyp_6-31g(d).qchem.inp (generated)

000700493.b3lyp_6-31g(d).gjf (generated)

000700493.b3lyp_6-31g(d).firefly.inp (generated)

000700493.b3lyp_6-31g(d).smash.inp (generated)

000700493.b3lyp_6-31g(d).nwchem.inp (generated) 000700493.b3lyp_6-31g(d).log.xz 000700493.td-b3lyp_6-31g+(d).inp 000700493.td-b3lyp_6-31g+(d).log.xz

000700493.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700493.td-b3lyp_6-31+g(d).gjf (generated)

000700493.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700493.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700493.mol 000700493.PUBCHEM 000700493.mol (via Jmol)
000700505.b3lyp_6-31g(d).inp

000700505.b3lyp_6-31g(d).qchem.inp (generated)

000700505.b3lyp_6-31g(d).gjf (generated)

000700505.b3lyp_6-31g(d).firefly.inp (generated)

000700505.b3lyp_6-31g(d).smash.inp (generated)

000700505.b3lyp_6-31g(d).nwchem.inp (generated) 000700505.b3lyp_6-31g(d).log.xz 000700505.td-b3lyp_6-31g+(d).inp 000700505.td-b3lyp_6-31g+(d).log.xz

000700505.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700505.td-b3lyp_6-31+g(d).gjf (generated)

000700505.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700505.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700505.mol 000700505.PUBCHEM 000700505.mol (via Jmol)
000700508.b3lyp_6-31g(d).inp

000700508.b3lyp_6-31g(d).qchem.inp (generated)

000700508.b3lyp_6-31g(d).gjf (generated)

000700508.b3lyp_6-31g(d).firefly.inp (generated)

000700508.b3lyp_6-31g(d).smash.inp (generated)

000700508.b3lyp_6-31g(d).nwchem.inp (generated) 000700508.b3lyp_6-31g(d).log.xz 000700508.td-b3lyp_6-31g+(d).inp 000700508.td-b3lyp_6-31g+(d).log.xz

000700508.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700508.td-b3lyp_6-31+g(d).gjf (generated)

000700508.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700508.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700508.mol 000700508.PUBCHEM 000700508.mol (via Jmol)
000700513.b3lyp_6-31g(d).inp

000700513.b3lyp_6-31g(d).qchem.inp (generated)

000700513.b3lyp_6-31g(d).gjf (generated)

000700513.b3lyp_6-31g(d).firefly.inp (generated)

000700513.b3lyp_6-31g(d).smash.inp (generated)

000700513.b3lyp_6-31g(d).nwchem.inp (generated) 000700513.b3lyp_6-31g(d).log.xz 000700513.td-b3lyp_6-31g+(d).inp 000700513.td-b3lyp_6-31g+(d).log.xz

000700513.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700513.td-b3lyp_6-31+g(d).gjf (generated)

000700513.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700513.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700513.mol 000700513.PUBCHEM 000700513.mol (via Jmol)
000700518.b3lyp_6-31g(d).inp

000700518.b3lyp_6-31g(d).qchem.inp (generated)

000700518.b3lyp_6-31g(d).gjf (generated)

000700518.b3lyp_6-31g(d).firefly.inp (generated)

000700518.b3lyp_6-31g(d).smash.inp (generated)

000700518.b3lyp_6-31g(d).nwchem.inp (generated) 000700518.b3lyp_6-31g(d).log.xz 000700518.td-b3lyp_6-31g+(d).inp 000700518.td-b3lyp_6-31g+(d).log.xz

000700518.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700518.td-b3lyp_6-31+g(d).gjf (generated)

000700518.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700518.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700518.mol 000700518.PUBCHEM 000700518.mol (via Jmol)
000700522.b3lyp_6-31g(d).inp

000700522.b3lyp_6-31g(d).qchem.inp (generated)

000700522.b3lyp_6-31g(d).gjf (generated)

000700522.b3lyp_6-31g(d).firefly.inp (generated)

000700522.b3lyp_6-31g(d).smash.inp (generated)

000700522.b3lyp_6-31g(d).nwchem.inp (generated) 000700522.b3lyp_6-31g(d).log.xz 000700522.td-b3lyp_6-31g+(d).inp 000700522.td-b3lyp_6-31g+(d).log.xz

000700522.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700522.td-b3lyp_6-31+g(d).gjf (generated)

000700522.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700522.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700522.mol 000700522.PUBCHEM 000700522.mol (via Jmol)
000700527.b3lyp_6-31g(d).inp

000700527.b3lyp_6-31g(d).qchem.inp (generated)

000700527.b3lyp_6-31g(d).gjf (generated)

000700527.b3lyp_6-31g(d).firefly.inp (generated)

000700527.b3lyp_6-31g(d).smash.inp (generated)

000700527.b3lyp_6-31g(d).nwchem.inp (generated) 000700527.b3lyp_6-31g(d).log.xz 000700527.td-b3lyp_6-31g+(d).inp 000700527.td-b3lyp_6-31g+(d).log.xz

000700527.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700527.td-b3lyp_6-31+g(d).gjf (generated)

000700527.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700527.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700527.mol 000700527.PUBCHEM 000700527.mol (via Jmol)
000700529.b3lyp_6-31g(d).inp

000700529.b3lyp_6-31g(d).qchem.inp (generated)

000700529.b3lyp_6-31g(d).gjf (generated)

000700529.b3lyp_6-31g(d).firefly.inp (generated)

000700529.b3lyp_6-31g(d).smash.inp (generated)

000700529.b3lyp_6-31g(d).nwchem.inp (generated) 000700529.b3lyp_6-31g(d).log.xz 000700529.td-b3lyp_6-31g+(d).inp 000700529.td-b3lyp_6-31g+(d).log.xz

000700529.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700529.td-b3lyp_6-31+g(d).gjf (generated)

000700529.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700529.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700529.mol 000700529.PUBCHEM 000700529.mol (via Jmol)
000700530.b3lyp_6-31g(d).inp

000700530.b3lyp_6-31g(d).qchem.inp (generated)

000700530.b3lyp_6-31g(d).gjf (generated)

000700530.b3lyp_6-31g(d).firefly.inp (generated)

000700530.b3lyp_6-31g(d).smash.inp (generated)

000700530.b3lyp_6-31g(d).nwchem.inp (generated) 000700530.b3lyp_6-31g(d).log.xz 000700530.td-b3lyp_6-31g+(d).inp 000700530.td-b3lyp_6-31g+(d).log.xz

000700530.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700530.td-b3lyp_6-31+g(d).gjf (generated)

000700530.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700530.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700530.mol 000700530.PUBCHEM 000700530.mol (via Jmol)
000700557.b3lyp_6-31g(d).inp

000700557.b3lyp_6-31g(d).qchem.inp (generated)

000700557.b3lyp_6-31g(d).gjf (generated)

000700557.b3lyp_6-31g(d).firefly.inp (generated)

000700557.b3lyp_6-31g(d).smash.inp (generated)

000700557.b3lyp_6-31g(d).nwchem.inp (generated) 000700557.b3lyp_6-31g(d).log.xz 000700557.mol 000700557.PUBCHEM 000700557.mol (via Jmol)
000700561.b3lyp_6-31g(d).inp

000700561.b3lyp_6-31g(d).qchem.inp (generated)

000700561.b3lyp_6-31g(d).gjf (generated)

000700561.b3lyp_6-31g(d).firefly.inp (generated)

000700561.b3lyp_6-31g(d).smash.inp (generated)

000700561.b3lyp_6-31g(d).nwchem.inp (generated) 000700561.b3lyp_6-31g(d).log.xz 000700561.td-b3lyp_6-31g+(d).inp 000700561.td-b3lyp_6-31g+(d).log.xz

000700561.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700561.td-b3lyp_6-31+g(d).gjf (generated)

000700561.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700561.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700561.mol 000700561.PUBCHEM 000700561.mol (via Jmol)
000700562.b3lyp_6-31g(d).inp

000700562.b3lyp_6-31g(d).qchem.inp (generated)

000700562.b3lyp_6-31g(d).gjf (generated)

000700562.b3lyp_6-31g(d).firefly.inp (generated)

000700562.b3lyp_6-31g(d).smash.inp (generated)

000700562.b3lyp_6-31g(d).nwchem.inp (generated) 000700562.b3lyp_6-31g(d).log.xz 000700562.td-b3lyp_6-31g+(d).inp 000700562.td-b3lyp_6-31g+(d).log.xz

000700562.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700562.td-b3lyp_6-31+g(d).gjf (generated)

000700562.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700562.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700562.mol 000700562.PUBCHEM 000700562.mol (via Jmol)
000700587.b3lyp_6-31g(d).inp

000700587.b3lyp_6-31g(d).qchem.inp (generated)

000700587.b3lyp_6-31g(d).gjf (generated)

000700587.b3lyp_6-31g(d).firefly.inp (generated)

000700587.b3lyp_6-31g(d).smash.inp (generated)

000700587.b3lyp_6-31g(d).nwchem.inp (generated) 000700587.b3lyp_6-31g(d).log.xz 000700587.td-b3lyp_6-31g+(d).inp 000700587.td-b3lyp_6-31g+(d).log.xz

000700587.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700587.td-b3lyp_6-31+g(d).gjf (generated)

000700587.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700587.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700587.mol 000700587.PUBCHEM 000700587.mol (via Jmol)
000700589.b3lyp_6-31g(d).inp

000700589.b3lyp_6-31g(d).qchem.inp (generated)

000700589.b3lyp_6-31g(d).gjf (generated)

000700589.b3lyp_6-31g(d).firefly.inp (generated)

000700589.b3lyp_6-31g(d).smash.inp (generated)

000700589.b3lyp_6-31g(d).nwchem.inp (generated) 000700589.b3lyp_6-31g(d).log.xz 000700589.td-b3lyp_6-31g+(d).inp 000700589.td-b3lyp_6-31g+(d).log.xz

000700589.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700589.td-b3lyp_6-31+g(d).gjf (generated)

000700589.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700589.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700589.mol 000700589.PUBCHEM 000700589.mol (via Jmol)
000700604.b3lyp_6-31g(d).inp

000700604.b3lyp_6-31g(d).qchem.inp (generated)

000700604.b3lyp_6-31g(d).gjf (generated)

000700604.b3lyp_6-31g(d).firefly.inp (generated)

000700604.b3lyp_6-31g(d).smash.inp (generated)

000700604.b3lyp_6-31g(d).nwchem.inp (generated) 000700604.b3lyp_6-31g(d).log.xz 000700604.mol 000700604.PUBCHEM 000700604.mol (via Jmol)
000700608.b3lyp_6-31g(d).inp

000700608.b3lyp_6-31g(d).qchem.inp (generated)

000700608.b3lyp_6-31g(d).gjf (generated)

000700608.b3lyp_6-31g(d).firefly.inp (generated)

000700608.b3lyp_6-31g(d).smash.inp (generated)

000700608.b3lyp_6-31g(d).nwchem.inp (generated) 000700608.b3lyp_6-31g(d).log.xz 000700608.td-b3lyp_6-31g+(d).inp 000700608.td-b3lyp_6-31g+(d).log.xz

000700608.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700608.td-b3lyp_6-31+g(d).gjf (generated)

000700608.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700608.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700608.mol 000700608.PUBCHEM 000700608.mol (via Jmol)
000700620.b3lyp_6-31g(d).inp

000700620.b3lyp_6-31g(d).qchem.inp (generated)

000700620.b3lyp_6-31g(d).gjf (generated)

000700620.b3lyp_6-31g(d).firefly.inp (generated)

000700620.b3lyp_6-31g(d).smash.inp (generated)

000700620.b3lyp_6-31g(d).nwchem.inp (generated) 000700620.b3lyp_6-31g(d).log.xz 000700620.mol 000700620.PUBCHEM 000700620.mol (via Jmol)
000700622.b3lyp_6-31g(d).inp

000700622.b3lyp_6-31g(d).qchem.inp (generated)

000700622.b3lyp_6-31g(d).gjf (generated)

000700622.b3lyp_6-31g(d).firefly.inp (generated)

000700622.b3lyp_6-31g(d).smash.inp (generated)

000700622.b3lyp_6-31g(d).nwchem.inp (generated) 000700622.b3lyp_6-31g(d).log.xz 000700622.mol 000700622.PUBCHEM 000700622.mol (via Jmol)
000700642.b3lyp_6-31g(d).inp

000700642.b3lyp_6-31g(d).qchem.inp (generated)

000700642.b3lyp_6-31g(d).gjf (generated)

000700642.b3lyp_6-31g(d).firefly.inp (generated)

000700642.b3lyp_6-31g(d).smash.inp (generated)

000700642.b3lyp_6-31g(d).nwchem.inp (generated) 000700642.b3lyp_6-31g(d).log.xz 000700642.td-b3lyp_6-31g+(d).inp 000700642.td-b3lyp_6-31g+(d).log.xz

000700642.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700642.td-b3lyp_6-31+g(d).gjf (generated)

000700642.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700642.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700642.mol 000700642.PUBCHEM 000700642.mol (via Jmol)
000700649.b3lyp_6-31g(d).inp

000700649.b3lyp_6-31g(d).qchem.inp (generated)

000700649.b3lyp_6-31g(d).gjf (generated)

000700649.b3lyp_6-31g(d).firefly.inp (generated)

000700649.b3lyp_6-31g(d).smash.inp (generated)

000700649.b3lyp_6-31g(d).nwchem.inp (generated) 000700649.b3lyp_6-31g(d).log.xz 000700649.td-b3lyp_6-31g+(d).inp 000700649.td-b3lyp_6-31g+(d).log.xz

000700649.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700649.td-b3lyp_6-31+g(d).gjf (generated)

000700649.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700649.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700649.mol 000700649.PUBCHEM 000700649.mol (via Jmol)
000700650.b3lyp_6-31g(d).inp

000700650.b3lyp_6-31g(d).qchem.inp (generated)

000700650.b3lyp_6-31g(d).gjf (generated)

000700650.b3lyp_6-31g(d).firefly.inp (generated)

000700650.b3lyp_6-31g(d).smash.inp (generated)

000700650.b3lyp_6-31g(d).nwchem.inp (generated) 000700650.b3lyp_6-31g(d).log.xz 000700650.td-b3lyp_6-31g+(d).inp 000700650.td-b3lyp_6-31g+(d).log.xz

000700650.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700650.td-b3lyp_6-31+g(d).gjf (generated)

000700650.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700650.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700650.mol 000700650.PUBCHEM 000700650.mol (via Jmol)
000700656.b3lyp_6-31g(d).inp

000700656.b3lyp_6-31g(d).qchem.inp (generated)

000700656.b3lyp_6-31g(d).gjf (generated)

000700656.b3lyp_6-31g(d).firefly.inp (generated)

000700656.b3lyp_6-31g(d).smash.inp (generated)

000700656.b3lyp_6-31g(d).nwchem.inp (generated) 000700656.b3lyp_6-31g(d).log.xz 000700656.mol 000700656.PUBCHEM 000700656.mol (via Jmol)
000700668.b3lyp_6-31g(d).inp

000700668.b3lyp_6-31g(d).qchem.inp (generated)

000700668.b3lyp_6-31g(d).gjf (generated)

000700668.b3lyp_6-31g(d).firefly.inp (generated)

000700668.b3lyp_6-31g(d).smash.inp (generated)

000700668.b3lyp_6-31g(d).nwchem.inp (generated) 000700668.b3lyp_6-31g(d).log.xz 000700668.td-b3lyp_6-31g+(d).inp 000700668.td-b3lyp_6-31g+(d).log.xz

000700668.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700668.td-b3lyp_6-31+g(d).gjf (generated)

000700668.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700668.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700668.mol 000700668.PUBCHEM 000700668.mol (via Jmol)
000700672.b3lyp_6-31g(d).inp

000700672.b3lyp_6-31g(d).qchem.inp (generated)

000700672.b3lyp_6-31g(d).gjf (generated)

000700672.b3lyp_6-31g(d).firefly.inp (generated)

000700672.b3lyp_6-31g(d).smash.inp (generated)

000700672.b3lyp_6-31g(d).nwchem.inp (generated) 000700672.b3lyp_6-31g(d).log.xz 000700672.td-b3lyp_6-31g+(d).inp 000700672.td-b3lyp_6-31g+(d).log.xz

000700672.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700672.td-b3lyp_6-31+g(d).gjf (generated)

000700672.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700672.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700672.mol 000700672.PUBCHEM 000700672.mol (via Jmol)
000700673.b3lyp_6-31g(d).inp

000700673.b3lyp_6-31g(d).qchem.inp (generated)

000700673.b3lyp_6-31g(d).gjf (generated)

000700673.b3lyp_6-31g(d).firefly.inp (generated)

000700673.b3lyp_6-31g(d).smash.inp (generated)

000700673.b3lyp_6-31g(d).nwchem.inp (generated) 000700673.b3lyp_6-31g(d).log.xz 000700673.td-b3lyp_6-31g+(d).inp 000700673.td-b3lyp_6-31g+(d).log.xz

000700673.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700673.td-b3lyp_6-31+g(d).gjf (generated)

000700673.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700673.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700673.mol 000700673.PUBCHEM 000700673.mol (via Jmol)
000700696.b3lyp_6-31g(d).inp

000700696.b3lyp_6-31g(d).qchem.inp (generated)

000700696.b3lyp_6-31g(d).gjf (generated)

000700696.b3lyp_6-31g(d).firefly.inp (generated)

000700696.b3lyp_6-31g(d).smash.inp (generated)

000700696.b3lyp_6-31g(d).nwchem.inp (generated) 000700696.b3lyp_6-31g(d).log.xz 000700696.mol 000700696.PUBCHEM 000700696.mol (via Jmol)
000700704.b3lyp_6-31g(d).inp

000700704.b3lyp_6-31g(d).qchem.inp (generated)

000700704.b3lyp_6-31g(d).gjf (generated)

000700704.b3lyp_6-31g(d).firefly.inp (generated)

000700704.b3lyp_6-31g(d).smash.inp (generated)

000700704.b3lyp_6-31g(d).nwchem.inp (generated) 000700704.b3lyp_6-31g(d).log.xz 000700704.td-b3lyp_6-31g+(d).inp 000700704.td-b3lyp_6-31g+(d).log.xz

000700704.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700704.td-b3lyp_6-31+g(d).gjf (generated)

000700704.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700704.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700704.mol 000700704.PUBCHEM 000700704.mol (via Jmol)
000700705.b3lyp_6-31g(d).inp

000700705.b3lyp_6-31g(d).qchem.inp (generated)

000700705.b3lyp_6-31g(d).gjf (generated)

000700705.b3lyp_6-31g(d).firefly.inp (generated)

000700705.b3lyp_6-31g(d).smash.inp (generated)

000700705.b3lyp_6-31g(d).nwchem.inp (generated) 000700705.b3lyp_6-31g(d).log.xz 000700705.td-b3lyp_6-31g+(d).inp 000700705.td-b3lyp_6-31g+(d).log.xz

000700705.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700705.td-b3lyp_6-31+g(d).gjf (generated)

000700705.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700705.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700705.mol 000700705.PUBCHEM 000700705.mol (via Jmol)
000700731.b3lyp_6-31g(d).inp

000700731.b3lyp_6-31g(d).qchem.inp (generated)

000700731.b3lyp_6-31g(d).gjf (generated)

000700731.b3lyp_6-31g(d).firefly.inp (generated)

000700731.b3lyp_6-31g(d).smash.inp (generated)

000700731.b3lyp_6-31g(d).nwchem.inp (generated) 000700731.b3lyp_6-31g(d).log.xz 000700731.td-b3lyp_6-31g+(d).inp 000700731.td-b3lyp_6-31g+(d).log.xz

000700731.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700731.td-b3lyp_6-31+g(d).gjf (generated)

000700731.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700731.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700731.mol 000700731.PUBCHEM 000700731.mol (via Jmol)
000700742.b3lyp_6-31g(d).inp

000700742.b3lyp_6-31g(d).qchem.inp (generated)

000700742.b3lyp_6-31g(d).gjf (generated)

000700742.b3lyp_6-31g(d).firefly.inp (generated)

000700742.b3lyp_6-31g(d).smash.inp (generated)

000700742.b3lyp_6-31g(d).nwchem.inp (generated) 000700742.b3lyp_6-31g(d).log.xz 000700742.td-b3lyp_6-31g+(d).inp 000700742.td-b3lyp_6-31g+(d).log.xz

000700742.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700742.td-b3lyp_6-31+g(d).gjf (generated)

000700742.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700742.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700742.mol 000700742.PUBCHEM 000700742.mol (via Jmol)
000700755.b3lyp_6-31g(d).inp

000700755.b3lyp_6-31g(d).qchem.inp (generated)

000700755.b3lyp_6-31g(d).gjf (generated)

000700755.b3lyp_6-31g(d).firefly.inp (generated)

000700755.b3lyp_6-31g(d).smash.inp (generated)

000700755.b3lyp_6-31g(d).nwchem.inp (generated) 000700755.b3lyp_6-31g(d).log.xz 000700755.td-b3lyp_6-31g+(d).inp 000700755.td-b3lyp_6-31g+(d).log.xz

000700755.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700755.td-b3lyp_6-31+g(d).gjf (generated)

000700755.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700755.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700755.mol 000700755.PUBCHEM 000700755.mol (via Jmol)
000700760.b3lyp_6-31g(d).inp

000700760.b3lyp_6-31g(d).qchem.inp (generated)

000700760.b3lyp_6-31g(d).gjf (generated)

000700760.b3lyp_6-31g(d).firefly.inp (generated)

000700760.b3lyp_6-31g(d).smash.inp (generated)

000700760.b3lyp_6-31g(d).nwchem.inp (generated) 000700760.b3lyp_6-31g(d).log.xz 000700760.td-b3lyp_6-31g+(d).inp 000700760.td-b3lyp_6-31g+(d).log.xz

000700760.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700760.td-b3lyp_6-31+g(d).gjf (generated)

000700760.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700760.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700760.mol 000700760.PUBCHEM 000700760.mol (via Jmol)
000700775.b3lyp_6-31g(d).inp

000700775.b3lyp_6-31g(d).qchem.inp (generated)

000700775.b3lyp_6-31g(d).gjf (generated)

000700775.b3lyp_6-31g(d).firefly.inp (generated)

000700775.b3lyp_6-31g(d).smash.inp (generated)

000700775.b3lyp_6-31g(d).nwchem.inp (generated) 000700775.b3lyp_6-31g(d).log.xz 000700775.td-b3lyp_6-31g+(d).inp 000700775.td-b3lyp_6-31g+(d).log.xz

000700775.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700775.td-b3lyp_6-31+g(d).gjf (generated)

000700775.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700775.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700775.mol 000700775.PUBCHEM 000700775.mol (via Jmol)
000700790.b3lyp_6-31g(d).inp

000700790.b3lyp_6-31g(d).qchem.inp (generated)

000700790.b3lyp_6-31g(d).gjf (generated)

000700790.b3lyp_6-31g(d).firefly.inp (generated)

000700790.b3lyp_6-31g(d).smash.inp (generated)

000700790.b3lyp_6-31g(d).nwchem.inp (generated) 000700790.b3lyp_6-31g(d).log.xz 000700790.mol 000700790.PUBCHEM 000700790.mol (via Jmol)
000700794.b3lyp_6-31g(d).inp

000700794.b3lyp_6-31g(d).qchem.inp (generated)

000700794.b3lyp_6-31g(d).gjf (generated)

000700794.b3lyp_6-31g(d).firefly.inp (generated)

000700794.b3lyp_6-31g(d).smash.inp (generated)

000700794.b3lyp_6-31g(d).nwchem.inp (generated) 000700794.b3lyp_6-31g(d).log.xz 000700794.td-b3lyp_6-31g+(d).inp 000700794.td-b3lyp_6-31g+(d).log.xz

000700794.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700794.td-b3lyp_6-31+g(d).gjf (generated)

000700794.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700794.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700794.mol 000700794.PUBCHEM 000700794.mol (via Jmol)
000700801.b3lyp_6-31g(d).inp

000700801.b3lyp_6-31g(d).qchem.inp (generated)

000700801.b3lyp_6-31g(d).gjf (generated)

000700801.b3lyp_6-31g(d).firefly.inp (generated)

000700801.b3lyp_6-31g(d).smash.inp (generated)

000700801.b3lyp_6-31g(d).nwchem.inp (generated) 000700801.b3lyp_6-31g(d).log.xz 000700801.td-b3lyp_6-31g+(d).inp 000700801.td-b3lyp_6-31g+(d).log.xz

000700801.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700801.td-b3lyp_6-31+g(d).gjf (generated)

000700801.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700801.mol 000700801.PUBCHEM 000700801.mol (via Jmol)
000700804.b3lyp_6-31g(d).inp

000700804.b3lyp_6-31g(d).qchem.inp (generated)

000700804.b3lyp_6-31g(d).gjf (generated)

000700804.b3lyp_6-31g(d).firefly.inp (generated)

000700804.b3lyp_6-31g(d).smash.inp (generated)

000700804.b3lyp_6-31g(d).nwchem.inp (generated) 000700804.b3lyp_6-31g(d).log.xz 000700804.td-b3lyp_6-31g+(d).inp 000700804.td-b3lyp_6-31g+(d).log.xz

000700804.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700804.td-b3lyp_6-31+g(d).gjf (generated)

000700804.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700804.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700804.mol 000700804.PUBCHEM 000700804.mol (via Jmol)
000700805.b3lyp_6-31g(d).inp

000700805.b3lyp_6-31g(d).qchem.inp (generated)

000700805.b3lyp_6-31g(d).gjf (generated)

000700805.b3lyp_6-31g(d).firefly.inp (generated)

000700805.b3lyp_6-31g(d).smash.inp (generated)

000700805.b3lyp_6-31g(d).nwchem.inp (generated) 000700805.b3lyp_6-31g(d).log.xz 000700805.td-b3lyp_6-31g+(d).inp 000700805.td-b3lyp_6-31g+(d).log.xz

000700805.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700805.td-b3lyp_6-31+g(d).gjf (generated)

000700805.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700805.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700805.mol 000700805.PUBCHEM 000700805.mol (via Jmol)
000700810.b3lyp_6-31g(d).inp

000700810.b3lyp_6-31g(d).qchem.inp (generated)

000700810.b3lyp_6-31g(d).gjf (generated)

000700810.b3lyp_6-31g(d).firefly.inp (generated)

000700810.b3lyp_6-31g(d).smash.inp (generated)

000700810.b3lyp_6-31g(d).nwchem.inp (generated) 000700810.b3lyp_6-31g(d).log.xz 000700810.td-b3lyp_6-31g+(d).inp 000700810.td-b3lyp_6-31g+(d).log.xz

000700810.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700810.td-b3lyp_6-31+g(d).gjf (generated)

000700810.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700810.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700810.mol 000700810.PUBCHEM 000700810.mol (via Jmol)
000700829.b3lyp_6-31g(d).inp

000700829.b3lyp_6-31g(d).qchem.inp (generated)

000700829.b3lyp_6-31g(d).gjf (generated)

000700829.b3lyp_6-31g(d).firefly.inp (generated)

000700829.b3lyp_6-31g(d).smash.inp (generated)

000700829.b3lyp_6-31g(d).nwchem.inp (generated) 000700829.b3lyp_6-31g(d).log.xz 000700829.td-b3lyp_6-31g+(d).inp 000700829.td-b3lyp_6-31g+(d).log.xz

000700829.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700829.td-b3lyp_6-31+g(d).gjf (generated)

000700829.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700829.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700829.mol 000700829.PUBCHEM 000700829.mol (via Jmol)
000700848.b3lyp_6-31g(d).inp

000700848.b3lyp_6-31g(d).qchem.inp (generated)

000700848.b3lyp_6-31g(d).gjf (generated)

000700848.b3lyp_6-31g(d).firefly.inp (generated)

000700848.b3lyp_6-31g(d).smash.inp (generated)

000700848.b3lyp_6-31g(d).nwchem.inp (generated) 000700848.b3lyp_6-31g(d).log.xz 000700848.td-b3lyp_6-31g+(d).inp 000700848.td-b3lyp_6-31g+(d).log.xz

000700848.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700848.td-b3lyp_6-31+g(d).gjf (generated)

000700848.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700848.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700848.mol 000700848.PUBCHEM 000700848.mol (via Jmol)
000700853.b3lyp_6-31g(d).inp

000700853.b3lyp_6-31g(d).qchem.inp (generated)

000700853.b3lyp_6-31g(d).gjf (generated)

000700853.b3lyp_6-31g(d).firefly.inp (generated)

000700853.b3lyp_6-31g(d).smash.inp (generated)

000700853.b3lyp_6-31g(d).nwchem.inp (generated) 000700853.b3lyp_6-31g(d).log.xz 000700853.td-b3lyp_6-31g+(d).inp 000700853.td-b3lyp_6-31g+(d).log.xz

000700853.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700853.td-b3lyp_6-31+g(d).gjf (generated)

000700853.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700853.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700853.mol 000700853.PUBCHEM 000700853.mol (via Jmol)
000700861.b3lyp_6-31g(d).inp

000700861.b3lyp_6-31g(d).qchem.inp (generated)

000700861.b3lyp_6-31g(d).gjf (generated)

000700861.b3lyp_6-31g(d).firefly.inp (generated)

000700861.b3lyp_6-31g(d).smash.inp (generated)

000700861.b3lyp_6-31g(d).nwchem.inp (generated) 000700861.b3lyp_6-31g(d).log.xz 000700861.mol 000700861.PUBCHEM 000700861.mol (via Jmol)
000700871.b3lyp_6-31g(d).inp

000700871.b3lyp_6-31g(d).qchem.inp (generated)

000700871.b3lyp_6-31g(d).gjf (generated)

000700871.b3lyp_6-31g(d).firefly.inp (generated)

000700871.b3lyp_6-31g(d).smash.inp (generated)

000700871.b3lyp_6-31g(d).nwchem.inp (generated) 000700871.b3lyp_6-31g(d).log.xz 000700871.td-b3lyp_6-31g+(d).inp 000700871.td-b3lyp_6-31g+(d).log.xz

000700871.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700871.td-b3lyp_6-31+g(d).gjf (generated)

000700871.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700871.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700871.mol 000700871.PUBCHEM 000700871.mol (via Jmol)
000700885.b3lyp_6-31g(d).inp

000700885.b3lyp_6-31g(d).qchem.inp (generated)

000700885.b3lyp_6-31g(d).gjf (generated)

000700885.b3lyp_6-31g(d).firefly.inp (generated)

000700885.b3lyp_6-31g(d).smash.inp (generated)

000700885.b3lyp_6-31g(d).nwchem.inp (generated) 000700885.b3lyp_6-31g(d).log.xz 000700885.td-b3lyp_6-31g+(d).inp 000700885.td-b3lyp_6-31g+(d).log.xz

000700885.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700885.td-b3lyp_6-31+g(d).gjf (generated)

000700885.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700885.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700885.mol 000700885.PUBCHEM 000700885.mol (via Jmol)
000700893.b3lyp_6-31g(d).inp

000700893.b3lyp_6-31g(d).qchem.inp (generated)

000700893.b3lyp_6-31g(d).gjf (generated)

000700893.b3lyp_6-31g(d).firefly.inp (generated)

000700893.b3lyp_6-31g(d).smash.inp (generated)

000700893.b3lyp_6-31g(d).nwchem.inp (generated) 000700893.b3lyp_6-31g(d).log.xz 000700893.td-b3lyp_6-31g+(d).inp 000700893.td-b3lyp_6-31g+(d).log.xz

000700893.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700893.td-b3lyp_6-31+g(d).gjf (generated)

000700893.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700893.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700893.mol 000700893.PUBCHEM 000700893.mol (via Jmol)
000700904.b3lyp_6-31g(d).inp

000700904.b3lyp_6-31g(d).qchem.inp (generated)

000700904.b3lyp_6-31g(d).gjf (generated)

000700904.b3lyp_6-31g(d).firefly.inp (generated)

000700904.b3lyp_6-31g(d).smash.inp (generated)

000700904.b3lyp_6-31g(d).nwchem.inp (generated) 000700904.b3lyp_6-31g(d).log.xz 000700904.td-b3lyp_6-31g+(d).inp 000700904.td-b3lyp_6-31g+(d).log.xz

000700904.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700904.td-b3lyp_6-31+g(d).gjf (generated)

000700904.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700904.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700904.mol 000700904.PUBCHEM 000700904.mol (via Jmol)
000700923.b3lyp_6-31g(d).inp

000700923.b3lyp_6-31g(d).qchem.inp (generated)

000700923.b3lyp_6-31g(d).gjf (generated)

000700923.b3lyp_6-31g(d).firefly.inp (generated)

000700923.b3lyp_6-31g(d).smash.inp (generated)

000700923.b3lyp_6-31g(d).nwchem.inp (generated) 000700923.b3lyp_6-31g(d).log.xz 000700923.td-b3lyp_6-31g+(d).inp 000700923.td-b3lyp_6-31g+(d).log.xz

000700923.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700923.td-b3lyp_6-31+g(d).gjf (generated)

000700923.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700923.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700923.mol 000700923.PUBCHEM 000700923.mol (via Jmol)
000700947.b3lyp_6-31g(d).inp

000700947.b3lyp_6-31g(d).qchem.inp (generated)

000700947.b3lyp_6-31g(d).gjf (generated)

000700947.b3lyp_6-31g(d).firefly.inp (generated)

000700947.b3lyp_6-31g(d).smash.inp (generated)

000700947.b3lyp_6-31g(d).nwchem.inp (generated) 000700947.b3lyp_6-31g(d).log.xz 000700947.td-b3lyp_6-31g+(d).inp 000700947.td-b3lyp_6-31g+(d).log.xz

000700947.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700947.td-b3lyp_6-31+g(d).gjf (generated)

000700947.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700947.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700947.mol 000700947.PUBCHEM 000700947.mol (via Jmol)
000700950.b3lyp_6-31g(d).inp

000700950.b3lyp_6-31g(d).qchem.inp (generated)

000700950.b3lyp_6-31g(d).gjf (generated)

000700950.b3lyp_6-31g(d).firefly.inp (generated)

000700950.b3lyp_6-31g(d).smash.inp (generated)

000700950.b3lyp_6-31g(d).nwchem.inp (generated) 000700950.b3lyp_6-31g(d).log.xz 000700950.td-b3lyp_6-31g+(d).inp 000700950.td-b3lyp_6-31g+(d).log.xz

000700950.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700950.td-b3lyp_6-31+g(d).gjf (generated)

000700950.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700950.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700950.mol 000700950.PUBCHEM 000700950.mol (via Jmol)
000700954.b3lyp_6-31g(d).inp

000700954.b3lyp_6-31g(d).qchem.inp (generated)

000700954.b3lyp_6-31g(d).gjf (generated)

000700954.b3lyp_6-31g(d).firefly.inp (generated)

000700954.b3lyp_6-31g(d).smash.inp (generated)

000700954.b3lyp_6-31g(d).nwchem.inp (generated) 000700954.b3lyp_6-31g(d).log.xz 000700954.td-b3lyp_6-31g+(d).inp 000700954.td-b3lyp_6-31g+(d).log.xz

000700954.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700954.td-b3lyp_6-31+g(d).gjf (generated)

000700954.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700954.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700954.mol 000700954.PUBCHEM 000700954.mol (via Jmol)
000700956.b3lyp_6-31g(d).inp

000700956.b3lyp_6-31g(d).qchem.inp (generated)

000700956.b3lyp_6-31g(d).gjf (generated)

000700956.b3lyp_6-31g(d).firefly.inp (generated)

000700956.b3lyp_6-31g(d).smash.inp (generated)

000700956.b3lyp_6-31g(d).nwchem.inp (generated) 000700956.b3lyp_6-31g(d).log.xz 000700956.td-b3lyp_6-31g+(d).inp 000700956.td-b3lyp_6-31g+(d).log.xz

000700956.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700956.td-b3lyp_6-31+g(d).gjf (generated)

000700956.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700956.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700956.mol 000700956.PUBCHEM 000700956.mol (via Jmol)
000700959.b3lyp_6-31g(d).inp

000700959.b3lyp_6-31g(d).qchem.inp (generated)

000700959.b3lyp_6-31g(d).gjf (generated)

000700959.b3lyp_6-31g(d).firefly.inp (generated)

000700959.b3lyp_6-31g(d).smash.inp (generated)

000700959.b3lyp_6-31g(d).nwchem.inp (generated) 000700959.b3lyp_6-31g(d).log.xz 000700959.td-b3lyp_6-31g+(d).inp 000700959.td-b3lyp_6-31g+(d).log.xz

000700959.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700959.td-b3lyp_6-31+g(d).gjf (generated)

000700959.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700959.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700959.mol 000700959.PUBCHEM 000700959.mol (via Jmol)
000700961.b3lyp_6-31g(d).inp

000700961.b3lyp_6-31g(d).qchem.inp (generated)

000700961.b3lyp_6-31g(d).gjf (generated)

000700961.b3lyp_6-31g(d).firefly.inp (generated)

000700961.b3lyp_6-31g(d).smash.inp (generated)

000700961.b3lyp_6-31g(d).nwchem.inp (generated) 000700961.b3lyp_6-31g(d).log.xz 000700961.td-b3lyp_6-31g+(d).inp 000700961.td-b3lyp_6-31g+(d).log.xz

000700961.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700961.td-b3lyp_6-31+g(d).gjf (generated)

000700961.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700961.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700961.mol 000700961.PUBCHEM 000700961.mol (via Jmol)
000700974.b3lyp_6-31g(d).inp

000700974.b3lyp_6-31g(d).qchem.inp (generated)

000700974.b3lyp_6-31g(d).gjf (generated)

000700974.b3lyp_6-31g(d).firefly.inp (generated)

000700974.b3lyp_6-31g(d).smash.inp (generated)

000700974.b3lyp_6-31g(d).nwchem.inp (generated) 000700974.b3lyp_6-31g(d).log.xz 000700974.td-b3lyp_6-31g+(d).inp 000700974.td-b3lyp_6-31g+(d).log.xz

000700974.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700974.td-b3lyp_6-31+g(d).gjf (generated)

000700974.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700974.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700974.mol 000700974.PUBCHEM 000700974.mol (via Jmol)
000700998.b3lyp_6-31g(d).inp

000700998.b3lyp_6-31g(d).qchem.inp (generated)

000700998.b3lyp_6-31g(d).gjf (generated)

000700998.b3lyp_6-31g(d).firefly.inp (generated)

000700998.b3lyp_6-31g(d).smash.inp (generated)

000700998.b3lyp_6-31g(d).nwchem.inp (generated) 000700998.b3lyp_6-31g(d).log.xz 000700998.td-b3lyp_6-31g+(d).inp 000700998.td-b3lyp_6-31g+(d).log.xz

000700998.td-b3lyp_6-31+g(d).qchem.inp (generated)

000700998.td-b3lyp_6-31+g(d).gjf (generated)

000700998.td-b3lyp_6-31+g(d).firefly.inp (generated)

000700998.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000700998.mol 000700998.PUBCHEM 000700998.mol (via Jmol)
000701004.b3lyp_6-31g(d).inp

000701004.b3lyp_6-31g(d).qchem.inp (generated)

000701004.b3lyp_6-31g(d).gjf (generated)

000701004.b3lyp_6-31g(d).firefly.inp (generated)

000701004.b3lyp_6-31g(d).smash.inp (generated)

000701004.b3lyp_6-31g(d).nwchem.inp (generated) 000701004.b3lyp_6-31g(d).log.xz 000701004.td-b3lyp_6-31g+(d).inp 000701004.td-b3lyp_6-31g+(d).log.xz

000701004.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701004.td-b3lyp_6-31+g(d).gjf (generated)

000701004.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701004.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701004.mol 000701004.PUBCHEM 000701004.mol (via Jmol)
000701015.b3lyp_6-31g(d).inp

000701015.b3lyp_6-31g(d).qchem.inp (generated)

000701015.b3lyp_6-31g(d).gjf (generated)

000701015.b3lyp_6-31g(d).firefly.inp (generated)

000701015.b3lyp_6-31g(d).smash.inp (generated)

000701015.b3lyp_6-31g(d).nwchem.inp (generated) 000701015.b3lyp_6-31g(d).log.xz 000701015.td-b3lyp_6-31g+(d).inp 000701015.td-b3lyp_6-31g+(d).log.xz

000701015.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701015.td-b3lyp_6-31+g(d).gjf (generated)

000701015.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701015.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701015.mol 000701015.PUBCHEM 000701015.mol (via Jmol)
000701023.b3lyp_6-31g(d).inp

000701023.b3lyp_6-31g(d).qchem.inp (generated)

000701023.b3lyp_6-31g(d).gjf (generated)

000701023.b3lyp_6-31g(d).firefly.inp (generated)

000701023.b3lyp_6-31g(d).smash.inp (generated)

000701023.b3lyp_6-31g(d).nwchem.inp (generated) 000701023.b3lyp_6-31g(d).log.xz 000701023.td-b3lyp_6-31g+(d).inp 000701023.td-b3lyp_6-31g+(d).log.xz

000701023.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701023.td-b3lyp_6-31+g(d).gjf (generated)

000701023.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701023.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701023.mol 000701023.PUBCHEM 000701023.mol (via Jmol)
000701025.b3lyp_6-31g(d).inp

000701025.b3lyp_6-31g(d).qchem.inp (generated)

000701025.b3lyp_6-31g(d).gjf (generated)

000701025.b3lyp_6-31g(d).firefly.inp (generated)

000701025.b3lyp_6-31g(d).smash.inp (generated)

000701025.b3lyp_6-31g(d).nwchem.inp (generated) 000701025.b3lyp_6-31g(d).log.xz 000701025.td-b3lyp_6-31g+(d).inp 000701025.td-b3lyp_6-31g+(d).log.xz

000701025.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701025.td-b3lyp_6-31+g(d).gjf (generated)

000701025.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701025.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701025.mol 000701025.PUBCHEM 000701025.mol (via Jmol)
000701029.b3lyp_6-31g(d).inp

000701029.b3lyp_6-31g(d).qchem.inp (generated)

000701029.b3lyp_6-31g(d).gjf (generated)

000701029.b3lyp_6-31g(d).firefly.inp (generated)

000701029.b3lyp_6-31g(d).smash.inp (generated)

000701029.b3lyp_6-31g(d).nwchem.inp (generated) 000701029.b3lyp_6-31g(d).log.xz 000701029.td-b3lyp_6-31g+(d).inp 000701029.td-b3lyp_6-31g+(d).log.xz

000701029.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701029.td-b3lyp_6-31+g(d).gjf (generated)

000701029.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701029.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701029.mol 000701029.PUBCHEM 000701029.mol (via Jmol)
000701041.b3lyp_6-31g(d).inp

000701041.b3lyp_6-31g(d).qchem.inp (generated)

000701041.b3lyp_6-31g(d).gjf (generated)

000701041.b3lyp_6-31g(d).firefly.inp (generated)

000701041.b3lyp_6-31g(d).smash.inp (generated)

000701041.b3lyp_6-31g(d).nwchem.inp (generated) 000701041.b3lyp_6-31g(d).log.xz 000701041.mol 000701041.PUBCHEM 000701041.mol (via Jmol)
000701049.b3lyp_6-31g(d).inp

000701049.b3lyp_6-31g(d).qchem.inp (generated)

000701049.b3lyp_6-31g(d).gjf (generated)

000701049.b3lyp_6-31g(d).firefly.inp (generated)

000701049.b3lyp_6-31g(d).smash.inp (generated)

000701049.b3lyp_6-31g(d).nwchem.inp (generated) 000701049.b3lyp_6-31g(d).log.xz 000701049.mol 000701049.PUBCHEM 000701049.mol (via Jmol)
000701052.b3lyp_6-31g(d).inp

000701052.b3lyp_6-31g(d).qchem.inp (generated)

000701052.b3lyp_6-31g(d).gjf (generated)

000701052.b3lyp_6-31g(d).firefly.inp (generated)

000701052.b3lyp_6-31g(d).smash.inp (generated)

000701052.b3lyp_6-31g(d).nwchem.inp (generated) 000701052.b3lyp_6-31g(d).log.xz 000701052.mol 000701052.PUBCHEM 000701052.mol (via Jmol)
000701077.b3lyp_6-31g(d).inp

000701077.b3lyp_6-31g(d).qchem.inp (generated)

000701077.b3lyp_6-31g(d).gjf (generated)

000701077.b3lyp_6-31g(d).firefly.inp (generated)

000701077.b3lyp_6-31g(d).smash.inp (generated)

000701077.b3lyp_6-31g(d).nwchem.inp (generated) 000701077.b3lyp_6-31g(d).log.xz 000701077.mol 000701077.PUBCHEM 000701077.mol (via Jmol)
000701089.b3lyp_6-31g(d).inp

000701089.b3lyp_6-31g(d).qchem.inp (generated)

000701089.b3lyp_6-31g(d).gjf (generated)

000701089.b3lyp_6-31g(d).firefly.inp (generated)

000701089.b3lyp_6-31g(d).smash.inp (generated)

000701089.b3lyp_6-31g(d).nwchem.inp (generated) 000701089.b3lyp_6-31g(d).log.xz 000701089.td-b3lyp_6-31g+(d).inp 000701089.td-b3lyp_6-31g+(d).log.xz

000701089.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701089.td-b3lyp_6-31+g(d).gjf (generated)

000701089.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701089.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701089.mol 000701089.PUBCHEM 000701089.mol (via Jmol)
000701152.b3lyp_6-31g(d).inp

000701152.b3lyp_6-31g(d).qchem.inp (generated)

000701152.b3lyp_6-31g(d).gjf (generated)

000701152.b3lyp_6-31g(d).firefly.inp (generated)

000701152.b3lyp_6-31g(d).smash.inp (generated)

000701152.b3lyp_6-31g(d).nwchem.inp (generated) 000701152.b3lyp_6-31g(d).log.xz 000701152.td-b3lyp_6-31g+(d).inp 000701152.td-b3lyp_6-31g+(d).log.xz

000701152.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701152.td-b3lyp_6-31+g(d).gjf (generated)

000701152.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701152.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701152.mol 000701152.PUBCHEM 000701152.mol (via Jmol)
000701193.b3lyp_6-31g(d).inp

000701193.b3lyp_6-31g(d).qchem.inp (generated)

000701193.b3lyp_6-31g(d).gjf (generated)

000701193.b3lyp_6-31g(d).firefly.inp (generated)

000701193.b3lyp_6-31g(d).smash.inp (generated)

000701193.b3lyp_6-31g(d).nwchem.inp (generated) 000701193.b3lyp_6-31g(d).log.xz 000701193.mol 000701193.PUBCHEM 000701193.mol (via Jmol)
000701269.b3lyp_6-31g(d).inp

000701269.b3lyp_6-31g(d).qchem.inp (generated)

000701269.b3lyp_6-31g(d).gjf (generated)

000701269.b3lyp_6-31g(d).firefly.inp (generated)

000701269.b3lyp_6-31g(d).smash.inp (generated)

000701269.b3lyp_6-31g(d).nwchem.inp (generated) 000701269.b3lyp_6-31g(d).log.xz 000701269.td-b3lyp_6-31g+(d).inp 000701269.td-b3lyp_6-31g+(d).log.xz

000701269.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701269.td-b3lyp_6-31+g(d).gjf (generated)

000701269.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701269.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701269.mol 000701269.PUBCHEM 000701269.mol (via Jmol)
000701282.b3lyp_6-31g(d).inp

000701282.b3lyp_6-31g(d).qchem.inp (generated)

000701282.b3lyp_6-31g(d).gjf (generated)

000701282.b3lyp_6-31g(d).firefly.inp (generated)

000701282.b3lyp_6-31g(d).smash.inp (generated)

000701282.b3lyp_6-31g(d).nwchem.inp (generated) 000701282.b3lyp_6-31g(d).log.xz 000701282.td-b3lyp_6-31g+(d).inp 000701282.td-b3lyp_6-31g+(d).log.xz

000701282.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701282.td-b3lyp_6-31+g(d).gjf (generated)

000701282.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701282.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701282.mol 000701282.PUBCHEM 000701282.mol (via Jmol)
000701283.b3lyp_6-31g(d).inp

000701283.b3lyp_6-31g(d).qchem.inp (generated)

000701283.b3lyp_6-31g(d).gjf (generated)

000701283.b3lyp_6-31g(d).firefly.inp (generated)

000701283.b3lyp_6-31g(d).smash.inp (generated)

000701283.b3lyp_6-31g(d).nwchem.inp (generated) 000701283.b3lyp_6-31g(d).log.xz 000701283.mol 000701283.PUBCHEM 000701283.mol (via Jmol)
000701294.b3lyp_6-31g(d).inp

000701294.b3lyp_6-31g(d).qchem.inp (generated)

000701294.b3lyp_6-31g(d).gjf (generated)

000701294.b3lyp_6-31g(d).firefly.inp (generated)

000701294.b3lyp_6-31g(d).smash.inp (generated)

000701294.b3lyp_6-31g(d).nwchem.inp (generated) 000701294.b3lyp_6-31g(d).log.xz 000701294.td-b3lyp_6-31g+(d).inp 000701294.td-b3lyp_6-31g+(d).log.xz

000701294.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701294.td-b3lyp_6-31+g(d).gjf (generated)

000701294.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701294.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701294.mol 000701294.PUBCHEM 000701294.mol (via Jmol)
000701344.b3lyp_6-31g(d).inp

000701344.b3lyp_6-31g(d).qchem.inp (generated)

000701344.b3lyp_6-31g(d).gjf (generated)

000701344.b3lyp_6-31g(d).firefly.inp (generated)

000701344.b3lyp_6-31g(d).smash.inp (generated)

000701344.b3lyp_6-31g(d).nwchem.inp (generated) 000701344.b3lyp_6-31g(d).log.xz 000701344.td-b3lyp_6-31g+(d).inp 000701344.td-b3lyp_6-31g+(d).log.xz

000701344.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701344.td-b3lyp_6-31+g(d).gjf (generated)

000701344.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701344.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701344.mol 000701344.PUBCHEM 000701344.mol (via Jmol)
000701345.b3lyp_6-31g(d).inp

000701345.b3lyp_6-31g(d).qchem.inp (generated)

000701345.b3lyp_6-31g(d).gjf (generated)

000701345.b3lyp_6-31g(d).firefly.inp (generated)

000701345.b3lyp_6-31g(d).smash.inp (generated)

000701345.b3lyp_6-31g(d).nwchem.inp (generated) 000701345.b3lyp_6-31g(d).log.xz 000701345.td-b3lyp_6-31g+(d).inp 000701345.td-b3lyp_6-31g+(d).log.xz

000701345.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701345.td-b3lyp_6-31+g(d).gjf (generated)

000701345.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701345.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701345.mol 000701345.PUBCHEM 000701345.mol (via Jmol)
000701347.b3lyp_6-31g(d).inp

000701347.b3lyp_6-31g(d).qchem.inp (generated)

000701347.b3lyp_6-31g(d).gjf (generated)

000701347.b3lyp_6-31g(d).firefly.inp (generated)

000701347.b3lyp_6-31g(d).smash.inp (generated)

000701347.b3lyp_6-31g(d).nwchem.inp (generated) 000701347.b3lyp_6-31g(d).log.xz 000701347.td-b3lyp_6-31g+(d).inp 000701347.td-b3lyp_6-31g+(d).log.xz

000701347.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701347.td-b3lyp_6-31+g(d).gjf (generated)

000701347.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701347.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701347.mol 000701347.PUBCHEM 000701347.mol (via Jmol)
000701351.b3lyp_6-31g(d).inp

000701351.b3lyp_6-31g(d).qchem.inp (generated)

000701351.b3lyp_6-31g(d).gjf (generated)

000701351.b3lyp_6-31g(d).firefly.inp (generated)

000701351.b3lyp_6-31g(d).smash.inp (generated)

000701351.b3lyp_6-31g(d).nwchem.inp (generated) 000701351.b3lyp_6-31g(d).log.xz 000701351.td-b3lyp_6-31g+(d).inp 000701351.td-b3lyp_6-31g+(d).log.xz

000701351.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701351.td-b3lyp_6-31+g(d).gjf (generated)

000701351.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701351.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701351.mol 000701351.PUBCHEM 000701351.mol (via Jmol)
000701352.b3lyp_6-31g(d).inp

000701352.b3lyp_6-31g(d).qchem.inp (generated)

000701352.b3lyp_6-31g(d).gjf (generated)

000701352.b3lyp_6-31g(d).firefly.inp (generated)

000701352.b3lyp_6-31g(d).smash.inp (generated)

000701352.b3lyp_6-31g(d).nwchem.inp (generated) 000701352.b3lyp_6-31g(d).log.xz 000701352.td-b3lyp_6-31g+(d).inp 000701352.td-b3lyp_6-31g+(d).log.xz

000701352.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701352.td-b3lyp_6-31+g(d).gjf (generated)

000701352.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701352.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701352.mol 000701352.PUBCHEM 000701352.mol (via Jmol)
000701378.b3lyp_6-31g(d).inp

000701378.b3lyp_6-31g(d).qchem.inp (generated)

000701378.b3lyp_6-31g(d).gjf (generated)

000701378.b3lyp_6-31g(d).firefly.inp (generated)

000701378.b3lyp_6-31g(d).smash.inp (generated)

000701378.b3lyp_6-31g(d).nwchem.inp (generated) 000701378.b3lyp_6-31g(d).log.xz 000701378.td-b3lyp_6-31g+(d).inp 000701378.td-b3lyp_6-31g+(d).log.xz

000701378.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701378.td-b3lyp_6-31+g(d).gjf (generated)

000701378.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701378.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701378.mol 000701378.PUBCHEM 000701378.mol (via Jmol)
000701392.b3lyp_6-31g(d).inp

000701392.b3lyp_6-31g(d).qchem.inp (generated)

000701392.b3lyp_6-31g(d).gjf (generated)

000701392.b3lyp_6-31g(d).firefly.inp (generated)

000701392.b3lyp_6-31g(d).smash.inp (generated)

000701392.b3lyp_6-31g(d).nwchem.inp (generated) 000701392.b3lyp_6-31g(d).log.xz 000701392.td-b3lyp_6-31g+(d).inp 000701392.td-b3lyp_6-31g+(d).log.xz

000701392.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701392.td-b3lyp_6-31+g(d).gjf (generated)

000701392.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701392.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701392.mol 000701392.PUBCHEM 000701392.mol (via Jmol)
000701394.b3lyp_6-31g(d).inp

000701394.b3lyp_6-31g(d).qchem.inp (generated)

000701394.b3lyp_6-31g(d).gjf (generated)

000701394.b3lyp_6-31g(d).firefly.inp (generated)

000701394.b3lyp_6-31g(d).smash.inp (generated)

000701394.b3lyp_6-31g(d).nwchem.inp (generated) 000701394.b3lyp_6-31g(d).log.xz 000701394.td-b3lyp_6-31g+(d).inp 000701394.td-b3lyp_6-31g+(d).log.xz

000701394.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701394.td-b3lyp_6-31+g(d).gjf (generated)

000701394.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701394.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701394.mol 000701394.PUBCHEM 000701394.mol (via Jmol)
000701413.b3lyp_6-31g(d).inp

000701413.b3lyp_6-31g(d).qchem.inp (generated)

000701413.b3lyp_6-31g(d).gjf (generated)

000701413.b3lyp_6-31g(d).firefly.inp (generated)

000701413.b3lyp_6-31g(d).smash.inp (generated)

000701413.b3lyp_6-31g(d).nwchem.inp (generated) 000701413.b3lyp_6-31g(d).log.xz 000701413.mol 000701413.PUBCHEM 000701413.mol (via Jmol)
000701439.b3lyp_6-31g(d).inp

000701439.b3lyp_6-31g(d).qchem.inp (generated)

000701439.b3lyp_6-31g(d).gjf (generated)

000701439.b3lyp_6-31g(d).firefly.inp (generated)

000701439.b3lyp_6-31g(d).smash.inp (generated)

000701439.b3lyp_6-31g(d).nwchem.inp (generated) 000701439.b3lyp_6-31g(d).log.xz 000701439.mol 000701439.PUBCHEM 000701439.mol (via Jmol)
000701441.b3lyp_6-31g(d).inp

000701441.b3lyp_6-31g(d).qchem.inp (generated)

000701441.b3lyp_6-31g(d).gjf (generated)

000701441.b3lyp_6-31g(d).firefly.inp (generated)

000701441.b3lyp_6-31g(d).smash.inp (generated)

000701441.b3lyp_6-31g(d).nwchem.inp (generated) 000701441.b3lyp_6-31g(d).log.xz 000701441.mol 000701441.PUBCHEM 000701441.mol (via Jmol)
000701504.b3lyp_6-31g(d).inp

000701504.b3lyp_6-31g(d).qchem.inp (generated)

000701504.b3lyp_6-31g(d).gjf (generated)

000701504.b3lyp_6-31g(d).firefly.inp (generated)

000701504.b3lyp_6-31g(d).smash.inp (generated)

000701504.b3lyp_6-31g(d).nwchem.inp (generated) 000701504.b3lyp_6-31g(d).log.xz 000701504.mol 000701504.PUBCHEM 000701504.mol (via Jmol)
000701509.b3lyp_6-31g(d).inp

000701509.b3lyp_6-31g(d).qchem.inp (generated)

000701509.b3lyp_6-31g(d).gjf (generated)

000701509.b3lyp_6-31g(d).firefly.inp (generated)

000701509.b3lyp_6-31g(d).smash.inp (generated)

000701509.b3lyp_6-31g(d).nwchem.inp (generated) 000701509.b3lyp_6-31g(d).log.xz 000701509.td-b3lyp_6-31g+(d).inp 000701509.td-b3lyp_6-31g+(d).log.xz

000701509.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701509.td-b3lyp_6-31+g(d).gjf (generated)

000701509.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701509.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701509.mol 000701509.PUBCHEM 000701509.mol (via Jmol)
000701637.b3lyp_6-31g(d).inp

000701637.b3lyp_6-31g(d).qchem.inp (generated)

000701637.b3lyp_6-31g(d).gjf (generated)

000701637.b3lyp_6-31g(d).firefly.inp (generated)

000701637.b3lyp_6-31g(d).smash.inp (generated)

000701637.b3lyp_6-31g(d).nwchem.inp (generated) 000701637.b3lyp_6-31g(d).log.xz 000701637.td-b3lyp_6-31g+(d).inp 000701637.td-b3lyp_6-31g+(d).log.xz

000701637.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701637.td-b3lyp_6-31+g(d).gjf (generated)

000701637.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701637.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701637.mol 000701637.PUBCHEM 000701637.mol (via Jmol)
000701675.b3lyp_6-31g(d).inp

000701675.b3lyp_6-31g(d).qchem.inp (generated)

000701675.b3lyp_6-31g(d).gjf (generated)

000701675.b3lyp_6-31g(d).firefly.inp (generated)

000701675.b3lyp_6-31g(d).smash.inp (generated)

000701675.b3lyp_6-31g(d).nwchem.inp (generated) 000701675.b3lyp_6-31g(d).log.xz 000701675.mol 000701675.PUBCHEM 000701675.mol (via Jmol)
000701727.b3lyp_6-31g(d).inp

000701727.b3lyp_6-31g(d).qchem.inp (generated)

000701727.b3lyp_6-31g(d).gjf (generated)

000701727.b3lyp_6-31g(d).firefly.inp (generated)

000701727.b3lyp_6-31g(d).smash.inp (generated)

000701727.b3lyp_6-31g(d).nwchem.inp (generated) 000701727.b3lyp_6-31g(d).log.xz 000701727.td-b3lyp_6-31g+(d).inp 000701727.td-b3lyp_6-31g+(d).log.xz

000701727.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701727.td-b3lyp_6-31+g(d).gjf (generated)

000701727.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701727.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701727.mol 000701727.PUBCHEM 000701727.mol (via Jmol)
000701729.b3lyp_6-31g(d).inp

000701729.b3lyp_6-31g(d).qchem.inp (generated)

000701729.b3lyp_6-31g(d).gjf (generated)

000701729.b3lyp_6-31g(d).firefly.inp (generated)

000701729.b3lyp_6-31g(d).smash.inp (generated)

000701729.b3lyp_6-31g(d).nwchem.inp (generated) 000701729.b3lyp_6-31g(d).log.xz 000701729.td-b3lyp_6-31g+(d).inp 000701729.td-b3lyp_6-31g+(d).log.xz

000701729.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701729.td-b3lyp_6-31+g(d).gjf (generated)

000701729.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701729.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701729.mol 000701729.PUBCHEM 000701729.mol (via Jmol)
000701731.b3lyp_6-31g(d).inp

000701731.b3lyp_6-31g(d).qchem.inp (generated)

000701731.b3lyp_6-31g(d).gjf (generated)

000701731.b3lyp_6-31g(d).firefly.inp (generated)

000701731.b3lyp_6-31g(d).smash.inp (generated)

000701731.b3lyp_6-31g(d).nwchem.inp (generated) 000701731.b3lyp_6-31g(d).log.xz 000701731.td-b3lyp_6-31g+(d).inp 000701731.td-b3lyp_6-31g+(d).log.xz

000701731.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701731.td-b3lyp_6-31+g(d).gjf (generated)

000701731.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701731.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701731.mol 000701731.PUBCHEM 000701731.mol (via Jmol)
000701733.b3lyp_6-31g(d).inp

000701733.b3lyp_6-31g(d).qchem.inp (generated)

000701733.b3lyp_6-31g(d).gjf (generated)

000701733.b3lyp_6-31g(d).firefly.inp (generated)

000701733.b3lyp_6-31g(d).smash.inp (generated)

000701733.b3lyp_6-31g(d).nwchem.inp (generated) 000701733.b3lyp_6-31g(d).log.xz 000701733.td-b3lyp_6-31g+(d).inp 000701733.td-b3lyp_6-31g+(d).log.xz

000701733.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701733.td-b3lyp_6-31+g(d).gjf (generated)

000701733.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701733.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701733.mol 000701733.PUBCHEM 000701733.mol (via Jmol)
000701757.b3lyp_6-31g(d).inp

000701757.b3lyp_6-31g(d).qchem.inp (generated)

000701757.b3lyp_6-31g(d).gjf (generated)

000701757.b3lyp_6-31g(d).firefly.inp (generated)

000701757.b3lyp_6-31g(d).smash.inp (generated)

000701757.b3lyp_6-31g(d).nwchem.inp (generated) 000701757.b3lyp_6-31g(d).log.xz 000701757.mol 000701757.PUBCHEM 000701757.mol (via Jmol)
000701782.b3lyp_6-31g(d).inp

000701782.b3lyp_6-31g(d).qchem.inp (generated)

000701782.b3lyp_6-31g(d).gjf (generated)

000701782.b3lyp_6-31g(d).firefly.inp (generated)

000701782.b3lyp_6-31g(d).smash.inp (generated)

000701782.b3lyp_6-31g(d).nwchem.inp (generated) 000701782.b3lyp_6-31g(d).log.xz 000701782.td-b3lyp_6-31g+(d).inp 000701782.td-b3lyp_6-31g+(d).log.xz

000701782.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701782.td-b3lyp_6-31+g(d).gjf (generated)

000701782.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701782.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701782.mol 000701782.PUBCHEM 000701782.mol (via Jmol)
000701804.b3lyp_6-31g(d).inp

000701804.b3lyp_6-31g(d).qchem.inp (generated)

000701804.b3lyp_6-31g(d).gjf (generated)

000701804.b3lyp_6-31g(d).firefly.inp (generated)

000701804.b3lyp_6-31g(d).smash.inp (generated)

000701804.b3lyp_6-31g(d).nwchem.inp (generated) 000701804.b3lyp_6-31g(d).log.xz 000701804.td-b3lyp_6-31g+(d).inp 000701804.td-b3lyp_6-31g+(d).log.xz

000701804.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701804.td-b3lyp_6-31+g(d).gjf (generated)

000701804.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701804.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701804.mol 000701804.PUBCHEM 000701804.mol (via Jmol)
000701809.b3lyp_6-31g(d).inp

000701809.b3lyp_6-31g(d).qchem.inp (generated)

000701809.b3lyp_6-31g(d).gjf (generated)

000701809.b3lyp_6-31g(d).firefly.inp (generated)

000701809.b3lyp_6-31g(d).smash.inp (generated)

000701809.b3lyp_6-31g(d).nwchem.inp (generated) 000701809.b3lyp_6-31g(d).log.xz 000701809.td-b3lyp_6-31g+(d).inp 000701809.td-b3lyp_6-31g+(d).log.xz

000701809.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701809.td-b3lyp_6-31+g(d).gjf (generated)

000701809.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701809.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701809.mol 000701809.PUBCHEM 000701809.mol (via Jmol)
000701810.b3lyp_6-31g(d).inp

000701810.b3lyp_6-31g(d).qchem.inp (generated)

000701810.b3lyp_6-31g(d).gjf (generated)

000701810.b3lyp_6-31g(d).firefly.inp (generated)

000701810.b3lyp_6-31g(d).smash.inp (generated)

000701810.b3lyp_6-31g(d).nwchem.inp (generated) 000701810.b3lyp_6-31g(d).log.xz 000701810.td-b3lyp_6-31g+(d).inp 000701810.td-b3lyp_6-31g+(d).log.xz

000701810.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701810.td-b3lyp_6-31+g(d).gjf (generated)

000701810.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701810.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701810.mol 000701810.PUBCHEM 000701810.mol (via Jmol)
000701811.b3lyp_6-31g(d).inp

000701811.b3lyp_6-31g(d).qchem.inp (generated)

000701811.b3lyp_6-31g(d).gjf (generated)

000701811.b3lyp_6-31g(d).firefly.inp (generated)

000701811.b3lyp_6-31g(d).smash.inp (generated)

000701811.b3lyp_6-31g(d).nwchem.inp (generated) 000701811.b3lyp_6-31g(d).log.xz 000701811.td-b3lyp_6-31g+(d).inp 000701811.td-b3lyp_6-31g+(d).log.xz

000701811.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701811.td-b3lyp_6-31+g(d).gjf (generated)

000701811.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701811.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701811.mol 000701811.PUBCHEM 000701811.mol (via Jmol)
000701825.b3lyp_6-31g(d).inp

000701825.b3lyp_6-31g(d).qchem.inp (generated)

000701825.b3lyp_6-31g(d).gjf (generated)

000701825.b3lyp_6-31g(d).firefly.inp (generated)

000701825.b3lyp_6-31g(d).smash.inp (generated)

000701825.b3lyp_6-31g(d).nwchem.inp (generated) 000701825.b3lyp_6-31g(d).log.xz 000701825.td-b3lyp_6-31g+(d).inp 000701825.td-b3lyp_6-31g+(d).log.xz

000701825.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701825.td-b3lyp_6-31+g(d).gjf (generated)

000701825.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701825.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701825.mol 000701825.PUBCHEM 000701825.mol (via Jmol)
000701899.b3lyp_6-31g(d).inp

000701899.b3lyp_6-31g(d).qchem.inp (generated)

000701899.b3lyp_6-31g(d).gjf (generated)

000701899.b3lyp_6-31g(d).firefly.inp (generated)

000701899.b3lyp_6-31g(d).smash.inp (generated)

000701899.b3lyp_6-31g(d).nwchem.inp (generated) 000701899.b3lyp_6-31g(d).log.xz 000701899.mol 000701899.PUBCHEM 000701899.mol (via Jmol)
000701900.b3lyp_6-31g(d).inp

000701900.b3lyp_6-31g(d).qchem.inp (generated)

000701900.b3lyp_6-31g(d).gjf (generated)

000701900.b3lyp_6-31g(d).firefly.inp (generated)

000701900.b3lyp_6-31g(d).smash.inp (generated)

000701900.b3lyp_6-31g(d).nwchem.inp (generated) 000701900.b3lyp_6-31g(d).log.xz 000701900.td-b3lyp_6-31g+(d).inp 000701900.td-b3lyp_6-31g+(d).log.xz

000701900.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701900.td-b3lyp_6-31+g(d).gjf (generated)

000701900.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701900.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701900.mol 000701900.PUBCHEM 000701900.mol (via Jmol)
000701924.b3lyp_6-31g(d).inp

000701924.b3lyp_6-31g(d).qchem.inp (generated)

000701924.b3lyp_6-31g(d).gjf (generated)

000701924.b3lyp_6-31g(d).firefly.inp (generated)

000701924.b3lyp_6-31g(d).smash.inp (generated)

000701924.b3lyp_6-31g(d).nwchem.inp (generated) 000701924.b3lyp_6-31g(d).log.xz 000701924.td-b3lyp_6-31g+(d).inp 000701924.td-b3lyp_6-31g+(d).log.xz

000701924.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701924.td-b3lyp_6-31+g(d).gjf (generated)

000701924.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701924.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701924.mol 000701924.PUBCHEM 000701924.mol (via Jmol)
000701939.b3lyp_6-31g(d).inp

000701939.b3lyp_6-31g(d).qchem.inp (generated)

000701939.b3lyp_6-31g(d).gjf (generated)

000701939.b3lyp_6-31g(d).firefly.inp (generated)

000701939.b3lyp_6-31g(d).smash.inp (generated)

000701939.b3lyp_6-31g(d).nwchem.inp (generated) 000701939.b3lyp_6-31g(d).log.xz 000701939.td-b3lyp_6-31g+(d).inp 000701939.td-b3lyp_6-31g+(d).log.xz

000701939.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701939.td-b3lyp_6-31+g(d).gjf (generated)

000701939.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701939.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701939.mol 000701939.PUBCHEM 000701939.mol (via Jmol)
000701945.b3lyp_6-31g(d).inp

000701945.b3lyp_6-31g(d).qchem.inp (generated)

000701945.b3lyp_6-31g(d).gjf (generated)

000701945.b3lyp_6-31g(d).firefly.inp (generated)

000701945.b3lyp_6-31g(d).smash.inp (generated)

000701945.b3lyp_6-31g(d).nwchem.inp (generated) 000701945.b3lyp_6-31g(d).log.xz 000701945.mol 000701945.PUBCHEM 000701945.mol (via Jmol)
000701955.b3lyp_6-31g(d).inp

000701955.b3lyp_6-31g(d).qchem.inp (generated)

000701955.b3lyp_6-31g(d).gjf (generated)

000701955.b3lyp_6-31g(d).firefly.inp (generated)

000701955.b3lyp_6-31g(d).smash.inp (generated)

000701955.b3lyp_6-31g(d).nwchem.inp (generated) 000701955.b3lyp_6-31g(d).log.xz 000701955.td-b3lyp_6-31g+(d).inp 000701955.td-b3lyp_6-31g+(d).log.xz

000701955.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701955.td-b3lyp_6-31+g(d).gjf (generated)

000701955.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701955.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701955.mol 000701955.PUBCHEM 000701955.mol (via Jmol)
000701984.b3lyp_6-31g(d).inp

000701984.b3lyp_6-31g(d).qchem.inp (generated)

000701984.b3lyp_6-31g(d).gjf (generated)

000701984.b3lyp_6-31g(d).firefly.inp (generated)

000701984.b3lyp_6-31g(d).smash.inp (generated)

000701984.b3lyp_6-31g(d).nwchem.inp (generated) 000701984.b3lyp_6-31g(d).log.xz 000701984.td-b3lyp_6-31g+(d).inp 000701984.td-b3lyp_6-31g+(d).log.xz

000701984.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701984.td-b3lyp_6-31+g(d).gjf (generated)

000701984.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701984.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701984.mol 000701984.PUBCHEM 000701984.mol (via Jmol)
000701985.b3lyp_6-31g(d).inp

000701985.b3lyp_6-31g(d).qchem.inp (generated)

000701985.b3lyp_6-31g(d).gjf (generated)

000701985.b3lyp_6-31g(d).firefly.inp (generated)

000701985.b3lyp_6-31g(d).smash.inp (generated)

000701985.b3lyp_6-31g(d).nwchem.inp (generated) 000701985.b3lyp_6-31g(d).log.xz 000701985.td-b3lyp_6-31g+(d).inp 000701985.td-b3lyp_6-31g+(d).log.xz

000701985.td-b3lyp_6-31+g(d).qchem.inp (generated)

000701985.td-b3lyp_6-31+g(d).gjf (generated)

000701985.td-b3lyp_6-31+g(d).firefly.inp (generated)

000701985.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000701985.mol 000701985.PUBCHEM 000701985.mol (via Jmol)
000702008.b3lyp_6-31g(d).inp

000702008.b3lyp_6-31g(d).qchem.inp (generated)

000702008.b3lyp_6-31g(d).gjf (generated)

000702008.b3lyp_6-31g(d).firefly.inp (generated)

000702008.b3lyp_6-31g(d).smash.inp (generated)

000702008.b3lyp_6-31g(d).nwchem.inp (generated) 000702008.b3lyp_6-31g(d).log.xz 000702008.td-b3lyp_6-31g+(d).inp 000702008.td-b3lyp_6-31g+(d).log.xz

000702008.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702008.td-b3lyp_6-31+g(d).gjf (generated)

000702008.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702008.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702008.mol 000702008.PUBCHEM 000702008.mol (via Jmol)
000702012.b3lyp_6-31g(d).inp

000702012.b3lyp_6-31g(d).qchem.inp (generated)

000702012.b3lyp_6-31g(d).gjf (generated)

000702012.b3lyp_6-31g(d).firefly.inp (generated)

000702012.b3lyp_6-31g(d).smash.inp (generated)

000702012.b3lyp_6-31g(d).nwchem.inp (generated) 000702012.b3lyp_6-31g(d).log.xz 000702012.td-b3lyp_6-31g+(d).inp 000702012.td-b3lyp_6-31g+(d).log.xz

000702012.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702012.td-b3lyp_6-31+g(d).gjf (generated)

000702012.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702012.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702012.mol 000702012.PUBCHEM 000702012.mol (via Jmol)
000702035.b3lyp_6-31g(d).inp

000702035.b3lyp_6-31g(d).qchem.inp (generated)

000702035.b3lyp_6-31g(d).gjf (generated)

000702035.b3lyp_6-31g(d).firefly.inp (generated)

000702035.b3lyp_6-31g(d).smash.inp (generated)

000702035.b3lyp_6-31g(d).nwchem.inp (generated) 000702035.b3lyp_6-31g(d).log.xz 000702035.td-b3lyp_6-31g+(d).inp 000702035.td-b3lyp_6-31g+(d).log.xz

000702035.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702035.td-b3lyp_6-31+g(d).gjf (generated)

000702035.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702035.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702035.mol 000702035.PUBCHEM 000702035.mol (via Jmol)
000702039.b3lyp_6-31g(d).inp

000702039.b3lyp_6-31g(d).qchem.inp (generated)

000702039.b3lyp_6-31g(d).gjf (generated)

000702039.b3lyp_6-31g(d).firefly.inp (generated)

000702039.b3lyp_6-31g(d).smash.inp (generated)

000702039.b3lyp_6-31g(d).nwchem.inp (generated) 000702039.b3lyp_6-31g(d).log.xz 000702039.td-b3lyp_6-31g+(d).inp 000702039.td-b3lyp_6-31g+(d).log.xz

000702039.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702039.td-b3lyp_6-31+g(d).gjf (generated)

000702039.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702039.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702039.mol 000702039.PUBCHEM 000702039.mol (via Jmol)
000702044.b3lyp_6-31g(d).inp

000702044.b3lyp_6-31g(d).qchem.inp (generated)

000702044.b3lyp_6-31g(d).gjf (generated)

000702044.b3lyp_6-31g(d).firefly.inp (generated)

000702044.b3lyp_6-31g(d).smash.inp (generated)

000702044.b3lyp_6-31g(d).nwchem.inp (generated) 000702044.b3lyp_6-31g(d).log.xz 000702044.td-b3lyp_6-31g+(d).inp 000702044.td-b3lyp_6-31g+(d).log.xz

000702044.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702044.td-b3lyp_6-31+g(d).gjf (generated)

000702044.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702044.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702044.mol 000702044.PUBCHEM 000702044.mol (via Jmol)
000702083.b3lyp_6-31g(d).inp

000702083.b3lyp_6-31g(d).qchem.inp (generated)

000702083.b3lyp_6-31g(d).gjf (generated)

000702083.b3lyp_6-31g(d).firefly.inp (generated)

000702083.b3lyp_6-31g(d).smash.inp (generated)

000702083.b3lyp_6-31g(d).nwchem.inp (generated) 000702083.b3lyp_6-31g(d).log.xz 000702083.td-b3lyp_6-31g+(d).inp 000702083.td-b3lyp_6-31g+(d).log.xz

000702083.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702083.td-b3lyp_6-31+g(d).gjf (generated)

000702083.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702083.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702083.mol 000702083.PUBCHEM 000702083.mol (via Jmol)
000702115.b3lyp_6-31g(d).inp

000702115.b3lyp_6-31g(d).qchem.inp (generated)

000702115.b3lyp_6-31g(d).gjf (generated)

000702115.b3lyp_6-31g(d).firefly.inp (generated)

000702115.b3lyp_6-31g(d).smash.inp (generated)

000702115.b3lyp_6-31g(d).nwchem.inp (generated) 000702115.b3lyp_6-31g(d).log.xz 000702115.td-b3lyp_6-31g+(d).inp 000702115.td-b3lyp_6-31g+(d).log.xz

000702115.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702115.td-b3lyp_6-31+g(d).gjf (generated)

000702115.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702115.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702115.mol 000702115.PUBCHEM 000702115.mol (via Jmol)
000702129.b3lyp_6-31g(d).inp

000702129.b3lyp_6-31g(d).qchem.inp (generated)

000702129.b3lyp_6-31g(d).gjf (generated)

000702129.b3lyp_6-31g(d).firefly.inp (generated)

000702129.b3lyp_6-31g(d).smash.inp (generated)

000702129.b3lyp_6-31g(d).nwchem.inp (generated) 000702129.b3lyp_6-31g(d).log.xz 000702129.td-b3lyp_6-31g+(d).inp 000702129.td-b3lyp_6-31g+(d).log.xz

000702129.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702129.td-b3lyp_6-31+g(d).gjf (generated)

000702129.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702129.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702129.mol 000702129.PUBCHEM 000702129.mol (via Jmol)
000702130.b3lyp_6-31g(d).inp

000702130.b3lyp_6-31g(d).qchem.inp (generated)

000702130.b3lyp_6-31g(d).gjf (generated)

000702130.b3lyp_6-31g(d).firefly.inp (generated)

000702130.b3lyp_6-31g(d).smash.inp (generated)

000702130.b3lyp_6-31g(d).nwchem.inp (generated) 000702130.b3lyp_6-31g(d).log.xz 000702130.td-b3lyp_6-31g+(d).inp 000702130.td-b3lyp_6-31g+(d).log.xz

000702130.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702130.td-b3lyp_6-31+g(d).gjf (generated)

000702130.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702130.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702130.mol 000702130.PUBCHEM 000702130.mol (via Jmol)
000702134.b3lyp_6-31g(d).inp

000702134.b3lyp_6-31g(d).qchem.inp (generated)

000702134.b3lyp_6-31g(d).gjf (generated)

000702134.b3lyp_6-31g(d).firefly.inp (generated)

000702134.b3lyp_6-31g(d).smash.inp (generated)

000702134.b3lyp_6-31g(d).nwchem.inp (generated) 000702134.b3lyp_6-31g(d).log.xz 000702134.td-b3lyp_6-31g+(d).inp 000702134.td-b3lyp_6-31g+(d).log.xz

000702134.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702134.td-b3lyp_6-31+g(d).gjf (generated)

000702134.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702134.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702134.mol 000702134.PUBCHEM 000702134.mol (via Jmol)
000702145.b3lyp_6-31g(d).inp

000702145.b3lyp_6-31g(d).qchem.inp (generated)

000702145.b3lyp_6-31g(d).gjf (generated)

000702145.b3lyp_6-31g(d).firefly.inp (generated)

000702145.b3lyp_6-31g(d).smash.inp (generated)

000702145.b3lyp_6-31g(d).nwchem.inp (generated) 000702145.b3lyp_6-31g(d).log.xz 000702145.mol 000702145.PUBCHEM 000702145.mol (via Jmol)
000702147.b3lyp_6-31g(d).inp

000702147.b3lyp_6-31g(d).qchem.inp (generated)

000702147.b3lyp_6-31g(d).gjf (generated)

000702147.b3lyp_6-31g(d).firefly.inp (generated)

000702147.b3lyp_6-31g(d).smash.inp (generated)

000702147.b3lyp_6-31g(d).nwchem.inp (generated) 000702147.b3lyp_6-31g(d).log.xz 000702147.td-b3lyp_6-31g+(d).inp 000702147.td-b3lyp_6-31g+(d).log.xz

000702147.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702147.td-b3lyp_6-31+g(d).gjf (generated)

000702147.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702147.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702147.mol 000702147.PUBCHEM 000702147.mol (via Jmol)
000702153.b3lyp_6-31g(d).inp

000702153.b3lyp_6-31g(d).qchem.inp (generated)

000702153.b3lyp_6-31g(d).gjf (generated)

000702153.b3lyp_6-31g(d).firefly.inp (generated)

000702153.b3lyp_6-31g(d).smash.inp (generated)

000702153.b3lyp_6-31g(d).nwchem.inp (generated) 000702153.b3lyp_6-31g(d).log.xz 000702153.td-b3lyp_6-31g+(d).inp 000702153.td-b3lyp_6-31g+(d).log.xz

000702153.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702153.td-b3lyp_6-31+g(d).gjf (generated)

000702153.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702153.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702153.mol 000702153.PUBCHEM 000702153.mol (via Jmol)
000702170.b3lyp_6-31g(d).inp

000702170.b3lyp_6-31g(d).qchem.inp (generated)

000702170.b3lyp_6-31g(d).gjf (generated)

000702170.b3lyp_6-31g(d).firefly.inp (generated)

000702170.b3lyp_6-31g(d).smash.inp (generated)

000702170.b3lyp_6-31g(d).nwchem.inp (generated) 000702170.b3lyp_6-31g(d).log.xz 000702170.td-b3lyp_6-31g+(d).inp 000702170.td-b3lyp_6-31g+(d).log.xz

000702170.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702170.td-b3lyp_6-31+g(d).gjf (generated)

000702170.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702170.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702170.mol 000702170.PUBCHEM 000702170.mol (via Jmol)
000702175.b3lyp_6-31g(d).inp

000702175.b3lyp_6-31g(d).qchem.inp (generated)

000702175.b3lyp_6-31g(d).gjf (generated)

000702175.b3lyp_6-31g(d).firefly.inp (generated)

000702175.b3lyp_6-31g(d).smash.inp (generated)

000702175.b3lyp_6-31g(d).nwchem.inp (generated) 000702175.b3lyp_6-31g(d).log.xz 000702175.td-b3lyp_6-31g+(d).inp 000702175.td-b3lyp_6-31g+(d).log.xz

000702175.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702175.td-b3lyp_6-31+g(d).gjf (generated)

000702175.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702175.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702175.mol 000702175.PUBCHEM 000702175.mol (via Jmol)
000702182.b3lyp_6-31g(d).inp

000702182.b3lyp_6-31g(d).qchem.inp (generated)

000702182.b3lyp_6-31g(d).gjf (generated)

000702182.b3lyp_6-31g(d).firefly.inp (generated)

000702182.b3lyp_6-31g(d).smash.inp (generated)

000702182.b3lyp_6-31g(d).nwchem.inp (generated) 000702182.b3lyp_6-31g(d).log.xz 000702182.mol 000702182.PUBCHEM 000702182.mol (via Jmol)
000702184.b3lyp_6-31g(d).inp

000702184.b3lyp_6-31g(d).qchem.inp (generated)

000702184.b3lyp_6-31g(d).gjf (generated)

000702184.b3lyp_6-31g(d).firefly.inp (generated)

000702184.b3lyp_6-31g(d).smash.inp (generated)

000702184.b3lyp_6-31g(d).nwchem.inp (generated) 000702184.b3lyp_6-31g(d).log.xz 000702184.td-b3lyp_6-31g+(d).inp 000702184.td-b3lyp_6-31g+(d).log.xz

000702184.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702184.td-b3lyp_6-31+g(d).gjf (generated)

000702184.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702184.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702184.mol 000702184.PUBCHEM 000702184.mol (via Jmol)
000702189.b3lyp_6-31g(d).inp

000702189.b3lyp_6-31g(d).qchem.inp (generated)

000702189.b3lyp_6-31g(d).gjf (generated)

000702189.b3lyp_6-31g(d).firefly.inp (generated)

000702189.b3lyp_6-31g(d).smash.inp (generated)

000702189.b3lyp_6-31g(d).nwchem.inp (generated) 000702189.b3lyp_6-31g(d).log.xz 000702189.td-b3lyp_6-31g+(d).inp 000702189.td-b3lyp_6-31g+(d).log.xz

000702189.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702189.td-b3lyp_6-31+g(d).gjf (generated)

000702189.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702189.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702189.mol 000702189.PUBCHEM 000702189.mol (via Jmol)
000702192.b3lyp_6-31g(d).inp

000702192.b3lyp_6-31g(d).qchem.inp (generated)

000702192.b3lyp_6-31g(d).gjf (generated)

000702192.b3lyp_6-31g(d).firefly.inp (generated)

000702192.b3lyp_6-31g(d).smash.inp (generated)

000702192.b3lyp_6-31g(d).nwchem.inp (generated) 000702192.b3lyp_6-31g(d).log.xz 000702192.mol 000702192.PUBCHEM 000702192.mol (via Jmol)
000702207.b3lyp_6-31g(d).inp

000702207.b3lyp_6-31g(d).qchem.inp (generated)

000702207.b3lyp_6-31g(d).gjf (generated)

000702207.b3lyp_6-31g(d).firefly.inp (generated)

000702207.b3lyp_6-31g(d).smash.inp (generated)

000702207.b3lyp_6-31g(d).nwchem.inp (generated) 000702207.b3lyp_6-31g(d).log.xz 000702207.mol 000702207.PUBCHEM 000702207.mol (via Jmol)
000702219.b3lyp_6-31g(d).inp

000702219.b3lyp_6-31g(d).qchem.inp (generated)

000702219.b3lyp_6-31g(d).gjf (generated)

000702219.b3lyp_6-31g(d).firefly.inp (generated)

000702219.b3lyp_6-31g(d).smash.inp (generated)

000702219.b3lyp_6-31g(d).nwchem.inp (generated) 000702219.b3lyp_6-31g(d).log.xz 000702219.td-b3lyp_6-31g+(d).inp 000702219.td-b3lyp_6-31g+(d).log.xz

000702219.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702219.td-b3lyp_6-31+g(d).gjf (generated)

000702219.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702219.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702219.mol 000702219.PUBCHEM 000702219.mol (via Jmol)
000702220.b3lyp_6-31g(d).inp

000702220.b3lyp_6-31g(d).qchem.inp (generated)

000702220.b3lyp_6-31g(d).gjf (generated)

000702220.b3lyp_6-31g(d).firefly.inp (generated)

000702220.b3lyp_6-31g(d).smash.inp (generated)

000702220.b3lyp_6-31g(d).nwchem.inp (generated) 000702220.b3lyp_6-31g(d).log.xz 000702220.td-b3lyp_6-31g+(d).inp 000702220.td-b3lyp_6-31g+(d).log.xz

000702220.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702220.td-b3lyp_6-31+g(d).gjf (generated)

000702220.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702220.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702220.mol 000702220.PUBCHEM 000702220.mol (via Jmol)
000702232.b3lyp_6-31g(d).inp

000702232.b3lyp_6-31g(d).qchem.inp (generated)

000702232.b3lyp_6-31g(d).gjf (generated)

000702232.b3lyp_6-31g(d).firefly.inp (generated)

000702232.b3lyp_6-31g(d).smash.inp (generated)

000702232.b3lyp_6-31g(d).nwchem.inp (generated) 000702232.b3lyp_6-31g(d).log.xz 000702232.td-b3lyp_6-31g+(d).inp 000702232.td-b3lyp_6-31g+(d).log.xz

000702232.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702232.td-b3lyp_6-31+g(d).gjf (generated)

000702232.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702232.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702232.mol 000702232.PUBCHEM 000702232.mol (via Jmol)
000702235.b3lyp_6-31g(d).inp

000702235.b3lyp_6-31g(d).qchem.inp (generated)

000702235.b3lyp_6-31g(d).gjf (generated)

000702235.b3lyp_6-31g(d).firefly.inp (generated)

000702235.b3lyp_6-31g(d).smash.inp (generated)

000702235.b3lyp_6-31g(d).nwchem.inp (generated) 000702235.b3lyp_6-31g(d).log.xz 000702235.td-b3lyp_6-31g+(d).inp 000702235.td-b3lyp_6-31g+(d).log.xz

000702235.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702235.td-b3lyp_6-31+g(d).gjf (generated)

000702235.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702235.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702235.mol 000702235.PUBCHEM 000702235.mol (via Jmol)
000702250.b3lyp_6-31g(d).inp

000702250.b3lyp_6-31g(d).qchem.inp (generated)

000702250.b3lyp_6-31g(d).gjf (generated)

000702250.b3lyp_6-31g(d).firefly.inp (generated)

000702250.b3lyp_6-31g(d).smash.inp (generated)

000702250.b3lyp_6-31g(d).nwchem.inp (generated) 000702250.b3lyp_6-31g(d).log.xz 000702250.mol 000702250.PUBCHEM 000702250.mol (via Jmol)
000702265.b3lyp_6-31g(d).inp

000702265.b3lyp_6-31g(d).qchem.inp (generated)

000702265.b3lyp_6-31g(d).gjf (generated)

000702265.b3lyp_6-31g(d).firefly.inp (generated)

000702265.b3lyp_6-31g(d).smash.inp (generated)

000702265.b3lyp_6-31g(d).nwchem.inp (generated) 000702265.b3lyp_6-31g(d).log.xz 000702265.td-b3lyp_6-31g+(d).inp 000702265.td-b3lyp_6-31g+(d).log.xz

000702265.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702265.td-b3lyp_6-31+g(d).gjf (generated)

000702265.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702265.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702265.mol 000702265.PUBCHEM 000702265.mol (via Jmol)
000702270.b3lyp_6-31g(d).inp

000702270.b3lyp_6-31g(d).qchem.inp (generated)

000702270.b3lyp_6-31g(d).gjf (generated)

000702270.b3lyp_6-31g(d).firefly.inp (generated)

000702270.b3lyp_6-31g(d).smash.inp (generated)

000702270.b3lyp_6-31g(d).nwchem.inp (generated) 000702270.b3lyp_6-31g(d).log.xz 000702270.td-b3lyp_6-31g+(d).inp 000702270.td-b3lyp_6-31g+(d).log.xz

000702270.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702270.td-b3lyp_6-31+g(d).gjf (generated)

000702270.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702270.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702270.mol 000702270.PUBCHEM 000702270.mol (via Jmol)
000702271.b3lyp_6-31g(d).inp

000702271.b3lyp_6-31g(d).qchem.inp (generated)

000702271.b3lyp_6-31g(d).gjf (generated)

000702271.b3lyp_6-31g(d).firefly.inp (generated)

000702271.b3lyp_6-31g(d).smash.inp (generated)

000702271.b3lyp_6-31g(d).nwchem.inp (generated) 000702271.b3lyp_6-31g(d).log.xz 000702271.td-b3lyp_6-31g+(d).inp 000702271.td-b3lyp_6-31g+(d).log.xz

000702271.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702271.td-b3lyp_6-31+g(d).gjf (generated)

000702271.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702271.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702271.mol 000702271.PUBCHEM 000702271.mol (via Jmol)
000702274.b3lyp_6-31g(d).inp

000702274.b3lyp_6-31g(d).qchem.inp (generated)

000702274.b3lyp_6-31g(d).gjf (generated)

000702274.b3lyp_6-31g(d).firefly.inp (generated)

000702274.b3lyp_6-31g(d).smash.inp (generated)

000702274.b3lyp_6-31g(d).nwchem.inp (generated) 000702274.b3lyp_6-31g(d).log.xz 000702274.td-b3lyp_6-31g+(d).inp 000702274.td-b3lyp_6-31g+(d).log.xz

000702274.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702274.td-b3lyp_6-31+g(d).gjf (generated)

000702274.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702274.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702274.mol 000702274.PUBCHEM 000702274.mol (via Jmol)
000702275.b3lyp_6-31g(d).inp

000702275.b3lyp_6-31g(d).qchem.inp (generated)

000702275.b3lyp_6-31g(d).gjf (generated)

000702275.b3lyp_6-31g(d).firefly.inp (generated)

000702275.b3lyp_6-31g(d).smash.inp (generated)

000702275.b3lyp_6-31g(d).nwchem.inp (generated) 000702275.b3lyp_6-31g(d).log.xz 000702275.td-b3lyp_6-31g+(d).inp 000702275.td-b3lyp_6-31g+(d).log.xz

000702275.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702275.td-b3lyp_6-31+g(d).gjf (generated)

000702275.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702275.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702275.mol 000702275.PUBCHEM 000702275.mol (via Jmol)
000702277.b3lyp_6-31g(d).inp

000702277.b3lyp_6-31g(d).qchem.inp (generated)

000702277.b3lyp_6-31g(d).gjf (generated)

000702277.b3lyp_6-31g(d).firefly.inp (generated)

000702277.b3lyp_6-31g(d).smash.inp (generated)

000702277.b3lyp_6-31g(d).nwchem.inp (generated) 000702277.b3lyp_6-31g(d).log.xz 000702277.td-b3lyp_6-31g+(d).inp 000702277.td-b3lyp_6-31g+(d).log.xz

000702277.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702277.td-b3lyp_6-31+g(d).gjf (generated)

000702277.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702277.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702277.mol 000702277.PUBCHEM 000702277.mol (via Jmol)
000702285.b3lyp_6-31g(d).inp

000702285.b3lyp_6-31g(d).qchem.inp (generated)

000702285.b3lyp_6-31g(d).gjf (generated)

000702285.b3lyp_6-31g(d).firefly.inp (generated)

000702285.b3lyp_6-31g(d).smash.inp (generated)

000702285.b3lyp_6-31g(d).nwchem.inp (generated) 000702285.b3lyp_6-31g(d).log.xz 000702285.td-b3lyp_6-31g+(d).inp 000702285.td-b3lyp_6-31g+(d).log.xz

000702285.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702285.td-b3lyp_6-31+g(d).gjf (generated)

000702285.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702285.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702285.mol 000702285.PUBCHEM 000702285.mol (via Jmol)
000702289.b3lyp_6-31g(d).inp

000702289.b3lyp_6-31g(d).qchem.inp (generated)

000702289.b3lyp_6-31g(d).gjf (generated)

000702289.b3lyp_6-31g(d).firefly.inp (generated)

000702289.b3lyp_6-31g(d).smash.inp (generated)

000702289.b3lyp_6-31g(d).nwchem.inp (generated) 000702289.b3lyp_6-31g(d).log.xz 000702289.mol 000702289.PUBCHEM 000702289.mol (via Jmol)
000702293.b3lyp_6-31g(d).inp

000702293.b3lyp_6-31g(d).qchem.inp (generated)

000702293.b3lyp_6-31g(d).gjf (generated)

000702293.b3lyp_6-31g(d).firefly.inp (generated)

000702293.b3lyp_6-31g(d).smash.inp (generated)

000702293.b3lyp_6-31g(d).nwchem.inp (generated) 000702293.b3lyp_6-31g(d).log.xz 000702293.td-b3lyp_6-31g+(d).inp 000702293.td-b3lyp_6-31g+(d).log.xz

000702293.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702293.td-b3lyp_6-31+g(d).gjf (generated)

000702293.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702293.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702293.mol 000702293.PUBCHEM 000702293.mol (via Jmol)
000702294.b3lyp_6-31g(d).inp

000702294.b3lyp_6-31g(d).qchem.inp (generated)

000702294.b3lyp_6-31g(d).gjf (generated)

000702294.b3lyp_6-31g(d).firefly.inp (generated)

000702294.b3lyp_6-31g(d).smash.inp (generated)

000702294.b3lyp_6-31g(d).nwchem.inp (generated) 000702294.b3lyp_6-31g(d).log.xz 000702294.td-b3lyp_6-31g+(d).inp 000702294.td-b3lyp_6-31g+(d).log.xz

000702294.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702294.td-b3lyp_6-31+g(d).gjf (generated)

000702294.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702294.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702294.mol 000702294.PUBCHEM 000702294.mol (via Jmol)
000702295.b3lyp_6-31g(d).inp

000702295.b3lyp_6-31g(d).qchem.inp (generated)

000702295.b3lyp_6-31g(d).gjf (generated)

000702295.b3lyp_6-31g(d).firefly.inp (generated)

000702295.b3lyp_6-31g(d).smash.inp (generated)

000702295.b3lyp_6-31g(d).nwchem.inp (generated) 000702295.b3lyp_6-31g(d).log.xz 000702295.td-b3lyp_6-31g+(d).inp 000702295.td-b3lyp_6-31g+(d).log.xz

000702295.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702295.td-b3lyp_6-31+g(d).gjf (generated)

000702295.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702295.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702295.mol 000702295.PUBCHEM 000702295.mol (via Jmol)
000702297.b3lyp_6-31g(d).inp

000702297.b3lyp_6-31g(d).qchem.inp (generated)

000702297.b3lyp_6-31g(d).gjf (generated)

000702297.b3lyp_6-31g(d).firefly.inp (generated)

000702297.b3lyp_6-31g(d).smash.inp (generated)

000702297.b3lyp_6-31g(d).nwchem.inp (generated) 000702297.b3lyp_6-31g(d).log.xz 000702297.mol 000702297.PUBCHEM 000702297.mol (via Jmol)
000702299.b3lyp_6-31g(d).inp

000702299.b3lyp_6-31g(d).qchem.inp (generated)

000702299.b3lyp_6-31g(d).gjf (generated)

000702299.b3lyp_6-31g(d).firefly.inp (generated)

000702299.b3lyp_6-31g(d).smash.inp (generated)

000702299.b3lyp_6-31g(d).nwchem.inp (generated) 000702299.b3lyp_6-31g(d).log.xz 000702299.mol 000702299.PUBCHEM 000702299.mol (via Jmol)
000702312.b3lyp_6-31g(d).inp

000702312.b3lyp_6-31g(d).qchem.inp (generated)

000702312.b3lyp_6-31g(d).gjf (generated)

000702312.b3lyp_6-31g(d).firefly.inp (generated)

000702312.b3lyp_6-31g(d).smash.inp (generated)

000702312.b3lyp_6-31g(d).nwchem.inp (generated) 000702312.b3lyp_6-31g(d).log.xz 000702312.td-b3lyp_6-31g+(d).inp 000702312.td-b3lyp_6-31g+(d).log.xz

000702312.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702312.td-b3lyp_6-31+g(d).gjf (generated)

000702312.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702312.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702312.mol 000702312.PUBCHEM 000702312.mol (via Jmol)
000702313.b3lyp_6-31g(d).inp

000702313.b3lyp_6-31g(d).qchem.inp (generated)

000702313.b3lyp_6-31g(d).gjf (generated)

000702313.b3lyp_6-31g(d).firefly.inp (generated)

000702313.b3lyp_6-31g(d).smash.inp (generated)

000702313.b3lyp_6-31g(d).nwchem.inp (generated) 000702313.b3lyp_6-31g(d).log.xz 000702313.td-b3lyp_6-31g+(d).inp 000702313.td-b3lyp_6-31g+(d).log.xz

000702313.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702313.td-b3lyp_6-31+g(d).gjf (generated)

000702313.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702313.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702313.mol 000702313.PUBCHEM 000702313.mol (via Jmol)
000702316.b3lyp_6-31g(d).inp

000702316.b3lyp_6-31g(d).qchem.inp (generated)

000702316.b3lyp_6-31g(d).gjf (generated)

000702316.b3lyp_6-31g(d).firefly.inp (generated)

000702316.b3lyp_6-31g(d).smash.inp (generated)

000702316.b3lyp_6-31g(d).nwchem.inp (generated) 000702316.b3lyp_6-31g(d).log.xz 000702316.td-b3lyp_6-31g+(d).inp 000702316.td-b3lyp_6-31g+(d).log.xz

000702316.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702316.td-b3lyp_6-31+g(d).gjf (generated)

000702316.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702316.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702316.mol 000702316.PUBCHEM 000702316.mol (via Jmol)
000702337.b3lyp_6-31g(d).inp

000702337.b3lyp_6-31g(d).qchem.inp (generated)

000702337.b3lyp_6-31g(d).gjf (generated)

000702337.b3lyp_6-31g(d).firefly.inp (generated)

000702337.b3lyp_6-31g(d).smash.inp (generated)

000702337.b3lyp_6-31g(d).nwchem.inp (generated) 000702337.b3lyp_6-31g(d).log.xz 000702337.td-b3lyp_6-31g+(d).inp 000702337.td-b3lyp_6-31g+(d).log.xz

000702337.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702337.td-b3lyp_6-31+g(d).gjf (generated)

000702337.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702337.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702337.mol 000702337.PUBCHEM 000702337.mol (via Jmol)
000702365.b3lyp_6-31g(d).inp

000702365.b3lyp_6-31g(d).qchem.inp (generated)

000702365.b3lyp_6-31g(d).gjf (generated)

000702365.b3lyp_6-31g(d).firefly.inp (generated)

000702365.b3lyp_6-31g(d).smash.inp (generated)

000702365.b3lyp_6-31g(d).nwchem.inp (generated) 000702365.b3lyp_6-31g(d).log.xz 000702365.td-b3lyp_6-31g+(d).inp 000702365.td-b3lyp_6-31g+(d).log.xz

000702365.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702365.td-b3lyp_6-31+g(d).gjf (generated)

000702365.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702365.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702365.mol 000702365.PUBCHEM 000702365.mol (via Jmol)
000702366.b3lyp_6-31g(d).inp

000702366.b3lyp_6-31g(d).qchem.inp (generated)

000702366.b3lyp_6-31g(d).gjf (generated)

000702366.b3lyp_6-31g(d).firefly.inp (generated)

000702366.b3lyp_6-31g(d).smash.inp (generated)

000702366.b3lyp_6-31g(d).nwchem.inp (generated) 000702366.b3lyp_6-31g(d).log.xz 000702366.td-b3lyp_6-31g+(d).inp 000702366.td-b3lyp_6-31g+(d).log.xz

000702366.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702366.td-b3lyp_6-31+g(d).gjf (generated)

000702366.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702366.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702366.mol 000702366.PUBCHEM 000702366.mol (via Jmol)
000702368.b3lyp_6-31g(d).inp

000702368.b3lyp_6-31g(d).qchem.inp (generated)

000702368.b3lyp_6-31g(d).gjf (generated)

000702368.b3lyp_6-31g(d).firefly.inp (generated)

000702368.b3lyp_6-31g(d).smash.inp (generated)

000702368.b3lyp_6-31g(d).nwchem.inp (generated) 000702368.b3lyp_6-31g(d).log.xz 000702368.mol 000702368.PUBCHEM 000702368.mol (via Jmol)
000702369.b3lyp_6-31g(d).inp

000702369.b3lyp_6-31g(d).qchem.inp (generated)

000702369.b3lyp_6-31g(d).gjf (generated)

000702369.b3lyp_6-31g(d).firefly.inp (generated)

000702369.b3lyp_6-31g(d).smash.inp (generated)

000702369.b3lyp_6-31g(d).nwchem.inp (generated) 000702369.b3lyp_6-31g(d).log.xz 000702369.mol 000702369.PUBCHEM 000702369.mol (via Jmol)
000702371.b3lyp_6-31g(d).inp

000702371.b3lyp_6-31g(d).qchem.inp (generated)

000702371.b3lyp_6-31g(d).gjf (generated)

000702371.b3lyp_6-31g(d).firefly.inp (generated)

000702371.b3lyp_6-31g(d).smash.inp (generated)

000702371.b3lyp_6-31g(d).nwchem.inp (generated) 000702371.b3lyp_6-31g(d).log.xz 000702371.mol 000702371.PUBCHEM 000702371.mol (via Jmol)
000702374.b3lyp_6-31g(d).inp

000702374.b3lyp_6-31g(d).qchem.inp (generated)

000702374.b3lyp_6-31g(d).gjf (generated)

000702374.b3lyp_6-31g(d).firefly.inp (generated)

000702374.b3lyp_6-31g(d).smash.inp (generated)

000702374.b3lyp_6-31g(d).nwchem.inp (generated) 000702374.b3lyp_6-31g(d).log.xz 000702374.mol 000702374.PUBCHEM 000702374.mol (via Jmol)
000702400.b3lyp_6-31g(d).inp

000702400.b3lyp_6-31g(d).qchem.inp (generated)

000702400.b3lyp_6-31g(d).gjf (generated)

000702400.b3lyp_6-31g(d).firefly.inp (generated)

000702400.b3lyp_6-31g(d).smash.inp (generated)

000702400.b3lyp_6-31g(d).nwchem.inp (generated) 000702400.b3lyp_6-31g(d).log.xz 000702400.td-b3lyp_6-31g+(d).inp 000702400.td-b3lyp_6-31g+(d).log.xz

000702400.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702400.td-b3lyp_6-31+g(d).gjf (generated)

000702400.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702400.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702400.mol 000702400.PUBCHEM 000702400.mol (via Jmol)
000702404.b3lyp_6-31g(d).inp

000702404.b3lyp_6-31g(d).qchem.inp (generated)

000702404.b3lyp_6-31g(d).gjf (generated)

000702404.b3lyp_6-31g(d).firefly.inp (generated)

000702404.b3lyp_6-31g(d).smash.inp (generated)

000702404.b3lyp_6-31g(d).nwchem.inp (generated) 000702404.b3lyp_6-31g(d).log.xz 000702404.td-b3lyp_6-31g+(d).inp 000702404.td-b3lyp_6-31g+(d).log.xz

000702404.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702404.td-b3lyp_6-31+g(d).gjf (generated)

000702404.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702404.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702404.mol 000702404.PUBCHEM 000702404.mol (via Jmol)
000702405.b3lyp_6-31g(d).inp

000702405.b3lyp_6-31g(d).qchem.inp (generated)

000702405.b3lyp_6-31g(d).gjf (generated)

000702405.b3lyp_6-31g(d).firefly.inp (generated)

000702405.b3lyp_6-31g(d).smash.inp (generated)

000702405.b3lyp_6-31g(d).nwchem.inp (generated) 000702405.b3lyp_6-31g(d).log.xz 000702405.td-b3lyp_6-31g+(d).inp 000702405.td-b3lyp_6-31g+(d).log.xz

000702405.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702405.td-b3lyp_6-31+g(d).gjf (generated)

000702405.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702405.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702405.mol 000702405.PUBCHEM 000702405.mol (via Jmol)
000702428.b3lyp_6-31g(d).inp

000702428.b3lyp_6-31g(d).qchem.inp (generated)

000702428.b3lyp_6-31g(d).gjf (generated)

000702428.b3lyp_6-31g(d).firefly.inp (generated)

000702428.b3lyp_6-31g(d).smash.inp (generated)

000702428.b3lyp_6-31g(d).nwchem.inp (generated) 000702428.b3lyp_6-31g(d).log.xz 000702428.td-b3lyp_6-31g+(d).inp 000702428.td-b3lyp_6-31g+(d).log.xz

000702428.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702428.td-b3lyp_6-31+g(d).gjf (generated)

000702428.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702428.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702428.mol 000702428.PUBCHEM 000702428.mol (via Jmol)
000702433.b3lyp_6-31g(d).inp

000702433.b3lyp_6-31g(d).qchem.inp (generated)

000702433.b3lyp_6-31g(d).gjf (generated)

000702433.b3lyp_6-31g(d).firefly.inp (generated)

000702433.b3lyp_6-31g(d).smash.inp (generated)

000702433.b3lyp_6-31g(d).nwchem.inp (generated) 000702433.b3lyp_6-31g(d).log.xz 000702433.td-b3lyp_6-31g+(d).inp 000702433.td-b3lyp_6-31g+(d).log.xz

000702433.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702433.td-b3lyp_6-31+g(d).gjf (generated)

000702433.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702433.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702433.mol 000702433.PUBCHEM 000702433.mol (via Jmol)
000702508.b3lyp_6-31g(d).inp

000702508.b3lyp_6-31g(d).qchem.inp (generated)

000702508.b3lyp_6-31g(d).gjf (generated)

000702508.b3lyp_6-31g(d).firefly.inp (generated)

000702508.b3lyp_6-31g(d).smash.inp (generated)

000702508.b3lyp_6-31g(d).nwchem.inp (generated) 000702508.b3lyp_6-31g(d).log.xz 000702508.mol 000702508.PUBCHEM 000702508.mol (via Jmol)
000702509.b3lyp_6-31g(d).inp

000702509.b3lyp_6-31g(d).qchem.inp (generated)

000702509.b3lyp_6-31g(d).gjf (generated)

000702509.b3lyp_6-31g(d).firefly.inp (generated)

000702509.b3lyp_6-31g(d).smash.inp (generated)

000702509.b3lyp_6-31g(d).nwchem.inp (generated) 000702509.b3lyp_6-31g(d).log.xz 000702509.mol 000702509.PUBCHEM 000702509.mol (via Jmol)
000702529.b3lyp_6-31g(d).inp

000702529.b3lyp_6-31g(d).qchem.inp (generated)

000702529.b3lyp_6-31g(d).gjf (generated)

000702529.b3lyp_6-31g(d).firefly.inp (generated)

000702529.b3lyp_6-31g(d).smash.inp (generated)

000702529.b3lyp_6-31g(d).nwchem.inp (generated) 000702529.b3lyp_6-31g(d).log.xz 000702529.mol 000702529.PUBCHEM 000702529.mol (via Jmol)
000702538.b3lyp_6-31g(d).inp

000702538.b3lyp_6-31g(d).qchem.inp (generated)

000702538.b3lyp_6-31g(d).gjf (generated)

000702538.b3lyp_6-31g(d).firefly.inp (generated)

000702538.b3lyp_6-31g(d).smash.inp (generated)

000702538.b3lyp_6-31g(d).nwchem.inp (generated) 000702538.b3lyp_6-31g(d).log.xz 000702538.td-b3lyp_6-31g+(d).inp 000702538.td-b3lyp_6-31g+(d).log.xz

000702538.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702538.td-b3lyp_6-31+g(d).gjf (generated)

000702538.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702538.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702538.mol 000702538.PUBCHEM 000702538.mol (via Jmol)
000702548.b3lyp_6-31g(d).inp

000702548.b3lyp_6-31g(d).qchem.inp (generated)

000702548.b3lyp_6-31g(d).gjf (generated)

000702548.b3lyp_6-31g(d).firefly.inp (generated)

000702548.b3lyp_6-31g(d).smash.inp (generated)

000702548.b3lyp_6-31g(d).nwchem.inp (generated) 000702548.b3lyp_6-31g(d).log.xz 000702548.td-b3lyp_6-31g+(d).inp 000702548.td-b3lyp_6-31g+(d).log.xz

000702548.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702548.td-b3lyp_6-31+g(d).gjf (generated)

000702548.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702548.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702548.mol 000702548.PUBCHEM 000702548.mol (via Jmol)
000702576.b3lyp_6-31g(d).inp

000702576.b3lyp_6-31g(d).qchem.inp (generated)

000702576.b3lyp_6-31g(d).gjf (generated)

000702576.b3lyp_6-31g(d).firefly.inp (generated)

000702576.b3lyp_6-31g(d).smash.inp (generated)

000702576.b3lyp_6-31g(d).nwchem.inp (generated) 000702576.b3lyp_6-31g(d).log.xz 000702576.td-b3lyp_6-31g+(d).inp 000702576.td-b3lyp_6-31g+(d).log.xz

000702576.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702576.td-b3lyp_6-31+g(d).gjf (generated)

000702576.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702576.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702576.mol 000702576.PUBCHEM 000702576.mol (via Jmol)
000702580.b3lyp_6-31g(d).inp

000702580.b3lyp_6-31g(d).qchem.inp (generated)

000702580.b3lyp_6-31g(d).gjf (generated)

000702580.b3lyp_6-31g(d).firefly.inp (generated)

000702580.b3lyp_6-31g(d).smash.inp (generated)

000702580.b3lyp_6-31g(d).nwchem.inp (generated) 000702580.b3lyp_6-31g(d).log.xz 000702580.td-b3lyp_6-31g+(d).inp 000702580.td-b3lyp_6-31g+(d).log.xz

000702580.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702580.td-b3lyp_6-31+g(d).gjf (generated)

000702580.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702580.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702580.mol 000702580.PUBCHEM 000702580.mol (via Jmol)
000702585.b3lyp_6-31g(d).inp

000702585.b3lyp_6-31g(d).qchem.inp (generated)

000702585.b3lyp_6-31g(d).gjf (generated)

000702585.b3lyp_6-31g(d).firefly.inp (generated)

000702585.b3lyp_6-31g(d).smash.inp (generated)

000702585.b3lyp_6-31g(d).nwchem.inp (generated) 000702585.b3lyp_6-31g(d).log.xz 000702585.mol 000702585.PUBCHEM 000702585.mol (via Jmol)
000702588.b3lyp_6-31g(d).inp

000702588.b3lyp_6-31g(d).qchem.inp (generated)

000702588.b3lyp_6-31g(d).gjf (generated)

000702588.b3lyp_6-31g(d).firefly.inp (generated)

000702588.b3lyp_6-31g(d).smash.inp (generated)

000702588.b3lyp_6-31g(d).nwchem.inp (generated) 000702588.b3lyp_6-31g(d).log.xz 000702588.td-b3lyp_6-31g+(d).inp 000702588.td-b3lyp_6-31g+(d).log.xz

000702588.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702588.td-b3lyp_6-31+g(d).gjf (generated)

000702588.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702588.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702588.mol 000702588.PUBCHEM 000702588.mol (via Jmol)
000702591.b3lyp_6-31g(d).inp

000702591.b3lyp_6-31g(d).qchem.inp (generated)

000702591.b3lyp_6-31g(d).gjf (generated)

000702591.b3lyp_6-31g(d).firefly.inp (generated)

000702591.b3lyp_6-31g(d).smash.inp (generated)

000702591.b3lyp_6-31g(d).nwchem.inp (generated) 000702591.b3lyp_6-31g(d).log.xz 000702591.td-b3lyp_6-31g+(d).inp 000702591.td-b3lyp_6-31g+(d).log.xz

000702591.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702591.td-b3lyp_6-31+g(d).gjf (generated)

000702591.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702591.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702591.mol 000702591.PUBCHEM 000702591.mol (via Jmol)
000702594.b3lyp_6-31g(d).inp

000702594.b3lyp_6-31g(d).qchem.inp (generated)

000702594.b3lyp_6-31g(d).gjf (generated)

000702594.b3lyp_6-31g(d).firefly.inp (generated)

000702594.b3lyp_6-31g(d).smash.inp (generated)

000702594.b3lyp_6-31g(d).nwchem.inp (generated) 000702594.b3lyp_6-31g(d).log.xz 000702594.td-b3lyp_6-31g+(d).inp 000702594.td-b3lyp_6-31g+(d).log.xz

000702594.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702594.td-b3lyp_6-31+g(d).gjf (generated)

000702594.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702594.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702594.mol 000702594.PUBCHEM 000702594.mol (via Jmol)
000702600.b3lyp_6-31g(d).inp

000702600.b3lyp_6-31g(d).qchem.inp (generated)

000702600.b3lyp_6-31g(d).gjf (generated)

000702600.b3lyp_6-31g(d).firefly.inp (generated)

000702600.b3lyp_6-31g(d).smash.inp (generated)

000702600.b3lyp_6-31g(d).nwchem.inp (generated) 000702600.b3lyp_6-31g(d).log.xz 000702600.td-b3lyp_6-31g+(d).inp 000702600.td-b3lyp_6-31g+(d).log.xz

000702600.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702600.td-b3lyp_6-31+g(d).gjf (generated)

000702600.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702600.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702600.mol 000702600.PUBCHEM 000702600.mol (via Jmol)
000702602.b3lyp_6-31g(d).inp

000702602.b3lyp_6-31g(d).qchem.inp (generated)

000702602.b3lyp_6-31g(d).gjf (generated)

000702602.b3lyp_6-31g(d).firefly.inp (generated)

000702602.b3lyp_6-31g(d).smash.inp (generated)

000702602.b3lyp_6-31g(d).nwchem.inp (generated) 000702602.b3lyp_6-31g(d).log.xz 000702602.td-b3lyp_6-31g+(d).inp 000702602.td-b3lyp_6-31g+(d).log.xz

000702602.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702602.td-b3lyp_6-31+g(d).gjf (generated)

000702602.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702602.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702602.mol 000702602.PUBCHEM 000702602.mol (via Jmol)
000702623.b3lyp_6-31g(d).inp

000702623.b3lyp_6-31g(d).qchem.inp (generated)

000702623.b3lyp_6-31g(d).gjf (generated)

000702623.b3lyp_6-31g(d).firefly.inp (generated)

000702623.b3lyp_6-31g(d).smash.inp (generated)

000702623.b3lyp_6-31g(d).nwchem.inp (generated) 000702623.b3lyp_6-31g(d).log.xz 000702623.td-b3lyp_6-31g+(d).inp 000702623.td-b3lyp_6-31g+(d).log.xz

000702623.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702623.td-b3lyp_6-31+g(d).gjf (generated)

000702623.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702623.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702623.mol 000702623.PUBCHEM 000702623.mol (via Jmol)
000702628.b3lyp_6-31g(d).inp

000702628.b3lyp_6-31g(d).qchem.inp (generated)

000702628.b3lyp_6-31g(d).gjf (generated)

000702628.b3lyp_6-31g(d).firefly.inp (generated)

000702628.b3lyp_6-31g(d).smash.inp (generated)

000702628.b3lyp_6-31g(d).nwchem.inp (generated) 000702628.b3lyp_6-31g(d).log.xz 000702628.td-b3lyp_6-31g+(d).inp 000702628.td-b3lyp_6-31g+(d).log.xz

000702628.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702628.td-b3lyp_6-31+g(d).gjf (generated)

000702628.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702628.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702628.mol 000702628.PUBCHEM 000702628.mol (via Jmol)
000702695.b3lyp_6-31g(d).inp

000702695.b3lyp_6-31g(d).qchem.inp (generated)

000702695.b3lyp_6-31g(d).gjf (generated)

000702695.b3lyp_6-31g(d).firefly.inp (generated)

000702695.b3lyp_6-31g(d).smash.inp (generated)

000702695.b3lyp_6-31g(d).nwchem.inp (generated) 000702695.b3lyp_6-31g(d).log.xz 000702695.td-b3lyp_6-31g+(d).inp 000702695.td-b3lyp_6-31g+(d).log.xz

000702695.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702695.td-b3lyp_6-31+g(d).gjf (generated)

000702695.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702695.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702695.mol 000702695.PUBCHEM 000702695.mol (via Jmol)
000702698.b3lyp_6-31g(d).inp

000702698.b3lyp_6-31g(d).qchem.inp (generated)

000702698.b3lyp_6-31g(d).gjf (generated)

000702698.b3lyp_6-31g(d).firefly.inp (generated)

000702698.b3lyp_6-31g(d).smash.inp (generated)

000702698.b3lyp_6-31g(d).nwchem.inp (generated) 000702698.b3lyp_6-31g(d).log.xz 000702698.td-b3lyp_6-31g+(d).inp 000702698.td-b3lyp_6-31g+(d).log.xz

000702698.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702698.td-b3lyp_6-31+g(d).gjf (generated)

000702698.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702698.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702698.mol 000702698.PUBCHEM 000702698.mol (via Jmol)
000702701.b3lyp_6-31g(d).inp

000702701.b3lyp_6-31g(d).qchem.inp (generated)

000702701.b3lyp_6-31g(d).gjf (generated)

000702701.b3lyp_6-31g(d).firefly.inp (generated)

000702701.b3lyp_6-31g(d).smash.inp (generated)

000702701.b3lyp_6-31g(d).nwchem.inp (generated) 000702701.b3lyp_6-31g(d).log.xz 000702701.td-b3lyp_6-31g+(d).inp 000702701.td-b3lyp_6-31g+(d).log.xz

000702701.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702701.td-b3lyp_6-31+g(d).gjf (generated)

000702701.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702701.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702701.mol 000702701.PUBCHEM 000702701.mol (via Jmol)
000702759.b3lyp_6-31g(d).inp

000702759.b3lyp_6-31g(d).qchem.inp (generated)

000702759.b3lyp_6-31g(d).gjf (generated)

000702759.b3lyp_6-31g(d).firefly.inp (generated)

000702759.b3lyp_6-31g(d).smash.inp (generated)

000702759.b3lyp_6-31g(d).nwchem.inp (generated) 000702759.b3lyp_6-31g(d).log.xz 000702759.td-b3lyp_6-31g+(d).inp 000702759.td-b3lyp_6-31g+(d).log.xz

000702759.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702759.td-b3lyp_6-31+g(d).gjf (generated)

000702759.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702759.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702759.mol 000702759.PUBCHEM 000702759.mol (via Jmol)
000702760.b3lyp_6-31g(d).inp

000702760.b3lyp_6-31g(d).qchem.inp (generated)

000702760.b3lyp_6-31g(d).gjf (generated)

000702760.b3lyp_6-31g(d).firefly.inp (generated)

000702760.b3lyp_6-31g(d).smash.inp (generated)

000702760.b3lyp_6-31g(d).nwchem.inp (generated) 000702760.b3lyp_6-31g(d).log.xz 000702760.td-b3lyp_6-31g+(d).inp 000702760.td-b3lyp_6-31g+(d).log.xz

000702760.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702760.td-b3lyp_6-31+g(d).gjf (generated)

000702760.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702760.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702760.mol 000702760.PUBCHEM 000702760.mol (via Jmol)
000702761.b3lyp_6-31g(d).inp

000702761.b3lyp_6-31g(d).qchem.inp (generated)

000702761.b3lyp_6-31g(d).gjf (generated)

000702761.b3lyp_6-31g(d).firefly.inp (generated)

000702761.b3lyp_6-31g(d).smash.inp (generated)

000702761.b3lyp_6-31g(d).nwchem.inp (generated) 000702761.b3lyp_6-31g(d).log.xz 000702761.mol 000702761.PUBCHEM 000702761.mol (via Jmol)
000702768.b3lyp_6-31g(d).inp

000702768.b3lyp_6-31g(d).qchem.inp (generated)

000702768.b3lyp_6-31g(d).gjf (generated)

000702768.b3lyp_6-31g(d).firefly.inp (generated)

000702768.b3lyp_6-31g(d).smash.inp (generated)

000702768.b3lyp_6-31g(d).nwchem.inp (generated) 000702768.b3lyp_6-31g(d).log.xz 000702768.td-b3lyp_6-31g+(d).inp 000702768.td-b3lyp_6-31g+(d).log.xz

000702768.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702768.td-b3lyp_6-31+g(d).gjf (generated)

000702768.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702768.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702768.mol 000702768.PUBCHEM 000702768.mol (via Jmol)
000702793.b3lyp_6-31g(d).inp

000702793.b3lyp_6-31g(d).qchem.inp (generated)

000702793.b3lyp_6-31g(d).gjf (generated)

000702793.b3lyp_6-31g(d).firefly.inp (generated)

000702793.b3lyp_6-31g(d).smash.inp (generated)

000702793.b3lyp_6-31g(d).nwchem.inp (generated) 000702793.b3lyp_6-31g(d).log.xz 000702793.td-b3lyp_6-31g+(d).inp 000702793.td-b3lyp_6-31g+(d).log.xz

000702793.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702793.td-b3lyp_6-31+g(d).gjf (generated)

000702793.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702793.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702793.mol 000702793.PUBCHEM 000702793.mol (via Jmol)
000702800.b3lyp_6-31g(d).inp

000702800.b3lyp_6-31g(d).qchem.inp (generated)

000702800.b3lyp_6-31g(d).gjf (generated)

000702800.b3lyp_6-31g(d).firefly.inp (generated)

000702800.b3lyp_6-31g(d).smash.inp (generated)

000702800.b3lyp_6-31g(d).nwchem.inp (generated) 000702800.b3lyp_6-31g(d).log.xz 000702800.td-b3lyp_6-31g+(d).inp 000702800.td-b3lyp_6-31g+(d).log.xz

000702800.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702800.td-b3lyp_6-31+g(d).gjf (generated)

000702800.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702800.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702800.mol 000702800.PUBCHEM 000702800.mol (via Jmol)
000702802.b3lyp_6-31g(d).inp

000702802.b3lyp_6-31g(d).qchem.inp (generated)

000702802.b3lyp_6-31g(d).gjf (generated)

000702802.b3lyp_6-31g(d).firefly.inp (generated)

000702802.b3lyp_6-31g(d).smash.inp (generated)

000702802.b3lyp_6-31g(d).nwchem.inp (generated) 000702802.b3lyp_6-31g(d).log.xz 000702802.mol 000702802.PUBCHEM 000702802.mol (via Jmol)
000702841.b3lyp_6-31g(d).inp

000702841.b3lyp_6-31g(d).qchem.inp (generated)

000702841.b3lyp_6-31g(d).gjf (generated)

000702841.b3lyp_6-31g(d).firefly.inp (generated)

000702841.b3lyp_6-31g(d).smash.inp (generated)

000702841.b3lyp_6-31g(d).nwchem.inp (generated) 000702841.b3lyp_6-31g(d).log.xz 000702841.td-b3lyp_6-31g+(d).inp 000702841.td-b3lyp_6-31g+(d).log.xz

000702841.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702841.td-b3lyp_6-31+g(d).gjf (generated)

000702841.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702841.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702841.mol 000702841.PUBCHEM 000702841.mol (via Jmol)
000702848.b3lyp_6-31g(d).inp

000702848.b3lyp_6-31g(d).qchem.inp (generated)

000702848.b3lyp_6-31g(d).gjf (generated)

000702848.b3lyp_6-31g(d).firefly.inp (generated)

000702848.b3lyp_6-31g(d).smash.inp (generated)

000702848.b3lyp_6-31g(d).nwchem.inp (generated) 000702848.b3lyp_6-31g(d).log.xz 000702848.td-b3lyp_6-31g+(d).inp 000702848.td-b3lyp_6-31g+(d).log.xz

000702848.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702848.td-b3lyp_6-31+g(d).gjf (generated)

000702848.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702848.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702848.mol 000702848.PUBCHEM 000702848.mol (via Jmol)
000702850.b3lyp_6-31g(d).inp

000702850.b3lyp_6-31g(d).qchem.inp (generated)

000702850.b3lyp_6-31g(d).gjf (generated)

000702850.b3lyp_6-31g(d).firefly.inp (generated)

000702850.b3lyp_6-31g(d).smash.inp (generated)

000702850.b3lyp_6-31g(d).nwchem.inp (generated) 000702850.b3lyp_6-31g(d).log.xz 000702850.td-b3lyp_6-31g+(d).inp 000702850.td-b3lyp_6-31g+(d).log.xz

000702850.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702850.td-b3lyp_6-31+g(d).gjf (generated)

000702850.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702850.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702850.mol 000702850.PUBCHEM 000702850.mol (via Jmol)
000702852.b3lyp_6-31g(d).inp

000702852.b3lyp_6-31g(d).qchem.inp (generated)

000702852.b3lyp_6-31g(d).gjf (generated)

000702852.b3lyp_6-31g(d).firefly.inp (generated)

000702852.b3lyp_6-31g(d).smash.inp (generated)

000702852.b3lyp_6-31g(d).nwchem.inp (generated) 000702852.b3lyp_6-31g(d).log.xz 000702852.td-b3lyp_6-31g+(d).inp 000702852.td-b3lyp_6-31g+(d).log.xz

000702852.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702852.td-b3lyp_6-31+g(d).gjf (generated)

000702852.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702852.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702852.mol 000702852.PUBCHEM 000702852.mol (via Jmol)
000702855.b3lyp_6-31g(d).inp

000702855.b3lyp_6-31g(d).qchem.inp (generated)

000702855.b3lyp_6-31g(d).gjf (generated)

000702855.b3lyp_6-31g(d).firefly.inp (generated)

000702855.b3lyp_6-31g(d).smash.inp (generated)

000702855.b3lyp_6-31g(d).nwchem.inp (generated) 000702855.b3lyp_6-31g(d).log.xz 000702855.td-b3lyp_6-31g+(d).inp 000702855.td-b3lyp_6-31g+(d).log.xz

000702855.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702855.td-b3lyp_6-31+g(d).gjf (generated)

000702855.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702855.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702855.mol 000702855.PUBCHEM 000702855.mol (via Jmol)
000702862.b3lyp_6-31g(d).inp

000702862.b3lyp_6-31g(d).qchem.inp (generated)

000702862.b3lyp_6-31g(d).gjf (generated)

000702862.b3lyp_6-31g(d).firefly.inp (generated)

000702862.b3lyp_6-31g(d).smash.inp (generated)

000702862.b3lyp_6-31g(d).nwchem.inp (generated) 000702862.b3lyp_6-31g(d).log.xz 000702862.td-b3lyp_6-31g+(d).inp 000702862.td-b3lyp_6-31g+(d).log.xz

000702862.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702862.td-b3lyp_6-31+g(d).gjf (generated)

000702862.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702862.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702862.mol 000702862.PUBCHEM 000702862.mol (via Jmol)
000702863.b3lyp_6-31g(d).inp

000702863.b3lyp_6-31g(d).qchem.inp (generated)

000702863.b3lyp_6-31g(d).gjf (generated)

000702863.b3lyp_6-31g(d).firefly.inp (generated)

000702863.b3lyp_6-31g(d).smash.inp (generated)

000702863.b3lyp_6-31g(d).nwchem.inp (generated) 000702863.b3lyp_6-31g(d).log.xz 000702863.td-b3lyp_6-31g+(d).inp 000702863.td-b3lyp_6-31g+(d).log.xz

000702863.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702863.td-b3lyp_6-31+g(d).gjf (generated)

000702863.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702863.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702863.mol 000702863.PUBCHEM 000702863.mol (via Jmol)
000702875.b3lyp_6-31g(d).inp

000702875.b3lyp_6-31g(d).qchem.inp (generated)

000702875.b3lyp_6-31g(d).gjf (generated)

000702875.b3lyp_6-31g(d).firefly.inp (generated)

000702875.b3lyp_6-31g(d).smash.inp (generated)

000702875.b3lyp_6-31g(d).nwchem.inp (generated) 000702875.b3lyp_6-31g(d).log.xz 000702875.td-b3lyp_6-31g+(d).inp 000702875.td-b3lyp_6-31g+(d).log.xz

000702875.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702875.td-b3lyp_6-31+g(d).gjf (generated)

000702875.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702875.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702875.mol 000702875.PUBCHEM 000702875.mol (via Jmol)
000702876.b3lyp_6-31g(d).inp

000702876.b3lyp_6-31g(d).qchem.inp (generated)

000702876.b3lyp_6-31g(d).gjf (generated)

000702876.b3lyp_6-31g(d).firefly.inp (generated)

000702876.b3lyp_6-31g(d).smash.inp (generated)

000702876.b3lyp_6-31g(d).nwchem.inp (generated) 000702876.b3lyp_6-31g(d).log.xz 000702876.td-b3lyp_6-31g+(d).inp 000702876.td-b3lyp_6-31g+(d).log.xz

000702876.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702876.td-b3lyp_6-31+g(d).gjf (generated)

000702876.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702876.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702876.mol 000702876.PUBCHEM 000702876.mol (via Jmol)
000702879.b3lyp_6-31g(d).inp

000702879.b3lyp_6-31g(d).qchem.inp (generated)

000702879.b3lyp_6-31g(d).gjf (generated)

000702879.b3lyp_6-31g(d).firefly.inp (generated)

000702879.b3lyp_6-31g(d).smash.inp (generated)

000702879.b3lyp_6-31g(d).nwchem.inp (generated) 000702879.b3lyp_6-31g(d).log.xz 000702879.td-b3lyp_6-31g+(d).inp 000702879.td-b3lyp_6-31g+(d).log.xz

000702879.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702879.td-b3lyp_6-31+g(d).gjf (generated)

000702879.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702879.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702879.mol 000702879.PUBCHEM 000702879.mol (via Jmol)
000702889.b3lyp_6-31g(d).inp

000702889.b3lyp_6-31g(d).qchem.inp (generated)

000702889.b3lyp_6-31g(d).gjf (generated)

000702889.b3lyp_6-31g(d).firefly.inp (generated)

000702889.b3lyp_6-31g(d).smash.inp (generated)

000702889.b3lyp_6-31g(d).nwchem.inp (generated) 000702889.b3lyp_6-31g(d).log.xz 000702889.td-b3lyp_6-31g+(d).inp 000702889.td-b3lyp_6-31g+(d).log.xz

000702889.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702889.td-b3lyp_6-31+g(d).gjf (generated)

000702889.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702889.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702889.mol 000702889.PUBCHEM 000702889.mol (via Jmol)
000702892.b3lyp_6-31g(d).inp

000702892.b3lyp_6-31g(d).qchem.inp (generated)

000702892.b3lyp_6-31g(d).gjf (generated)

000702892.b3lyp_6-31g(d).firefly.inp (generated)

000702892.b3lyp_6-31g(d).smash.inp (generated)

000702892.b3lyp_6-31g(d).nwchem.inp (generated) 000702892.b3lyp_6-31g(d).log.xz 000702892.td-b3lyp_6-31g+(d).inp 000702892.td-b3lyp_6-31g+(d).log.xz

000702892.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702892.td-b3lyp_6-31+g(d).gjf (generated)

000702892.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702892.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702892.mol 000702892.PUBCHEM 000702892.mol (via Jmol)
000702893.b3lyp_6-31g(d).inp

000702893.b3lyp_6-31g(d).qchem.inp (generated)

000702893.b3lyp_6-31g(d).gjf (generated)

000702893.b3lyp_6-31g(d).firefly.inp (generated)

000702893.b3lyp_6-31g(d).smash.inp (generated)

000702893.b3lyp_6-31g(d).nwchem.inp (generated) 000702893.b3lyp_6-31g(d).log.xz 000702893.td-b3lyp_6-31g+(d).inp 000702893.td-b3lyp_6-31g+(d).log.xz

000702893.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702893.td-b3lyp_6-31+g(d).gjf (generated)

000702893.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702893.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702893.mol 000702893.PUBCHEM 000702893.mol (via Jmol)
000702899.b3lyp_6-31g(d).inp

000702899.b3lyp_6-31g(d).qchem.inp (generated)

000702899.b3lyp_6-31g(d).gjf (generated)

000702899.b3lyp_6-31g(d).firefly.inp (generated)

000702899.b3lyp_6-31g(d).smash.inp (generated)

000702899.b3lyp_6-31g(d).nwchem.inp (generated) 000702899.b3lyp_6-31g(d).log.xz 000702899.td-b3lyp_6-31g+(d).inp 000702899.td-b3lyp_6-31g+(d).log.xz

000702899.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702899.td-b3lyp_6-31+g(d).gjf (generated)

000702899.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702899.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702899.mol 000702899.PUBCHEM 000702899.mol (via Jmol)
000702903.b3lyp_6-31g(d).inp

000702903.b3lyp_6-31g(d).qchem.inp (generated)

000702903.b3lyp_6-31g(d).gjf (generated)

000702903.b3lyp_6-31g(d).firefly.inp (generated)

000702903.b3lyp_6-31g(d).smash.inp (generated)

000702903.b3lyp_6-31g(d).nwchem.inp (generated) 000702903.b3lyp_6-31g(d).log.xz 000702903.td-b3lyp_6-31g+(d).inp 000702903.td-b3lyp_6-31g+(d).log.xz

000702903.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702903.td-b3lyp_6-31+g(d).gjf (generated)

000702903.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702903.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702903.mol 000702903.PUBCHEM 000702903.mol (via Jmol)
000702904.b3lyp_6-31g(d).inp

000702904.b3lyp_6-31g(d).qchem.inp (generated)

000702904.b3lyp_6-31g(d).gjf (generated)

000702904.b3lyp_6-31g(d).firefly.inp (generated)

000702904.b3lyp_6-31g(d).smash.inp (generated)

000702904.b3lyp_6-31g(d).nwchem.inp (generated) 000702904.b3lyp_6-31g(d).log.xz 000702904.td-b3lyp_6-31g+(d).inp 000702904.td-b3lyp_6-31g+(d).log.xz

000702904.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702904.td-b3lyp_6-31+g(d).gjf (generated)

000702904.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702904.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702904.mol 000702904.PUBCHEM 000702904.mol (via Jmol)
000702906.b3lyp_6-31g(d).inp

000702906.b3lyp_6-31g(d).qchem.inp (generated)

000702906.b3lyp_6-31g(d).gjf (generated)

000702906.b3lyp_6-31g(d).firefly.inp (generated)

000702906.b3lyp_6-31g(d).smash.inp (generated)

000702906.b3lyp_6-31g(d).nwchem.inp (generated) 000702906.b3lyp_6-31g(d).log.xz 000702906.td-b3lyp_6-31g+(d).inp 000702906.td-b3lyp_6-31g+(d).log.xz

000702906.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702906.td-b3lyp_6-31+g(d).gjf (generated)

000702906.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702906.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702906.mol 000702906.PUBCHEM 000702906.mol (via Jmol)
000702933.b3lyp_6-31g(d).inp

000702933.b3lyp_6-31g(d).qchem.inp (generated)

000702933.b3lyp_6-31g(d).gjf (generated)

000702933.b3lyp_6-31g(d).firefly.inp (generated)

000702933.b3lyp_6-31g(d).smash.inp (generated)

000702933.b3lyp_6-31g(d).nwchem.inp (generated) 000702933.b3lyp_6-31g(d).log.xz 000702933.td-b3lyp_6-31g+(d).inp 000702933.td-b3lyp_6-31g+(d).log.xz

000702933.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702933.td-b3lyp_6-31+g(d).gjf (generated)

000702933.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702933.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702933.mol 000702933.PUBCHEM 000702933.mol (via Jmol)
000702934.b3lyp_6-31g(d).inp

000702934.b3lyp_6-31g(d).qchem.inp (generated)

000702934.b3lyp_6-31g(d).gjf (generated)

000702934.b3lyp_6-31g(d).firefly.inp (generated)

000702934.b3lyp_6-31g(d).smash.inp (generated)

000702934.b3lyp_6-31g(d).nwchem.inp (generated) 000702934.b3lyp_6-31g(d).log.xz 000702934.td-b3lyp_6-31g+(d).inp 000702934.td-b3lyp_6-31g+(d).log.xz

000702934.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702934.td-b3lyp_6-31+g(d).gjf (generated)

000702934.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702934.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702934.mol 000702934.PUBCHEM 000702934.mol (via Jmol)
000702948.b3lyp_6-31g(d).inp

000702948.b3lyp_6-31g(d).qchem.inp (generated)

000702948.b3lyp_6-31g(d).gjf (generated)

000702948.b3lyp_6-31g(d).firefly.inp (generated)

000702948.b3lyp_6-31g(d).smash.inp (generated)

000702948.b3lyp_6-31g(d).nwchem.inp (generated) 000702948.b3lyp_6-31g(d).log.xz 000702948.td-b3lyp_6-31g+(d).inp 000702948.td-b3lyp_6-31g+(d).log.xz

000702948.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702948.td-b3lyp_6-31+g(d).gjf (generated)

000702948.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702948.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702948.mol 000702948.PUBCHEM 000702948.mol (via Jmol)
000702949.b3lyp_6-31g(d).inp

000702949.b3lyp_6-31g(d).qchem.inp (generated)

000702949.b3lyp_6-31g(d).gjf (generated)

000702949.b3lyp_6-31g(d).firefly.inp (generated)

000702949.b3lyp_6-31g(d).smash.inp (generated)

000702949.b3lyp_6-31g(d).nwchem.inp (generated) 000702949.b3lyp_6-31g(d).log.xz 000702949.td-b3lyp_6-31g+(d).inp 000702949.td-b3lyp_6-31g+(d).log.xz

000702949.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702949.td-b3lyp_6-31+g(d).gjf (generated)

000702949.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702949.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702949.mol 000702949.PUBCHEM 000702949.mol (via Jmol)
000702971.b3lyp_6-31g(d).inp

000702971.b3lyp_6-31g(d).qchem.inp (generated)

000702971.b3lyp_6-31g(d).gjf (generated)

000702971.b3lyp_6-31g(d).firefly.inp (generated)

000702971.b3lyp_6-31g(d).smash.inp (generated)

000702971.b3lyp_6-31g(d).nwchem.inp (generated) 000702971.b3lyp_6-31g(d).log.xz 000702971.mol 000702971.PUBCHEM 000702971.mol (via Jmol)
000702973.b3lyp_6-31g(d).inp

000702973.b3lyp_6-31g(d).qchem.inp (generated)

000702973.b3lyp_6-31g(d).gjf (generated)

000702973.b3lyp_6-31g(d).firefly.inp (generated)

000702973.b3lyp_6-31g(d).smash.inp (generated)

000702973.b3lyp_6-31g(d).nwchem.inp (generated) 000702973.b3lyp_6-31g(d).log.xz 000702973.mol 000702973.PUBCHEM 000702973.mol (via Jmol)
000702975.b3lyp_6-31g(d).inp

000702975.b3lyp_6-31g(d).qchem.inp (generated)

000702975.b3lyp_6-31g(d).gjf (generated)

000702975.b3lyp_6-31g(d).firefly.inp (generated)

000702975.b3lyp_6-31g(d).smash.inp (generated)

000702975.b3lyp_6-31g(d).nwchem.inp (generated) 000702975.b3lyp_6-31g(d).log.xz 000702975.mol 000702975.PUBCHEM 000702975.mol (via Jmol)
000702977.b3lyp_6-31g(d).inp

000702977.b3lyp_6-31g(d).qchem.inp (generated)

000702977.b3lyp_6-31g(d).gjf (generated)

000702977.b3lyp_6-31g(d).firefly.inp (generated)

000702977.b3lyp_6-31g(d).smash.inp (generated)

000702977.b3lyp_6-31g(d).nwchem.inp (generated) 000702977.b3lyp_6-31g(d).log.xz 000702977.mol 000702977.PUBCHEM 000702977.mol (via Jmol)
000702998.b3lyp_6-31g(d).inp

000702998.b3lyp_6-31g(d).qchem.inp (generated)

000702998.b3lyp_6-31g(d).gjf (generated)

000702998.b3lyp_6-31g(d).firefly.inp (generated)

000702998.b3lyp_6-31g(d).smash.inp (generated)

000702998.b3lyp_6-31g(d).nwchem.inp (generated) 000702998.b3lyp_6-31g(d).log.xz 000702998.td-b3lyp_6-31g+(d).inp 000702998.td-b3lyp_6-31g+(d).log.xz

000702998.td-b3lyp_6-31+g(d).qchem.inp (generated)

000702998.td-b3lyp_6-31+g(d).gjf (generated)

000702998.td-b3lyp_6-31+g(d).firefly.inp (generated)

000702998.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000702998.mol 000702998.PUBCHEM 000702998.mol (via Jmol)
000703003.b3lyp_6-31g(d).inp

000703003.b3lyp_6-31g(d).qchem.inp (generated)

000703003.b3lyp_6-31g(d).gjf (generated)

000703003.b3lyp_6-31g(d).firefly.inp (generated)

000703003.b3lyp_6-31g(d).smash.inp (generated)

000703003.b3lyp_6-31g(d).nwchem.inp (generated) 000703003.b3lyp_6-31g(d).log.xz 000703003.td-b3lyp_6-31g+(d).inp 000703003.td-b3lyp_6-31g+(d).log.xz

000703003.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703003.td-b3lyp_6-31+g(d).gjf (generated)

000703003.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703003.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703003.mol 000703003.PUBCHEM 000703003.mol (via Jmol)
000703011.b3lyp_6-31g(d).inp

000703011.b3lyp_6-31g(d).qchem.inp (generated)

000703011.b3lyp_6-31g(d).gjf (generated)

000703011.b3lyp_6-31g(d).firefly.inp (generated)

000703011.b3lyp_6-31g(d).smash.inp (generated)

000703011.b3lyp_6-31g(d).nwchem.inp (generated) 000703011.b3lyp_6-31g(d).log.xz 000703011.td-b3lyp_6-31g+(d).inp 000703011.td-b3lyp_6-31g+(d).log.xz

000703011.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703011.td-b3lyp_6-31+g(d).gjf (generated)

000703011.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703011.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703011.mol 000703011.PUBCHEM 000703011.mol (via Jmol)
000703015.b3lyp_6-31g(d).inp

000703015.b3lyp_6-31g(d).qchem.inp (generated)

000703015.b3lyp_6-31g(d).gjf (generated)

000703015.b3lyp_6-31g(d).firefly.inp (generated)

000703015.b3lyp_6-31g(d).smash.inp (generated)

000703015.b3lyp_6-31g(d).nwchem.inp (generated) 000703015.b3lyp_6-31g(d).log.xz 000703015.td-b3lyp_6-31g+(d).inp 000703015.td-b3lyp_6-31g+(d).log.xz

000703015.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703015.td-b3lyp_6-31+g(d).gjf (generated)

000703015.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703015.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703015.mol 000703015.PUBCHEM 000703015.mol (via Jmol)
000703024.b3lyp_6-31g(d).inp

000703024.b3lyp_6-31g(d).qchem.inp (generated)

000703024.b3lyp_6-31g(d).gjf (generated)

000703024.b3lyp_6-31g(d).firefly.inp (generated)

000703024.b3lyp_6-31g(d).smash.inp (generated)

000703024.b3lyp_6-31g(d).nwchem.inp (generated) 000703024.b3lyp_6-31g(d).log.xz 000703024.td-b3lyp_6-31g+(d).inp 000703024.td-b3lyp_6-31g+(d).log.xz

000703024.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703024.td-b3lyp_6-31+g(d).gjf (generated)

000703024.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703024.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703024.mol 000703024.PUBCHEM 000703024.mol (via Jmol)
000703041.b3lyp_6-31g(d).inp

000703041.b3lyp_6-31g(d).qchem.inp (generated)

000703041.b3lyp_6-31g(d).gjf (generated)

000703041.b3lyp_6-31g(d).firefly.inp (generated)

000703041.b3lyp_6-31g(d).smash.inp (generated)

000703041.b3lyp_6-31g(d).nwchem.inp (generated) 000703041.b3lyp_6-31g(d).log.xz 000703041.td-b3lyp_6-31g+(d).inp 000703041.td-b3lyp_6-31g+(d).log.xz

000703041.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703041.td-b3lyp_6-31+g(d).gjf (generated)

000703041.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703041.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703041.mol 000703041.PUBCHEM 000703041.mol (via Jmol)
000703056.b3lyp_6-31g(d).inp

000703056.b3lyp_6-31g(d).qchem.inp (generated)

000703056.b3lyp_6-31g(d).gjf (generated)

000703056.b3lyp_6-31g(d).firefly.inp (generated)

000703056.b3lyp_6-31g(d).smash.inp (generated)

000703056.b3lyp_6-31g(d).nwchem.inp (generated) 000703056.b3lyp_6-31g(d).log.xz 000703056.td-b3lyp_6-31g+(d).inp 000703056.td-b3lyp_6-31g+(d).log.xz

000703056.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703056.td-b3lyp_6-31+g(d).gjf (generated)

000703056.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703056.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703056.mol 000703056.PUBCHEM 000703056.mol (via Jmol)
000703083.b3lyp_6-31g(d).inp

000703083.b3lyp_6-31g(d).qchem.inp (generated)

000703083.b3lyp_6-31g(d).gjf (generated)

000703083.b3lyp_6-31g(d).firefly.inp (generated)

000703083.b3lyp_6-31g(d).smash.inp (generated)

000703083.b3lyp_6-31g(d).nwchem.inp (generated) 000703083.b3lyp_6-31g(d).log.xz 000703083.td-b3lyp_6-31g+(d).inp 000703083.td-b3lyp_6-31g+(d).log.xz

000703083.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703083.td-b3lyp_6-31+g(d).gjf (generated)

000703083.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703083.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703083.mol 000703083.PUBCHEM 000703083.mol (via Jmol)
000703086.b3lyp_6-31g(d).inp

000703086.b3lyp_6-31g(d).qchem.inp (generated)

000703086.b3lyp_6-31g(d).gjf (generated)

000703086.b3lyp_6-31g(d).firefly.inp (generated)

000703086.b3lyp_6-31g(d).smash.inp (generated)

000703086.b3lyp_6-31g(d).nwchem.inp (generated) 000703086.b3lyp_6-31g(d).log.xz 000703086.td-b3lyp_6-31g+(d).inp 000703086.td-b3lyp_6-31g+(d).log.xz

000703086.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703086.td-b3lyp_6-31+g(d).gjf (generated)

000703086.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703086.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703086.mol 000703086.PUBCHEM 000703086.mol (via Jmol)
000703088.b3lyp_6-31g(d).inp

000703088.b3lyp_6-31g(d).qchem.inp (generated)

000703088.b3lyp_6-31g(d).gjf (generated)

000703088.b3lyp_6-31g(d).firefly.inp (generated)

000703088.b3lyp_6-31g(d).smash.inp (generated)

000703088.b3lyp_6-31g(d).nwchem.inp (generated) 000703088.b3lyp_6-31g(d).log.xz 000703088.td-b3lyp_6-31g+(d).inp 000703088.td-b3lyp_6-31g+(d).log.xz

000703088.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703088.td-b3lyp_6-31+g(d).gjf (generated)

000703088.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703088.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703088.mol 000703088.PUBCHEM 000703088.mol (via Jmol)
000703107.b3lyp_6-31g(d).inp

000703107.b3lyp_6-31g(d).qchem.inp (generated)

000703107.b3lyp_6-31g(d).gjf (generated)

000703107.b3lyp_6-31g(d).firefly.inp (generated)

000703107.b3lyp_6-31g(d).smash.inp (generated)

000703107.b3lyp_6-31g(d).nwchem.inp (generated) 000703107.b3lyp_6-31g(d).log.xz 000703107.td-b3lyp_6-31g+(d).inp 000703107.td-b3lyp_6-31g+(d).log.xz

000703107.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703107.td-b3lyp_6-31+g(d).gjf (generated)

000703107.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703107.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703107.mol 000703107.PUBCHEM 000703107.mol (via Jmol)
000703169.b3lyp_6-31g(d).inp

000703169.b3lyp_6-31g(d).qchem.inp (generated)

000703169.b3lyp_6-31g(d).gjf (generated)

000703169.b3lyp_6-31g(d).firefly.inp (generated)

000703169.b3lyp_6-31g(d).smash.inp (generated)

000703169.b3lyp_6-31g(d).nwchem.inp (generated) 000703169.b3lyp_6-31g(d).log.xz 000703169.td-b3lyp_6-31g+(d).inp 000703169.td-b3lyp_6-31g+(d).log.xz

000703169.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703169.td-b3lyp_6-31+g(d).gjf (generated)

000703169.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703169.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703169.mol 000703169.PUBCHEM 000703169.mol (via Jmol)
000703189.b3lyp_6-31g(d).inp

000703189.b3lyp_6-31g(d).qchem.inp (generated)

000703189.b3lyp_6-31g(d).gjf (generated)

000703189.b3lyp_6-31g(d).firefly.inp (generated)

000703189.b3lyp_6-31g(d).smash.inp (generated)

000703189.b3lyp_6-31g(d).nwchem.inp (generated) 000703189.b3lyp_6-31g(d).log.xz 000703189.td-b3lyp_6-31g+(d).inp 000703189.td-b3lyp_6-31g+(d).log.xz

000703189.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703189.td-b3lyp_6-31+g(d).gjf (generated)

000703189.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703189.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703189.mol 000703189.PUBCHEM 000703189.mol (via Jmol)
000703191.b3lyp_6-31g(d).inp

000703191.b3lyp_6-31g(d).qchem.inp (generated)

000703191.b3lyp_6-31g(d).gjf (generated)

000703191.b3lyp_6-31g(d).firefly.inp (generated)

000703191.b3lyp_6-31g(d).smash.inp (generated)

000703191.b3lyp_6-31g(d).nwchem.inp (generated) 000703191.b3lyp_6-31g(d).log.xz 000703191.td-b3lyp_6-31g+(d).inp 000703191.td-b3lyp_6-31g+(d).log.xz

000703191.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703191.td-b3lyp_6-31+g(d).gjf (generated)

000703191.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703191.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703191.mol 000703191.PUBCHEM 000703191.mol (via Jmol)
000703197.b3lyp_6-31g(d).inp

000703197.b3lyp_6-31g(d).qchem.inp (generated)

000703197.b3lyp_6-31g(d).gjf (generated)

000703197.b3lyp_6-31g(d).firefly.inp (generated)

000703197.b3lyp_6-31g(d).smash.inp (generated)

000703197.b3lyp_6-31g(d).nwchem.inp (generated) 000703197.b3lyp_6-31g(d).log.xz 000703197.mol 000703197.PUBCHEM 000703197.mol (via Jmol)
000703218.b3lyp_6-31g(d).inp

000703218.b3lyp_6-31g(d).qchem.inp (generated)

000703218.b3lyp_6-31g(d).gjf (generated)

000703218.b3lyp_6-31g(d).firefly.inp (generated)

000703218.b3lyp_6-31g(d).smash.inp (generated)

000703218.b3lyp_6-31g(d).nwchem.inp (generated) 000703218.b3lyp_6-31g(d).log.xz 000703218.td-b3lyp_6-31g+(d).inp 000703218.td-b3lyp_6-31g+(d).log.xz

000703218.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703218.td-b3lyp_6-31+g(d).gjf (generated)

000703218.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703218.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703218.mol 000703218.PUBCHEM 000703218.mol (via Jmol)
000703224.b3lyp_6-31g(d).inp

000703224.b3lyp_6-31g(d).qchem.inp (generated)

000703224.b3lyp_6-31g(d).gjf (generated)

000703224.b3lyp_6-31g(d).firefly.inp (generated)

000703224.b3lyp_6-31g(d).smash.inp (generated)

000703224.b3lyp_6-31g(d).nwchem.inp (generated) 000703224.b3lyp_6-31g(d).log.xz 000703224.mol 000703224.PUBCHEM 000703224.mol (via Jmol)
000703236.b3lyp_6-31g(d).inp

000703236.b3lyp_6-31g(d).qchem.inp (generated)

000703236.b3lyp_6-31g(d).gjf (generated)

000703236.b3lyp_6-31g(d).firefly.inp (generated)

000703236.b3lyp_6-31g(d).smash.inp (generated)

000703236.b3lyp_6-31g(d).nwchem.inp (generated) 000703236.b3lyp_6-31g(d).log.xz 000703236.td-b3lyp_6-31g+(d).inp 000703236.td-b3lyp_6-31g+(d).log.xz

000703236.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703236.td-b3lyp_6-31+g(d).gjf (generated)

000703236.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703236.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703236.mol 000703236.PUBCHEM 000703236.mol (via Jmol)
000703238.b3lyp_6-31g(d).inp

000703238.b3lyp_6-31g(d).qchem.inp (generated)

000703238.b3lyp_6-31g(d).gjf (generated)

000703238.b3lyp_6-31g(d).firefly.inp (generated)

000703238.b3lyp_6-31g(d).smash.inp (generated)

000703238.b3lyp_6-31g(d).nwchem.inp (generated) 000703238.b3lyp_6-31g(d).log.xz 000703238.td-b3lyp_6-31g+(d).inp 000703238.td-b3lyp_6-31g+(d).log.xz

000703238.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703238.td-b3lyp_6-31+g(d).gjf (generated)

000703238.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703238.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703238.mol 000703238.PUBCHEM 000703238.mol (via Jmol)
000703239.b3lyp_6-31g(d).inp

000703239.b3lyp_6-31g(d).qchem.inp (generated)

000703239.b3lyp_6-31g(d).gjf (generated)

000703239.b3lyp_6-31g(d).firefly.inp (generated)

000703239.b3lyp_6-31g(d).smash.inp (generated)

000703239.b3lyp_6-31g(d).nwchem.inp (generated) 000703239.b3lyp_6-31g(d).log.xz 000703239.td-b3lyp_6-31g+(d).inp 000703239.td-b3lyp_6-31g+(d).log.xz

000703239.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703239.td-b3lyp_6-31+g(d).gjf (generated)

000703239.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703239.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703239.mol 000703239.PUBCHEM 000703239.mol (via Jmol)
000703240.b3lyp_6-31g(d).inp

000703240.b3lyp_6-31g(d).qchem.inp (generated)

000703240.b3lyp_6-31g(d).gjf (generated)

000703240.b3lyp_6-31g(d).firefly.inp (generated)

000703240.b3lyp_6-31g(d).smash.inp (generated)

000703240.b3lyp_6-31g(d).nwchem.inp (generated) 000703240.b3lyp_6-31g(d).log.xz 000703240.td-b3lyp_6-31g+(d).inp 000703240.td-b3lyp_6-31g+(d).log.xz

000703240.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703240.td-b3lyp_6-31+g(d).gjf (generated)

000703240.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703240.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703240.mol 000703240.PUBCHEM 000703240.mol (via Jmol)
000703248.b3lyp_6-31g(d).inp

000703248.b3lyp_6-31g(d).qchem.inp (generated)

000703248.b3lyp_6-31g(d).gjf (generated)

000703248.b3lyp_6-31g(d).firefly.inp (generated)

000703248.b3lyp_6-31g(d).smash.inp (generated)

000703248.b3lyp_6-31g(d).nwchem.inp (generated) 000703248.b3lyp_6-31g(d).log.xz 000703248.td-b3lyp_6-31g+(d).inp 000703248.td-b3lyp_6-31g+(d).log.xz

000703248.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703248.td-b3lyp_6-31+g(d).gjf (generated)

000703248.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703248.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703248.mol 000703248.PUBCHEM 000703248.mol (via Jmol)
000703265.b3lyp_6-31g(d).inp

000703265.b3lyp_6-31g(d).qchem.inp (generated)

000703265.b3lyp_6-31g(d).gjf (generated)

000703265.b3lyp_6-31g(d).firefly.inp (generated)

000703265.b3lyp_6-31g(d).smash.inp (generated)

000703265.b3lyp_6-31g(d).nwchem.inp (generated) 000703265.b3lyp_6-31g(d).log.xz 000703265.td-b3lyp_6-31g+(d).inp 000703265.td-b3lyp_6-31g+(d).log.xz

000703265.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703265.td-b3lyp_6-31+g(d).gjf (generated)

000703265.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703265.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703265.mol 000703265.PUBCHEM 000703265.mol (via Jmol)
000703270.b3lyp_6-31g(d).inp

000703270.b3lyp_6-31g(d).qchem.inp (generated)

000703270.b3lyp_6-31g(d).gjf (generated)

000703270.b3lyp_6-31g(d).firefly.inp (generated)

000703270.b3lyp_6-31g(d).smash.inp (generated)

000703270.b3lyp_6-31g(d).nwchem.inp (generated) 000703270.b3lyp_6-31g(d).log.xz 000703270.td-b3lyp_6-31g+(d).inp 000703270.td-b3lyp_6-31g+(d).log.xz

000703270.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703270.td-b3lyp_6-31+g(d).gjf (generated)

000703270.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703270.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703270.mol 000703270.PUBCHEM 000703270.mol (via Jmol)
000703316.b3lyp_6-31g(d).inp

000703316.b3lyp_6-31g(d).qchem.inp (generated)

000703316.b3lyp_6-31g(d).gjf (generated)

000703316.b3lyp_6-31g(d).firefly.inp (generated)

000703316.b3lyp_6-31g(d).smash.inp (generated)

000703316.b3lyp_6-31g(d).nwchem.inp (generated) 000703316.b3lyp_6-31g(d).log.xz 000703316.td-b3lyp_6-31g+(d).inp 000703316.td-b3lyp_6-31g+(d).log.xz

000703316.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703316.td-b3lyp_6-31+g(d).gjf (generated)

000703316.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703316.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703316.mol 000703316.PUBCHEM 000703316.mol (via Jmol)
000703333.b3lyp_6-31g(d).inp

000703333.b3lyp_6-31g(d).qchem.inp (generated)

000703333.b3lyp_6-31g(d).gjf (generated)

000703333.b3lyp_6-31g(d).firefly.inp (generated)

000703333.b3lyp_6-31g(d).smash.inp (generated)

000703333.b3lyp_6-31g(d).nwchem.inp (generated) 000703333.b3lyp_6-31g(d).log.xz 000703333.td-b3lyp_6-31g+(d).inp 000703333.td-b3lyp_6-31g+(d).log.xz

000703333.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703333.td-b3lyp_6-31+g(d).gjf (generated)

000703333.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703333.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703333.mol 000703333.PUBCHEM 000703333.mol (via Jmol)
000703341.b3lyp_6-31g(d).inp

000703341.b3lyp_6-31g(d).qchem.inp (generated)

000703341.b3lyp_6-31g(d).gjf (generated)

000703341.b3lyp_6-31g(d).firefly.inp (generated)

000703341.b3lyp_6-31g(d).smash.inp (generated)

000703341.b3lyp_6-31g(d).nwchem.inp (generated) 000703341.b3lyp_6-31g(d).log.xz 000703341.td-b3lyp_6-31g+(d).inp 000703341.td-b3lyp_6-31g+(d).log.xz

000703341.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703341.td-b3lyp_6-31+g(d).gjf (generated)

000703341.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703341.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703341.mol 000703341.PUBCHEM 000703341.mol (via Jmol)
000703343.b3lyp_6-31g(d).inp

000703343.b3lyp_6-31g(d).qchem.inp (generated)

000703343.b3lyp_6-31g(d).gjf (generated)

000703343.b3lyp_6-31g(d).firefly.inp (generated)

000703343.b3lyp_6-31g(d).smash.inp (generated)

000703343.b3lyp_6-31g(d).nwchem.inp (generated) 000703343.b3lyp_6-31g(d).log.xz 000703343.td-b3lyp_6-31g+(d).inp 000703343.td-b3lyp_6-31g+(d).log.xz

000703343.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703343.td-b3lyp_6-31+g(d).gjf (generated)

000703343.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703343.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703343.mol 000703343.PUBCHEM 000703343.mol (via Jmol)
000703345.b3lyp_6-31g(d).inp

000703345.b3lyp_6-31g(d).qchem.inp (generated)

000703345.b3lyp_6-31g(d).gjf (generated)

000703345.b3lyp_6-31g(d).firefly.inp (generated)

000703345.b3lyp_6-31g(d).smash.inp (generated)

000703345.b3lyp_6-31g(d).nwchem.inp (generated) 000703345.b3lyp_6-31g(d).log.xz 000703345.td-b3lyp_6-31g+(d).inp 000703345.td-b3lyp_6-31g+(d).log.xz

000703345.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703345.td-b3lyp_6-31+g(d).gjf (generated)

000703345.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703345.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703345.mol 000703345.PUBCHEM 000703345.mol (via Jmol)
000703379.b3lyp_6-31g(d).inp

000703379.b3lyp_6-31g(d).qchem.inp (generated)

000703379.b3lyp_6-31g(d).gjf (generated)

000703379.b3lyp_6-31g(d).firefly.inp (generated)

000703379.b3lyp_6-31g(d).smash.inp (generated)

000703379.b3lyp_6-31g(d).nwchem.inp (generated) 000703379.b3lyp_6-31g(d).log.xz 000703379.td-b3lyp_6-31g+(d).inp 000703379.td-b3lyp_6-31g+(d).log.xz

000703379.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703379.td-b3lyp_6-31+g(d).gjf (generated)

000703379.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703379.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703379.mol 000703379.PUBCHEM 000703379.mol (via Jmol)
000703397.b3lyp_6-31g(d).inp

000703397.b3lyp_6-31g(d).qchem.inp (generated)

000703397.b3lyp_6-31g(d).gjf (generated)

000703397.b3lyp_6-31g(d).firefly.inp (generated)

000703397.b3lyp_6-31g(d).smash.inp (generated)

000703397.b3lyp_6-31g(d).nwchem.inp (generated) 000703397.b3lyp_6-31g(d).log.xz 000703397.td-b3lyp_6-31g+(d).inp 000703397.td-b3lyp_6-31g+(d).log.xz

000703397.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703397.td-b3lyp_6-31+g(d).gjf (generated)

000703397.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703397.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703397.mol 000703397.PUBCHEM 000703397.mol (via Jmol)
000703428.b3lyp_6-31g(d).inp

000703428.b3lyp_6-31g(d).qchem.inp (generated)

000703428.b3lyp_6-31g(d).gjf (generated)

000703428.b3lyp_6-31g(d).firefly.inp (generated)

000703428.b3lyp_6-31g(d).smash.inp (generated)

000703428.b3lyp_6-31g(d).nwchem.inp (generated) 000703428.b3lyp_6-31g(d).log.xz 000703428.td-b3lyp_6-31g+(d).inp 000703428.td-b3lyp_6-31g+(d).log.xz

000703428.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703428.td-b3lyp_6-31+g(d).gjf (generated)

000703428.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703428.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703428.mol 000703428.PUBCHEM 000703428.mol (via Jmol)
000703431.b3lyp_6-31g(d).inp

000703431.b3lyp_6-31g(d).qchem.inp (generated)

000703431.b3lyp_6-31g(d).gjf (generated)

000703431.b3lyp_6-31g(d).firefly.inp (generated)

000703431.b3lyp_6-31g(d).smash.inp (generated)

000703431.b3lyp_6-31g(d).nwchem.inp (generated) 000703431.b3lyp_6-31g(d).log.xz 000703431.mol 000703431.PUBCHEM 000703431.mol (via Jmol)
000703479.b3lyp_6-31g(d).inp

000703479.b3lyp_6-31g(d).qchem.inp (generated)

000703479.b3lyp_6-31g(d).gjf (generated)

000703479.b3lyp_6-31g(d).firefly.inp (generated)

000703479.b3lyp_6-31g(d).smash.inp (generated)

000703479.b3lyp_6-31g(d).nwchem.inp (generated) 000703479.b3lyp_6-31g(d).log.xz 000703479.td-b3lyp_6-31g+(d).inp 000703479.td-b3lyp_6-31g+(d).log.xz

000703479.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703479.td-b3lyp_6-31+g(d).gjf (generated)

000703479.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703479.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703479.mol 000703479.PUBCHEM 000703479.mol (via Jmol)
000703493.b3lyp_6-31g(d).inp

000703493.b3lyp_6-31g(d).qchem.inp (generated)

000703493.b3lyp_6-31g(d).gjf (generated)

000703493.b3lyp_6-31g(d).firefly.inp (generated)

000703493.b3lyp_6-31g(d).smash.inp (generated)

000703493.b3lyp_6-31g(d).nwchem.inp (generated) 000703493.b3lyp_6-31g(d).log.xz 000703493.td-b3lyp_6-31g+(d).inp 000703493.td-b3lyp_6-31g+(d).log.xz

000703493.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703493.td-b3lyp_6-31+g(d).gjf (generated)

000703493.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703493.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703493.mol 000703493.PUBCHEM 000703493.mol (via Jmol)
000703504.b3lyp_6-31g(d).inp

000703504.b3lyp_6-31g(d).qchem.inp (generated)

000703504.b3lyp_6-31g(d).gjf (generated)

000703504.b3lyp_6-31g(d).firefly.inp (generated)

000703504.b3lyp_6-31g(d).smash.inp (generated)

000703504.b3lyp_6-31g(d).nwchem.inp (generated) 000703504.b3lyp_6-31g(d).log.xz 000703504.td-b3lyp_6-31g+(d).inp 000703504.td-b3lyp_6-31g+(d).log.xz

000703504.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703504.td-b3lyp_6-31+g(d).gjf (generated)

000703504.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703504.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703504.mol 000703504.PUBCHEM 000703504.mol (via Jmol)
000703505.b3lyp_6-31g(d).inp

000703505.b3lyp_6-31g(d).qchem.inp (generated)

000703505.b3lyp_6-31g(d).gjf (generated)

000703505.b3lyp_6-31g(d).firefly.inp (generated)

000703505.b3lyp_6-31g(d).smash.inp (generated)

000703505.b3lyp_6-31g(d).nwchem.inp (generated) 000703505.b3lyp_6-31g(d).log.xz 000703505.td-b3lyp_6-31g+(d).inp 000703505.td-b3lyp_6-31g+(d).log.xz

000703505.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703505.td-b3lyp_6-31+g(d).gjf (generated)

000703505.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703505.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703505.mol 000703505.PUBCHEM 000703505.mol (via Jmol)
000703507.b3lyp_6-31g(d).inp

000703507.b3lyp_6-31g(d).qchem.inp (generated)

000703507.b3lyp_6-31g(d).gjf (generated)

000703507.b3lyp_6-31g(d).firefly.inp (generated)

000703507.b3lyp_6-31g(d).smash.inp (generated)

000703507.b3lyp_6-31g(d).nwchem.inp (generated) 000703507.b3lyp_6-31g(d).log.xz 000703507.mol 000703507.PUBCHEM 000703507.mol (via Jmol)
000703527.b3lyp_6-31g(d).inp

000703527.b3lyp_6-31g(d).qchem.inp (generated)

000703527.b3lyp_6-31g(d).gjf (generated)

000703527.b3lyp_6-31g(d).firefly.inp (generated)

000703527.b3lyp_6-31g(d).smash.inp (generated)

000703527.b3lyp_6-31g(d).nwchem.inp (generated) 000703527.b3lyp_6-31g(d).log.xz 000703527.td-b3lyp_6-31g+(d).inp 000703527.td-b3lyp_6-31g+(d).log.xz

000703527.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703527.td-b3lyp_6-31+g(d).gjf (generated)

000703527.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703527.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703527.mol 000703527.PUBCHEM 000703527.mol (via Jmol)
000703530.b3lyp_6-31g(d).inp

000703530.b3lyp_6-31g(d).qchem.inp (generated)

000703530.b3lyp_6-31g(d).gjf (generated)

000703530.b3lyp_6-31g(d).firefly.inp (generated)

000703530.b3lyp_6-31g(d).smash.inp (generated)

000703530.b3lyp_6-31g(d).nwchem.inp (generated) 000703530.b3lyp_6-31g(d).log.xz 000703530.td-b3lyp_6-31g+(d).inp 000703530.td-b3lyp_6-31g+(d).log.xz

000703530.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703530.td-b3lyp_6-31+g(d).gjf (generated)

000703530.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703530.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703530.mol 000703530.PUBCHEM 000703530.mol (via Jmol)
000703531.b3lyp_6-31g(d).inp

000703531.b3lyp_6-31g(d).qchem.inp (generated)

000703531.b3lyp_6-31g(d).gjf (generated)

000703531.b3lyp_6-31g(d).firefly.inp (generated)

000703531.b3lyp_6-31g(d).smash.inp (generated)

000703531.b3lyp_6-31g(d).nwchem.inp (generated) 000703531.b3lyp_6-31g(d).log.xz 000703531.td-b3lyp_6-31g+(d).inp 000703531.td-b3lyp_6-31g+(d).log.xz

000703531.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703531.td-b3lyp_6-31+g(d).gjf (generated)

000703531.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703531.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703531.mol 000703531.PUBCHEM 000703531.mol (via Jmol)
000703607.b3lyp_6-31g(d).inp

000703607.b3lyp_6-31g(d).qchem.inp (generated)

000703607.b3lyp_6-31g(d).gjf (generated)

000703607.b3lyp_6-31g(d).firefly.inp (generated)

000703607.b3lyp_6-31g(d).smash.inp (generated)

000703607.b3lyp_6-31g(d).nwchem.inp (generated) 000703607.b3lyp_6-31g(d).log.xz 000703607.mol 000703607.PUBCHEM 000703607.mol (via Jmol)
000703609.b3lyp_6-31g(d).inp

000703609.b3lyp_6-31g(d).qchem.inp (generated)

000703609.b3lyp_6-31g(d).gjf (generated)

000703609.b3lyp_6-31g(d).firefly.inp (generated)

000703609.b3lyp_6-31g(d).smash.inp (generated)

000703609.b3lyp_6-31g(d).nwchem.inp (generated) 000703609.b3lyp_6-31g(d).log.xz 000703609.mol 000703609.PUBCHEM 000703609.mol (via Jmol)
000703628.b3lyp_6-31g(d).inp

000703628.b3lyp_6-31g(d).qchem.inp (generated)

000703628.b3lyp_6-31g(d).gjf (generated)

000703628.b3lyp_6-31g(d).firefly.inp (generated)

000703628.b3lyp_6-31g(d).smash.inp (generated)

000703628.b3lyp_6-31g(d).nwchem.inp (generated) 000703628.b3lyp_6-31g(d).log.xz 000703628.td-b3lyp_6-31g+(d).inp 000703628.td-b3lyp_6-31g+(d).log.xz

000703628.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703628.td-b3lyp_6-31+g(d).gjf (generated)

000703628.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703628.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703628.mol 000703628.PUBCHEM 000703628.mol (via Jmol)
000703631.b3lyp_6-31g(d).inp

000703631.b3lyp_6-31g(d).qchem.inp (generated)

000703631.b3lyp_6-31g(d).gjf (generated)

000703631.b3lyp_6-31g(d).firefly.inp (generated)

000703631.b3lyp_6-31g(d).smash.inp (generated)

000703631.b3lyp_6-31g(d).nwchem.inp (generated) 000703631.b3lyp_6-31g(d).log.xz 000703631.td-b3lyp_6-31g+(d).inp 000703631.td-b3lyp_6-31g+(d).log.xz

000703631.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703631.td-b3lyp_6-31+g(d).gjf (generated)

000703631.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703631.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703631.mol 000703631.PUBCHEM 000703631.mol (via Jmol)
000703634.b3lyp_6-31g(d).inp

000703634.b3lyp_6-31g(d).qchem.inp (generated)

000703634.b3lyp_6-31g(d).gjf (generated)

000703634.b3lyp_6-31g(d).firefly.inp (generated)

000703634.b3lyp_6-31g(d).smash.inp (generated)

000703634.b3lyp_6-31g(d).nwchem.inp (generated) 000703634.b3lyp_6-31g(d).log.xz 000703634.td-b3lyp_6-31g+(d).inp 000703634.td-b3lyp_6-31g+(d).log.xz

000703634.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703634.td-b3lyp_6-31+g(d).gjf (generated)

000703634.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703634.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703634.mol 000703634.PUBCHEM 000703634.mol (via Jmol)
000703636.b3lyp_6-31g(d).inp

000703636.b3lyp_6-31g(d).qchem.inp (generated)

000703636.b3lyp_6-31g(d).gjf (generated)

000703636.b3lyp_6-31g(d).firefly.inp (generated)

000703636.b3lyp_6-31g(d).smash.inp (generated)

000703636.b3lyp_6-31g(d).nwchem.inp (generated) 000703636.b3lyp_6-31g(d).log.xz 000703636.td-b3lyp_6-31g+(d).inp 000703636.td-b3lyp_6-31g+(d).log.xz

000703636.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703636.td-b3lyp_6-31+g(d).gjf (generated)

000703636.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703636.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703636.mol 000703636.PUBCHEM 000703636.mol (via Jmol)
000703650.b3lyp_6-31g(d).inp

000703650.b3lyp_6-31g(d).qchem.inp (generated)

000703650.b3lyp_6-31g(d).gjf (generated)

000703650.b3lyp_6-31g(d).firefly.inp (generated)

000703650.b3lyp_6-31g(d).smash.inp (generated)

000703650.b3lyp_6-31g(d).nwchem.inp (generated) 000703650.b3lyp_6-31g(d).log.xz 000703650.td-b3lyp_6-31g+(d).inp 000703650.td-b3lyp_6-31g+(d).log.xz

000703650.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703650.td-b3lyp_6-31+g(d).gjf (generated)

000703650.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703650.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703650.mol 000703650.PUBCHEM 000703650.mol (via Jmol)
000703657.b3lyp_6-31g(d).inp

000703657.b3lyp_6-31g(d).qchem.inp (generated)

000703657.b3lyp_6-31g(d).gjf (generated)

000703657.b3lyp_6-31g(d).firefly.inp (generated)

000703657.b3lyp_6-31g(d).smash.inp (generated)

000703657.b3lyp_6-31g(d).nwchem.inp (generated) 000703657.b3lyp_6-31g(d).log.xz 000703657.td-b3lyp_6-31g+(d).inp 000703657.td-b3lyp_6-31g+(d).log.xz

000703657.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703657.td-b3lyp_6-31+g(d).gjf (generated)

000703657.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703657.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703657.mol 000703657.PUBCHEM 000703657.mol (via Jmol)
000703684.b3lyp_6-31g(d).inp

000703684.b3lyp_6-31g(d).qchem.inp (generated)

000703684.b3lyp_6-31g(d).gjf (generated)

000703684.b3lyp_6-31g(d).firefly.inp (generated)

000703684.b3lyp_6-31g(d).smash.inp (generated)

000703684.b3lyp_6-31g(d).nwchem.inp (generated) 000703684.b3lyp_6-31g(d).log.xz 000703684.td-b3lyp_6-31g+(d).inp 000703684.td-b3lyp_6-31g+(d).log.xz

000703684.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703684.td-b3lyp_6-31+g(d).gjf (generated)

000703684.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703684.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703684.mol 000703684.PUBCHEM 000703684.mol (via Jmol)
000703698.b3lyp_6-31g(d).inp

000703698.b3lyp_6-31g(d).qchem.inp (generated)

000703698.b3lyp_6-31g(d).gjf (generated)

000703698.b3lyp_6-31g(d).firefly.inp (generated)

000703698.b3lyp_6-31g(d).smash.inp (generated)

000703698.b3lyp_6-31g(d).nwchem.inp (generated) 000703698.b3lyp_6-31g(d).log.xz 000703698.td-b3lyp_6-31g+(d).inp 000703698.td-b3lyp_6-31g+(d).log.xz

000703698.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703698.td-b3lyp_6-31+g(d).gjf (generated)

000703698.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703698.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703698.mol 000703698.PUBCHEM 000703698.mol (via Jmol)
000703701.b3lyp_6-31g(d).inp

000703701.b3lyp_6-31g(d).qchem.inp (generated)

000703701.b3lyp_6-31g(d).gjf (generated)

000703701.b3lyp_6-31g(d).firefly.inp (generated)

000703701.b3lyp_6-31g(d).smash.inp (generated)

000703701.b3lyp_6-31g(d).nwchem.inp (generated) 000703701.b3lyp_6-31g(d).log.xz 000703701.mol 000703701.PUBCHEM 000703701.mol (via Jmol)
000703702.b3lyp_6-31g(d).inp

000703702.b3lyp_6-31g(d).qchem.inp (generated)

000703702.b3lyp_6-31g(d).gjf (generated)

000703702.b3lyp_6-31g(d).firefly.inp (generated)

000703702.b3lyp_6-31g(d).smash.inp (generated)

000703702.b3lyp_6-31g(d).nwchem.inp (generated) 000703702.b3lyp_6-31g(d).log.xz 000703702.td-b3lyp_6-31g+(d).inp 000703702.td-b3lyp_6-31g+(d).log.xz

000703702.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703702.td-b3lyp_6-31+g(d).gjf (generated)

000703702.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703702.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703702.mol 000703702.PUBCHEM 000703702.mol (via Jmol)
000703708.b3lyp_6-31g(d).inp

000703708.b3lyp_6-31g(d).qchem.inp (generated)

000703708.b3lyp_6-31g(d).gjf (generated)

000703708.b3lyp_6-31g(d).firefly.inp (generated)

000703708.b3lyp_6-31g(d).smash.inp (generated)

000703708.b3lyp_6-31g(d).nwchem.inp (generated) 000703708.b3lyp_6-31g(d).log.xz 000703708.td-b3lyp_6-31g+(d).inp 000703708.td-b3lyp_6-31g+(d).log.xz

000703708.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703708.td-b3lyp_6-31+g(d).gjf (generated)

000703708.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703708.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703708.mol 000703708.PUBCHEM 000703708.mol (via Jmol)
000703719.b3lyp_6-31g(d).inp

000703719.b3lyp_6-31g(d).qchem.inp (generated)

000703719.b3lyp_6-31g(d).gjf (generated)

000703719.b3lyp_6-31g(d).firefly.inp (generated)

000703719.b3lyp_6-31g(d).smash.inp (generated)

000703719.b3lyp_6-31g(d).nwchem.inp (generated) 000703719.b3lyp_6-31g(d).log.xz 000703719.mol 000703719.PUBCHEM 000703719.mol (via Jmol)
000703741.b3lyp_6-31g(d).inp

000703741.b3lyp_6-31g(d).qchem.inp (generated)

000703741.b3lyp_6-31g(d).gjf (generated)

000703741.b3lyp_6-31g(d).firefly.inp (generated)

000703741.b3lyp_6-31g(d).smash.inp (generated)

000703741.b3lyp_6-31g(d).nwchem.inp (generated) 000703741.b3lyp_6-31g(d).log.xz 000703741.td-b3lyp_6-31g+(d).inp 000703741.td-b3lyp_6-31g+(d).log.xz

000703741.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703741.td-b3lyp_6-31+g(d).gjf (generated)

000703741.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703741.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703741.mol 000703741.PUBCHEM 000703741.mol (via Jmol)
000703749.b3lyp_6-31g(d).inp

000703749.b3lyp_6-31g(d).qchem.inp (generated)

000703749.b3lyp_6-31g(d).gjf (generated)

000703749.b3lyp_6-31g(d).firefly.inp (generated)

000703749.b3lyp_6-31g(d).smash.inp (generated)

000703749.b3lyp_6-31g(d).nwchem.inp (generated) 000703749.b3lyp_6-31g(d).log.xz 000703749.td-b3lyp_6-31g+(d).inp 000703749.td-b3lyp_6-31g+(d).log.xz

000703749.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703749.td-b3lyp_6-31+g(d).gjf (generated)

000703749.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703749.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703749.mol 000703749.PUBCHEM 000703749.mol (via Jmol)
000703784.b3lyp_6-31g(d).inp

000703784.b3lyp_6-31g(d).qchem.inp (generated)

000703784.b3lyp_6-31g(d).gjf (generated)

000703784.b3lyp_6-31g(d).firefly.inp (generated)

000703784.b3lyp_6-31g(d).smash.inp (generated)

000703784.b3lyp_6-31g(d).nwchem.inp (generated) 000703784.b3lyp_6-31g(d).log.xz 000703784.mol 000703784.PUBCHEM 000703784.mol (via Jmol)
000703797.b3lyp_6-31g(d).inp

000703797.b3lyp_6-31g(d).qchem.inp (generated)

000703797.b3lyp_6-31g(d).gjf (generated)

000703797.b3lyp_6-31g(d).firefly.inp (generated)

000703797.b3lyp_6-31g(d).smash.inp (generated)

000703797.b3lyp_6-31g(d).nwchem.inp (generated) 000703797.b3lyp_6-31g(d).log.xz 000703797.td-b3lyp_6-31g+(d).inp 000703797.td-b3lyp_6-31g+(d).log.xz

000703797.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703797.td-b3lyp_6-31+g(d).gjf (generated)

000703797.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703797.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703797.mol 000703797.PUBCHEM 000703797.mol (via Jmol)
000703808.b3lyp_6-31g(d).inp

000703808.b3lyp_6-31g(d).qchem.inp (generated)

000703808.b3lyp_6-31g(d).gjf (generated)

000703808.b3lyp_6-31g(d).firefly.inp (generated)

000703808.b3lyp_6-31g(d).smash.inp (generated)

000703808.b3lyp_6-31g(d).nwchem.inp (generated) 000703808.b3lyp_6-31g(d).log.xz 000703808.td-b3lyp_6-31g+(d).inp 000703808.td-b3lyp_6-31g+(d).log.xz

000703808.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703808.td-b3lyp_6-31+g(d).gjf (generated)

000703808.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703808.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703808.mol 000703808.PUBCHEM 000703808.mol (via Jmol)
000703851.b3lyp_6-31g(d).inp

000703851.b3lyp_6-31g(d).qchem.inp (generated)

000703851.b3lyp_6-31g(d).gjf (generated)

000703851.b3lyp_6-31g(d).firefly.inp (generated)

000703851.b3lyp_6-31g(d).smash.inp (generated)

000703851.b3lyp_6-31g(d).nwchem.inp (generated) 000703851.b3lyp_6-31g(d).log.xz 000703851.td-b3lyp_6-31g+(d).inp 000703851.td-b3lyp_6-31g+(d).log.xz

000703851.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703851.td-b3lyp_6-31+g(d).gjf (generated)

000703851.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703851.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703851.mol 000703851.PUBCHEM 000703851.mol (via Jmol)
000703936.b3lyp_6-31g(d).inp

000703936.b3lyp_6-31g(d).qchem.inp (generated)

000703936.b3lyp_6-31g(d).gjf (generated)

000703936.b3lyp_6-31g(d).firefly.inp (generated)

000703936.b3lyp_6-31g(d).smash.inp (generated)

000703936.b3lyp_6-31g(d).nwchem.inp (generated) 000703936.b3lyp_6-31g(d).log.xz 000703936.td-b3lyp_6-31g+(d).inp 000703936.td-b3lyp_6-31g+(d).log.xz

000703936.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703936.td-b3lyp_6-31+g(d).gjf (generated)

000703936.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703936.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703936.mol 000703936.PUBCHEM 000703936.mol (via Jmol)
000703938.b3lyp_6-31g(d).inp

000703938.b3lyp_6-31g(d).qchem.inp (generated)

000703938.b3lyp_6-31g(d).gjf (generated)

000703938.b3lyp_6-31g(d).firefly.inp (generated)

000703938.b3lyp_6-31g(d).smash.inp (generated)

000703938.b3lyp_6-31g(d).nwchem.inp (generated) 000703938.b3lyp_6-31g(d).log.xz 000703938.td-b3lyp_6-31g+(d).inp 000703938.td-b3lyp_6-31g+(d).log.xz

000703938.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703938.td-b3lyp_6-31+g(d).gjf (generated)

000703938.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703938.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703938.mol 000703938.PUBCHEM 000703938.mol (via Jmol)
000703947.b3lyp_6-31g(d).inp

000703947.b3lyp_6-31g(d).qchem.inp (generated)

000703947.b3lyp_6-31g(d).gjf (generated)

000703947.b3lyp_6-31g(d).firefly.inp (generated)

000703947.b3lyp_6-31g(d).smash.inp (generated)

000703947.b3lyp_6-31g(d).nwchem.inp (generated) 000703947.b3lyp_6-31g(d).log.xz 000703947.td-b3lyp_6-31g+(d).inp 000703947.td-b3lyp_6-31g+(d).log.xz

000703947.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703947.td-b3lyp_6-31+g(d).gjf (generated)

000703947.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703947.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703947.mol 000703947.PUBCHEM 000703947.mol (via Jmol)
000703951.b3lyp_6-31g(d).inp

000703951.b3lyp_6-31g(d).qchem.inp (generated)

000703951.b3lyp_6-31g(d).gjf (generated)

000703951.b3lyp_6-31g(d).firefly.inp (generated)

000703951.b3lyp_6-31g(d).smash.inp (generated)

000703951.b3lyp_6-31g(d).nwchem.inp (generated) 000703951.b3lyp_6-31g(d).log.xz 000703951.td-b3lyp_6-31g+(d).inp 000703951.td-b3lyp_6-31g+(d).log.xz

000703951.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703951.td-b3lyp_6-31+g(d).gjf (generated)

000703951.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703951.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703951.mol 000703951.PUBCHEM 000703951.mol (via Jmol)
000703960.b3lyp_6-31g(d).inp

000703960.b3lyp_6-31g(d).qchem.inp (generated)

000703960.b3lyp_6-31g(d).gjf (generated)

000703960.b3lyp_6-31g(d).firefly.inp (generated)

000703960.b3lyp_6-31g(d).smash.inp (generated)

000703960.b3lyp_6-31g(d).nwchem.inp (generated) 000703960.b3lyp_6-31g(d).log.xz 000703960.td-b3lyp_6-31g+(d).inp 000703960.td-b3lyp_6-31g+(d).log.xz

000703960.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703960.td-b3lyp_6-31+g(d).gjf (generated)

000703960.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703960.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703960.mol 000703960.PUBCHEM 000703960.mol (via Jmol)
000703965.b3lyp_6-31g(d).inp

000703965.b3lyp_6-31g(d).qchem.inp (generated)

000703965.b3lyp_6-31g(d).gjf (generated)

000703965.b3lyp_6-31g(d).firefly.inp (generated)

000703965.b3lyp_6-31g(d).smash.inp (generated)

000703965.b3lyp_6-31g(d).nwchem.inp (generated) 000703965.b3lyp_6-31g(d).log.xz 000703965.td-b3lyp_6-31g+(d).inp 000703965.td-b3lyp_6-31g+(d).log.xz

000703965.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703965.td-b3lyp_6-31+g(d).gjf (generated)

000703965.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703965.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703965.mol 000703965.PUBCHEM 000703965.mol (via Jmol)
000703981.b3lyp_6-31g(d).inp

000703981.b3lyp_6-31g(d).qchem.inp (generated)

000703981.b3lyp_6-31g(d).gjf (generated)

000703981.b3lyp_6-31g(d).firefly.inp (generated)

000703981.b3lyp_6-31g(d).smash.inp (generated)

000703981.b3lyp_6-31g(d).nwchem.inp (generated) 000703981.b3lyp_6-31g(d).log.xz 000703981.td-b3lyp_6-31g+(d).inp 000703981.td-b3lyp_6-31g+(d).log.xz

000703981.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703981.td-b3lyp_6-31+g(d).gjf (generated)

000703981.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703981.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703981.mol 000703981.PUBCHEM 000703981.mol (via Jmol)
000703984.b3lyp_6-31g(d).inp

000703984.b3lyp_6-31g(d).qchem.inp (generated)

000703984.b3lyp_6-31g(d).gjf (generated)

000703984.b3lyp_6-31g(d).firefly.inp (generated)

000703984.b3lyp_6-31g(d).smash.inp (generated)

000703984.b3lyp_6-31g(d).nwchem.inp (generated) 000703984.b3lyp_6-31g(d).log.xz 000703984.td-b3lyp_6-31g+(d).inp 000703984.td-b3lyp_6-31g+(d).log.xz

000703984.td-b3lyp_6-31+g(d).qchem.inp (generated)

000703984.td-b3lyp_6-31+g(d).gjf (generated)

000703984.td-b3lyp_6-31+g(d).firefly.inp (generated)

000703984.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000703984.mol 000703984.PUBCHEM 000703984.mol (via Jmol)
000704002.b3lyp_6-31g(d).inp

000704002.b3lyp_6-31g(d).qchem.inp (generated)

000704002.b3lyp_6-31g(d).gjf (generated)

000704002.b3lyp_6-31g(d).firefly.inp (generated)

000704002.b3lyp_6-31g(d).smash.inp (generated)

000704002.b3lyp_6-31g(d).nwchem.inp (generated) 000704002.b3lyp_6-31g(d).log.xz 000704002.mol 000704002.PUBCHEM 000704002.mol (via Jmol)
000704003.b3lyp_6-31g(d).inp

000704003.b3lyp_6-31g(d).qchem.inp (generated)

000704003.b3lyp_6-31g(d).gjf (generated)

000704003.b3lyp_6-31g(d).firefly.inp (generated)

000704003.b3lyp_6-31g(d).smash.inp (generated)

000704003.b3lyp_6-31g(d).nwchem.inp (generated) 000704003.b3lyp_6-31g(d).log.xz 000704003.mol 000704003.PUBCHEM 000704003.mol (via Jmol)
000704037.b3lyp_6-31g(d).inp

000704037.b3lyp_6-31g(d).qchem.inp (generated)

000704037.b3lyp_6-31g(d).gjf (generated)

000704037.b3lyp_6-31g(d).firefly.inp (generated)

000704037.b3lyp_6-31g(d).smash.inp (generated)

000704037.b3lyp_6-31g(d).nwchem.inp (generated) 000704037.b3lyp_6-31g(d).log.xz 000704037.td-b3lyp_6-31g+(d).inp 000704037.td-b3lyp_6-31g+(d).log.xz

000704037.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704037.td-b3lyp_6-31+g(d).gjf (generated)

000704037.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704037.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704037.mol 000704037.PUBCHEM 000704037.mol (via Jmol)
000704040.b3lyp_6-31g(d).inp

000704040.b3lyp_6-31g(d).qchem.inp (generated)

000704040.b3lyp_6-31g(d).gjf (generated)

000704040.b3lyp_6-31g(d).firefly.inp (generated)

000704040.b3lyp_6-31g(d).smash.inp (generated)

000704040.b3lyp_6-31g(d).nwchem.inp (generated) 000704040.b3lyp_6-31g(d).log.xz 000704040.td-b3lyp_6-31g+(d).inp 000704040.td-b3lyp_6-31g+(d).log.xz

000704040.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704040.td-b3lyp_6-31+g(d).gjf (generated)

000704040.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704040.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704040.mol 000704040.PUBCHEM 000704040.mol (via Jmol)
000704041.b3lyp_6-31g(d).inp

000704041.b3lyp_6-31g(d).qchem.inp (generated)

000704041.b3lyp_6-31g(d).gjf (generated)

000704041.b3lyp_6-31g(d).firefly.inp (generated)

000704041.b3lyp_6-31g(d).smash.inp (generated)

000704041.b3lyp_6-31g(d).nwchem.inp (generated) 000704041.b3lyp_6-31g(d).log.xz 000704041.td-b3lyp_6-31g+(d).inp 000704041.td-b3lyp_6-31g+(d).log.xz

000704041.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704041.td-b3lyp_6-31+g(d).gjf (generated)

000704041.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704041.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704041.mol 000704041.PUBCHEM 000704041.mol (via Jmol)
000704053.b3lyp_6-31g(d).inp

000704053.b3lyp_6-31g(d).qchem.inp (generated)

000704053.b3lyp_6-31g(d).gjf (generated)

000704053.b3lyp_6-31g(d).firefly.inp (generated)

000704053.b3lyp_6-31g(d).smash.inp (generated)

000704053.b3lyp_6-31g(d).nwchem.inp (generated) 000704053.b3lyp_6-31g(d).log.xz 000704053.td-b3lyp_6-31g+(d).inp 000704053.td-b3lyp_6-31g+(d).log.xz

000704053.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704053.td-b3lyp_6-31+g(d).gjf (generated)

000704053.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704053.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704053.mol 000704053.PUBCHEM 000704053.mol (via Jmol)
000704091.b3lyp_6-31g(d).inp

000704091.b3lyp_6-31g(d).qchem.inp (generated)

000704091.b3lyp_6-31g(d).gjf (generated)

000704091.b3lyp_6-31g(d).firefly.inp (generated)

000704091.b3lyp_6-31g(d).smash.inp (generated)

000704091.b3lyp_6-31g(d).nwchem.inp (generated) 000704091.b3lyp_6-31g(d).log.xz 000704091.mol 000704091.PUBCHEM 000704091.mol (via Jmol)
000704128.b3lyp_6-31g(d).inp

000704128.b3lyp_6-31g(d).qchem.inp (generated)

000704128.b3lyp_6-31g(d).gjf (generated)

000704128.b3lyp_6-31g(d).firefly.inp (generated)

000704128.b3lyp_6-31g(d).smash.inp (generated)

000704128.b3lyp_6-31g(d).nwchem.inp (generated) 000704128.b3lyp_6-31g(d).log.xz 000704128.td-b3lyp_6-31g+(d).inp 000704128.td-b3lyp_6-31g+(d).log.xz

000704128.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704128.td-b3lyp_6-31+g(d).gjf (generated)

000704128.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704128.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704128.mol 000704128.PUBCHEM 000704128.mol (via Jmol)
000704134.b3lyp_6-31g(d).inp

000704134.b3lyp_6-31g(d).qchem.inp (generated)

000704134.b3lyp_6-31g(d).gjf (generated)

000704134.b3lyp_6-31g(d).firefly.inp (generated)

000704134.b3lyp_6-31g(d).smash.inp (generated)

000704134.b3lyp_6-31g(d).nwchem.inp (generated) 000704134.b3lyp_6-31g(d).log.xz 000704134.td-b3lyp_6-31g+(d).inp 000704134.td-b3lyp_6-31g+(d).log.xz

000704134.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704134.td-b3lyp_6-31+g(d).gjf (generated)

000704134.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704134.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704134.mol 000704134.PUBCHEM 000704134.mol (via Jmol)
000704135.b3lyp_6-31g(d).inp

000704135.b3lyp_6-31g(d).qchem.inp (generated)

000704135.b3lyp_6-31g(d).gjf (generated)

000704135.b3lyp_6-31g(d).firefly.inp (generated)

000704135.b3lyp_6-31g(d).smash.inp (generated)

000704135.b3lyp_6-31g(d).nwchem.inp (generated) 000704135.b3lyp_6-31g(d).log.xz 000704135.td-b3lyp_6-31g+(d).inp 000704135.td-b3lyp_6-31g+(d).log.xz

000704135.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704135.td-b3lyp_6-31+g(d).gjf (generated)

000704135.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704135.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704135.mol 000704135.PUBCHEM 000704135.mol (via Jmol)
000704149.b3lyp_6-31g(d).inp

000704149.b3lyp_6-31g(d).qchem.inp (generated)

000704149.b3lyp_6-31g(d).gjf (generated)

000704149.b3lyp_6-31g(d).firefly.inp (generated)

000704149.b3lyp_6-31g(d).smash.inp (generated)

000704149.b3lyp_6-31g(d).nwchem.inp (generated) 000704149.b3lyp_6-31g(d).log.xz 000704149.td-b3lyp_6-31g+(d).inp 000704149.td-b3lyp_6-31g+(d).log.xz

000704149.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704149.td-b3lyp_6-31+g(d).gjf (generated)

000704149.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704149.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704149.mol 000704149.PUBCHEM 000704149.mol (via Jmol)
000704160.b3lyp_6-31g(d).inp

000704160.b3lyp_6-31g(d).qchem.inp (generated)

000704160.b3lyp_6-31g(d).gjf (generated)

000704160.b3lyp_6-31g(d).firefly.inp (generated)

000704160.b3lyp_6-31g(d).smash.inp (generated)

000704160.b3lyp_6-31g(d).nwchem.inp (generated) 000704160.b3lyp_6-31g(d).log.xz 000704160.td-b3lyp_6-31g+(d).inp 000704160.td-b3lyp_6-31g+(d).log.xz

000704160.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704160.td-b3lyp_6-31+g(d).gjf (generated)

000704160.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704160.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704160.mol 000704160.PUBCHEM 000704160.mol (via Jmol)
000704161.b3lyp_6-31g(d).inp

000704161.b3lyp_6-31g(d).qchem.inp (generated)

000704161.b3lyp_6-31g(d).gjf (generated)

000704161.b3lyp_6-31g(d).firefly.inp (generated)

000704161.b3lyp_6-31g(d).smash.inp (generated)

000704161.b3lyp_6-31g(d).nwchem.inp (generated) 000704161.b3lyp_6-31g(d).log.xz 000704161.td-b3lyp_6-31g+(d).inp 000704161.td-b3lyp_6-31g+(d).log.xz

000704161.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704161.td-b3lyp_6-31+g(d).gjf (generated)

000704161.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704161.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704161.mol 000704161.PUBCHEM 000704161.mol (via Jmol)
000704165.b3lyp_6-31g(d).inp

000704165.b3lyp_6-31g(d).qchem.inp (generated)

000704165.b3lyp_6-31g(d).gjf (generated)

000704165.b3lyp_6-31g(d).firefly.inp (generated)

000704165.b3lyp_6-31g(d).smash.inp (generated)

000704165.b3lyp_6-31g(d).nwchem.inp (generated) 000704165.b3lyp_6-31g(d).log.xz 000704165.td-b3lyp_6-31g+(d).inp 000704165.td-b3lyp_6-31g+(d).log.xz

000704165.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704165.td-b3lyp_6-31+g(d).gjf (generated)

000704165.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704165.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704165.mol 000704165.PUBCHEM 000704165.mol (via Jmol)
000704208.b3lyp_6-31g(d).inp

000704208.b3lyp_6-31g(d).qchem.inp (generated)

000704208.b3lyp_6-31g(d).gjf (generated)

000704208.b3lyp_6-31g(d).firefly.inp (generated)

000704208.b3lyp_6-31g(d).smash.inp (generated)

000704208.b3lyp_6-31g(d).nwchem.inp (generated) 000704208.b3lyp_6-31g(d).log.xz 000704208.mol 000704208.PUBCHEM 000704208.mol (via Jmol)
000704210.b3lyp_6-31g(d).inp

000704210.b3lyp_6-31g(d).qchem.inp (generated)

000704210.b3lyp_6-31g(d).gjf (generated)

000704210.b3lyp_6-31g(d).firefly.inp (generated)

000704210.b3lyp_6-31g(d).smash.inp (generated)

000704210.b3lyp_6-31g(d).nwchem.inp (generated) 000704210.b3lyp_6-31g(d).log.xz 000704210.td-b3lyp_6-31g+(d).inp 000704210.td-b3lyp_6-31g+(d).log.xz

000704210.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704210.td-b3lyp_6-31+g(d).gjf (generated)

000704210.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704210.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704210.mol 000704210.PUBCHEM 000704210.mol (via Jmol)
000704214.b3lyp_6-31g(d).inp

000704214.b3lyp_6-31g(d).qchem.inp (generated)

000704214.b3lyp_6-31g(d).gjf (generated)

000704214.b3lyp_6-31g(d).firefly.inp (generated)

000704214.b3lyp_6-31g(d).smash.inp (generated)

000704214.b3lyp_6-31g(d).nwchem.inp (generated) 000704214.b3lyp_6-31g(d).log.xz 000704214.td-b3lyp_6-31g+(d).inp 000704214.td-b3lyp_6-31g+(d).log.xz

000704214.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704214.td-b3lyp_6-31+g(d).gjf (generated)

000704214.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704214.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704214.mol 000704214.PUBCHEM 000704214.mol (via Jmol)
000704218.b3lyp_6-31g(d).inp

000704218.b3lyp_6-31g(d).qchem.inp (generated)

000704218.b3lyp_6-31g(d).gjf (generated)

000704218.b3lyp_6-31g(d).firefly.inp (generated)

000704218.b3lyp_6-31g(d).smash.inp (generated)

000704218.b3lyp_6-31g(d).nwchem.inp (generated) 000704218.b3lyp_6-31g(d).log.xz 000704218.td-b3lyp_6-31g+(d).inp 000704218.td-b3lyp_6-31g+(d).log.xz

000704218.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704218.td-b3lyp_6-31+g(d).gjf (generated)

000704218.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704218.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704218.mol 000704218.PUBCHEM 000704218.mol (via Jmol)
000704227.b3lyp_6-31g(d).inp

000704227.b3lyp_6-31g(d).qchem.inp (generated)

000704227.b3lyp_6-31g(d).gjf (generated)

000704227.b3lyp_6-31g(d).firefly.inp (generated)

000704227.b3lyp_6-31g(d).smash.inp (generated)

000704227.b3lyp_6-31g(d).nwchem.inp (generated) 000704227.b3lyp_6-31g(d).log.xz 000704227.td-b3lyp_6-31g+(d).inp 000704227.td-b3lyp_6-31g+(d).log.xz

000704227.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704227.td-b3lyp_6-31+g(d).gjf (generated)

000704227.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704227.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704227.mol 000704227.PUBCHEM 000704227.mol (via Jmol)
000704265.b3lyp_6-31g(d).inp

000704265.b3lyp_6-31g(d).qchem.inp (generated)

000704265.b3lyp_6-31g(d).gjf (generated)

000704265.b3lyp_6-31g(d).firefly.inp (generated)

000704265.b3lyp_6-31g(d).smash.inp (generated)

000704265.b3lyp_6-31g(d).nwchem.inp (generated) 000704265.b3lyp_6-31g(d).log.xz 000704265.td-b3lyp_6-31g+(d).inp 000704265.td-b3lyp_6-31g+(d).log.xz

000704265.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704265.td-b3lyp_6-31+g(d).gjf (generated)

000704265.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704265.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704265.mol 000704265.PUBCHEM 000704265.mol (via Jmol)
000704317.b3lyp_6-31g(d).inp

000704317.b3lyp_6-31g(d).qchem.inp (generated)

000704317.b3lyp_6-31g(d).gjf (generated)

000704317.b3lyp_6-31g(d).firefly.inp (generated)

000704317.b3lyp_6-31g(d).smash.inp (generated)

000704317.b3lyp_6-31g(d).nwchem.inp (generated) 000704317.b3lyp_6-31g(d).log.xz 000704317.td-b3lyp_6-31g+(d).inp 000704317.td-b3lyp_6-31g+(d).log.xz

000704317.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704317.td-b3lyp_6-31+g(d).gjf (generated)

000704317.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704317.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704317.mol 000704317.PUBCHEM 000704317.mol (via Jmol)
000704349.b3lyp_6-31g(d).inp

000704349.b3lyp_6-31g(d).qchem.inp (generated)

000704349.b3lyp_6-31g(d).gjf (generated)

000704349.b3lyp_6-31g(d).firefly.inp (generated)

000704349.b3lyp_6-31g(d).smash.inp (generated)

000704349.b3lyp_6-31g(d).nwchem.inp (generated) 000704349.b3lyp_6-31g(d).log.xz 000704349.td-b3lyp_6-31g+(d).inp 000704349.td-b3lyp_6-31g+(d).log.xz

000704349.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704349.td-b3lyp_6-31+g(d).gjf (generated)

000704349.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704349.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704349.mol 000704349.PUBCHEM 000704349.mol (via Jmol)
000704352.b3lyp_6-31g(d).inp

000704352.b3lyp_6-31g(d).qchem.inp (generated)

000704352.b3lyp_6-31g(d).gjf (generated)

000704352.b3lyp_6-31g(d).firefly.inp (generated)

000704352.b3lyp_6-31g(d).smash.inp (generated)

000704352.b3lyp_6-31g(d).nwchem.inp (generated) 000704352.b3lyp_6-31g(d).log.xz 000704352.td-b3lyp_6-31g+(d).inp 000704352.td-b3lyp_6-31g+(d).log.xz

000704352.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704352.td-b3lyp_6-31+g(d).gjf (generated)

000704352.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704352.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704352.mol 000704352.PUBCHEM 000704352.mol (via Jmol)
000704370.b3lyp_6-31g(d).inp

000704370.b3lyp_6-31g(d).qchem.inp (generated)

000704370.b3lyp_6-31g(d).gjf (generated)

000704370.b3lyp_6-31g(d).firefly.inp (generated)

000704370.b3lyp_6-31g(d).smash.inp (generated)

000704370.b3lyp_6-31g(d).nwchem.inp (generated) 000704370.b3lyp_6-31g(d).log.xz 000704370.td-b3lyp_6-31g+(d).inp 000704370.td-b3lyp_6-31g+(d).log.xz

000704370.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704370.td-b3lyp_6-31+g(d).gjf (generated)

000704370.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704370.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704370.mol 000704370.PUBCHEM 000704370.mol (via Jmol)
000704372.b3lyp_6-31g(d).inp

000704372.b3lyp_6-31g(d).qchem.inp (generated)

000704372.b3lyp_6-31g(d).gjf (generated)

000704372.b3lyp_6-31g(d).firefly.inp (generated)

000704372.b3lyp_6-31g(d).smash.inp (generated)

000704372.b3lyp_6-31g(d).nwchem.inp (generated) 000704372.b3lyp_6-31g(d).log.xz 000704372.mol 000704372.PUBCHEM 000704372.mol (via Jmol)
000704373.b3lyp_6-31g(d).inp

000704373.b3lyp_6-31g(d).qchem.inp (generated)

000704373.b3lyp_6-31g(d).gjf (generated)

000704373.b3lyp_6-31g(d).firefly.inp (generated)

000704373.b3lyp_6-31g(d).smash.inp (generated)

000704373.b3lyp_6-31g(d).nwchem.inp (generated) 000704373.b3lyp_6-31g(d).log.xz 000704373.mol 000704373.PUBCHEM 000704373.mol (via Jmol)
000704480.b3lyp_6-31g(d).inp

000704480.b3lyp_6-31g(d).qchem.inp (generated)

000704480.b3lyp_6-31g(d).gjf (generated)

000704480.b3lyp_6-31g(d).firefly.inp (generated)

000704480.b3lyp_6-31g(d).smash.inp (generated)

000704480.b3lyp_6-31g(d).nwchem.inp (generated) 000704480.b3lyp_6-31g(d).log.xz 000704480.td-b3lyp_6-31g+(d).inp 000704480.td-b3lyp_6-31g+(d).log.xz

000704480.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704480.td-b3lyp_6-31+g(d).gjf (generated)

000704480.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704480.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704480.mol 000704480.PUBCHEM 000704480.mol (via Jmol)
000704486.b3lyp_6-31g(d).inp

000704486.b3lyp_6-31g(d).qchem.inp (generated)

000704486.b3lyp_6-31g(d).gjf (generated)

000704486.b3lyp_6-31g(d).firefly.inp (generated)

000704486.b3lyp_6-31g(d).smash.inp (generated)

000704486.b3lyp_6-31g(d).nwchem.inp (generated) 000704486.b3lyp_6-31g(d).log.xz 000704486.td-b3lyp_6-31g+(d).inp 000704486.td-b3lyp_6-31g+(d).log.xz

000704486.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704486.td-b3lyp_6-31+g(d).gjf (generated)

000704486.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704486.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704486.mol 000704486.PUBCHEM 000704486.mol (via Jmol)
000704489.b3lyp_6-31g(d).inp

000704489.b3lyp_6-31g(d).qchem.inp (generated)

000704489.b3lyp_6-31g(d).gjf (generated)

000704489.b3lyp_6-31g(d).firefly.inp (generated)

000704489.b3lyp_6-31g(d).smash.inp (generated)

000704489.b3lyp_6-31g(d).nwchem.inp (generated) 000704489.b3lyp_6-31g(d).log.xz 000704489.td-b3lyp_6-31g+(d).inp 000704489.td-b3lyp_6-31g+(d).log.xz

000704489.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704489.td-b3lyp_6-31+g(d).gjf (generated)

000704489.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704489.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704489.mol 000704489.PUBCHEM 000704489.mol (via Jmol)
000704492.b3lyp_6-31g(d).inp

000704492.b3lyp_6-31g(d).qchem.inp (generated)

000704492.b3lyp_6-31g(d).gjf (generated)

000704492.b3lyp_6-31g(d).firefly.inp (generated)

000704492.b3lyp_6-31g(d).smash.inp (generated)

000704492.b3lyp_6-31g(d).nwchem.inp (generated) 000704492.b3lyp_6-31g(d).log.xz 000704492.mol 000704492.PUBCHEM 000704492.mol (via Jmol)
000704498.b3lyp_6-31g(d).inp

000704498.b3lyp_6-31g(d).qchem.inp (generated)

000704498.b3lyp_6-31g(d).gjf (generated)

000704498.b3lyp_6-31g(d).firefly.inp (generated)

000704498.b3lyp_6-31g(d).smash.inp (generated)

000704498.b3lyp_6-31g(d).nwchem.inp (generated) 000704498.b3lyp_6-31g(d).log.xz 000704498.td-b3lyp_6-31g+(d).inp 000704498.td-b3lyp_6-31g+(d).log.xz

000704498.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704498.td-b3lyp_6-31+g(d).gjf (generated)

000704498.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704498.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704498.mol 000704498.PUBCHEM 000704498.mol (via Jmol)
000704501.b3lyp_6-31g(d).inp

000704501.b3lyp_6-31g(d).qchem.inp (generated)

000704501.b3lyp_6-31g(d).gjf (generated)

000704501.b3lyp_6-31g(d).firefly.inp (generated)

000704501.b3lyp_6-31g(d).smash.inp (generated)

000704501.b3lyp_6-31g(d).nwchem.inp (generated) 000704501.b3lyp_6-31g(d).log.xz 000704501.td-b3lyp_6-31g+(d).inp 000704501.td-b3lyp_6-31g+(d).log.xz

000704501.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704501.td-b3lyp_6-31+g(d).gjf (generated)

000704501.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704501.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704501.mol 000704501.PUBCHEM 000704501.mol (via Jmol)
000704509.b3lyp_6-31g(d).inp

000704509.b3lyp_6-31g(d).qchem.inp (generated)

000704509.b3lyp_6-31g(d).gjf (generated)

000704509.b3lyp_6-31g(d).firefly.inp (generated)

000704509.b3lyp_6-31g(d).smash.inp (generated)

000704509.b3lyp_6-31g(d).nwchem.inp (generated) 000704509.b3lyp_6-31g(d).log.xz 000704509.mol 000704509.PUBCHEM 000704509.mol (via Jmol)
000704516.b3lyp_6-31g(d).inp

000704516.b3lyp_6-31g(d).qchem.inp (generated)

000704516.b3lyp_6-31g(d).gjf (generated)

000704516.b3lyp_6-31g(d).firefly.inp (generated)

000704516.b3lyp_6-31g(d).smash.inp (generated)

000704516.b3lyp_6-31g(d).nwchem.inp (generated) 000704516.b3lyp_6-31g(d).log.xz 000704516.td-b3lyp_6-31g+(d).inp 000704516.td-b3lyp_6-31g+(d).log.xz

000704516.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704516.td-b3lyp_6-31+g(d).gjf (generated)

000704516.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704516.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704516.mol 000704516.PUBCHEM 000704516.mol (via Jmol)
000704530.b3lyp_6-31g(d).inp

000704530.b3lyp_6-31g(d).qchem.inp (generated)

000704530.b3lyp_6-31g(d).gjf (generated)

000704530.b3lyp_6-31g(d).firefly.inp (generated)

000704530.b3lyp_6-31g(d).smash.inp (generated)

000704530.b3lyp_6-31g(d).nwchem.inp (generated) 000704530.b3lyp_6-31g(d).log.xz 000704530.mol 000704530.PUBCHEM 000704530.mol (via Jmol)
000704534.b3lyp_6-31g(d).inp

000704534.b3lyp_6-31g(d).qchem.inp (generated)

000704534.b3lyp_6-31g(d).gjf (generated)

000704534.b3lyp_6-31g(d).firefly.inp (generated)

000704534.b3lyp_6-31g(d).smash.inp (generated)

000704534.b3lyp_6-31g(d).nwchem.inp (generated) 000704534.b3lyp_6-31g(d).log.xz 000704534.mol 000704534.PUBCHEM 000704534.mol (via Jmol)
000704538.b3lyp_6-31g(d).inp

000704538.b3lyp_6-31g(d).qchem.inp (generated)

000704538.b3lyp_6-31g(d).gjf (generated)

000704538.b3lyp_6-31g(d).firefly.inp (generated)

000704538.b3lyp_6-31g(d).smash.inp (generated)

000704538.b3lyp_6-31g(d).nwchem.inp (generated) 000704538.b3lyp_6-31g(d).log.xz 000704538.mol 000704538.PUBCHEM 000704538.mol (via Jmol)
000704539.b3lyp_6-31g(d).inp

000704539.b3lyp_6-31g(d).qchem.inp (generated)

000704539.b3lyp_6-31g(d).gjf (generated)

000704539.b3lyp_6-31g(d).firefly.inp (generated)

000704539.b3lyp_6-31g(d).smash.inp (generated)

000704539.b3lyp_6-31g(d).nwchem.inp (generated) 000704539.b3lyp_6-31g(d).log.xz 000704539.td-b3lyp_6-31g+(d).inp 000704539.td-b3lyp_6-31g+(d).log.xz

000704539.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704539.td-b3lyp_6-31+g(d).gjf (generated)

000704539.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704539.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704539.mol 000704539.PUBCHEM 000704539.mol (via Jmol)
000704540.b3lyp_6-31g(d).inp

000704540.b3lyp_6-31g(d).qchem.inp (generated)

000704540.b3lyp_6-31g(d).gjf (generated)

000704540.b3lyp_6-31g(d).firefly.inp (generated)

000704540.b3lyp_6-31g(d).smash.inp (generated)

000704540.b3lyp_6-31g(d).nwchem.inp (generated) 000704540.b3lyp_6-31g(d).log.xz 000704540.td-b3lyp_6-31g+(d).inp 000704540.td-b3lyp_6-31g+(d).log.xz

000704540.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704540.td-b3lyp_6-31+g(d).gjf (generated)

000704540.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704540.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704540.mol 000704540.PUBCHEM 000704540.mol (via Jmol)
000704557.b3lyp_6-31g(d).inp

000704557.b3lyp_6-31g(d).qchem.inp (generated)

000704557.b3lyp_6-31g(d).gjf (generated)

000704557.b3lyp_6-31g(d).firefly.inp (generated)

000704557.b3lyp_6-31g(d).smash.inp (generated)

000704557.b3lyp_6-31g(d).nwchem.inp (generated) 000704557.b3lyp_6-31g(d).log.xz 000704557.td-b3lyp_6-31g+(d).inp 000704557.td-b3lyp_6-31g+(d).log.xz

000704557.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704557.td-b3lyp_6-31+g(d).gjf (generated)

000704557.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704557.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704557.mol 000704557.PUBCHEM 000704557.mol (via Jmol)
000704562.b3lyp_6-31g(d).inp

000704562.b3lyp_6-31g(d).qchem.inp (generated)

000704562.b3lyp_6-31g(d).gjf (generated)

000704562.b3lyp_6-31g(d).firefly.inp (generated)

000704562.b3lyp_6-31g(d).smash.inp (generated)

000704562.b3lyp_6-31g(d).nwchem.inp (generated) 000704562.b3lyp_6-31g(d).log.xz 000704562.td-b3lyp_6-31g+(d).inp 000704562.td-b3lyp_6-31g+(d).log.xz

000704562.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704562.td-b3lyp_6-31+g(d).gjf (generated)

000704562.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704562.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704562.mol 000704562.PUBCHEM 000704562.mol (via Jmol)
000704563.b3lyp_6-31g(d).inp

000704563.b3lyp_6-31g(d).qchem.inp (generated)

000704563.b3lyp_6-31g(d).gjf (generated)

000704563.b3lyp_6-31g(d).firefly.inp (generated)

000704563.b3lyp_6-31g(d).smash.inp (generated)

000704563.b3lyp_6-31g(d).nwchem.inp (generated) 000704563.b3lyp_6-31g(d).log.xz 000704563.td-b3lyp_6-31g+(d).inp 000704563.td-b3lyp_6-31g+(d).log.xz

000704563.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704563.td-b3lyp_6-31+g(d).gjf (generated)

000704563.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704563.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704563.mol 000704563.PUBCHEM 000704563.mol (via Jmol)
000704581.b3lyp_6-31g(d).inp

000704581.b3lyp_6-31g(d).qchem.inp (generated)

000704581.b3lyp_6-31g(d).gjf (generated)

000704581.b3lyp_6-31g(d).firefly.inp (generated)

000704581.b3lyp_6-31g(d).smash.inp (generated)

000704581.b3lyp_6-31g(d).nwchem.inp (generated) 000704581.b3lyp_6-31g(d).log.xz 000704581.mol 000704581.PUBCHEM 000704581.mol (via Jmol)
000704583.b3lyp_6-31g(d).inp

000704583.b3lyp_6-31g(d).qchem.inp (generated)

000704583.b3lyp_6-31g(d).gjf (generated)

000704583.b3lyp_6-31g(d).firefly.inp (generated)

000704583.b3lyp_6-31g(d).smash.inp (generated)

000704583.b3lyp_6-31g(d).nwchem.inp (generated) 000704583.b3lyp_6-31g(d).log.xz 000704583.td-b3lyp_6-31g+(d).inp 000704583.td-b3lyp_6-31g+(d).log.xz

000704583.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704583.td-b3lyp_6-31+g(d).gjf (generated)

000704583.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704583.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704583.mol 000704583.PUBCHEM 000704583.mol (via Jmol)
000704593.b3lyp_6-31g(d).inp

000704593.b3lyp_6-31g(d).qchem.inp (generated)

000704593.b3lyp_6-31g(d).gjf (generated)

000704593.b3lyp_6-31g(d).firefly.inp (generated)

000704593.b3lyp_6-31g(d).smash.inp (generated)

000704593.b3lyp_6-31g(d).nwchem.inp (generated) 000704593.b3lyp_6-31g(d).log.xz 000704593.td-b3lyp_6-31g+(d).inp 000704593.td-b3lyp_6-31g+(d).log.xz

000704593.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704593.td-b3lyp_6-31+g(d).gjf (generated)

000704593.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704593.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704593.mol 000704593.PUBCHEM 000704593.mol (via Jmol)
000704639.b3lyp_6-31g(d).inp

000704639.b3lyp_6-31g(d).qchem.inp (generated)

000704639.b3lyp_6-31g(d).gjf (generated)

000704639.b3lyp_6-31g(d).firefly.inp (generated)

000704639.b3lyp_6-31g(d).smash.inp (generated)

000704639.b3lyp_6-31g(d).nwchem.inp (generated) 000704639.b3lyp_6-31g(d).log.xz 000704639.td-b3lyp_6-31g+(d).inp 000704639.td-b3lyp_6-31g+(d).log.xz

000704639.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704639.td-b3lyp_6-31+g(d).gjf (generated)

000704639.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704639.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704639.mol 000704639.PUBCHEM 000704639.mol (via Jmol)
000704642.b3lyp_6-31g(d).inp

000704642.b3lyp_6-31g(d).qchem.inp (generated)

000704642.b3lyp_6-31g(d).gjf (generated)

000704642.b3lyp_6-31g(d).firefly.inp (generated)

000704642.b3lyp_6-31g(d).smash.inp (generated)

000704642.b3lyp_6-31g(d).nwchem.inp (generated) 000704642.b3lyp_6-31g(d).log.xz 000704642.td-b3lyp_6-31g+(d).inp 000704642.td-b3lyp_6-31g+(d).log.xz

000704642.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704642.td-b3lyp_6-31+g(d).gjf (generated)

000704642.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704642.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704642.mol 000704642.PUBCHEM 000704642.mol (via Jmol)
000704671.b3lyp_6-31g(d).inp

000704671.b3lyp_6-31g(d).qchem.inp (generated)

000704671.b3lyp_6-31g(d).gjf (generated)

000704671.b3lyp_6-31g(d).firefly.inp (generated)

000704671.b3lyp_6-31g(d).smash.inp (generated)

000704671.b3lyp_6-31g(d).nwchem.inp (generated) 000704671.b3lyp_6-31g(d).log.xz 000704671.td-b3lyp_6-31g+(d).inp 000704671.td-b3lyp_6-31g+(d).log.xz

000704671.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704671.td-b3lyp_6-31+g(d).gjf (generated)

000704671.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704671.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704671.mol 000704671.PUBCHEM 000704671.mol (via Jmol)
000704698.b3lyp_6-31g(d).inp

000704698.b3lyp_6-31g(d).qchem.inp (generated)

000704698.b3lyp_6-31g(d).gjf (generated)

000704698.b3lyp_6-31g(d).firefly.inp (generated)

000704698.b3lyp_6-31g(d).smash.inp (generated)

000704698.b3lyp_6-31g(d).nwchem.inp (generated) 000704698.b3lyp_6-31g(d).log.xz 000704698.td-b3lyp_6-31g+(d).inp 000704698.td-b3lyp_6-31g+(d).log.xz

000704698.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704698.td-b3lyp_6-31+g(d).gjf (generated)

000704698.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704698.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704698.mol 000704698.PUBCHEM 000704698.mol (via Jmol)
000704701.b3lyp_6-31g(d).inp

000704701.b3lyp_6-31g(d).qchem.inp (generated)

000704701.b3lyp_6-31g(d).gjf (generated)

000704701.b3lyp_6-31g(d).firefly.inp (generated)

000704701.b3lyp_6-31g(d).smash.inp (generated)

000704701.b3lyp_6-31g(d).nwchem.inp (generated) 000704701.b3lyp_6-31g(d).log.xz 000704701.mol 000704701.PUBCHEM 000704701.mol (via Jmol)
000704702.b3lyp_6-31g(d).inp

000704702.b3lyp_6-31g(d).qchem.inp (generated)

000704702.b3lyp_6-31g(d).gjf (generated)

000704702.b3lyp_6-31g(d).firefly.inp (generated)

000704702.b3lyp_6-31g(d).smash.inp (generated)

000704702.b3lyp_6-31g(d).nwchem.inp (generated) 000704702.b3lyp_6-31g(d).log.xz 000704702.mol 000704702.PUBCHEM 000704702.mol (via Jmol)
000704704.b3lyp_6-31g(d).inp

000704704.b3lyp_6-31g(d).qchem.inp (generated)

000704704.b3lyp_6-31g(d).gjf (generated)

000704704.b3lyp_6-31g(d).firefly.inp (generated)

000704704.b3lyp_6-31g(d).smash.inp (generated)

000704704.b3lyp_6-31g(d).nwchem.inp (generated) 000704704.b3lyp_6-31g(d).log.xz 000704704.mol 000704704.PUBCHEM 000704704.mol (via Jmol)
000704705.b3lyp_6-31g(d).inp

000704705.b3lyp_6-31g(d).qchem.inp (generated)

000704705.b3lyp_6-31g(d).gjf (generated)

000704705.b3lyp_6-31g(d).firefly.inp (generated)

000704705.b3lyp_6-31g(d).smash.inp (generated)

000704705.b3lyp_6-31g(d).nwchem.inp (generated) 000704705.b3lyp_6-31g(d).log.xz 000704705.mol 000704705.PUBCHEM 000704705.mol (via Jmol)
000704798.b3lyp_6-31g(d).inp

000704798.b3lyp_6-31g(d).qchem.inp (generated)

000704798.b3lyp_6-31g(d).gjf (generated)

000704798.b3lyp_6-31g(d).firefly.inp (generated)

000704798.b3lyp_6-31g(d).smash.inp (generated)

000704798.b3lyp_6-31g(d).nwchem.inp (generated) 000704798.b3lyp_6-31g(d).log.xz 000704798.mol 000704798.PUBCHEM 000704798.mol (via Jmol)
000704803.b3lyp_6-31g(d).inp

000704803.b3lyp_6-31g(d).qchem.inp (generated)

000704803.b3lyp_6-31g(d).gjf (generated)

000704803.b3lyp_6-31g(d).firefly.inp (generated)

000704803.b3lyp_6-31g(d).smash.inp (generated)

000704803.b3lyp_6-31g(d).nwchem.inp (generated) 000704803.b3lyp_6-31g(d).log.xz 000704803.mol 000704803.PUBCHEM 000704803.mol (via Jmol)
000704807.b3lyp_6-31g(d).inp

000704807.b3lyp_6-31g(d).qchem.inp (generated)

000704807.b3lyp_6-31g(d).gjf (generated)

000704807.b3lyp_6-31g(d).firefly.inp (generated)

000704807.b3lyp_6-31g(d).smash.inp (generated)

000704807.b3lyp_6-31g(d).nwchem.inp (generated) 000704807.b3lyp_6-31g(d).log.xz 000704807.td-b3lyp_6-31g+(d).inp 000704807.td-b3lyp_6-31g+(d).log.xz

000704807.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704807.td-b3lyp_6-31+g(d).gjf (generated)

000704807.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704807.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704807.mol 000704807.PUBCHEM 000704807.mol (via Jmol)
000704811.b3lyp_6-31g(d).inp

000704811.b3lyp_6-31g(d).qchem.inp (generated)

000704811.b3lyp_6-31g(d).gjf (generated)

000704811.b3lyp_6-31g(d).firefly.inp (generated)

000704811.b3lyp_6-31g(d).smash.inp (generated)

000704811.b3lyp_6-31g(d).nwchem.inp (generated) 000704811.b3lyp_6-31g(d).log.xz 000704811.td-b3lyp_6-31g+(d).inp 000704811.td-b3lyp_6-31g+(d).log.xz

000704811.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704811.td-b3lyp_6-31+g(d).gjf (generated)

000704811.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704811.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704811.mol 000704811.PUBCHEM 000704811.mol (via Jmol)
000704826.b3lyp_6-31g(d).inp

000704826.b3lyp_6-31g(d).qchem.inp (generated)

000704826.b3lyp_6-31g(d).gjf (generated)

000704826.b3lyp_6-31g(d).firefly.inp (generated)

000704826.b3lyp_6-31g(d).smash.inp (generated)

000704826.b3lyp_6-31g(d).nwchem.inp (generated) 000704826.b3lyp_6-31g(d).log.xz 000704826.mol 000704826.PUBCHEM 000704826.mol (via Jmol)
000704838.b3lyp_6-31g(d).inp

000704838.b3lyp_6-31g(d).qchem.inp (generated)

000704838.b3lyp_6-31g(d).gjf (generated)

000704838.b3lyp_6-31g(d).firefly.inp (generated)

000704838.b3lyp_6-31g(d).smash.inp (generated)

000704838.b3lyp_6-31g(d).nwchem.inp (generated) 000704838.b3lyp_6-31g(d).log.xz 000704838.td-b3lyp_6-31g+(d).inp 000704838.td-b3lyp_6-31g+(d).log.xz

000704838.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704838.td-b3lyp_6-31+g(d).gjf (generated)

000704838.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704838.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704838.mol 000704838.PUBCHEM 000704838.mol (via Jmol)
000704888.b3lyp_6-31g(d).inp

000704888.b3lyp_6-31g(d).qchem.inp (generated)

000704888.b3lyp_6-31g(d).gjf (generated)

000704888.b3lyp_6-31g(d).firefly.inp (generated)

000704888.b3lyp_6-31g(d).smash.inp (generated)

000704888.b3lyp_6-31g(d).nwchem.inp (generated) 000704888.b3lyp_6-31g(d).log.xz 000704888.td-b3lyp_6-31g+(d).inp 000704888.td-b3lyp_6-31g+(d).log.xz

000704888.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704888.td-b3lyp_6-31+g(d).gjf (generated)

000704888.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704888.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704888.mol 000704888.PUBCHEM 000704888.mol (via Jmol)
000704892.b3lyp_6-31g(d).inp

000704892.b3lyp_6-31g(d).qchem.inp (generated)

000704892.b3lyp_6-31g(d).gjf (generated)

000704892.b3lyp_6-31g(d).firefly.inp (generated)

000704892.b3lyp_6-31g(d).smash.inp (generated)

000704892.b3lyp_6-31g(d).nwchem.inp (generated) 000704892.b3lyp_6-31g(d).log.xz 000704892.mol 000704892.PUBCHEM 000704892.mol (via Jmol)
000704896.b3lyp_6-31g(d).inp

000704896.b3lyp_6-31g(d).qchem.inp (generated)

000704896.b3lyp_6-31g(d).gjf (generated)

000704896.b3lyp_6-31g(d).firefly.inp (generated)

000704896.b3lyp_6-31g(d).smash.inp (generated)

000704896.b3lyp_6-31g(d).nwchem.inp (generated) 000704896.b3lyp_6-31g(d).log.xz 000704896.td-b3lyp_6-31g+(d).inp 000704896.td-b3lyp_6-31g+(d).log.xz

000704896.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704896.td-b3lyp_6-31+g(d).gjf (generated)

000704896.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704896.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704896.mol 000704896.PUBCHEM 000704896.mol (via Jmol)
000704910.b3lyp_6-31g(d).inp

000704910.b3lyp_6-31g(d).qchem.inp (generated)

000704910.b3lyp_6-31g(d).gjf (generated)

000704910.b3lyp_6-31g(d).firefly.inp (generated)

000704910.b3lyp_6-31g(d).smash.inp (generated)

000704910.b3lyp_6-31g(d).nwchem.inp (generated) 000704910.b3lyp_6-31g(d).log.xz 000704910.td-b3lyp_6-31g+(d).inp 000704910.td-b3lyp_6-31g+(d).log.xz

000704910.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704910.td-b3lyp_6-31+g(d).gjf (generated)

000704910.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704910.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704910.mol 000704910.PUBCHEM 000704910.mol (via Jmol)
000704922.b3lyp_6-31g(d).inp

000704922.b3lyp_6-31g(d).qchem.inp (generated)

000704922.b3lyp_6-31g(d).gjf (generated)

000704922.b3lyp_6-31g(d).firefly.inp (generated)

000704922.b3lyp_6-31g(d).smash.inp (generated)

000704922.b3lyp_6-31g(d).nwchem.inp (generated) 000704922.b3lyp_6-31g(d).log.xz 000704922.td-b3lyp_6-31g+(d).inp 000704922.td-b3lyp_6-31g+(d).log.xz

000704922.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704922.td-b3lyp_6-31+g(d).gjf (generated)

000704922.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704922.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704922.mol 000704922.PUBCHEM 000704922.mol (via Jmol)
000704937.b3lyp_6-31g(d).inp

000704937.b3lyp_6-31g(d).qchem.inp (generated)

000704937.b3lyp_6-31g(d).gjf (generated)

000704937.b3lyp_6-31g(d).firefly.inp (generated)

000704937.b3lyp_6-31g(d).smash.inp (generated)

000704937.b3lyp_6-31g(d).nwchem.inp (generated) 000704937.b3lyp_6-31g(d).log.xz 000704937.td-b3lyp_6-31g+(d).inp 000704937.td-b3lyp_6-31g+(d).log.xz

000704937.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704937.td-b3lyp_6-31+g(d).gjf (generated)

000704937.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704937.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704937.mol 000704937.PUBCHEM 000704937.mol (via Jmol)
000704940.b3lyp_6-31g(d).inp

000704940.b3lyp_6-31g(d).qchem.inp (generated)

000704940.b3lyp_6-31g(d).gjf (generated)

000704940.b3lyp_6-31g(d).firefly.inp (generated)

000704940.b3lyp_6-31g(d).smash.inp (generated)

000704940.b3lyp_6-31g(d).nwchem.inp (generated) 000704940.b3lyp_6-31g(d).log.xz 000704940.td-b3lyp_6-31g+(d).inp 000704940.td-b3lyp_6-31g+(d).log.xz

000704940.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704940.td-b3lyp_6-31+g(d).gjf (generated)

000704940.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704940.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704940.mol 000704940.PUBCHEM 000704940.mol (via Jmol)
000704942.b3lyp_6-31g(d).inp

000704942.b3lyp_6-31g(d).qchem.inp (generated)

000704942.b3lyp_6-31g(d).gjf (generated)

000704942.b3lyp_6-31g(d).firefly.inp (generated)

000704942.b3lyp_6-31g(d).smash.inp (generated)

000704942.b3lyp_6-31g(d).nwchem.inp (generated) 000704942.b3lyp_6-31g(d).log.xz 000704942.td-b3lyp_6-31g+(d).inp 000704942.td-b3lyp_6-31g+(d).log.xz

000704942.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704942.td-b3lyp_6-31+g(d).gjf (generated)

000704942.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704942.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704942.mol 000704942.PUBCHEM 000704942.mol (via Jmol)
000704954.b3lyp_6-31g(d).inp

000704954.b3lyp_6-31g(d).qchem.inp (generated)

000704954.b3lyp_6-31g(d).gjf (generated)

000704954.b3lyp_6-31g(d).firefly.inp (generated)

000704954.b3lyp_6-31g(d).smash.inp (generated)

000704954.b3lyp_6-31g(d).nwchem.inp (generated) 000704954.b3lyp_6-31g(d).log.xz 000704954.mol 000704954.PUBCHEM 000704954.mol (via Jmol)
000704964.b3lyp_6-31g(d).inp

000704964.b3lyp_6-31g(d).qchem.inp (generated)

000704964.b3lyp_6-31g(d).gjf (generated)

000704964.b3lyp_6-31g(d).firefly.inp (generated)

000704964.b3lyp_6-31g(d).smash.inp (generated)

000704964.b3lyp_6-31g(d).nwchem.inp (generated) 000704964.b3lyp_6-31g(d).log.xz 000704964.td-b3lyp_6-31g+(d).inp 000704964.td-b3lyp_6-31g+(d).log.xz

000704964.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704964.td-b3lyp_6-31+g(d).gjf (generated)

000704964.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704964.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704964.mol 000704964.PUBCHEM 000704964.mol (via Jmol)
000704967.b3lyp_6-31g(d).inp

000704967.b3lyp_6-31g(d).qchem.inp (generated)

000704967.b3lyp_6-31g(d).gjf (generated)

000704967.b3lyp_6-31g(d).firefly.inp (generated)

000704967.b3lyp_6-31g(d).smash.inp (generated)

000704967.b3lyp_6-31g(d).nwchem.inp (generated) 000704967.b3lyp_6-31g(d).log.xz 000704967.td-b3lyp_6-31g+(d).inp 000704967.td-b3lyp_6-31g+(d).log.xz

000704967.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704967.td-b3lyp_6-31+g(d).gjf (generated)

000704967.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704967.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704967.mol 000704967.PUBCHEM 000704967.mol (via Jmol)
000704991.b3lyp_6-31g(d).inp

000704991.b3lyp_6-31g(d).qchem.inp (generated)

000704991.b3lyp_6-31g(d).gjf (generated)

000704991.b3lyp_6-31g(d).firefly.inp (generated)

000704991.b3lyp_6-31g(d).smash.inp (generated)

000704991.b3lyp_6-31g(d).nwchem.inp (generated) 000704991.b3lyp_6-31g(d).log.xz 000704991.td-b3lyp_6-31g+(d).inp 000704991.td-b3lyp_6-31g+(d).log.xz

000704991.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704991.td-b3lyp_6-31+g(d).gjf (generated)

000704991.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704991.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704991.mol 000704991.PUBCHEM 000704991.mol (via Jmol)
000704992.b3lyp_6-31g(d).inp

000704992.b3lyp_6-31g(d).qchem.inp (generated)

000704992.b3lyp_6-31g(d).gjf (generated)

000704992.b3lyp_6-31g(d).firefly.inp (generated)

000704992.b3lyp_6-31g(d).smash.inp (generated)

000704992.b3lyp_6-31g(d).nwchem.inp (generated) 000704992.b3lyp_6-31g(d).log.xz 000704992.td-b3lyp_6-31g+(d).inp 000704992.td-b3lyp_6-31g+(d).log.xz

000704992.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704992.td-b3lyp_6-31+g(d).gjf (generated)

000704992.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704992.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704992.mol 000704992.PUBCHEM 000704992.mol (via Jmol)
000704996.b3lyp_6-31g(d).inp

000704996.b3lyp_6-31g(d).qchem.inp (generated)

000704996.b3lyp_6-31g(d).gjf (generated)

000704996.b3lyp_6-31g(d).firefly.inp (generated)

000704996.b3lyp_6-31g(d).smash.inp (generated)

000704996.b3lyp_6-31g(d).nwchem.inp (generated) 000704996.b3lyp_6-31g(d).log.xz 000704996.td-b3lyp_6-31g+(d).inp 000704996.td-b3lyp_6-31g+(d).log.xz

000704996.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704996.td-b3lyp_6-31+g(d).gjf (generated)

000704996.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704996.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704996.mol 000704996.PUBCHEM 000704996.mol (via Jmol)
000704997.b3lyp_6-31g(d).inp

000704997.b3lyp_6-31g(d).qchem.inp (generated)

000704997.b3lyp_6-31g(d).gjf (generated)

000704997.b3lyp_6-31g(d).firefly.inp (generated)

000704997.b3lyp_6-31g(d).smash.inp (generated)

000704997.b3lyp_6-31g(d).nwchem.inp (generated) 000704997.b3lyp_6-31g(d).log.xz 000704997.td-b3lyp_6-31g+(d).inp 000704997.td-b3lyp_6-31g+(d).log.xz

000704997.td-b3lyp_6-31+g(d).qchem.inp (generated)

000704997.td-b3lyp_6-31+g(d).gjf (generated)

000704997.td-b3lyp_6-31+g(d).firefly.inp (generated)

000704997.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000704997.mol 000704997.PUBCHEM 000704997.mol (via Jmol)
000705020.b3lyp_6-31g(d).inp

000705020.b3lyp_6-31g(d).qchem.inp (generated)

000705020.b3lyp_6-31g(d).gjf (generated)

000705020.b3lyp_6-31g(d).firefly.inp (generated)

000705020.b3lyp_6-31g(d).smash.inp (generated)

000705020.b3lyp_6-31g(d).nwchem.inp (generated) 000705020.b3lyp_6-31g(d).log.xz 000705020.td-b3lyp_6-31g+(d).inp 000705020.td-b3lyp_6-31g+(d).log.xz

000705020.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705020.td-b3lyp_6-31+g(d).gjf (generated)

000705020.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705020.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705020.mol 000705020.PUBCHEM 000705020.mol (via Jmol)
000705022.b3lyp_6-31g(d).inp

000705022.b3lyp_6-31g(d).qchem.inp (generated)

000705022.b3lyp_6-31g(d).gjf (generated)

000705022.b3lyp_6-31g(d).firefly.inp (generated)

000705022.b3lyp_6-31g(d).smash.inp (generated)

000705022.b3lyp_6-31g(d).nwchem.inp (generated) 000705022.b3lyp_6-31g(d).log.xz 000705022.td-b3lyp_6-31g+(d).inp 000705022.td-b3lyp_6-31g+(d).log.xz

000705022.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705022.td-b3lyp_6-31+g(d).gjf (generated)

000705022.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705022.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705022.mol 000705022.PUBCHEM 000705022.mol (via Jmol)
000705039.b3lyp_6-31g(d).inp

000705039.b3lyp_6-31g(d).qchem.inp (generated)

000705039.b3lyp_6-31g(d).gjf (generated)

000705039.b3lyp_6-31g(d).firefly.inp (generated)

000705039.b3lyp_6-31g(d).smash.inp (generated)

000705039.b3lyp_6-31g(d).nwchem.inp (generated) 000705039.b3lyp_6-31g(d).log.xz 000705039.td-b3lyp_6-31g+(d).inp 000705039.td-b3lyp_6-31g+(d).log.xz

000705039.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705039.td-b3lyp_6-31+g(d).gjf (generated)

000705039.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705039.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705039.mol 000705039.PUBCHEM 000705039.mol (via Jmol)
000705047.b3lyp_6-31g(d).inp

000705047.b3lyp_6-31g(d).qchem.inp (generated)

000705047.b3lyp_6-31g(d).gjf (generated)

000705047.b3lyp_6-31g(d).firefly.inp (generated)

000705047.b3lyp_6-31g(d).smash.inp (generated)

000705047.b3lyp_6-31g(d).nwchem.inp (generated) 000705047.b3lyp_6-31g(d).log.xz 000705047.td-b3lyp_6-31g+(d).inp 000705047.td-b3lyp_6-31g+(d).log.xz

000705047.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705047.td-b3lyp_6-31+g(d).gjf (generated)

000705047.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705047.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705047.mol 000705047.PUBCHEM 000705047.mol (via Jmol)
000705051.b3lyp_6-31g(d).inp

000705051.b3lyp_6-31g(d).qchem.inp (generated)

000705051.b3lyp_6-31g(d).gjf (generated)

000705051.b3lyp_6-31g(d).firefly.inp (generated)

000705051.b3lyp_6-31g(d).smash.inp (generated)

000705051.b3lyp_6-31g(d).nwchem.inp (generated) 000705051.b3lyp_6-31g(d).log.xz 000705051.td-b3lyp_6-31g+(d).inp 000705051.td-b3lyp_6-31g+(d).log.xz

000705051.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705051.td-b3lyp_6-31+g(d).gjf (generated)

000705051.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705051.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705051.mol 000705051.PUBCHEM 000705051.mol (via Jmol)
000705071.b3lyp_6-31g(d).inp

000705071.b3lyp_6-31g(d).qchem.inp (generated)

000705071.b3lyp_6-31g(d).gjf (generated)

000705071.b3lyp_6-31g(d).firefly.inp (generated)

000705071.b3lyp_6-31g(d).smash.inp (generated)

000705071.b3lyp_6-31g(d).nwchem.inp (generated) 000705071.b3lyp_6-31g(d).log.xz 000705071.mol 000705071.PUBCHEM 000705071.mol (via Jmol)
000705072.b3lyp_6-31g(d).inp

000705072.b3lyp_6-31g(d).qchem.inp (generated)

000705072.b3lyp_6-31g(d).gjf (generated)

000705072.b3lyp_6-31g(d).firefly.inp (generated)

000705072.b3lyp_6-31g(d).smash.inp (generated)

000705072.b3lyp_6-31g(d).nwchem.inp (generated) 000705072.b3lyp_6-31g(d).log.xz 000705072.td-b3lyp_6-31g+(d).inp 000705072.td-b3lyp_6-31g+(d).log.xz

000705072.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705072.td-b3lyp_6-31+g(d).gjf (generated)

000705072.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705072.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705072.mol 000705072.PUBCHEM 000705072.mol (via Jmol)
000705094.b3lyp_6-31g(d).inp

000705094.b3lyp_6-31g(d).qchem.inp (generated)

000705094.b3lyp_6-31g(d).gjf (generated)

000705094.b3lyp_6-31g(d).firefly.inp (generated)

000705094.b3lyp_6-31g(d).smash.inp (generated)

000705094.b3lyp_6-31g(d).nwchem.inp (generated) 000705094.b3lyp_6-31g(d).log.xz 000705094.mol 000705094.PUBCHEM 000705094.mol (via Jmol)
000705105.b3lyp_6-31g(d).inp

000705105.b3lyp_6-31g(d).qchem.inp (generated)

000705105.b3lyp_6-31g(d).gjf (generated)

000705105.b3lyp_6-31g(d).firefly.inp (generated)

000705105.b3lyp_6-31g(d).smash.inp (generated)

000705105.b3lyp_6-31g(d).nwchem.inp (generated) 000705105.b3lyp_6-31g(d).log.xz 000705105.td-b3lyp_6-31g+(d).inp 000705105.td-b3lyp_6-31g+(d).log.xz

000705105.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705105.td-b3lyp_6-31+g(d).gjf (generated)

000705105.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705105.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705105.mol 000705105.PUBCHEM 000705105.mol (via Jmol)
000705112.b3lyp_6-31g(d).inp

000705112.b3lyp_6-31g(d).qchem.inp (generated)

000705112.b3lyp_6-31g(d).gjf (generated)

000705112.b3lyp_6-31g(d).firefly.inp (generated)

000705112.b3lyp_6-31g(d).smash.inp (generated)

000705112.b3lyp_6-31g(d).nwchem.inp (generated) 000705112.b3lyp_6-31g(d).log.xz 000705112.mol 000705112.PUBCHEM 000705112.mol (via Jmol)
000705115.b3lyp_6-31g(d).inp

000705115.b3lyp_6-31g(d).qchem.inp (generated)

000705115.b3lyp_6-31g(d).gjf (generated)

000705115.b3lyp_6-31g(d).firefly.inp (generated)

000705115.b3lyp_6-31g(d).smash.inp (generated)

000705115.b3lyp_6-31g(d).nwchem.inp (generated) 000705115.b3lyp_6-31g(d).log.xz 000705115.mol 000705115.PUBCHEM 000705115.mol (via Jmol)
000705141.b3lyp_6-31g(d).inp

000705141.b3lyp_6-31g(d).qchem.inp (generated)

000705141.b3lyp_6-31g(d).gjf (generated)

000705141.b3lyp_6-31g(d).firefly.inp (generated)

000705141.b3lyp_6-31g(d).smash.inp (generated)

000705141.b3lyp_6-31g(d).nwchem.inp (generated) 000705141.b3lyp_6-31g(d).log.xz 000705141.td-b3lyp_6-31g+(d).inp 000705141.td-b3lyp_6-31g+(d).log.xz

000705141.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705141.td-b3lyp_6-31+g(d).gjf (generated)

000705141.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705141.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705141.mol 000705141.PUBCHEM 000705141.mol (via Jmol)
000705155.b3lyp_6-31g(d).inp

000705155.b3lyp_6-31g(d).qchem.inp (generated)

000705155.b3lyp_6-31g(d).gjf (generated)

000705155.b3lyp_6-31g(d).firefly.inp (generated)

000705155.b3lyp_6-31g(d).smash.inp (generated)

000705155.b3lyp_6-31g(d).nwchem.inp (generated) 000705155.b3lyp_6-31g(d).log.xz 000705155.td-b3lyp_6-31g+(d).inp 000705155.td-b3lyp_6-31g+(d).log.xz

000705155.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705155.td-b3lyp_6-31+g(d).gjf (generated)

000705155.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705155.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705155.mol 000705155.PUBCHEM 000705155.mol (via Jmol)
000705256.b3lyp_6-31g(d).inp

000705256.b3lyp_6-31g(d).qchem.inp (generated)

000705256.b3lyp_6-31g(d).gjf (generated)

000705256.b3lyp_6-31g(d).firefly.inp (generated)

000705256.b3lyp_6-31g(d).smash.inp (generated)

000705256.b3lyp_6-31g(d).nwchem.inp (generated) 000705256.b3lyp_6-31g(d).log.xz 000705256.td-b3lyp_6-31g+(d).inp 000705256.td-b3lyp_6-31g+(d).log.xz

000705256.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705256.td-b3lyp_6-31+g(d).gjf (generated)

000705256.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705256.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705256.mol 000705256.PUBCHEM 000705256.mol (via Jmol)
000705264.b3lyp_6-31g(d).inp

000705264.b3lyp_6-31g(d).qchem.inp (generated)

000705264.b3lyp_6-31g(d).gjf (generated)

000705264.b3lyp_6-31g(d).firefly.inp (generated)

000705264.b3lyp_6-31g(d).smash.inp (generated)

000705264.b3lyp_6-31g(d).nwchem.inp (generated) 000705264.b3lyp_6-31g(d).log.xz 000705264.td-b3lyp_6-31g+(d).inp 000705264.td-b3lyp_6-31g+(d).log.xz

000705264.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705264.td-b3lyp_6-31+g(d).gjf (generated)

000705264.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705264.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705264.mol 000705264.PUBCHEM 000705264.mol (via Jmol)
000705294.b3lyp_6-31g(d).inp

000705294.b3lyp_6-31g(d).qchem.inp (generated)

000705294.b3lyp_6-31g(d).gjf (generated)

000705294.b3lyp_6-31g(d).firefly.inp (generated)

000705294.b3lyp_6-31g(d).smash.inp (generated)

000705294.b3lyp_6-31g(d).nwchem.inp (generated) 000705294.b3lyp_6-31g(d).log.xz 000705294.td-b3lyp_6-31g+(d).inp 000705294.td-b3lyp_6-31g+(d).log.xz

000705294.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705294.td-b3lyp_6-31+g(d).gjf (generated)

000705294.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705294.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705294.mol 000705294.PUBCHEM 000705294.mol (via Jmol)
000705319.b3lyp_6-31g(d).inp

000705319.b3lyp_6-31g(d).qchem.inp (generated)

000705319.b3lyp_6-31g(d).gjf (generated)

000705319.b3lyp_6-31g(d).firefly.inp (generated)

000705319.b3lyp_6-31g(d).smash.inp (generated)

000705319.b3lyp_6-31g(d).nwchem.inp (generated) 000705319.b3lyp_6-31g(d).log.xz 000705319.td-b3lyp_6-31g+(d).inp 000705319.td-b3lyp_6-31g+(d).log.xz

000705319.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705319.td-b3lyp_6-31+g(d).gjf (generated)

000705319.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705319.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705319.mol 000705319.PUBCHEM 000705319.mol (via Jmol)
000705400.b3lyp_6-31g(d).inp

000705400.b3lyp_6-31g(d).qchem.inp (generated)

000705400.b3lyp_6-31g(d).gjf (generated)

000705400.b3lyp_6-31g(d).firefly.inp (generated)

000705400.b3lyp_6-31g(d).smash.inp (generated)

000705400.b3lyp_6-31g(d).nwchem.inp (generated) 000705400.b3lyp_6-31g(d).log.xz 000705400.td-b3lyp_6-31g+(d).inp 000705400.td-b3lyp_6-31g+(d).log.xz

000705400.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705400.td-b3lyp_6-31+g(d).gjf (generated)

000705400.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705400.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705400.mol 000705400.PUBCHEM 000705400.mol (via Jmol)
000705406.b3lyp_6-31g(d).inp

000705406.b3lyp_6-31g(d).qchem.inp (generated)

000705406.b3lyp_6-31g(d).gjf (generated)

000705406.b3lyp_6-31g(d).firefly.inp (generated)

000705406.b3lyp_6-31g(d).smash.inp (generated)

000705406.b3lyp_6-31g(d).nwchem.inp (generated) 000705406.b3lyp_6-31g(d).log.xz 000705406.td-b3lyp_6-31g+(d).inp 000705406.td-b3lyp_6-31g+(d).log.xz

000705406.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705406.td-b3lyp_6-31+g(d).gjf (generated)

000705406.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705406.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705406.mol 000705406.PUBCHEM 000705406.mol (via Jmol)
000705408.b3lyp_6-31g(d).inp

000705408.b3lyp_6-31g(d).qchem.inp (generated)

000705408.b3lyp_6-31g(d).gjf (generated)

000705408.b3lyp_6-31g(d).firefly.inp (generated)

000705408.b3lyp_6-31g(d).smash.inp (generated)

000705408.b3lyp_6-31g(d).nwchem.inp (generated) 000705408.b3lyp_6-31g(d).log.xz 000705408.td-b3lyp_6-31g+(d).inp 000705408.td-b3lyp_6-31g+(d).log.xz

000705408.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705408.td-b3lyp_6-31+g(d).gjf (generated)

000705408.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705408.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705408.mol 000705408.PUBCHEM 000705408.mol (via Jmol)
000705419.b3lyp_6-31g(d).inp

000705419.b3lyp_6-31g(d).qchem.inp (generated)

000705419.b3lyp_6-31g(d).gjf (generated)

000705419.b3lyp_6-31g(d).firefly.inp (generated)

000705419.b3lyp_6-31g(d).smash.inp (generated)

000705419.b3lyp_6-31g(d).nwchem.inp (generated) 000705419.b3lyp_6-31g(d).log.xz 000705419.td-b3lyp_6-31g+(d).inp 000705419.td-b3lyp_6-31g+(d).log.xz

000705419.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705419.td-b3lyp_6-31+g(d).gjf (generated)

000705419.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705419.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705419.mol 000705419.PUBCHEM 000705419.mol (via Jmol)
000705426.b3lyp_6-31g(d).inp

000705426.b3lyp_6-31g(d).qchem.inp (generated)

000705426.b3lyp_6-31g(d).gjf (generated)

000705426.b3lyp_6-31g(d).firefly.inp (generated)

000705426.b3lyp_6-31g(d).smash.inp (generated)

000705426.b3lyp_6-31g(d).nwchem.inp (generated) 000705426.b3lyp_6-31g(d).log.xz 000705426.td-b3lyp_6-31g+(d).inp 000705426.td-b3lyp_6-31g+(d).log.xz

000705426.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705426.td-b3lyp_6-31+g(d).gjf (generated)

000705426.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705426.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705426.mol 000705426.PUBCHEM 000705426.mol (via Jmol)
000705428.b3lyp_6-31g(d).inp

000705428.b3lyp_6-31g(d).qchem.inp (generated)

000705428.b3lyp_6-31g(d).gjf (generated)

000705428.b3lyp_6-31g(d).firefly.inp (generated)

000705428.b3lyp_6-31g(d).smash.inp (generated)

000705428.b3lyp_6-31g(d).nwchem.inp (generated) 000705428.b3lyp_6-31g(d).log.xz 000705428.td-b3lyp_6-31g+(d).inp 000705428.td-b3lyp_6-31g+(d).log.xz

000705428.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705428.td-b3lyp_6-31+g(d).gjf (generated)

000705428.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705428.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705428.mol 000705428.PUBCHEM 000705428.mol (via Jmol)
000705437.b3lyp_6-31g(d).inp

000705437.b3lyp_6-31g(d).qchem.inp (generated)

000705437.b3lyp_6-31g(d).gjf (generated)

000705437.b3lyp_6-31g(d).firefly.inp (generated)

000705437.b3lyp_6-31g(d).smash.inp (generated)

000705437.b3lyp_6-31g(d).nwchem.inp (generated) 000705437.b3lyp_6-31g(d).log.xz 000705437.td-b3lyp_6-31g+(d).inp 000705437.td-b3lyp_6-31g+(d).log.xz

000705437.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705437.td-b3lyp_6-31+g(d).gjf (generated)

000705437.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705437.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705437.mol 000705437.PUBCHEM 000705437.mol (via Jmol)
000705471.b3lyp_6-31g(d).inp

000705471.b3lyp_6-31g(d).qchem.inp (generated)

000705471.b3lyp_6-31g(d).gjf (generated)

000705471.b3lyp_6-31g(d).firefly.inp (generated)

000705471.b3lyp_6-31g(d).smash.inp (generated)

000705471.b3lyp_6-31g(d).nwchem.inp (generated) 000705471.b3lyp_6-31g(d).log.xz 000705471.td-b3lyp_6-31g+(d).inp 000705471.td-b3lyp_6-31g+(d).log.xz

000705471.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705471.td-b3lyp_6-31+g(d).gjf (generated)

000705471.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705471.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705471.mol 000705471.PUBCHEM 000705471.mol (via Jmol)
000705474.b3lyp_6-31g(d).inp

000705474.b3lyp_6-31g(d).qchem.inp (generated)

000705474.b3lyp_6-31g(d).gjf (generated)

000705474.b3lyp_6-31g(d).firefly.inp (generated)

000705474.b3lyp_6-31g(d).smash.inp (generated)

000705474.b3lyp_6-31g(d).nwchem.inp (generated) 000705474.b3lyp_6-31g(d).log.xz 000705474.td-b3lyp_6-31g+(d).inp 000705474.td-b3lyp_6-31g+(d).log.xz

000705474.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705474.td-b3lyp_6-31+g(d).gjf (generated)

000705474.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705474.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705474.mol 000705474.PUBCHEM 000705474.mol (via Jmol)
000705479.b3lyp_6-31g(d).inp

000705479.b3lyp_6-31g(d).qchem.inp (generated)

000705479.b3lyp_6-31g(d).gjf (generated)

000705479.b3lyp_6-31g(d).firefly.inp (generated)

000705479.b3lyp_6-31g(d).smash.inp (generated)

000705479.b3lyp_6-31g(d).nwchem.inp (generated) 000705479.b3lyp_6-31g(d).log.xz 000705479.td-b3lyp_6-31g+(d).inp 000705479.td-b3lyp_6-31g+(d).log.xz

000705479.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705479.td-b3lyp_6-31+g(d).gjf (generated)

000705479.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705479.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705479.mol 000705479.PUBCHEM 000705479.mol (via Jmol)
000705511.b3lyp_6-31g(d).inp

000705511.b3lyp_6-31g(d).qchem.inp (generated)

000705511.b3lyp_6-31g(d).gjf (generated)

000705511.b3lyp_6-31g(d).firefly.inp (generated)

000705511.b3lyp_6-31g(d).smash.inp (generated)

000705511.b3lyp_6-31g(d).nwchem.inp (generated) 000705511.b3lyp_6-31g(d).log.xz 000705511.td-b3lyp_6-31g+(d).inp 000705511.td-b3lyp_6-31g+(d).log.xz

000705511.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705511.td-b3lyp_6-31+g(d).gjf (generated)

000705511.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705511.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705511.mol 000705511.PUBCHEM 000705511.mol (via Jmol)
000705512.b3lyp_6-31g(d).inp

000705512.b3lyp_6-31g(d).qchem.inp (generated)

000705512.b3lyp_6-31g(d).gjf (generated)

000705512.b3lyp_6-31g(d).firefly.inp (generated)

000705512.b3lyp_6-31g(d).smash.inp (generated)

000705512.b3lyp_6-31g(d).nwchem.inp (generated) 000705512.b3lyp_6-31g(d).log.xz 000705512.mol 000705512.PUBCHEM 000705512.mol (via Jmol)
000705523.b3lyp_6-31g(d).inp

000705523.b3lyp_6-31g(d).qchem.inp (generated)

000705523.b3lyp_6-31g(d).gjf (generated)

000705523.b3lyp_6-31g(d).firefly.inp (generated)

000705523.b3lyp_6-31g(d).smash.inp (generated)

000705523.b3lyp_6-31g(d).nwchem.inp (generated) 000705523.b3lyp_6-31g(d).log.xz 000705523.td-b3lyp_6-31g+(d).inp 000705523.td-b3lyp_6-31g+(d).log.xz

000705523.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705523.td-b3lyp_6-31+g(d).gjf (generated)

000705523.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705523.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705523.mol 000705523.PUBCHEM 000705523.mol (via Jmol)
000705532.b3lyp_6-31g(d).inp

000705532.b3lyp_6-31g(d).qchem.inp (generated)

000705532.b3lyp_6-31g(d).gjf (generated)

000705532.b3lyp_6-31g(d).firefly.inp (generated)

000705532.b3lyp_6-31g(d).smash.inp (generated)

000705532.b3lyp_6-31g(d).nwchem.inp (generated) 000705532.b3lyp_6-31g(d).log.xz 000705532.td-b3lyp_6-31g+(d).inp 000705532.td-b3lyp_6-31g+(d).log.xz

000705532.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705532.td-b3lyp_6-31+g(d).gjf (generated)

000705532.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705532.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705532.mol 000705532.PUBCHEM 000705532.mol (via Jmol)
000705533.b3lyp_6-31g(d).inp

000705533.b3lyp_6-31g(d).qchem.inp (generated)

000705533.b3lyp_6-31g(d).gjf (generated)

000705533.b3lyp_6-31g(d).firefly.inp (generated)

000705533.b3lyp_6-31g(d).smash.inp (generated)

000705533.b3lyp_6-31g(d).nwchem.inp (generated) 000705533.b3lyp_6-31g(d).log.xz 000705533.td-b3lyp_6-31g+(d).inp 000705533.td-b3lyp_6-31g+(d).log.xz

000705533.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705533.td-b3lyp_6-31+g(d).gjf (generated)

000705533.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705533.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705533.mol 000705533.PUBCHEM 000705533.mol (via Jmol)
000705535.b3lyp_6-31g(d).inp

000705535.b3lyp_6-31g(d).qchem.inp (generated)

000705535.b3lyp_6-31g(d).gjf (generated)

000705535.b3lyp_6-31g(d).firefly.inp (generated)

000705535.b3lyp_6-31g(d).smash.inp (generated)

000705535.b3lyp_6-31g(d).nwchem.inp (generated) 000705535.b3lyp_6-31g(d).log.xz 000705535.td-b3lyp_6-31g+(d).inp 000705535.td-b3lyp_6-31g+(d).log.xz

000705535.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705535.td-b3lyp_6-31+g(d).gjf (generated)

000705535.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705535.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705535.mol 000705535.PUBCHEM 000705535.mol (via Jmol)
000705539.b3lyp_6-31g(d).inp

000705539.b3lyp_6-31g(d).qchem.inp (generated)

000705539.b3lyp_6-31g(d).gjf (generated)

000705539.b3lyp_6-31g(d).firefly.inp (generated)

000705539.b3lyp_6-31g(d).smash.inp (generated)

000705539.b3lyp_6-31g(d).nwchem.inp (generated) 000705539.b3lyp_6-31g(d).log.xz 000705539.mol 000705539.PUBCHEM 000705539.mol (via Jmol)
000705540.b3lyp_6-31g(d).inp

000705540.b3lyp_6-31g(d).qchem.inp (generated)

000705540.b3lyp_6-31g(d).gjf (generated)

000705540.b3lyp_6-31g(d).firefly.inp (generated)

000705540.b3lyp_6-31g(d).smash.inp (generated)

000705540.b3lyp_6-31g(d).nwchem.inp (generated) 000705540.b3lyp_6-31g(d).log.xz 000705540.td-b3lyp_6-31g+(d).inp 000705540.td-b3lyp_6-31g+(d).log.xz

000705540.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705540.td-b3lyp_6-31+g(d).gjf (generated)

000705540.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705540.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705540.mol 000705540.PUBCHEM 000705540.mol (via Jmol)
000705544.b3lyp_6-31g(d).inp

000705544.b3lyp_6-31g(d).qchem.inp (generated)

000705544.b3lyp_6-31g(d).gjf (generated)

000705544.b3lyp_6-31g(d).firefly.inp (generated)

000705544.b3lyp_6-31g(d).smash.inp (generated)

000705544.b3lyp_6-31g(d).nwchem.inp (generated) 000705544.b3lyp_6-31g(d).log.xz 000705544.td-b3lyp_6-31g+(d).inp 000705544.td-b3lyp_6-31g+(d).log.xz

000705544.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705544.td-b3lyp_6-31+g(d).gjf (generated)

000705544.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705544.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705544.mol 000705544.PUBCHEM 000705544.mol (via Jmol)
000705556.b3lyp_6-31g(d).inp

000705556.b3lyp_6-31g(d).qchem.inp (generated)

000705556.b3lyp_6-31g(d).gjf (generated)

000705556.b3lyp_6-31g(d).firefly.inp (generated)

000705556.b3lyp_6-31g(d).smash.inp (generated)

000705556.b3lyp_6-31g(d).nwchem.inp (generated) 000705556.b3lyp_6-31g(d).log.xz 000705556.td-b3lyp_6-31g+(d).inp 000705556.td-b3lyp_6-31g+(d).log.xz

000705556.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705556.td-b3lyp_6-31+g(d).gjf (generated)

000705556.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705556.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705556.mol 000705556.PUBCHEM 000705556.mol (via Jmol)
000705557.b3lyp_6-31g(d).inp

000705557.b3lyp_6-31g(d).qchem.inp (generated)

000705557.b3lyp_6-31g(d).gjf (generated)

000705557.b3lyp_6-31g(d).firefly.inp (generated)

000705557.b3lyp_6-31g(d).smash.inp (generated)

000705557.b3lyp_6-31g(d).nwchem.inp (generated) 000705557.b3lyp_6-31g(d).log.xz 000705557.td-b3lyp_6-31g+(d).inp 000705557.td-b3lyp_6-31g+(d).log.xz

000705557.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705557.td-b3lyp_6-31+g(d).gjf (generated)

000705557.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705557.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705557.mol 000705557.PUBCHEM 000705557.mol (via Jmol)
000705571.b3lyp_6-31g(d).inp

000705571.b3lyp_6-31g(d).qchem.inp (generated)

000705571.b3lyp_6-31g(d).gjf (generated)

000705571.b3lyp_6-31g(d).firefly.inp (generated)

000705571.b3lyp_6-31g(d).smash.inp (generated)

000705571.b3lyp_6-31g(d).nwchem.inp (generated) 000705571.b3lyp_6-31g(d).log.xz 000705571.td-b3lyp_6-31g+(d).inp 000705571.td-b3lyp_6-31g+(d).log.xz

000705571.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705571.td-b3lyp_6-31+g(d).gjf (generated)

000705571.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705571.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705571.mol 000705571.PUBCHEM 000705571.mol (via Jmol)
000705574.b3lyp_6-31g(d).inp

000705574.b3lyp_6-31g(d).qchem.inp (generated)

000705574.b3lyp_6-31g(d).gjf (generated)

000705574.b3lyp_6-31g(d).firefly.inp (generated)

000705574.b3lyp_6-31g(d).smash.inp (generated)

000705574.b3lyp_6-31g(d).nwchem.inp (generated) 000705574.b3lyp_6-31g(d).log.xz 000705574.td-b3lyp_6-31g+(d).inp 000705574.td-b3lyp_6-31g+(d).log.xz

000705574.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705574.td-b3lyp_6-31+g(d).gjf (generated)

000705574.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705574.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705574.mol 000705574.PUBCHEM 000705574.mol (via Jmol)
000705621.b3lyp_6-31g(d).inp

000705621.b3lyp_6-31g(d).qchem.inp (generated)

000705621.b3lyp_6-31g(d).gjf (generated)

000705621.b3lyp_6-31g(d).firefly.inp (generated)

000705621.b3lyp_6-31g(d).smash.inp (generated)

000705621.b3lyp_6-31g(d).nwchem.inp (generated) 000705621.b3lyp_6-31g(d).log.xz 000705621.td-b3lyp_6-31g+(d).inp 000705621.td-b3lyp_6-31g+(d).log.xz

000705621.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705621.td-b3lyp_6-31+g(d).gjf (generated)

000705621.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705621.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705621.mol 000705621.PUBCHEM 000705621.mol (via Jmol)
000705623.b3lyp_6-31g(d).inp

000705623.b3lyp_6-31g(d).qchem.inp (generated)

000705623.b3lyp_6-31g(d).gjf (generated)

000705623.b3lyp_6-31g(d).firefly.inp (generated)

000705623.b3lyp_6-31g(d).smash.inp (generated)

000705623.b3lyp_6-31g(d).nwchem.inp (generated) 000705623.b3lyp_6-31g(d).log.xz 000705623.td-b3lyp_6-31g+(d).inp 000705623.td-b3lyp_6-31g+(d).log.xz

000705623.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705623.td-b3lyp_6-31+g(d).gjf (generated)

000705623.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705623.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705623.mol 000705623.PUBCHEM 000705623.mol (via Jmol)
000705646.b3lyp_6-31g(d).inp

000705646.b3lyp_6-31g(d).qchem.inp (generated)

000705646.b3lyp_6-31g(d).gjf (generated)

000705646.b3lyp_6-31g(d).firefly.inp (generated)

000705646.b3lyp_6-31g(d).smash.inp (generated)

000705646.b3lyp_6-31g(d).nwchem.inp (generated) 000705646.b3lyp_6-31g(d).log.xz 000705646.td-b3lyp_6-31g+(d).inp 000705646.td-b3lyp_6-31g+(d).log.xz

000705646.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705646.td-b3lyp_6-31+g(d).gjf (generated)

000705646.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705646.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705646.mol 000705646.PUBCHEM 000705646.mol (via Jmol)
000705670.b3lyp_6-31g(d).inp

000705670.b3lyp_6-31g(d).qchem.inp (generated)

000705670.b3lyp_6-31g(d).gjf (generated)

000705670.b3lyp_6-31g(d).firefly.inp (generated)

000705670.b3lyp_6-31g(d).smash.inp (generated)

000705670.b3lyp_6-31g(d).nwchem.inp (generated) 000705670.b3lyp_6-31g(d).log.xz 000705670.td-b3lyp_6-31g+(d).inp 000705670.td-b3lyp_6-31g+(d).log.xz

000705670.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705670.td-b3lyp_6-31+g(d).gjf (generated)

000705670.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705670.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705670.mol 000705670.PUBCHEM 000705670.mol (via Jmol)
000705673.b3lyp_6-31g(d).inp

000705673.b3lyp_6-31g(d).qchem.inp (generated)

000705673.b3lyp_6-31g(d).gjf (generated)

000705673.b3lyp_6-31g(d).firefly.inp (generated)

000705673.b3lyp_6-31g(d).smash.inp (generated)

000705673.b3lyp_6-31g(d).nwchem.inp (generated) 000705673.b3lyp_6-31g(d).log.xz 000705673.td-b3lyp_6-31g+(d).inp 000705673.td-b3lyp_6-31g+(d).log.xz

000705673.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705673.td-b3lyp_6-31+g(d).gjf (generated)

000705673.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705673.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705673.mol 000705673.PUBCHEM 000705673.mol (via Jmol)
000705676.b3lyp_6-31g(d).inp

000705676.b3lyp_6-31g(d).qchem.inp (generated)

000705676.b3lyp_6-31g(d).gjf (generated)

000705676.b3lyp_6-31g(d).firefly.inp (generated)

000705676.b3lyp_6-31g(d).smash.inp (generated)

000705676.b3lyp_6-31g(d).nwchem.inp (generated) 000705676.b3lyp_6-31g(d).log.xz 000705676.td-b3lyp_6-31g+(d).inp 000705676.td-b3lyp_6-31g+(d).log.xz

000705676.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705676.td-b3lyp_6-31+g(d).gjf (generated)

000705676.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705676.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705676.mol 000705676.PUBCHEM 000705676.mol (via Jmol)
000705685.b3lyp_6-31g(d).inp

000705685.b3lyp_6-31g(d).qchem.inp (generated)

000705685.b3lyp_6-31g(d).gjf (generated)

000705685.b3lyp_6-31g(d).firefly.inp (generated)

000705685.b3lyp_6-31g(d).smash.inp (generated)

000705685.b3lyp_6-31g(d).nwchem.inp (generated) 000705685.b3lyp_6-31g(d).log.xz 000705685.td-b3lyp_6-31g+(d).inp 000705685.td-b3lyp_6-31g+(d).log.xz

000705685.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705685.td-b3lyp_6-31+g(d).gjf (generated)

000705685.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705685.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705685.mol 000705685.PUBCHEM 000705685.mol (via Jmol)
000705704.b3lyp_6-31g(d).inp

000705704.b3lyp_6-31g(d).qchem.inp (generated)

000705704.b3lyp_6-31g(d).gjf (generated)

000705704.b3lyp_6-31g(d).firefly.inp (generated)

000705704.b3lyp_6-31g(d).smash.inp (generated)

000705704.b3lyp_6-31g(d).nwchem.inp (generated) 000705704.b3lyp_6-31g(d).log.xz 000705704.td-b3lyp_6-31g+(d).inp 000705704.td-b3lyp_6-31g+(d).log.xz

000705704.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705704.td-b3lyp_6-31+g(d).gjf (generated)

000705704.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705704.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705704.mol 000705704.PUBCHEM 000705704.mol (via Jmol)
000705798.b3lyp_6-31g(d).inp

000705798.b3lyp_6-31g(d).qchem.inp (generated)

000705798.b3lyp_6-31g(d).gjf (generated)

000705798.b3lyp_6-31g(d).firefly.inp (generated)

000705798.b3lyp_6-31g(d).smash.inp (generated)

000705798.b3lyp_6-31g(d).nwchem.inp (generated) 000705798.b3lyp_6-31g(d).log.xz 000705798.td-b3lyp_6-31g+(d).inp 000705798.td-b3lyp_6-31g+(d).log.xz

000705798.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705798.td-b3lyp_6-31+g(d).gjf (generated)

000705798.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705798.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705798.mol 000705798.PUBCHEM 000705798.mol (via Jmol)
000705812.b3lyp_6-31g(d).inp

000705812.b3lyp_6-31g(d).qchem.inp (generated)

000705812.b3lyp_6-31g(d).gjf (generated)

000705812.b3lyp_6-31g(d).firefly.inp (generated)

000705812.b3lyp_6-31g(d).smash.inp (generated)

000705812.b3lyp_6-31g(d).nwchem.inp (generated) 000705812.b3lyp_6-31g(d).log.xz 000705812.td-b3lyp_6-31g+(d).inp 000705812.td-b3lyp_6-31g+(d).log.xz

000705812.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705812.td-b3lyp_6-31+g(d).gjf (generated)

000705812.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705812.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705812.mol 000705812.PUBCHEM 000705812.mol (via Jmol)
000705815.b3lyp_6-31g(d).inp

000705815.b3lyp_6-31g(d).qchem.inp (generated)

000705815.b3lyp_6-31g(d).gjf (generated)

000705815.b3lyp_6-31g(d).firefly.inp (generated)

000705815.b3lyp_6-31g(d).smash.inp (generated)

000705815.b3lyp_6-31g(d).nwchem.inp (generated) 000705815.b3lyp_6-31g(d).log.xz 000705815.td-b3lyp_6-31g+(d).inp 000705815.td-b3lyp_6-31g+(d).log.xz

000705815.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705815.td-b3lyp_6-31+g(d).gjf (generated)

000705815.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705815.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705815.mol 000705815.PUBCHEM 000705815.mol (via Jmol)
000705834.b3lyp_6-31g(d).inp

000705834.b3lyp_6-31g(d).qchem.inp (generated)

000705834.b3lyp_6-31g(d).gjf (generated)

000705834.b3lyp_6-31g(d).firefly.inp (generated)

000705834.b3lyp_6-31g(d).smash.inp (generated)

000705834.b3lyp_6-31g(d).nwchem.inp (generated) 000705834.b3lyp_6-31g(d).log.xz 000705834.td-b3lyp_6-31g+(d).inp 000705834.td-b3lyp_6-31g+(d).log.xz

000705834.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705834.td-b3lyp_6-31+g(d).gjf (generated)

000705834.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705834.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705834.mol 000705834.PUBCHEM 000705834.mol (via Jmol)
000705835.b3lyp_6-31g(d).inp

000705835.b3lyp_6-31g(d).qchem.inp (generated)

000705835.b3lyp_6-31g(d).gjf (generated)

000705835.b3lyp_6-31g(d).firefly.inp (generated)

000705835.b3lyp_6-31g(d).smash.inp (generated)

000705835.b3lyp_6-31g(d).nwchem.inp (generated) 000705835.b3lyp_6-31g(d).log.xz 000705835.td-b3lyp_6-31g+(d).inp 000705835.td-b3lyp_6-31g+(d).log.xz

000705835.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705835.td-b3lyp_6-31+g(d).gjf (generated)

000705835.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705835.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705835.mol 000705835.PUBCHEM 000705835.mol (via Jmol)
000705850.b3lyp_6-31g(d).inp

000705850.b3lyp_6-31g(d).qchem.inp (generated)

000705850.b3lyp_6-31g(d).gjf (generated)

000705850.b3lyp_6-31g(d).firefly.inp (generated)

000705850.b3lyp_6-31g(d).smash.inp (generated)

000705850.b3lyp_6-31g(d).nwchem.inp (generated) 000705850.b3lyp_6-31g(d).log.xz 000705850.td-b3lyp_6-31g+(d).inp 000705850.td-b3lyp_6-31g+(d).log.xz

000705850.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705850.td-b3lyp_6-31+g(d).gjf (generated)

000705850.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705850.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705850.mol 000705850.PUBCHEM 000705850.mol (via Jmol)
000705868.b3lyp_6-31g(d).inp

000705868.b3lyp_6-31g(d).qchem.inp (generated)

000705868.b3lyp_6-31g(d).gjf (generated)

000705868.b3lyp_6-31g(d).firefly.inp (generated)

000705868.b3lyp_6-31g(d).smash.inp (generated)

000705868.b3lyp_6-31g(d).nwchem.inp (generated) 000705868.b3lyp_6-31g(d).log.xz 000705868.td-b3lyp_6-31g+(d).inp 000705868.td-b3lyp_6-31g+(d).log.xz

000705868.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705868.td-b3lyp_6-31+g(d).gjf (generated)

000705868.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705868.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705868.mol 000705868.PUBCHEM 000705868.mol (via Jmol)
000705879.b3lyp_6-31g(d).inp

000705879.b3lyp_6-31g(d).qchem.inp (generated)

000705879.b3lyp_6-31g(d).gjf (generated)

000705879.b3lyp_6-31g(d).firefly.inp (generated)

000705879.b3lyp_6-31g(d).smash.inp (generated)

000705879.b3lyp_6-31g(d).nwchem.inp (generated) 000705879.b3lyp_6-31g(d).log.xz 000705879.td-b3lyp_6-31g+(d).inp 000705879.td-b3lyp_6-31g+(d).log.xz

000705879.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705879.td-b3lyp_6-31+g(d).gjf (generated)

000705879.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705879.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705879.mol 000705879.PUBCHEM 000705879.mol (via Jmol)
000705885.b3lyp_6-31g(d).inp

000705885.b3lyp_6-31g(d).qchem.inp (generated)

000705885.b3lyp_6-31g(d).gjf (generated)

000705885.b3lyp_6-31g(d).firefly.inp (generated)

000705885.b3lyp_6-31g(d).smash.inp (generated)

000705885.b3lyp_6-31g(d).nwchem.inp (generated) 000705885.b3lyp_6-31g(d).log.xz 000705885.td-b3lyp_6-31g+(d).inp 000705885.td-b3lyp_6-31g+(d).log.xz

000705885.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705885.td-b3lyp_6-31+g(d).gjf (generated)

000705885.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705885.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705885.mol 000705885.PUBCHEM 000705885.mol (via Jmol)
000705893.b3lyp_6-31g(d).inp

000705893.b3lyp_6-31g(d).qchem.inp (generated)

000705893.b3lyp_6-31g(d).gjf (generated)

000705893.b3lyp_6-31g(d).firefly.inp (generated)

000705893.b3lyp_6-31g(d).smash.inp (generated)

000705893.b3lyp_6-31g(d).nwchem.inp (generated) 000705893.b3lyp_6-31g(d).log.xz 000705893.td-b3lyp_6-31g+(d).inp 000705893.td-b3lyp_6-31g+(d).log.xz

000705893.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705893.td-b3lyp_6-31+g(d).gjf (generated)

000705893.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705893.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705893.mol 000705893.PUBCHEM 000705893.mol (via Jmol)
000705926.b3lyp_6-31g(d).inp

000705926.b3lyp_6-31g(d).qchem.inp (generated)

000705926.b3lyp_6-31g(d).gjf (generated)

000705926.b3lyp_6-31g(d).firefly.inp (generated)

000705926.b3lyp_6-31g(d).smash.inp (generated)

000705926.b3lyp_6-31g(d).nwchem.inp (generated) 000705926.b3lyp_6-31g(d).log.xz 000705926.td-b3lyp_6-31g+(d).inp 000705926.td-b3lyp_6-31g+(d).log.xz

000705926.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705926.td-b3lyp_6-31+g(d).gjf (generated)

000705926.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705926.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705926.mol 000705926.PUBCHEM 000705926.mol (via Jmol)
000705986.b3lyp_6-31g(d).inp

000705986.b3lyp_6-31g(d).qchem.inp (generated)

000705986.b3lyp_6-31g(d).gjf (generated)

000705986.b3lyp_6-31g(d).firefly.inp (generated)

000705986.b3lyp_6-31g(d).smash.inp (generated)

000705986.b3lyp_6-31g(d).nwchem.inp (generated) 000705986.b3lyp_6-31g(d).log.xz 000705986.td-b3lyp_6-31g+(d).inp 000705986.td-b3lyp_6-31g+(d).log.xz

000705986.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705986.td-b3lyp_6-31+g(d).gjf (generated)

000705986.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705986.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705986.mol 000705986.PUBCHEM 000705986.mol (via Jmol)
000705987.b3lyp_6-31g(d).inp

000705987.b3lyp_6-31g(d).qchem.inp (generated)

000705987.b3lyp_6-31g(d).gjf (generated)

000705987.b3lyp_6-31g(d).firefly.inp (generated)

000705987.b3lyp_6-31g(d).smash.inp (generated)

000705987.b3lyp_6-31g(d).nwchem.inp (generated) 000705987.b3lyp_6-31g(d).log.xz 000705987.td-b3lyp_6-31g+(d).inp 000705987.td-b3lyp_6-31g+(d).log.xz

000705987.td-b3lyp_6-31+g(d).qchem.inp (generated)

000705987.td-b3lyp_6-31+g(d).gjf (generated)

000705987.td-b3lyp_6-31+g(d).firefly.inp (generated)

000705987.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000705987.mol 000705987.PUBCHEM 000705987.mol (via Jmol)
000706010.b3lyp_6-31g(d).inp

000706010.b3lyp_6-31g(d).qchem.inp (generated)

000706010.b3lyp_6-31g(d).gjf (generated)

000706010.b3lyp_6-31g(d).firefly.inp (generated)

000706010.b3lyp_6-31g(d).smash.inp (generated)

000706010.b3lyp_6-31g(d).nwchem.inp (generated) 000706010.b3lyp_6-31g(d).log.xz 000706010.mol 000706010.PUBCHEM 000706010.mol (via Jmol)
000706060.b3lyp_6-31g(d).inp

000706060.b3lyp_6-31g(d).qchem.inp (generated)

000706060.b3lyp_6-31g(d).gjf (generated)

000706060.b3lyp_6-31g(d).firefly.inp (generated)

000706060.b3lyp_6-31g(d).smash.inp (generated)

000706060.b3lyp_6-31g(d).nwchem.inp (generated) 000706060.b3lyp_6-31g(d).log.xz 000706060.td-b3lyp_6-31g+(d).inp 000706060.td-b3lyp_6-31g+(d).log.xz

000706060.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706060.td-b3lyp_6-31+g(d).gjf (generated)

000706060.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706060.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706060.mol 000706060.PUBCHEM 000706060.mol (via Jmol)
000706061.b3lyp_6-31g(d).inp

000706061.b3lyp_6-31g(d).qchem.inp (generated)

000706061.b3lyp_6-31g(d).gjf (generated)

000706061.b3lyp_6-31g(d).firefly.inp (generated)

000706061.b3lyp_6-31g(d).smash.inp (generated)

000706061.b3lyp_6-31g(d).nwchem.inp (generated) 000706061.b3lyp_6-31g(d).log.xz 000706061.td-b3lyp_6-31g+(d).inp 000706061.td-b3lyp_6-31g+(d).log.xz

000706061.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706061.td-b3lyp_6-31+g(d).gjf (generated)

000706061.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706061.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706061.mol 000706061.PUBCHEM 000706061.mol (via Jmol)
000706121.b3lyp_6-31g(d).inp

000706121.b3lyp_6-31g(d).qchem.inp (generated)

000706121.b3lyp_6-31g(d).gjf (generated)

000706121.b3lyp_6-31g(d).firefly.inp (generated)

000706121.b3lyp_6-31g(d).smash.inp (generated)

000706121.b3lyp_6-31g(d).nwchem.inp (generated) 000706121.b3lyp_6-31g(d).log.xz 000706121.td-b3lyp_6-31g+(d).inp 000706121.td-b3lyp_6-31g+(d).log.xz

000706121.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706121.td-b3lyp_6-31+g(d).gjf (generated)

000706121.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706121.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706121.mol 000706121.PUBCHEM 000706121.mol (via Jmol)
000706122.b3lyp_6-31g(d).inp

000706122.b3lyp_6-31g(d).qchem.inp (generated)

000706122.b3lyp_6-31g(d).gjf (generated)

000706122.b3lyp_6-31g(d).firefly.inp (generated)

000706122.b3lyp_6-31g(d).smash.inp (generated)

000706122.b3lyp_6-31g(d).nwchem.inp (generated) 000706122.b3lyp_6-31g(d).log.xz 000706122.td-b3lyp_6-31g+(d).inp 000706122.td-b3lyp_6-31g+(d).log.xz

000706122.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706122.td-b3lyp_6-31+g(d).gjf (generated)

000706122.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706122.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706122.mol 000706122.PUBCHEM 000706122.mol (via Jmol)
000706126.b3lyp_6-31g(d).inp

000706126.b3lyp_6-31g(d).qchem.inp (generated)

000706126.b3lyp_6-31g(d).gjf (generated)

000706126.b3lyp_6-31g(d).firefly.inp (generated)

000706126.b3lyp_6-31g(d).smash.inp (generated)

000706126.b3lyp_6-31g(d).nwchem.inp (generated) 000706126.b3lyp_6-31g(d).log.xz 000706126.td-b3lyp_6-31g+(d).inp 000706126.td-b3lyp_6-31g+(d).log.xz

000706126.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706126.td-b3lyp_6-31+g(d).gjf (generated)

000706126.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706126.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706126.mol 000706126.PUBCHEM 000706126.mol (via Jmol)
000706129.b3lyp_6-31g(d).inp

000706129.b3lyp_6-31g(d).qchem.inp (generated)

000706129.b3lyp_6-31g(d).gjf (generated)

000706129.b3lyp_6-31g(d).firefly.inp (generated)

000706129.b3lyp_6-31g(d).smash.inp (generated)

000706129.b3lyp_6-31g(d).nwchem.inp (generated) 000706129.b3lyp_6-31g(d).log.xz 000706129.td-b3lyp_6-31g+(d).inp 000706129.td-b3lyp_6-31g+(d).log.xz

000706129.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706129.td-b3lyp_6-31+g(d).gjf (generated)

000706129.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706129.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706129.mol 000706129.PUBCHEM 000706129.mol (via Jmol)
000706132.b3lyp_6-31g(d).inp

000706132.b3lyp_6-31g(d).qchem.inp (generated)

000706132.b3lyp_6-31g(d).gjf (generated)

000706132.b3lyp_6-31g(d).firefly.inp (generated)

000706132.b3lyp_6-31g(d).smash.inp (generated)

000706132.b3lyp_6-31g(d).nwchem.inp (generated) 000706132.b3lyp_6-31g(d).log.xz 000706132.mol 000706132.PUBCHEM 000706132.mol (via Jmol)
000706135.b3lyp_6-31g(d).inp

000706135.b3lyp_6-31g(d).qchem.inp (generated)

000706135.b3lyp_6-31g(d).gjf (generated)

000706135.b3lyp_6-31g(d).firefly.inp (generated)

000706135.b3lyp_6-31g(d).smash.inp (generated)

000706135.b3lyp_6-31g(d).nwchem.inp (generated) 000706135.b3lyp_6-31g(d).log.xz 000706135.td-b3lyp_6-31g+(d).inp 000706135.td-b3lyp_6-31g+(d).log.xz

000706135.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706135.td-b3lyp_6-31+g(d).gjf (generated)

000706135.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706135.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706135.mol 000706135.PUBCHEM 000706135.mol (via Jmol)
000706139.b3lyp_6-31g(d).inp

000706139.b3lyp_6-31g(d).qchem.inp (generated)

000706139.b3lyp_6-31g(d).gjf (generated)

000706139.b3lyp_6-31g(d).firefly.inp (generated)

000706139.b3lyp_6-31g(d).smash.inp (generated)

000706139.b3lyp_6-31g(d).nwchem.inp (generated) 000706139.b3lyp_6-31g(d).log.xz 000706139.td-b3lyp_6-31g+(d).inp 000706139.td-b3lyp_6-31g+(d).log.xz

000706139.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706139.td-b3lyp_6-31+g(d).gjf (generated)

000706139.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706139.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706139.mol 000706139.PUBCHEM 000706139.mol (via Jmol)
000706140.b3lyp_6-31g(d).inp

000706140.b3lyp_6-31g(d).qchem.inp (generated)

000706140.b3lyp_6-31g(d).gjf (generated)

000706140.b3lyp_6-31g(d).firefly.inp (generated)

000706140.b3lyp_6-31g(d).smash.inp (generated)

000706140.b3lyp_6-31g(d).nwchem.inp (generated) 000706140.b3lyp_6-31g(d).log.xz 000706140.td-b3lyp_6-31g+(d).inp 000706140.td-b3lyp_6-31g+(d).log.xz

000706140.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706140.td-b3lyp_6-31+g(d).gjf (generated)

000706140.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706140.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706140.mol 000706140.PUBCHEM 000706140.mol (via Jmol)
000706143.b3lyp_6-31g(d).inp

000706143.b3lyp_6-31g(d).qchem.inp (generated)

000706143.b3lyp_6-31g(d).gjf (generated)

000706143.b3lyp_6-31g(d).firefly.inp (generated)

000706143.b3lyp_6-31g(d).smash.inp (generated)

000706143.b3lyp_6-31g(d).nwchem.inp (generated) 000706143.b3lyp_6-31g(d).log.xz 000706143.td-b3lyp_6-31g+(d).inp 000706143.td-b3lyp_6-31g+(d).log.xz

000706143.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706143.td-b3lyp_6-31+g(d).gjf (generated)

000706143.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706143.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706143.mol 000706143.PUBCHEM 000706143.mol (via Jmol)
000706147.b3lyp_6-31g(d).inp

000706147.b3lyp_6-31g(d).qchem.inp (generated)

000706147.b3lyp_6-31g(d).gjf (generated)

000706147.b3lyp_6-31g(d).firefly.inp (generated)

000706147.b3lyp_6-31g(d).smash.inp (generated)

000706147.b3lyp_6-31g(d).nwchem.inp (generated) 000706147.b3lyp_6-31g(d).log.xz 000706147.td-b3lyp_6-31g+(d).inp 000706147.td-b3lyp_6-31g+(d).log.xz

000706147.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706147.td-b3lyp_6-31+g(d).gjf (generated)

000706147.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706147.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706147.mol 000706147.PUBCHEM 000706147.mol (via Jmol)
000706178.b3lyp_6-31g(d).inp

000706178.b3lyp_6-31g(d).qchem.inp (generated)

000706178.b3lyp_6-31g(d).gjf (generated)

000706178.b3lyp_6-31g(d).firefly.inp (generated)

000706178.b3lyp_6-31g(d).smash.inp (generated)

000706178.b3lyp_6-31g(d).nwchem.inp (generated) 000706178.b3lyp_6-31g(d).log.xz 000706178.td-b3lyp_6-31g+(d).inp 000706178.td-b3lyp_6-31g+(d).log.xz

000706178.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706178.td-b3lyp_6-31+g(d).gjf (generated)

000706178.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706178.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706178.mol 000706178.PUBCHEM 000706178.mol (via Jmol)
000706187.b3lyp_6-31g(d).inp

000706187.b3lyp_6-31g(d).qchem.inp (generated)

000706187.b3lyp_6-31g(d).gjf (generated)

000706187.b3lyp_6-31g(d).firefly.inp (generated)

000706187.b3lyp_6-31g(d).smash.inp (generated)

000706187.b3lyp_6-31g(d).nwchem.inp (generated) 000706187.b3lyp_6-31g(d).log.xz 000706187.td-b3lyp_6-31g+(d).inp 000706187.td-b3lyp_6-31g+(d).log.xz

000706187.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706187.td-b3lyp_6-31+g(d).gjf (generated)

000706187.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706187.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706187.mol 000706187.PUBCHEM 000706187.mol (via Jmol)
000706271.b3lyp_6-31g(d).inp

000706271.b3lyp_6-31g(d).qchem.inp (generated)

000706271.b3lyp_6-31g(d).gjf (generated)

000706271.b3lyp_6-31g(d).firefly.inp (generated)

000706271.b3lyp_6-31g(d).smash.inp (generated)

000706271.b3lyp_6-31g(d).nwchem.inp (generated) 000706271.b3lyp_6-31g(d).log.xz 000706271.td-b3lyp_6-31g+(d).inp 000706271.td-b3lyp_6-31g+(d).log.xz

000706271.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706271.td-b3lyp_6-31+g(d).gjf (generated)

000706271.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706271.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706271.mol 000706271.PUBCHEM 000706271.mol (via Jmol)
000706301.b3lyp_6-31g(d).inp

000706301.b3lyp_6-31g(d).qchem.inp (generated)

000706301.b3lyp_6-31g(d).gjf (generated)

000706301.b3lyp_6-31g(d).firefly.inp (generated)

000706301.b3lyp_6-31g(d).smash.inp (generated)

000706301.b3lyp_6-31g(d).nwchem.inp (generated) 000706301.b3lyp_6-31g(d).log.xz 000706301.td-b3lyp_6-31g+(d).inp 000706301.td-b3lyp_6-31g+(d).log.xz

000706301.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706301.td-b3lyp_6-31+g(d).gjf (generated)

000706301.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706301.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706301.mol 000706301.PUBCHEM 000706301.mol (via Jmol)
000706326.b3lyp_6-31g(d).inp

000706326.b3lyp_6-31g(d).qchem.inp (generated)

000706326.b3lyp_6-31g(d).gjf (generated)

000706326.b3lyp_6-31g(d).firefly.inp (generated)

000706326.b3lyp_6-31g(d).smash.inp (generated)

000706326.b3lyp_6-31g(d).nwchem.inp (generated) 000706326.b3lyp_6-31g(d).log.xz 000706326.td-b3lyp_6-31g+(d).inp 000706326.td-b3lyp_6-31g+(d).log.xz

000706326.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706326.td-b3lyp_6-31+g(d).gjf (generated)

000706326.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706326.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706326.mol 000706326.PUBCHEM 000706326.mol (via Jmol)
000706327.b3lyp_6-31g(d).inp

000706327.b3lyp_6-31g(d).qchem.inp (generated)

000706327.b3lyp_6-31g(d).gjf (generated)

000706327.b3lyp_6-31g(d).firefly.inp (generated)

000706327.b3lyp_6-31g(d).smash.inp (generated)

000706327.b3lyp_6-31g(d).nwchem.inp (generated) 000706327.b3lyp_6-31g(d).log.xz 000706327.td-b3lyp_6-31g+(d).inp 000706327.td-b3lyp_6-31g+(d).log.xz

000706327.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706327.td-b3lyp_6-31+g(d).gjf (generated)

000706327.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706327.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706327.mol 000706327.PUBCHEM 000706327.mol (via Jmol)
000706394.b3lyp_6-31g(d).inp

000706394.b3lyp_6-31g(d).qchem.inp (generated)

000706394.b3lyp_6-31g(d).gjf (generated)

000706394.b3lyp_6-31g(d).firefly.inp (generated)

000706394.b3lyp_6-31g(d).smash.inp (generated)

000706394.b3lyp_6-31g(d).nwchem.inp (generated) 000706394.b3lyp_6-31g(d).log.xz 000706394.td-b3lyp_6-31g+(d).inp 000706394.td-b3lyp_6-31g+(d).log.xz

000706394.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706394.td-b3lyp_6-31+g(d).gjf (generated)

000706394.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706394.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706394.mol 000706394.PUBCHEM 000706394.mol (via Jmol)
000706395.b3lyp_6-31g(d).inp

000706395.b3lyp_6-31g(d).qchem.inp (generated)

000706395.b3lyp_6-31g(d).gjf (generated)

000706395.b3lyp_6-31g(d).firefly.inp (generated)

000706395.b3lyp_6-31g(d).smash.inp (generated)

000706395.b3lyp_6-31g(d).nwchem.inp (generated) 000706395.b3lyp_6-31g(d).log.xz 000706395.td-b3lyp_6-31g+(d).inp 000706395.td-b3lyp_6-31g+(d).log.xz

000706395.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706395.td-b3lyp_6-31+g(d).gjf (generated)

000706395.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706395.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706395.mol 000706395.PUBCHEM 000706395.mol (via Jmol)
000706398.b3lyp_6-31g(d).inp

000706398.b3lyp_6-31g(d).qchem.inp (generated)

000706398.b3lyp_6-31g(d).gjf (generated)

000706398.b3lyp_6-31g(d).firefly.inp (generated)

000706398.b3lyp_6-31g(d).smash.inp (generated)

000706398.b3lyp_6-31g(d).nwchem.inp (generated) 000706398.b3lyp_6-31g(d).log.xz 000706398.td-b3lyp_6-31g+(d).inp 000706398.td-b3lyp_6-31g+(d).log.xz

000706398.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706398.td-b3lyp_6-31+g(d).gjf (generated)

000706398.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706398.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706398.mol 000706398.PUBCHEM 000706398.mol (via Jmol)
000706401.b3lyp_6-31g(d).inp

000706401.b3lyp_6-31g(d).qchem.inp (generated)

000706401.b3lyp_6-31g(d).gjf (generated)

000706401.b3lyp_6-31g(d).firefly.inp (generated)

000706401.b3lyp_6-31g(d).smash.inp (generated)

000706401.b3lyp_6-31g(d).nwchem.inp (generated) 000706401.b3lyp_6-31g(d).log.xz 000706401.td-b3lyp_6-31g+(d).inp 000706401.td-b3lyp_6-31g+(d).log.xz

000706401.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706401.td-b3lyp_6-31+g(d).gjf (generated)

000706401.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706401.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706401.mol 000706401.PUBCHEM 000706401.mol (via Jmol)
000706423.b3lyp_6-31g(d).inp

000706423.b3lyp_6-31g(d).qchem.inp (generated)

000706423.b3lyp_6-31g(d).gjf (generated)

000706423.b3lyp_6-31g(d).firefly.inp (generated)

000706423.b3lyp_6-31g(d).smash.inp (generated)

000706423.b3lyp_6-31g(d).nwchem.inp (generated) 000706423.b3lyp_6-31g(d).log.xz 000706423.mol 000706423.PUBCHEM 000706423.mol (via Jmol)
000706424.b3lyp_6-31g(d).inp

000706424.b3lyp_6-31g(d).qchem.inp (generated)

000706424.b3lyp_6-31g(d).gjf (generated)

000706424.b3lyp_6-31g(d).firefly.inp (generated)

000706424.b3lyp_6-31g(d).smash.inp (generated)

000706424.b3lyp_6-31g(d).nwchem.inp (generated) 000706424.b3lyp_6-31g(d).log.xz 000706424.mol 000706424.PUBCHEM 000706424.mol (via Jmol)
000706425.b3lyp_6-31g(d).inp

000706425.b3lyp_6-31g(d).qchem.inp (generated)

000706425.b3lyp_6-31g(d).gjf (generated)

000706425.b3lyp_6-31g(d).firefly.inp (generated)

000706425.b3lyp_6-31g(d).smash.inp (generated)

000706425.b3lyp_6-31g(d).nwchem.inp (generated) 000706425.b3lyp_6-31g(d).log.xz 000706425.mol 000706425.PUBCHEM 000706425.mol (via Jmol)
000706428.b3lyp_6-31g(d).inp

000706428.b3lyp_6-31g(d).qchem.inp (generated)

000706428.b3lyp_6-31g(d).gjf (generated)

000706428.b3lyp_6-31g(d).firefly.inp (generated)

000706428.b3lyp_6-31g(d).smash.inp (generated)

000706428.b3lyp_6-31g(d).nwchem.inp (generated) 000706428.b3lyp_6-31g(d).log.xz 000706428.mol 000706428.PUBCHEM 000706428.mol (via Jmol)
000706461.b3lyp_6-31g(d).inp

000706461.b3lyp_6-31g(d).qchem.inp (generated)

000706461.b3lyp_6-31g(d).gjf (generated)

000706461.b3lyp_6-31g(d).firefly.inp (generated)

000706461.b3lyp_6-31g(d).smash.inp (generated)

000706461.b3lyp_6-31g(d).nwchem.inp (generated) 000706461.b3lyp_6-31g(d).log.xz 000706461.td-b3lyp_6-31g+(d).inp 000706461.td-b3lyp_6-31g+(d).log.xz

000706461.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706461.td-b3lyp_6-31+g(d).gjf (generated)

000706461.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706461.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706461.mol 000706461.PUBCHEM 000706461.mol (via Jmol)
000706462.b3lyp_6-31g(d).inp

000706462.b3lyp_6-31g(d).qchem.inp (generated)

000706462.b3lyp_6-31g(d).gjf (generated)

000706462.b3lyp_6-31g(d).firefly.inp (generated)

000706462.b3lyp_6-31g(d).smash.inp (generated)

000706462.b3lyp_6-31g(d).nwchem.inp (generated) 000706462.b3lyp_6-31g(d).log.xz 000706462.td-b3lyp_6-31g+(d).inp 000706462.td-b3lyp_6-31g+(d).log.xz

000706462.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706462.td-b3lyp_6-31+g(d).gjf (generated)

000706462.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706462.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706462.mol 000706462.PUBCHEM 000706462.mol (via Jmol)
000706477.b3lyp_6-31g(d).inp

000706477.b3lyp_6-31g(d).qchem.inp (generated)

000706477.b3lyp_6-31g(d).gjf (generated)

000706477.b3lyp_6-31g(d).firefly.inp (generated)

000706477.b3lyp_6-31g(d).smash.inp (generated)

000706477.b3lyp_6-31g(d).nwchem.inp (generated) 000706477.b3lyp_6-31g(d).log.xz 000706477.td-b3lyp_6-31g+(d).inp 000706477.td-b3lyp_6-31g+(d).log.xz

000706477.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706477.td-b3lyp_6-31+g(d).gjf (generated)

000706477.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706477.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706477.mol 000706477.PUBCHEM 000706477.mol (via Jmol)
000706488.b3lyp_6-31g(d).inp

000706488.b3lyp_6-31g(d).qchem.inp (generated)

000706488.b3lyp_6-31g(d).gjf (generated)

000706488.b3lyp_6-31g(d).firefly.inp (generated)

000706488.b3lyp_6-31g(d).smash.inp (generated)

000706488.b3lyp_6-31g(d).nwchem.inp (generated) 000706488.b3lyp_6-31g(d).log.xz 000706488.td-b3lyp_6-31g+(d).inp 000706488.td-b3lyp_6-31g+(d).log.xz

000706488.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706488.td-b3lyp_6-31+g(d).gjf (generated)

000706488.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706488.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706488.mol 000706488.PUBCHEM 000706488.mol (via Jmol)
000706495.b3lyp_6-31g(d).inp

000706495.b3lyp_6-31g(d).qchem.inp (generated)

000706495.b3lyp_6-31g(d).gjf (generated)

000706495.b3lyp_6-31g(d).firefly.inp (generated)

000706495.b3lyp_6-31g(d).smash.inp (generated)

000706495.b3lyp_6-31g(d).nwchem.inp (generated) 000706495.b3lyp_6-31g(d).log.xz 000706495.mol 000706495.PUBCHEM 000706495.mol (via Jmol)
000706524.b3lyp_6-31g(d).inp

000706524.b3lyp_6-31g(d).qchem.inp (generated)

000706524.b3lyp_6-31g(d).gjf (generated)

000706524.b3lyp_6-31g(d).firefly.inp (generated)

000706524.b3lyp_6-31g(d).smash.inp (generated)

000706524.b3lyp_6-31g(d).nwchem.inp (generated) 000706524.b3lyp_6-31g(d).log.xz 000706524.td-b3lyp_6-31g+(d).inp 000706524.td-b3lyp_6-31g+(d).log.xz

000706524.td-b3lyp_6-31+g(d).qchem.inp (generated)

000706524.td-b3lyp_6-31+g(d).gjf (generated)

000706524.td-b3lyp_6-31+g(d).firefly.inp (generated)

000706524.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000706524.mol 000706524.PUBCHEM 000706524.mol (via Jmol)
000706535.b3lyp_6-31g(d).inp