Index of

Last updated : Thu Apr 27 02:27:22 JST 2017
Total : 944 (817) in this page
004100059.b3lyp_6-31g(d).inp

004100059.b3lyp_6-31g(d).qchem.inp (generated)

004100059.b3lyp_6-31g(d).gjf (generated)

004100059.b3lyp_6-31g(d).firefly.inp (generated)

004100059.b3lyp_6-31g(d).smash.inp (generated)

004100059.b3lyp_6-31g(d).nwchem.inp (generated) 004100059.b3lyp_6-31g(d).log.xz 004100059.td-b3lyp_6-31g+(d).inp 004100059.td-b3lyp_6-31g+(d).log.xz

004100059.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100059.td-b3lyp_6-31+g(d).gjf (generated)

004100059.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100059.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100059.mol 004100059.PUBCHEM 004100059.mol (via Jmol)
004100067.b3lyp_6-31g(d).inp

004100067.b3lyp_6-31g(d).qchem.inp (generated)

004100067.b3lyp_6-31g(d).gjf (generated)

004100067.b3lyp_6-31g(d).firefly.inp (generated)

004100067.b3lyp_6-31g(d).smash.inp (generated)

004100067.b3lyp_6-31g(d).nwchem.inp (generated) 004100067.b3lyp_6-31g(d).log.xz 004100067.mol 004100067.PUBCHEM 004100067.mol (via Jmol)
004100069.b3lyp_6-31g(d).inp

004100069.b3lyp_6-31g(d).qchem.inp (generated)

004100069.b3lyp_6-31g(d).gjf (generated)

004100069.b3lyp_6-31g(d).firefly.inp (generated)

004100069.b3lyp_6-31g(d).smash.inp (generated)

004100069.b3lyp_6-31g(d).nwchem.inp (generated) 004100069.b3lyp_6-31g(d).log.xz 004100069.td-b3lyp_6-31g+(d).inp 004100069.td-b3lyp_6-31g+(d).log.xz

004100069.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100069.td-b3lyp_6-31+g(d).gjf (generated)

004100069.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100069.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100069.mol 004100069.PUBCHEM 004100069.mol (via Jmol)
004100091.b3lyp_6-31g(d).inp

004100091.b3lyp_6-31g(d).qchem.inp (generated)

004100091.b3lyp_6-31g(d).gjf (generated)

004100091.b3lyp_6-31g(d).firefly.inp (generated)

004100091.b3lyp_6-31g(d).smash.inp (generated)

004100091.b3lyp_6-31g(d).nwchem.inp (generated) 004100091.b3lyp_6-31g(d).log.xz 004100091.td-b3lyp_6-31g+(d).inp 004100091.td-b3lyp_6-31g+(d).log.xz

004100091.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100091.td-b3lyp_6-31+g(d).gjf (generated)

004100091.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100091.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100091.mol 004100091.PUBCHEM 004100091.mol (via Jmol)
004100125.b3lyp_6-31g(d).inp

004100125.b3lyp_6-31g(d).qchem.inp (generated)

004100125.b3lyp_6-31g(d).gjf (generated)

004100125.b3lyp_6-31g(d).firefly.inp (generated)

004100125.b3lyp_6-31g(d).smash.inp (generated)

004100125.b3lyp_6-31g(d).nwchem.inp (generated) 004100125.b3lyp_6-31g(d).log.xz 004100125.mol 004100125.PUBCHEM 004100125.mol (via Jmol)
004100213.b3lyp_6-31g(d).inp

004100213.b3lyp_6-31g(d).qchem.inp (generated)

004100213.b3lyp_6-31g(d).gjf (generated)

004100213.b3lyp_6-31g(d).firefly.inp (generated)

004100213.b3lyp_6-31g(d).smash.inp (generated)

004100213.b3lyp_6-31g(d).nwchem.inp (generated) 004100213.b3lyp_6-31g(d).log.xz 004100213.td-b3lyp_6-31g+(d).inp 004100213.td-b3lyp_6-31g+(d).log.xz

004100213.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100213.td-b3lyp_6-31+g(d).gjf (generated)

004100213.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100213.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100213.mol 004100213.PUBCHEM 004100213.mol (via Jmol)
004100216.b3lyp_6-31g(d).inp

004100216.b3lyp_6-31g(d).qchem.inp (generated)

004100216.b3lyp_6-31g(d).gjf (generated)

004100216.b3lyp_6-31g(d).firefly.inp (generated)

004100216.b3lyp_6-31g(d).smash.inp (generated)

004100216.b3lyp_6-31g(d).nwchem.inp (generated) 004100216.b3lyp_6-31g(d).log.xz 004100216.td-b3lyp_6-31g+(d).inp 004100216.td-b3lyp_6-31g+(d).log.xz

004100216.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100216.td-b3lyp_6-31+g(d).gjf (generated)

004100216.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100216.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100216.mol 004100216.PUBCHEM 004100216.mol (via Jmol)
004100338.b3lyp_6-31g(d).inp

004100338.b3lyp_6-31g(d).qchem.inp (generated)

004100338.b3lyp_6-31g(d).gjf (generated)

004100338.b3lyp_6-31g(d).firefly.inp (generated)

004100338.b3lyp_6-31g(d).smash.inp (generated)

004100338.b3lyp_6-31g(d).nwchem.inp (generated) 004100338.b3lyp_6-31g(d).log.xz 004100338.td-b3lyp_6-31g+(d).inp 004100338.td-b3lyp_6-31g+(d).log.xz

004100338.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100338.td-b3lyp_6-31+g(d).gjf (generated)

004100338.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100338.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100338.mol 004100338.PUBCHEM 004100338.mol (via Jmol)
004100344.b3lyp_6-31g(d).inp

004100344.b3lyp_6-31g(d).qchem.inp (generated)

004100344.b3lyp_6-31g(d).gjf (generated)

004100344.b3lyp_6-31g(d).firefly.inp (generated)

004100344.b3lyp_6-31g(d).smash.inp (generated)

004100344.b3lyp_6-31g(d).nwchem.inp (generated) 004100344.b3lyp_6-31g(d).log.xz 004100344.td-b3lyp_6-31g+(d).inp 004100344.td-b3lyp_6-31g+(d).log.xz

004100344.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100344.td-b3lyp_6-31+g(d).gjf (generated)

004100344.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100344.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100344.mol 004100344.PUBCHEM 004100344.mol (via Jmol)
004100367.b3lyp_6-31g(d).inp

004100367.b3lyp_6-31g(d).qchem.inp (generated)

004100367.b3lyp_6-31g(d).gjf (generated)

004100367.b3lyp_6-31g(d).firefly.inp (generated)

004100367.b3lyp_6-31g(d).smash.inp (generated)

004100367.b3lyp_6-31g(d).nwchem.inp (generated) 004100367.b3lyp_6-31g(d).log.xz 004100367.td-b3lyp_6-31g+(d).inp 004100367.td-b3lyp_6-31g+(d).log.xz

004100367.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100367.td-b3lyp_6-31+g(d).gjf (generated)

004100367.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100367.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100367.mol 004100367.PUBCHEM 004100367.mol (via Jmol)
004100429.b3lyp_6-31g(d).inp

004100429.b3lyp_6-31g(d).qchem.inp (generated)

004100429.b3lyp_6-31g(d).gjf (generated)

004100429.b3lyp_6-31g(d).firefly.inp (generated)

004100429.b3lyp_6-31g(d).smash.inp (generated)

004100429.b3lyp_6-31g(d).nwchem.inp (generated) 004100429.b3lyp_6-31g(d).log.xz 004100429.td-b3lyp_6-31g+(d).inp 004100429.td-b3lyp_6-31g+(d).log.xz

004100429.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100429.td-b3lyp_6-31+g(d).gjf (generated)

004100429.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100429.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100429.mol 004100429.PUBCHEM 004100429.mol (via Jmol)
004100430.b3lyp_6-31g(d).inp

004100430.b3lyp_6-31g(d).qchem.inp (generated)

004100430.b3lyp_6-31g(d).gjf (generated)

004100430.b3lyp_6-31g(d).firefly.inp (generated)

004100430.b3lyp_6-31g(d).smash.inp (generated)

004100430.b3lyp_6-31g(d).nwchem.inp (generated) 004100430.b3lyp_6-31g(d).log.xz 004100430.td-b3lyp_6-31g+(d).inp 004100430.td-b3lyp_6-31g+(d).log.xz

004100430.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100430.td-b3lyp_6-31+g(d).gjf (generated)

004100430.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100430.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100430.mol 004100430.PUBCHEM 004100430.mol (via Jmol)
004100431.b3lyp_6-31g(d).inp

004100431.b3lyp_6-31g(d).qchem.inp (generated)

004100431.b3lyp_6-31g(d).gjf (generated)

004100431.b3lyp_6-31g(d).firefly.inp (generated)

004100431.b3lyp_6-31g(d).smash.inp (generated)

004100431.b3lyp_6-31g(d).nwchem.inp (generated) 004100431.b3lyp_6-31g(d).log.xz 004100431.td-b3lyp_6-31g+(d).inp 004100431.td-b3lyp_6-31g+(d).log.xz

004100431.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100431.td-b3lyp_6-31+g(d).gjf (generated)

004100431.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100431.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100431.mol 004100431.PUBCHEM 004100431.mol (via Jmol)
004100438.b3lyp_6-31g(d).inp

004100438.b3lyp_6-31g(d).qchem.inp (generated)

004100438.b3lyp_6-31g(d).gjf (generated)

004100438.b3lyp_6-31g(d).firefly.inp (generated)

004100438.b3lyp_6-31g(d).smash.inp (generated)

004100438.b3lyp_6-31g(d).nwchem.inp (generated) 004100438.b3lyp_6-31g(d).log.xz 004100438.td-b3lyp_6-31g+(d).inp 004100438.td-b3lyp_6-31g+(d).log.xz

004100438.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100438.td-b3lyp_6-31+g(d).gjf (generated)

004100438.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100438.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100438.mol 004100438.PUBCHEM 004100438.mol (via Jmol)
004100458.b3lyp_6-31g(d).inp

004100458.b3lyp_6-31g(d).qchem.inp (generated)

004100458.b3lyp_6-31g(d).gjf (generated)

004100458.b3lyp_6-31g(d).firefly.inp (generated)

004100458.b3lyp_6-31g(d).smash.inp (generated)

004100458.b3lyp_6-31g(d).nwchem.inp (generated) 004100458.b3lyp_6-31g(d).log.xz 004100458.mol 004100458.PUBCHEM 004100458.mol (via Jmol)
004100516.b3lyp_6-31g(d).inp

004100516.b3lyp_6-31g(d).qchem.inp (generated)

004100516.b3lyp_6-31g(d).gjf (generated)

004100516.b3lyp_6-31g(d).firefly.inp (generated)

004100516.b3lyp_6-31g(d).smash.inp (generated)

004100516.b3lyp_6-31g(d).nwchem.inp (generated) 004100516.b3lyp_6-31g(d).log.xz 004100516.td-b3lyp_6-31g+(d).inp 004100516.td-b3lyp_6-31g+(d).log.xz

004100516.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100516.td-b3lyp_6-31+g(d).gjf (generated)

004100516.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100516.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100516.mol 004100516.PUBCHEM 004100516.mol (via Jmol)
004100526.b3lyp_6-31g(d).inp

004100526.b3lyp_6-31g(d).qchem.inp (generated)

004100526.b3lyp_6-31g(d).gjf (generated)

004100526.b3lyp_6-31g(d).firefly.inp (generated)

004100526.b3lyp_6-31g(d).smash.inp (generated)

004100526.b3lyp_6-31g(d).nwchem.inp (generated) 004100526.b3lyp_6-31g(d).log.xz 004100526.td-b3lyp_6-31g+(d).inp 004100526.td-b3lyp_6-31g+(d).log.xz

004100526.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100526.td-b3lyp_6-31+g(d).gjf (generated)

004100526.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100526.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100526.mol 004100526.PUBCHEM 004100526.mol (via Jmol)
004100565.b3lyp_6-31g(d).inp

004100565.b3lyp_6-31g(d).qchem.inp (generated)

004100565.b3lyp_6-31g(d).gjf (generated)

004100565.b3lyp_6-31g(d).firefly.inp (generated)

004100565.b3lyp_6-31g(d).smash.inp (generated)

004100565.b3lyp_6-31g(d).nwchem.inp (generated) 004100565.b3lyp_6-31g(d).log.xz 004100565.td-b3lyp_6-31g+(d).inp 004100565.td-b3lyp_6-31g+(d).log.xz

004100565.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100565.td-b3lyp_6-31+g(d).gjf (generated)

004100565.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100565.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100565.mol 004100565.PUBCHEM 004100565.mol (via Jmol)
004100578.b3lyp_6-31g(d).inp

004100578.b3lyp_6-31g(d).qchem.inp (generated)

004100578.b3lyp_6-31g(d).gjf (generated)

004100578.b3lyp_6-31g(d).firefly.inp (generated)

004100578.b3lyp_6-31g(d).smash.inp (generated)

004100578.b3lyp_6-31g(d).nwchem.inp (generated) 004100578.b3lyp_6-31g(d).log.xz 004100578.td-b3lyp_6-31g+(d).inp 004100578.td-b3lyp_6-31g+(d).log.xz

004100578.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100578.td-b3lyp_6-31+g(d).gjf (generated)

004100578.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100578.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100578.mol 004100578.PUBCHEM 004100578.mol (via Jmol)
004100581.b3lyp_6-31g(d).inp

004100581.b3lyp_6-31g(d).qchem.inp (generated)

004100581.b3lyp_6-31g(d).gjf (generated)

004100581.b3lyp_6-31g(d).firefly.inp (generated)

004100581.b3lyp_6-31g(d).smash.inp (generated)

004100581.b3lyp_6-31g(d).nwchem.inp (generated) 004100581.b3lyp_6-31g(d).log.xz 004100581.td-b3lyp_6-31g+(d).inp 004100581.td-b3lyp_6-31g+(d).log.xz

004100581.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100581.td-b3lyp_6-31+g(d).gjf (generated)

004100581.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100581.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100581.mol 004100581.PUBCHEM 004100581.mol (via Jmol)
004100582.b3lyp_6-31g(d).inp

004100582.b3lyp_6-31g(d).qchem.inp (generated)

004100582.b3lyp_6-31g(d).gjf (generated)

004100582.b3lyp_6-31g(d).firefly.inp (generated)

004100582.b3lyp_6-31g(d).smash.inp (generated)

004100582.b3lyp_6-31g(d).nwchem.inp (generated) 004100582.b3lyp_6-31g(d).log.xz 004100582.td-b3lyp_6-31g+(d).inp 004100582.td-b3lyp_6-31g+(d).log.xz

004100582.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100582.td-b3lyp_6-31+g(d).gjf (generated)

004100582.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100582.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100582.mol 004100582.PUBCHEM 004100582.mol (via Jmol)
004100598.b3lyp_6-31g(d).inp

004100598.b3lyp_6-31g(d).qchem.inp (generated)

004100598.b3lyp_6-31g(d).gjf (generated)

004100598.b3lyp_6-31g(d).firefly.inp (generated)

004100598.b3lyp_6-31g(d).smash.inp (generated)

004100598.b3lyp_6-31g(d).nwchem.inp (generated) 004100598.b3lyp_6-31g(d).log.xz 004100598.td-b3lyp_6-31g+(d).inp 004100598.td-b3lyp_6-31g+(d).log.xz

004100598.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100598.td-b3lyp_6-31+g(d).gjf (generated)

004100598.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100598.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100598.mol 004100598.PUBCHEM 004100598.mol (via Jmol)
004100618.b3lyp_6-31g(d).inp

004100618.b3lyp_6-31g(d).qchem.inp (generated)

004100618.b3lyp_6-31g(d).gjf (generated)

004100618.b3lyp_6-31g(d).firefly.inp (generated)

004100618.b3lyp_6-31g(d).smash.inp (generated)

004100618.b3lyp_6-31g(d).nwchem.inp (generated) 004100618.b3lyp_6-31g(d).log.xz 004100618.td-b3lyp_6-31g+(d).inp 004100618.td-b3lyp_6-31g+(d).log.xz

004100618.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100618.td-b3lyp_6-31+g(d).gjf (generated)

004100618.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100618.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100618.mol 004100618.PUBCHEM 004100618.mol (via Jmol)
004100747.b3lyp_6-31g(d).inp

004100747.b3lyp_6-31g(d).qchem.inp (generated)

004100747.b3lyp_6-31g(d).gjf (generated)

004100747.b3lyp_6-31g(d).firefly.inp (generated)

004100747.b3lyp_6-31g(d).smash.inp (generated)

004100747.b3lyp_6-31g(d).nwchem.inp (generated) 004100747.b3lyp_6-31g(d).log.xz 004100747.td-b3lyp_6-31g+(d).inp 004100747.td-b3lyp_6-31g+(d).log.xz

004100747.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100747.td-b3lyp_6-31+g(d).gjf (generated)

004100747.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100747.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100747.mol 004100747.PUBCHEM 004100747.mol (via Jmol)
004100753.b3lyp_6-31g(d).inp

004100753.b3lyp_6-31g(d).qchem.inp (generated)

004100753.b3lyp_6-31g(d).gjf (generated)

004100753.b3lyp_6-31g(d).firefly.inp (generated)

004100753.b3lyp_6-31g(d).smash.inp (generated)

004100753.b3lyp_6-31g(d).nwchem.inp (generated) 004100753.b3lyp_6-31g(d).log.xz 004100753.td-b3lyp_6-31g+(d).inp 004100753.td-b3lyp_6-31g+(d).log.xz

004100753.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100753.td-b3lyp_6-31+g(d).gjf (generated)

004100753.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100753.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100753.mol 004100753.PUBCHEM 004100753.mol (via Jmol)
004100754.b3lyp_6-31g(d).inp

004100754.b3lyp_6-31g(d).qchem.inp (generated)

004100754.b3lyp_6-31g(d).gjf (generated)

004100754.b3lyp_6-31g(d).firefly.inp (generated)

004100754.b3lyp_6-31g(d).smash.inp (generated)

004100754.b3lyp_6-31g(d).nwchem.inp (generated) 004100754.b3lyp_6-31g(d).log.xz 004100754.td-b3lyp_6-31g+(d).inp 004100754.td-b3lyp_6-31g+(d).log.xz

004100754.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100754.td-b3lyp_6-31+g(d).gjf (generated)

004100754.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100754.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100754.mol 004100754.PUBCHEM 004100754.mol (via Jmol)
004100755.b3lyp_6-31g(d).inp

004100755.b3lyp_6-31g(d).qchem.inp (generated)

004100755.b3lyp_6-31g(d).gjf (generated)

004100755.b3lyp_6-31g(d).firefly.inp (generated)

004100755.b3lyp_6-31g(d).smash.inp (generated)

004100755.b3lyp_6-31g(d).nwchem.inp (generated) 004100755.b3lyp_6-31g(d).log.xz 004100755.td-b3lyp_6-31g+(d).inp 004100755.td-b3lyp_6-31g+(d).log.xz

004100755.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100755.td-b3lyp_6-31+g(d).gjf (generated)

004100755.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100755.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100755.mol 004100755.PUBCHEM 004100755.mol (via Jmol)
004100757.b3lyp_6-31g(d).inp

004100757.b3lyp_6-31g(d).qchem.inp (generated)

004100757.b3lyp_6-31g(d).gjf (generated)

004100757.b3lyp_6-31g(d).firefly.inp (generated)

004100757.b3lyp_6-31g(d).smash.inp (generated)

004100757.b3lyp_6-31g(d).nwchem.inp (generated) 004100757.b3lyp_6-31g(d).log.xz 004100757.td-b3lyp_6-31g+(d).inp 004100757.td-b3lyp_6-31g+(d).log.xz

004100757.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100757.td-b3lyp_6-31+g(d).gjf (generated)

004100757.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100757.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100757.mol 004100757.PUBCHEM 004100757.mol (via Jmol)
004100856.b3lyp_6-31g(d).inp

004100856.b3lyp_6-31g(d).qchem.inp (generated)

004100856.b3lyp_6-31g(d).gjf (generated)

004100856.b3lyp_6-31g(d).firefly.inp (generated)

004100856.b3lyp_6-31g(d).smash.inp (generated)

004100856.b3lyp_6-31g(d).nwchem.inp (generated) 004100856.b3lyp_6-31g(d).log.xz 004100856.td-b3lyp_6-31g+(d).inp 004100856.td-b3lyp_6-31g+(d).log.xz

004100856.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100856.td-b3lyp_6-31+g(d).gjf (generated)

004100856.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100856.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100856.mol 004100856.PUBCHEM 004100856.mol (via Jmol)
004100857.b3lyp_6-31g(d).inp

004100857.b3lyp_6-31g(d).qchem.inp (generated)

004100857.b3lyp_6-31g(d).gjf (generated)

004100857.b3lyp_6-31g(d).firefly.inp (generated)

004100857.b3lyp_6-31g(d).smash.inp (generated)

004100857.b3lyp_6-31g(d).nwchem.inp (generated) 004100857.b3lyp_6-31g(d).log.xz 004100857.td-b3lyp_6-31g+(d).inp 004100857.td-b3lyp_6-31g+(d).log.xz

004100857.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100857.td-b3lyp_6-31+g(d).gjf (generated)

004100857.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100857.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100857.mol 004100857.PUBCHEM 004100857.mol (via Jmol)
004100860.b3lyp_6-31g(d).inp

004100860.b3lyp_6-31g(d).qchem.inp (generated)

004100860.b3lyp_6-31g(d).gjf (generated)

004100860.b3lyp_6-31g(d).firefly.inp (generated)

004100860.b3lyp_6-31g(d).smash.inp (generated)

004100860.b3lyp_6-31g(d).nwchem.inp (generated) 004100860.b3lyp_6-31g(d).log.xz 004100860.td-b3lyp_6-31g+(d).inp 004100860.td-b3lyp_6-31g+(d).log.xz

004100860.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100860.td-b3lyp_6-31+g(d).gjf (generated)

004100860.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100860.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100860.mol 004100860.PUBCHEM 004100860.mol (via Jmol)
004100861.b3lyp_6-31g(d).inp

004100861.b3lyp_6-31g(d).qchem.inp (generated)

004100861.b3lyp_6-31g(d).gjf (generated)

004100861.b3lyp_6-31g(d).firefly.inp (generated)

004100861.b3lyp_6-31g(d).smash.inp (generated)

004100861.b3lyp_6-31g(d).nwchem.inp (generated) 004100861.b3lyp_6-31g(d).log.xz 004100861.td-b3lyp_6-31g+(d).inp 004100861.td-b3lyp_6-31g+(d).log.xz

004100861.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100861.td-b3lyp_6-31+g(d).gjf (generated)

004100861.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100861.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100861.mol 004100861.PUBCHEM 004100861.mol (via Jmol)
004100862.b3lyp_6-31g(d).inp

004100862.b3lyp_6-31g(d).qchem.inp (generated)

004100862.b3lyp_6-31g(d).gjf (generated)

004100862.b3lyp_6-31g(d).firefly.inp (generated)

004100862.b3lyp_6-31g(d).smash.inp (generated)

004100862.b3lyp_6-31g(d).nwchem.inp (generated) 004100862.b3lyp_6-31g(d).log.xz 004100862.td-b3lyp_6-31g+(d).inp 004100862.td-b3lyp_6-31g+(d).log.xz

004100862.td-b3lyp_6-31+g(d).qchem.inp (generated)

004100862.td-b3lyp_6-31+g(d).gjf (generated)

004100862.td-b3lyp_6-31+g(d).firefly.inp (generated)

004100862.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004100862.mol 004100862.PUBCHEM 004100862.mol (via Jmol)
004100874.b3lyp_6-31g(d).inp

004100874.b3lyp_6-31g(d).qchem.inp (generated)

004100874.b3lyp_6-31g(d).gjf (generated)

004100874.b3lyp_6-31g(d).firefly.inp (generated)

004100874.b3lyp_6-31g(d).smash.inp (generated)

004100874.b3lyp_6-31g(d).nwchem.inp (generated) 004100874.b3lyp_6-31g(d).log.xz 004100874.mol 004100874.PUBCHEM 004100874.mol (via Jmol)
004101001.b3lyp_6-31g(d).inp

004101001.b3lyp_6-31g(d).qchem.inp (generated)

004101001.b3lyp_6-31g(d).gjf (generated)

004101001.b3lyp_6-31g(d).firefly.inp (generated)

004101001.b3lyp_6-31g(d).smash.inp (generated)

004101001.b3lyp_6-31g(d).nwchem.inp (generated) 004101001.b3lyp_6-31g(d).log.xz 004101001.td-b3lyp_6-31g+(d).inp 004101001.td-b3lyp_6-31g+(d).log.xz

004101001.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101001.td-b3lyp_6-31+g(d).gjf (generated)

004101001.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101001.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101001.mol 004101001.PUBCHEM 004101001.mol (via Jmol)
004101110.b3lyp_6-31g(d).inp

004101110.b3lyp_6-31g(d).qchem.inp (generated)

004101110.b3lyp_6-31g(d).gjf (generated)

004101110.b3lyp_6-31g(d).firefly.inp (generated)

004101110.b3lyp_6-31g(d).smash.inp (generated)

004101110.b3lyp_6-31g(d).nwchem.inp (generated) 004101110.b3lyp_6-31g(d).log.xz 004101110.td-b3lyp_6-31g+(d).inp 004101110.td-b3lyp_6-31g+(d).log.xz

004101110.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101110.td-b3lyp_6-31+g(d).gjf (generated)

004101110.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101110.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101110.mol 004101110.PUBCHEM 004101110.mol (via Jmol)
004101123.b3lyp_6-31g(d).inp

004101123.b3lyp_6-31g(d).qchem.inp (generated)

004101123.b3lyp_6-31g(d).gjf (generated)

004101123.b3lyp_6-31g(d).firefly.inp (generated)

004101123.b3lyp_6-31g(d).smash.inp (generated)

004101123.b3lyp_6-31g(d).nwchem.inp (generated) 004101123.b3lyp_6-31g(d).log.xz 004101123.mol 004101123.PUBCHEM 004101123.mol (via Jmol)
004101205.b3lyp_6-31g(d).inp

004101205.b3lyp_6-31g(d).qchem.inp (generated)

004101205.b3lyp_6-31g(d).gjf (generated)

004101205.b3lyp_6-31g(d).firefly.inp (generated)

004101205.b3lyp_6-31g(d).smash.inp (generated)

004101205.b3lyp_6-31g(d).nwchem.inp (generated) 004101205.b3lyp_6-31g(d).log.xz 004101205.td-b3lyp_6-31g+(d).inp 004101205.td-b3lyp_6-31g+(d).log.xz

004101205.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101205.td-b3lyp_6-31+g(d).gjf (generated)

004101205.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101205.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101205.mol 004101205.PUBCHEM 004101205.mol (via Jmol)
004101228.b3lyp_6-31g(d).inp

004101228.b3lyp_6-31g(d).qchem.inp (generated)

004101228.b3lyp_6-31g(d).gjf (generated)

004101228.b3lyp_6-31g(d).firefly.inp (generated)

004101228.b3lyp_6-31g(d).smash.inp (generated)

004101228.b3lyp_6-31g(d).nwchem.inp (generated) 004101228.b3lyp_6-31g(d).log.xz 004101228.td-b3lyp_6-31g+(d).inp 004101228.td-b3lyp_6-31g+(d).log.xz

004101228.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101228.td-b3lyp_6-31+g(d).gjf (generated)

004101228.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101228.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101228.mol 004101228.PUBCHEM 004101228.mol (via Jmol)
004101247.b3lyp_6-31g(d).inp

004101247.b3lyp_6-31g(d).qchem.inp (generated)

004101247.b3lyp_6-31g(d).gjf (generated)

004101247.b3lyp_6-31g(d).firefly.inp (generated)

004101247.b3lyp_6-31g(d).smash.inp (generated)

004101247.b3lyp_6-31g(d).nwchem.inp (generated) 004101247.b3lyp_6-31g(d).log.xz 004101247.td-b3lyp_6-31g+(d).inp 004101247.td-b3lyp_6-31g+(d).log.xz

004101247.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101247.td-b3lyp_6-31+g(d).gjf (generated)

004101247.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101247.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101247.mol 004101247.PUBCHEM 004101247.mol (via Jmol)
004101255.b3lyp_6-31g(d).inp

004101255.b3lyp_6-31g(d).qchem.inp (generated)

004101255.b3lyp_6-31g(d).gjf (generated)

004101255.b3lyp_6-31g(d).firefly.inp (generated)

004101255.b3lyp_6-31g(d).smash.inp (generated)

004101255.b3lyp_6-31g(d).nwchem.inp (generated) 004101255.b3lyp_6-31g(d).log.xz 004101255.td-b3lyp_6-31g+(d).inp 004101255.td-b3lyp_6-31g+(d).log.xz

004101255.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101255.td-b3lyp_6-31+g(d).gjf (generated)

004101255.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101255.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101255.mol 004101255.PUBCHEM 004101255.mol (via Jmol)
004101257.b3lyp_6-31g(d).inp

004101257.b3lyp_6-31g(d).qchem.inp (generated)

004101257.b3lyp_6-31g(d).gjf (generated)

004101257.b3lyp_6-31g(d).firefly.inp (generated)

004101257.b3lyp_6-31g(d).smash.inp (generated)

004101257.b3lyp_6-31g(d).nwchem.inp (generated) 004101257.b3lyp_6-31g(d).log.xz 004101257.td-b3lyp_6-31g+(d).inp 004101257.td-b3lyp_6-31g+(d).log.xz

004101257.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101257.td-b3lyp_6-31+g(d).gjf (generated)

004101257.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101257.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101257.mol 004101257.PUBCHEM 004101257.mol (via Jmol)
004101260.b3lyp_6-31g(d).inp

004101260.b3lyp_6-31g(d).qchem.inp (generated)

004101260.b3lyp_6-31g(d).gjf (generated)

004101260.b3lyp_6-31g(d).firefly.inp (generated)

004101260.b3lyp_6-31g(d).smash.inp (generated)

004101260.b3lyp_6-31g(d).nwchem.inp (generated) 004101260.b3lyp_6-31g(d).log.xz 004101260.td-b3lyp_6-31g+(d).inp 004101260.td-b3lyp_6-31g+(d).log.xz

004101260.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101260.td-b3lyp_6-31+g(d).gjf (generated)

004101260.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101260.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101260.mol 004101260.PUBCHEM 004101260.mol (via Jmol)
004101271.b3lyp_6-31g(d).inp

004101271.b3lyp_6-31g(d).qchem.inp (generated)

004101271.b3lyp_6-31g(d).gjf (generated)

004101271.b3lyp_6-31g(d).firefly.inp (generated)

004101271.b3lyp_6-31g(d).smash.inp (generated)

004101271.b3lyp_6-31g(d).nwchem.inp (generated) 004101271.b3lyp_6-31g(d).log.xz 004101271.td-b3lyp_6-31g+(d).inp 004101271.td-b3lyp_6-31g+(d).log.xz

004101271.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101271.td-b3lyp_6-31+g(d).gjf (generated)

004101271.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101271.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101271.mol 004101271.PUBCHEM 004101271.mol (via Jmol)
004101284.b3lyp_6-31g(d).inp

004101284.b3lyp_6-31g(d).qchem.inp (generated)

004101284.b3lyp_6-31g(d).gjf (generated)

004101284.b3lyp_6-31g(d).firefly.inp (generated)

004101284.b3lyp_6-31g(d).smash.inp (generated)

004101284.b3lyp_6-31g(d).nwchem.inp (generated) 004101284.b3lyp_6-31g(d).log.xz 004101284.mol 004101284.PUBCHEM 004101284.mol (via Jmol)
004101311.b3lyp_6-31g(d).inp

004101311.b3lyp_6-31g(d).qchem.inp (generated)

004101311.b3lyp_6-31g(d).gjf (generated)

004101311.b3lyp_6-31g(d).firefly.inp (generated)

004101311.b3lyp_6-31g(d).smash.inp (generated)

004101311.b3lyp_6-31g(d).nwchem.inp (generated) 004101311.b3lyp_6-31g(d).log.xz 004101311.mol 004101311.PUBCHEM 004101311.mol (via Jmol)
004101323.b3lyp_6-31g(d).inp

004101323.b3lyp_6-31g(d).qchem.inp (generated)

004101323.b3lyp_6-31g(d).gjf (generated)

004101323.b3lyp_6-31g(d).firefly.inp (generated)

004101323.b3lyp_6-31g(d).smash.inp (generated)

004101323.b3lyp_6-31g(d).nwchem.inp (generated) 004101323.b3lyp_6-31g(d).log.xz 004101323.td-b3lyp_6-31g+(d).inp 004101323.td-b3lyp_6-31g+(d).log.xz

004101323.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101323.td-b3lyp_6-31+g(d).gjf (generated)

004101323.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101323.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101323.mol 004101323.PUBCHEM 004101323.mol (via Jmol)
004101353.b3lyp_6-31g(d).inp

004101353.b3lyp_6-31g(d).qchem.inp (generated)

004101353.b3lyp_6-31g(d).gjf (generated)

004101353.b3lyp_6-31g(d).firefly.inp (generated)

004101353.b3lyp_6-31g(d).smash.inp (generated)

004101353.b3lyp_6-31g(d).nwchem.inp (generated) 004101353.b3lyp_6-31g(d).log.xz 004101353.td-b3lyp_6-31g+(d).inp 004101353.td-b3lyp_6-31g+(d).log.xz

004101353.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101353.td-b3lyp_6-31+g(d).gjf (generated)

004101353.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101353.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101353.mol 004101353.PUBCHEM 004101353.mol (via Jmol)
004101363.b3lyp_6-31g(d).inp

004101363.b3lyp_6-31g(d).qchem.inp (generated)

004101363.b3lyp_6-31g(d).gjf (generated)

004101363.b3lyp_6-31g(d).firefly.inp (generated)

004101363.b3lyp_6-31g(d).smash.inp (generated)

004101363.b3lyp_6-31g(d).nwchem.inp (generated) 004101363.b3lyp_6-31g(d).log.xz 004101363.td-b3lyp_6-31g+(d).inp 004101363.td-b3lyp_6-31g+(d).log.xz

004101363.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101363.td-b3lyp_6-31+g(d).gjf (generated)

004101363.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101363.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101363.mol 004101363.PUBCHEM 004101363.mol (via Jmol)
004101372.b3lyp_6-31g(d).inp

004101372.b3lyp_6-31g(d).qchem.inp (generated)

004101372.b3lyp_6-31g(d).gjf (generated)

004101372.b3lyp_6-31g(d).firefly.inp (generated)

004101372.b3lyp_6-31g(d).smash.inp (generated)

004101372.b3lyp_6-31g(d).nwchem.inp (generated) 004101372.b3lyp_6-31g(d).log.xz 004101372.td-b3lyp_6-31g+(d).inp 004101372.td-b3lyp_6-31g+(d).log.xz

004101372.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101372.td-b3lyp_6-31+g(d).gjf (generated)

004101372.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101372.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101372.mol 004101372.PUBCHEM 004101372.mol (via Jmol)
004101389.b3lyp_6-31g(d).inp

004101389.b3lyp_6-31g(d).qchem.inp (generated)

004101389.b3lyp_6-31g(d).gjf (generated)

004101389.b3lyp_6-31g(d).firefly.inp (generated)

004101389.b3lyp_6-31g(d).smash.inp (generated)

004101389.b3lyp_6-31g(d).nwchem.inp (generated) 004101389.b3lyp_6-31g(d).log.xz 004101389.td-b3lyp_6-31g+(d).inp 004101389.td-b3lyp_6-31g+(d).log.xz

004101389.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101389.td-b3lyp_6-31+g(d).gjf (generated)

004101389.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101389.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101389.mol 004101389.PUBCHEM 004101389.mol (via Jmol)
004101393.b3lyp_6-31g(d).inp

004101393.b3lyp_6-31g(d).qchem.inp (generated)

004101393.b3lyp_6-31g(d).gjf (generated)

004101393.b3lyp_6-31g(d).firefly.inp (generated)

004101393.b3lyp_6-31g(d).smash.inp (generated)

004101393.b3lyp_6-31g(d).nwchem.inp (generated) 004101393.b3lyp_6-31g(d).log.xz 004101393.td-b3lyp_6-31g+(d).inp 004101393.td-b3lyp_6-31g+(d).log.xz

004101393.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101393.td-b3lyp_6-31+g(d).gjf (generated)

004101393.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101393.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101393.mol 004101393.PUBCHEM 004101393.mol (via Jmol)
004101397.b3lyp_6-31g(d).inp

004101397.b3lyp_6-31g(d).qchem.inp (generated)

004101397.b3lyp_6-31g(d).gjf (generated)

004101397.b3lyp_6-31g(d).firefly.inp (generated)

004101397.b3lyp_6-31g(d).smash.inp (generated)

004101397.b3lyp_6-31g(d).nwchem.inp (generated) 004101397.b3lyp_6-31g(d).log.xz 004101397.td-b3lyp_6-31g+(d).inp 004101397.td-b3lyp_6-31g+(d).log.xz

004101397.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101397.td-b3lyp_6-31+g(d).gjf (generated)

004101397.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101397.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101397.mol 004101397.PUBCHEM 004101397.mol (via Jmol)
004101400.b3lyp_6-31g(d).inp

004101400.b3lyp_6-31g(d).qchem.inp (generated)

004101400.b3lyp_6-31g(d).gjf (generated)

004101400.b3lyp_6-31g(d).firefly.inp (generated)

004101400.b3lyp_6-31g(d).smash.inp (generated)

004101400.b3lyp_6-31g(d).nwchem.inp (generated) 004101400.b3lyp_6-31g(d).log.xz 004101400.td-b3lyp_6-31g+(d).inp 004101400.td-b3lyp_6-31g+(d).log.xz

004101400.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101400.td-b3lyp_6-31+g(d).gjf (generated)

004101400.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101400.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101400.mol 004101400.PUBCHEM 004101400.mol (via Jmol)
004101401.b3lyp_6-31g(d).inp

004101401.b3lyp_6-31g(d).qchem.inp (generated)

004101401.b3lyp_6-31g(d).gjf (generated)

004101401.b3lyp_6-31g(d).firefly.inp (generated)

004101401.b3lyp_6-31g(d).smash.inp (generated)

004101401.b3lyp_6-31g(d).nwchem.inp (generated) 004101401.b3lyp_6-31g(d).log.xz 004101401.td-b3lyp_6-31g+(d).inp 004101401.td-b3lyp_6-31g+(d).log.xz

004101401.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101401.td-b3lyp_6-31+g(d).gjf (generated)

004101401.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101401.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101401.mol 004101401.PUBCHEM 004101401.mol (via Jmol)
004101402.b3lyp_6-31g(d).inp

004101402.b3lyp_6-31g(d).qchem.inp (generated)

004101402.b3lyp_6-31g(d).gjf (generated)

004101402.b3lyp_6-31g(d).firefly.inp (generated)

004101402.b3lyp_6-31g(d).smash.inp (generated)

004101402.b3lyp_6-31g(d).nwchem.inp (generated) 004101402.b3lyp_6-31g(d).log.xz 004101402.td-b3lyp_6-31g+(d).inp 004101402.td-b3lyp_6-31g+(d).log.xz

004101402.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101402.td-b3lyp_6-31+g(d).gjf (generated)

004101402.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101402.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101402.mol 004101402.PUBCHEM 004101402.mol (via Jmol)
004101406.b3lyp_6-31g(d).inp

004101406.b3lyp_6-31g(d).qchem.inp (generated)

004101406.b3lyp_6-31g(d).gjf (generated)

004101406.b3lyp_6-31g(d).firefly.inp (generated)

004101406.b3lyp_6-31g(d).smash.inp (generated)

004101406.b3lyp_6-31g(d).nwchem.inp (generated) 004101406.b3lyp_6-31g(d).log.xz 004101406.td-b3lyp_6-31g+(d).inp 004101406.td-b3lyp_6-31g+(d).log.xz

004101406.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101406.td-b3lyp_6-31+g(d).gjf (generated)

004101406.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101406.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101406.mol 004101406.PUBCHEM 004101406.mol (via Jmol)
004101421.b3lyp_6-31g(d).inp

004101421.b3lyp_6-31g(d).qchem.inp (generated)

004101421.b3lyp_6-31g(d).gjf (generated)

004101421.b3lyp_6-31g(d).firefly.inp (generated)

004101421.b3lyp_6-31g(d).smash.inp (generated)

004101421.b3lyp_6-31g(d).nwchem.inp (generated) 004101421.b3lyp_6-31g(d).log.xz 004101421.td-b3lyp_6-31g+(d).inp 004101421.td-b3lyp_6-31g+(d).log.xz

004101421.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101421.td-b3lyp_6-31+g(d).gjf (generated)

004101421.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101421.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101421.mol 004101421.PUBCHEM 004101421.mol (via Jmol)
004101437.b3lyp_6-31g(d).inp

004101437.b3lyp_6-31g(d).qchem.inp (generated)

004101437.b3lyp_6-31g(d).gjf (generated)

004101437.b3lyp_6-31g(d).firefly.inp (generated)

004101437.b3lyp_6-31g(d).smash.inp (generated)

004101437.b3lyp_6-31g(d).nwchem.inp (generated) 004101437.b3lyp_6-31g(d).log.xz 004101437.td-b3lyp_6-31g+(d).inp 004101437.td-b3lyp_6-31g+(d).log.xz

004101437.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101437.td-b3lyp_6-31+g(d).gjf (generated)

004101437.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101437.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101437.mol 004101437.PUBCHEM 004101437.mol (via Jmol)
004101454.b3lyp_6-31g(d).inp

004101454.b3lyp_6-31g(d).qchem.inp (generated)

004101454.b3lyp_6-31g(d).gjf (generated)

004101454.b3lyp_6-31g(d).firefly.inp (generated)

004101454.b3lyp_6-31g(d).smash.inp (generated)

004101454.b3lyp_6-31g(d).nwchem.inp (generated) 004101454.b3lyp_6-31g(d).log.xz 004101454.td-b3lyp_6-31g+(d).inp 004101454.td-b3lyp_6-31g+(d).log.xz

004101454.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101454.td-b3lyp_6-31+g(d).gjf (generated)

004101454.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101454.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101454.mol 004101454.PUBCHEM 004101454.mol (via Jmol)
004101460.b3lyp_6-31g(d).inp

004101460.b3lyp_6-31g(d).qchem.inp (generated)

004101460.b3lyp_6-31g(d).gjf (generated)

004101460.b3lyp_6-31g(d).firefly.inp (generated)

004101460.b3lyp_6-31g(d).smash.inp (generated)

004101460.b3lyp_6-31g(d).nwchem.inp (generated) 004101460.b3lyp_6-31g(d).log.xz 004101460.td-b3lyp_6-31g+(d).inp 004101460.td-b3lyp_6-31g+(d).log.xz

004101460.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101460.td-b3lyp_6-31+g(d).gjf (generated)

004101460.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101460.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101460.mol 004101460.PUBCHEM 004101460.mol (via Jmol)
004101469.b3lyp_6-31g(d).inp

004101469.b3lyp_6-31g(d).qchem.inp (generated)

004101469.b3lyp_6-31g(d).gjf (generated)

004101469.b3lyp_6-31g(d).firefly.inp (generated)

004101469.b3lyp_6-31g(d).smash.inp (generated)

004101469.b3lyp_6-31g(d).nwchem.inp (generated) 004101469.b3lyp_6-31g(d).log.xz 004101469.td-b3lyp_6-31g+(d).inp 004101469.td-b3lyp_6-31g+(d).log.xz

004101469.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101469.td-b3lyp_6-31+g(d).gjf (generated)

004101469.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101469.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101469.mol 004101469.PUBCHEM 004101469.mol (via Jmol)
004101471.b3lyp_6-31g(d).inp

004101471.b3lyp_6-31g(d).qchem.inp (generated)

004101471.b3lyp_6-31g(d).gjf (generated)

004101471.b3lyp_6-31g(d).firefly.inp (generated)

004101471.b3lyp_6-31g(d).smash.inp (generated)

004101471.b3lyp_6-31g(d).nwchem.inp (generated) 004101471.b3lyp_6-31g(d).log.xz 004101471.mol 004101471.PUBCHEM 004101471.mol (via Jmol)
004101484.b3lyp_6-31g(d).inp

004101484.b3lyp_6-31g(d).qchem.inp (generated)

004101484.b3lyp_6-31g(d).gjf (generated)

004101484.b3lyp_6-31g(d).firefly.inp (generated)

004101484.b3lyp_6-31g(d).smash.inp (generated)

004101484.b3lyp_6-31g(d).nwchem.inp (generated) 004101484.b3lyp_6-31g(d).log.xz 004101484.mol 004101484.PUBCHEM 004101484.mol (via Jmol)
004101494.b3lyp_6-31g(d).inp

004101494.b3lyp_6-31g(d).qchem.inp (generated)

004101494.b3lyp_6-31g(d).gjf (generated)

004101494.b3lyp_6-31g(d).firefly.inp (generated)

004101494.b3lyp_6-31g(d).smash.inp (generated)

004101494.b3lyp_6-31g(d).nwchem.inp (generated) 004101494.b3lyp_6-31g(d).log.xz 004101494.td-b3lyp_6-31g+(d).inp 004101494.td-b3lyp_6-31g+(d).log.xz

004101494.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101494.td-b3lyp_6-31+g(d).gjf (generated)

004101494.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101494.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101494.mol 004101494.PUBCHEM 004101494.mol (via Jmol)
004101513.b3lyp_6-31g(d).inp

004101513.b3lyp_6-31g(d).qchem.inp (generated)

004101513.b3lyp_6-31g(d).gjf (generated)

004101513.b3lyp_6-31g(d).firefly.inp (generated)

004101513.b3lyp_6-31g(d).smash.inp (generated)

004101513.b3lyp_6-31g(d).nwchem.inp (generated) 004101513.b3lyp_6-31g(d).log.xz 004101513.td-b3lyp_6-31g+(d).inp 004101513.td-b3lyp_6-31g+(d).log.xz

004101513.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101513.td-b3lyp_6-31+g(d).gjf (generated)

004101513.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101513.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101513.mol 004101513.PUBCHEM 004101513.mol (via Jmol)
004101592.b3lyp_6-31g(d).inp

004101592.b3lyp_6-31g(d).qchem.inp (generated)

004101592.b3lyp_6-31g(d).gjf (generated)

004101592.b3lyp_6-31g(d).firefly.inp (generated)

004101592.b3lyp_6-31g(d).smash.inp (generated)

004101592.b3lyp_6-31g(d).nwchem.inp (generated) 004101592.b3lyp_6-31g(d).log.xz 004101592.td-b3lyp_6-31g+(d).inp 004101592.td-b3lyp_6-31g+(d).log.xz

004101592.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101592.td-b3lyp_6-31+g(d).gjf (generated)

004101592.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101592.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101592.mol 004101592.PUBCHEM 004101592.mol (via Jmol)
004101679.b3lyp_6-31g(d).inp

004101679.b3lyp_6-31g(d).qchem.inp (generated)

004101679.b3lyp_6-31g(d).gjf (generated)

004101679.b3lyp_6-31g(d).firefly.inp (generated)

004101679.b3lyp_6-31g(d).smash.inp (generated)

004101679.b3lyp_6-31g(d).nwchem.inp (generated) 004101679.b3lyp_6-31g(d).log.xz 004101679.td-b3lyp_6-31g+(d).inp 004101679.td-b3lyp_6-31g+(d).log.xz

004101679.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101679.td-b3lyp_6-31+g(d).gjf (generated)

004101679.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101679.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101679.mol 004101679.PUBCHEM 004101679.mol (via Jmol)
004101743.b3lyp_6-31g(d).inp

004101743.b3lyp_6-31g(d).qchem.inp (generated)

004101743.b3lyp_6-31g(d).gjf (generated)

004101743.b3lyp_6-31g(d).firefly.inp (generated)

004101743.b3lyp_6-31g(d).smash.inp (generated)

004101743.b3lyp_6-31g(d).nwchem.inp (generated) 004101743.b3lyp_6-31g(d).log.xz 004101743.td-b3lyp_6-31g+(d).inp 004101743.td-b3lyp_6-31g+(d).log.xz

004101743.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101743.td-b3lyp_6-31+g(d).gjf (generated)

004101743.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101743.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101743.mol 004101743.PUBCHEM 004101743.mol (via Jmol)
004101745.b3lyp_6-31g(d).inp

004101745.b3lyp_6-31g(d).qchem.inp (generated)

004101745.b3lyp_6-31g(d).gjf (generated)

004101745.b3lyp_6-31g(d).firefly.inp (generated)

004101745.b3lyp_6-31g(d).smash.inp (generated)

004101745.b3lyp_6-31g(d).nwchem.inp (generated) 004101745.b3lyp_6-31g(d).log.xz 004101745.td-b3lyp_6-31g+(d).inp 004101745.td-b3lyp_6-31g+(d).log.xz

004101745.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101745.td-b3lyp_6-31+g(d).gjf (generated)

004101745.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101745.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101745.mol 004101745.PUBCHEM 004101745.mol (via Jmol)
004101762.b3lyp_6-31g(d).inp

004101762.b3lyp_6-31g(d).qchem.inp (generated)

004101762.b3lyp_6-31g(d).gjf (generated)

004101762.b3lyp_6-31g(d).firefly.inp (generated)

004101762.b3lyp_6-31g(d).smash.inp (generated)

004101762.b3lyp_6-31g(d).nwchem.inp (generated) 004101762.b3lyp_6-31g(d).log.xz 004101762.td-b3lyp_6-31g+(d).inp 004101762.td-b3lyp_6-31g+(d).log.xz

004101762.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101762.td-b3lyp_6-31+g(d).gjf (generated)

004101762.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101762.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101762.mol 004101762.PUBCHEM 004101762.mol (via Jmol)
004101767.b3lyp_6-31g(d).inp

004101767.b3lyp_6-31g(d).qchem.inp (generated)

004101767.b3lyp_6-31g(d).gjf (generated)

004101767.b3lyp_6-31g(d).firefly.inp (generated)

004101767.b3lyp_6-31g(d).smash.inp (generated)

004101767.b3lyp_6-31g(d).nwchem.inp (generated) 004101767.b3lyp_6-31g(d).log.xz 004101767.td-b3lyp_6-31g+(d).inp 004101767.td-b3lyp_6-31g+(d).log.xz

004101767.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101767.td-b3lyp_6-31+g(d).gjf (generated)

004101767.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101767.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101767.mol 004101767.PUBCHEM 004101767.mol (via Jmol)
004101769.b3lyp_6-31g(d).inp

004101769.b3lyp_6-31g(d).qchem.inp (generated)

004101769.b3lyp_6-31g(d).gjf (generated)

004101769.b3lyp_6-31g(d).firefly.inp (generated)

004101769.b3lyp_6-31g(d).smash.inp (generated)

004101769.b3lyp_6-31g(d).nwchem.inp (generated) 004101769.b3lyp_6-31g(d).log.xz 004101769.td-b3lyp_6-31g+(d).inp 004101769.td-b3lyp_6-31g+(d).log.xz

004101769.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101769.td-b3lyp_6-31+g(d).gjf (generated)

004101769.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101769.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101769.mol 004101769.PUBCHEM 004101769.mol (via Jmol)
004101773.b3lyp_6-31g(d).inp

004101773.b3lyp_6-31g(d).qchem.inp (generated)

004101773.b3lyp_6-31g(d).gjf (generated)

004101773.b3lyp_6-31g(d).firefly.inp (generated)

004101773.b3lyp_6-31g(d).smash.inp (generated)

004101773.b3lyp_6-31g(d).nwchem.inp (generated) 004101773.b3lyp_6-31g(d).log.xz 004101773.td-b3lyp_6-31g+(d).inp 004101773.td-b3lyp_6-31g+(d).log.xz

004101773.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101773.td-b3lyp_6-31+g(d).gjf (generated)

004101773.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101773.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101773.mol 004101773.PUBCHEM 004101773.mol (via Jmol)
004101785.b3lyp_6-31g(d).inp

004101785.b3lyp_6-31g(d).qchem.inp (generated)

004101785.b3lyp_6-31g(d).gjf (generated)

004101785.b3lyp_6-31g(d).firefly.inp (generated)

004101785.b3lyp_6-31g(d).smash.inp (generated)

004101785.b3lyp_6-31g(d).nwchem.inp (generated) 004101785.b3lyp_6-31g(d).log.xz 004101785.td-b3lyp_6-31g+(d).inp 004101785.td-b3lyp_6-31g+(d).log.xz

004101785.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101785.td-b3lyp_6-31+g(d).gjf (generated)

004101785.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101785.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101785.mol 004101785.PUBCHEM 004101785.mol (via Jmol)
004101807.b3lyp_6-31g(d).inp

004101807.b3lyp_6-31g(d).qchem.inp (generated)

004101807.b3lyp_6-31g(d).gjf (generated)

004101807.b3lyp_6-31g(d).firefly.inp (generated)

004101807.b3lyp_6-31g(d).smash.inp (generated)

004101807.b3lyp_6-31g(d).nwchem.inp (generated) 004101807.b3lyp_6-31g(d).log.xz 004101807.td-b3lyp_6-31g+(d).inp 004101807.td-b3lyp_6-31g+(d).log.xz

004101807.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101807.td-b3lyp_6-31+g(d).gjf (generated)

004101807.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101807.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101807.mol 004101807.PUBCHEM 004101807.mol (via Jmol)
004101813.b3lyp_6-31g(d).inp

004101813.b3lyp_6-31g(d).qchem.inp (generated)

004101813.b3lyp_6-31g(d).gjf (generated)

004101813.b3lyp_6-31g(d).firefly.inp (generated)

004101813.b3lyp_6-31g(d).smash.inp (generated)

004101813.b3lyp_6-31g(d).nwchem.inp (generated) 004101813.b3lyp_6-31g(d).log.xz 004101813.td-b3lyp_6-31g+(d).inp 004101813.td-b3lyp_6-31g+(d).log.xz

004101813.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101813.td-b3lyp_6-31+g(d).gjf (generated)

004101813.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101813.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101813.mol 004101813.PUBCHEM 004101813.mol (via Jmol)
004101817.b3lyp_6-31g(d).inp

004101817.b3lyp_6-31g(d).qchem.inp (generated)

004101817.b3lyp_6-31g(d).gjf (generated)

004101817.b3lyp_6-31g(d).firefly.inp (generated)

004101817.b3lyp_6-31g(d).smash.inp (generated)

004101817.b3lyp_6-31g(d).nwchem.inp (generated) 004101817.b3lyp_6-31g(d).log.xz 004101817.td-b3lyp_6-31g+(d).inp 004101817.td-b3lyp_6-31g+(d).log.xz

004101817.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101817.td-b3lyp_6-31+g(d).gjf (generated)

004101817.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101817.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101817.mol 004101817.PUBCHEM 004101817.mol (via Jmol)
004101825.b3lyp_6-31g(d).inp

004101825.b3lyp_6-31g(d).qchem.inp (generated)

004101825.b3lyp_6-31g(d).gjf (generated)

004101825.b3lyp_6-31g(d).firefly.inp (generated)

004101825.b3lyp_6-31g(d).smash.inp (generated)

004101825.b3lyp_6-31g(d).nwchem.inp (generated) 004101825.b3lyp_6-31g(d).log.xz 004101825.td-b3lyp_6-31g+(d).inp 004101825.td-b3lyp_6-31g+(d).log.xz

004101825.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101825.td-b3lyp_6-31+g(d).gjf (generated)

004101825.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101825.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101825.mol 004101825.PUBCHEM 004101825.mol (via Jmol)
004101826.b3lyp_6-31g(d).inp

004101826.b3lyp_6-31g(d).qchem.inp (generated)

004101826.b3lyp_6-31g(d).gjf (generated)

004101826.b3lyp_6-31g(d).firefly.inp (generated)

004101826.b3lyp_6-31g(d).smash.inp (generated)

004101826.b3lyp_6-31g(d).nwchem.inp (generated) 004101826.b3lyp_6-31g(d).log.xz 004101826.td-b3lyp_6-31g+(d).inp 004101826.td-b3lyp_6-31g+(d).log.xz

004101826.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101826.td-b3lyp_6-31+g(d).gjf (generated)

004101826.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101826.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101826.mol 004101826.PUBCHEM 004101826.mol (via Jmol)
004101828.b3lyp_6-31g(d).inp

004101828.b3lyp_6-31g(d).qchem.inp (generated)

004101828.b3lyp_6-31g(d).gjf (generated)

004101828.b3lyp_6-31g(d).firefly.inp (generated)

004101828.b3lyp_6-31g(d).smash.inp (generated)

004101828.b3lyp_6-31g(d).nwchem.inp (generated) 004101828.b3lyp_6-31g(d).log.xz 004101828.td-b3lyp_6-31g+(d).inp 004101828.td-b3lyp_6-31g+(d).log.xz

004101828.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101828.td-b3lyp_6-31+g(d).gjf (generated)

004101828.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101828.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101828.mol 004101828.PUBCHEM 004101828.mol (via Jmol)
004101894.b3lyp_6-31g(d).inp

004101894.b3lyp_6-31g(d).qchem.inp (generated)

004101894.b3lyp_6-31g(d).gjf (generated)

004101894.b3lyp_6-31g(d).firefly.inp (generated)

004101894.b3lyp_6-31g(d).smash.inp (generated)

004101894.b3lyp_6-31g(d).nwchem.inp (generated) 004101894.b3lyp_6-31g(d).log.xz 004101894.td-b3lyp_6-31g+(d).inp 004101894.td-b3lyp_6-31g+(d).log.xz

004101894.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101894.td-b3lyp_6-31+g(d).gjf (generated)

004101894.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101894.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101894.mol 004101894.PUBCHEM 004101894.mol (via Jmol)
004101897.b3lyp_6-31g(d).inp

004101897.b3lyp_6-31g(d).qchem.inp (generated)

004101897.b3lyp_6-31g(d).gjf (generated)

004101897.b3lyp_6-31g(d).firefly.inp (generated)

004101897.b3lyp_6-31g(d).smash.inp (generated)

004101897.b3lyp_6-31g(d).nwchem.inp (generated) 004101897.b3lyp_6-31g(d).log.xz 004101897.td-b3lyp_6-31g+(d).inp 004101897.td-b3lyp_6-31g+(d).log.xz

004101897.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101897.td-b3lyp_6-31+g(d).gjf (generated)

004101897.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101897.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101897.mol 004101897.PUBCHEM 004101897.mol (via Jmol)
004101920.b3lyp_6-31g(d).inp

004101920.b3lyp_6-31g(d).qchem.inp (generated)

004101920.b3lyp_6-31g(d).gjf (generated)

004101920.b3lyp_6-31g(d).firefly.inp (generated)

004101920.b3lyp_6-31g(d).smash.inp (generated)

004101920.b3lyp_6-31g(d).nwchem.inp (generated) 004101920.b3lyp_6-31g(d).log.xz 004101920.mol 004101920.PUBCHEM 004101920.mol (via Jmol)
004101960.b3lyp_6-31g(d).inp

004101960.b3lyp_6-31g(d).qchem.inp (generated)

004101960.b3lyp_6-31g(d).gjf (generated)

004101960.b3lyp_6-31g(d).firefly.inp (generated)

004101960.b3lyp_6-31g(d).smash.inp (generated)

004101960.b3lyp_6-31g(d).nwchem.inp (generated) 004101960.b3lyp_6-31g(d).log.xz 004101960.td-b3lyp_6-31g+(d).inp 004101960.td-b3lyp_6-31g+(d).log.xz

004101960.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101960.td-b3lyp_6-31+g(d).gjf (generated)

004101960.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101960.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101960.mol 004101960.PUBCHEM 004101960.mol (via Jmol)
004101962.b3lyp_6-31g(d).inp

004101962.b3lyp_6-31g(d).qchem.inp (generated)

004101962.b3lyp_6-31g(d).gjf (generated)

004101962.b3lyp_6-31g(d).firefly.inp (generated)

004101962.b3lyp_6-31g(d).smash.inp (generated)

004101962.b3lyp_6-31g(d).nwchem.inp (generated) 004101962.b3lyp_6-31g(d).log.xz 004101962.mol 004101962.PUBCHEM 004101962.mol (via Jmol)
004101974.b3lyp_6-31g(d).inp

004101974.b3lyp_6-31g(d).qchem.inp (generated)

004101974.b3lyp_6-31g(d).gjf (generated)

004101974.b3lyp_6-31g(d).firefly.inp (generated)

004101974.b3lyp_6-31g(d).smash.inp (generated)

004101974.b3lyp_6-31g(d).nwchem.inp (generated) 004101974.b3lyp_6-31g(d).log.xz 004101974.td-b3lyp_6-31g+(d).inp 004101974.td-b3lyp_6-31g+(d).log.xz

004101974.td-b3lyp_6-31+g(d).qchem.inp (generated)

004101974.td-b3lyp_6-31+g(d).gjf (generated)

004101974.td-b3lyp_6-31+g(d).firefly.inp (generated)

004101974.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004101974.mol 004101974.PUBCHEM 004101974.mol (via Jmol)
004102020.b3lyp_6-31g(d).inp

004102020.b3lyp_6-31g(d).qchem.inp (generated)

004102020.b3lyp_6-31g(d).gjf (generated)

004102020.b3lyp_6-31g(d).firefly.inp (generated)

004102020.b3lyp_6-31g(d).smash.inp (generated)

004102020.b3lyp_6-31g(d).nwchem.inp (generated) 004102020.b3lyp_6-31g(d).log.xz 004102020.td-b3lyp_6-31g+(d).inp 004102020.td-b3lyp_6-31g+(d).log.xz

004102020.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102020.td-b3lyp_6-31+g(d).gjf (generated)

004102020.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102020.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102020.mol 004102020.PUBCHEM 004102020.mol (via Jmol)
004102024.b3lyp_6-31g(d).inp

004102024.b3lyp_6-31g(d).qchem.inp (generated)

004102024.b3lyp_6-31g(d).gjf (generated)

004102024.b3lyp_6-31g(d).firefly.inp (generated)

004102024.b3lyp_6-31g(d).smash.inp (generated)

004102024.b3lyp_6-31g(d).nwchem.inp (generated) 004102024.b3lyp_6-31g(d).log.xz 004102024.td-b3lyp_6-31g+(d).inp 004102024.td-b3lyp_6-31g+(d).log.xz

004102024.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102024.td-b3lyp_6-31+g(d).gjf (generated)

004102024.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102024.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102024.mol 004102024.PUBCHEM 004102024.mol (via Jmol)
004102126.b3lyp_6-31g(d).inp

004102126.b3lyp_6-31g(d).qchem.inp (generated)

004102126.b3lyp_6-31g(d).gjf (generated)

004102126.b3lyp_6-31g(d).firefly.inp (generated)

004102126.b3lyp_6-31g(d).smash.inp (generated)

004102126.b3lyp_6-31g(d).nwchem.inp (generated) 004102126.b3lyp_6-31g(d).log.xz 004102126.td-b3lyp_6-31g+(d).inp 004102126.td-b3lyp_6-31g+(d).log.xz

004102126.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102126.td-b3lyp_6-31+g(d).gjf (generated)

004102126.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102126.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102126.mol 004102126.PUBCHEM 004102126.mol (via Jmol)
004102130.b3lyp_6-31g(d).inp

004102130.b3lyp_6-31g(d).qchem.inp (generated)

004102130.b3lyp_6-31g(d).gjf (generated)

004102130.b3lyp_6-31g(d).firefly.inp (generated)

004102130.b3lyp_6-31g(d).smash.inp (generated)

004102130.b3lyp_6-31g(d).nwchem.inp (generated) 004102130.b3lyp_6-31g(d).log.xz 004102130.td-b3lyp_6-31g+(d).inp 004102130.td-b3lyp_6-31g+(d).log.xz

004102130.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102130.td-b3lyp_6-31+g(d).gjf (generated)

004102130.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102130.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102130.mol 004102130.PUBCHEM 004102130.mol (via Jmol)
004102149.b3lyp_6-31g(d).inp

004102149.b3lyp_6-31g(d).qchem.inp (generated)

004102149.b3lyp_6-31g(d).gjf (generated)

004102149.b3lyp_6-31g(d).firefly.inp (generated)

004102149.b3lyp_6-31g(d).smash.inp (generated)

004102149.b3lyp_6-31g(d).nwchem.inp (generated) 004102149.b3lyp_6-31g(d).log.xz 004102149.td-b3lyp_6-31g+(d).inp 004102149.td-b3lyp_6-31g+(d).log.xz

004102149.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102149.td-b3lyp_6-31+g(d).gjf (generated)

004102149.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102149.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102149.mol 004102149.PUBCHEM 004102149.mol (via Jmol)
004102150.b3lyp_6-31g(d).inp

004102150.b3lyp_6-31g(d).qchem.inp (generated)

004102150.b3lyp_6-31g(d).gjf (generated)

004102150.b3lyp_6-31g(d).firefly.inp (generated)

004102150.b3lyp_6-31g(d).smash.inp (generated)

004102150.b3lyp_6-31g(d).nwchem.inp (generated) 004102150.b3lyp_6-31g(d).log.xz 004102150.td-b3lyp_6-31g+(d).inp 004102150.td-b3lyp_6-31g+(d).log.xz

004102150.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102150.td-b3lyp_6-31+g(d).gjf (generated)

004102150.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102150.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102150.mol 004102150.PUBCHEM 004102150.mol (via Jmol)
004102151.b3lyp_6-31g(d).inp

004102151.b3lyp_6-31g(d).qchem.inp (generated)

004102151.b3lyp_6-31g(d).gjf (generated)

004102151.b3lyp_6-31g(d).firefly.inp (generated)

004102151.b3lyp_6-31g(d).smash.inp (generated)

004102151.b3lyp_6-31g(d).nwchem.inp (generated) 004102151.b3lyp_6-31g(d).log.xz 004102151.td-b3lyp_6-31g+(d).inp 004102151.td-b3lyp_6-31g+(d).log.xz

004102151.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102151.td-b3lyp_6-31+g(d).gjf (generated)

004102151.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102151.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102151.mol 004102151.PUBCHEM 004102151.mol (via Jmol)
004102203.b3lyp_6-31g(d).inp

004102203.b3lyp_6-31g(d).qchem.inp (generated)

004102203.b3lyp_6-31g(d).gjf (generated)

004102203.b3lyp_6-31g(d).firefly.inp (generated)

004102203.b3lyp_6-31g(d).smash.inp (generated)

004102203.b3lyp_6-31g(d).nwchem.inp (generated) 004102203.b3lyp_6-31g(d).log.xz 004102203.td-b3lyp_6-31g+(d).inp 004102203.td-b3lyp_6-31g+(d).log.xz

004102203.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102203.td-b3lyp_6-31+g(d).gjf (generated)

004102203.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102203.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102203.mol 004102203.PUBCHEM 004102203.mol (via Jmol)
004102220.b3lyp_6-31g(d).inp

004102220.b3lyp_6-31g(d).qchem.inp (generated)

004102220.b3lyp_6-31g(d).gjf (generated)

004102220.b3lyp_6-31g(d).firefly.inp (generated)

004102220.b3lyp_6-31g(d).smash.inp (generated)

004102220.b3lyp_6-31g(d).nwchem.inp (generated) 004102220.b3lyp_6-31g(d).log.xz 004102220.td-b3lyp_6-31g+(d).inp 004102220.td-b3lyp_6-31g+(d).log.xz

004102220.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102220.td-b3lyp_6-31+g(d).gjf (generated)

004102220.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102220.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102220.mol 004102220.PUBCHEM 004102220.mol (via Jmol)
004102247.b3lyp_6-31g(d).inp

004102247.b3lyp_6-31g(d).qchem.inp (generated)

004102247.b3lyp_6-31g(d).gjf (generated)

004102247.b3lyp_6-31g(d).firefly.inp (generated)

004102247.b3lyp_6-31g(d).smash.inp (generated)

004102247.b3lyp_6-31g(d).nwchem.inp (generated) 004102247.b3lyp_6-31g(d).log.xz 004102247.td-b3lyp_6-31g+(d).inp 004102247.td-b3lyp_6-31g+(d).log.xz

004102247.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102247.td-b3lyp_6-31+g(d).gjf (generated)

004102247.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102247.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102247.mol 004102247.PUBCHEM 004102247.mol (via Jmol)
004102253.b3lyp_6-31g(d).inp

004102253.b3lyp_6-31g(d).qchem.inp (generated)

004102253.b3lyp_6-31g(d).gjf (generated)

004102253.b3lyp_6-31g(d).firefly.inp (generated)

004102253.b3lyp_6-31g(d).smash.inp (generated)

004102253.b3lyp_6-31g(d).nwchem.inp (generated) 004102253.b3lyp_6-31g(d).log.xz 004102253.td-b3lyp_6-31g+(d).inp 004102253.td-b3lyp_6-31g+(d).log.xz

004102253.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102253.td-b3lyp_6-31+g(d).gjf (generated)

004102253.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102253.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102253.mol 004102253.PUBCHEM 004102253.mol (via Jmol)
004102302.b3lyp_6-31g(d).inp

004102302.b3lyp_6-31g(d).qchem.inp (generated)

004102302.b3lyp_6-31g(d).gjf (generated)

004102302.b3lyp_6-31g(d).firefly.inp (generated)

004102302.b3lyp_6-31g(d).smash.inp (generated)

004102302.b3lyp_6-31g(d).nwchem.inp (generated) 004102302.b3lyp_6-31g(d).log.xz 004102302.td-b3lyp_6-31g+(d).inp 004102302.td-b3lyp_6-31g+(d).log.xz

004102302.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102302.td-b3lyp_6-31+g(d).gjf (generated)

004102302.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102302.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102302.mol 004102302.PUBCHEM 004102302.mol (via Jmol)
004102304.b3lyp_6-31g(d).inp

004102304.b3lyp_6-31g(d).qchem.inp (generated)

004102304.b3lyp_6-31g(d).gjf (generated)

004102304.b3lyp_6-31g(d).firefly.inp (generated)

004102304.b3lyp_6-31g(d).smash.inp (generated)

004102304.b3lyp_6-31g(d).nwchem.inp (generated) 004102304.b3lyp_6-31g(d).log.xz 004102304.td-b3lyp_6-31g+(d).inp 004102304.td-b3lyp_6-31g+(d).log.xz

004102304.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102304.td-b3lyp_6-31+g(d).gjf (generated)

004102304.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102304.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102304.mol 004102304.PUBCHEM 004102304.mol (via Jmol)
004102308.b3lyp_6-31g(d).inp

004102308.b3lyp_6-31g(d).qchem.inp (generated)

004102308.b3lyp_6-31g(d).gjf (generated)

004102308.b3lyp_6-31g(d).firefly.inp (generated)

004102308.b3lyp_6-31g(d).smash.inp (generated)

004102308.b3lyp_6-31g(d).nwchem.inp (generated) 004102308.b3lyp_6-31g(d).log.xz 004102308.td-b3lyp_6-31g+(d).inp 004102308.td-b3lyp_6-31g+(d).log.xz

004102308.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102308.td-b3lyp_6-31+g(d).gjf (generated)

004102308.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102308.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102308.mol 004102308.PUBCHEM 004102308.mol (via Jmol)
004102312.b3lyp_6-31g(d).inp

004102312.b3lyp_6-31g(d).qchem.inp (generated)

004102312.b3lyp_6-31g(d).gjf (generated)

004102312.b3lyp_6-31g(d).firefly.inp (generated)

004102312.b3lyp_6-31g(d).smash.inp (generated)

004102312.b3lyp_6-31g(d).nwchem.inp (generated) 004102312.b3lyp_6-31g(d).log.xz 004102312.td-b3lyp_6-31g+(d).inp 004102312.td-b3lyp_6-31g+(d).log.xz

004102312.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102312.td-b3lyp_6-31+g(d).gjf (generated)

004102312.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102312.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102312.mol 004102312.PUBCHEM 004102312.mol (via Jmol)
004102317.b3lyp_6-31g(d).inp

004102317.b3lyp_6-31g(d).qchem.inp (generated)

004102317.b3lyp_6-31g(d).gjf (generated)

004102317.b3lyp_6-31g(d).firefly.inp (generated)

004102317.b3lyp_6-31g(d).smash.inp (generated)

004102317.b3lyp_6-31g(d).nwchem.inp (generated) 004102317.b3lyp_6-31g(d).log.xz 004102317.mol 004102317.PUBCHEM 004102317.mol (via Jmol)
004102320.b3lyp_6-31g(d).inp

004102320.b3lyp_6-31g(d).qchem.inp (generated)

004102320.b3lyp_6-31g(d).gjf (generated)

004102320.b3lyp_6-31g(d).firefly.inp (generated)

004102320.b3lyp_6-31g(d).smash.inp (generated)

004102320.b3lyp_6-31g(d).nwchem.inp (generated) 004102320.b3lyp_6-31g(d).log.xz 004102320.td-b3lyp_6-31g+(d).inp 004102320.td-b3lyp_6-31g+(d).log.xz

004102320.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102320.td-b3lyp_6-31+g(d).gjf (generated)

004102320.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102320.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102320.mol 004102320.PUBCHEM 004102320.mol (via Jmol)
004102322.b3lyp_6-31g(d).inp

004102322.b3lyp_6-31g(d).qchem.inp (generated)

004102322.b3lyp_6-31g(d).gjf (generated)

004102322.b3lyp_6-31g(d).firefly.inp (generated)

004102322.b3lyp_6-31g(d).smash.inp (generated)

004102322.b3lyp_6-31g(d).nwchem.inp (generated) 004102322.b3lyp_6-31g(d).log.xz 004102322.td-b3lyp_6-31g+(d).inp 004102322.td-b3lyp_6-31g+(d).log.xz

004102322.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102322.td-b3lyp_6-31+g(d).gjf (generated)

004102322.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102322.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102322.mol 004102322.PUBCHEM 004102322.mol (via Jmol)
004102437.b3lyp_6-31g(d).inp

004102437.b3lyp_6-31g(d).qchem.inp (generated)

004102437.b3lyp_6-31g(d).gjf (generated)

004102437.b3lyp_6-31g(d).firefly.inp (generated)

004102437.b3lyp_6-31g(d).smash.inp (generated)

004102437.b3lyp_6-31g(d).nwchem.inp (generated) 004102437.b3lyp_6-31g(d).log.xz 004102437.td-b3lyp_6-31g+(d).inp 004102437.td-b3lyp_6-31g+(d).log.xz

004102437.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102437.td-b3lyp_6-31+g(d).gjf (generated)

004102437.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102437.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102437.mol 004102437.PUBCHEM 004102437.mol (via Jmol)
004102458.b3lyp_6-31g(d).inp

004102458.b3lyp_6-31g(d).qchem.inp (generated)

004102458.b3lyp_6-31g(d).gjf (generated)

004102458.b3lyp_6-31g(d).firefly.inp (generated)

004102458.b3lyp_6-31g(d).smash.inp (generated)

004102458.b3lyp_6-31g(d).nwchem.inp (generated) 004102458.b3lyp_6-31g(d).log.xz 004102458.td-b3lyp_6-31g+(d).inp 004102458.td-b3lyp_6-31g+(d).log.xz

004102458.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102458.td-b3lyp_6-31+g(d).gjf (generated)

004102458.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102458.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102458.mol 004102458.PUBCHEM 004102458.mol (via Jmol)
004102500.b3lyp_6-31g(d).inp

004102500.b3lyp_6-31g(d).qchem.inp (generated)

004102500.b3lyp_6-31g(d).gjf (generated)

004102500.b3lyp_6-31g(d).firefly.inp (generated)

004102500.b3lyp_6-31g(d).smash.inp (generated)

004102500.b3lyp_6-31g(d).nwchem.inp (generated) 004102500.b3lyp_6-31g(d).log.xz 004102500.td-b3lyp_6-31g+(d).inp 004102500.td-b3lyp_6-31g+(d).log.xz

004102500.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102500.td-b3lyp_6-31+g(d).gjf (generated)

004102500.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102500.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102500.mol 004102500.PUBCHEM 004102500.mol (via Jmol)
004102541.b3lyp_6-31g(d).inp

004102541.b3lyp_6-31g(d).qchem.inp (generated)

004102541.b3lyp_6-31g(d).gjf (generated)

004102541.b3lyp_6-31g(d).firefly.inp (generated)

004102541.b3lyp_6-31g(d).smash.inp (generated)

004102541.b3lyp_6-31g(d).nwchem.inp (generated) 004102541.b3lyp_6-31g(d).log.xz 004102541.td-b3lyp_6-31g+(d).inp 004102541.td-b3lyp_6-31g+(d).log.xz

004102541.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102541.td-b3lyp_6-31+g(d).gjf (generated)

004102541.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102541.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102541.mol 004102541.PUBCHEM 004102541.mol (via Jmol)
004102599.b3lyp_6-31g(d).inp

004102599.b3lyp_6-31g(d).qchem.inp (generated)

004102599.b3lyp_6-31g(d).gjf (generated)

004102599.b3lyp_6-31g(d).firefly.inp (generated)

004102599.b3lyp_6-31g(d).smash.inp (generated)

004102599.b3lyp_6-31g(d).nwchem.inp (generated) 004102599.b3lyp_6-31g(d).log.xz 004102599.td-b3lyp_6-31g+(d).inp 004102599.td-b3lyp_6-31g+(d).log.xz

004102599.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102599.td-b3lyp_6-31+g(d).gjf (generated)

004102599.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102599.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102599.mol 004102599.PUBCHEM 004102599.mol (via Jmol)
004102602.b3lyp_6-31g(d).inp

004102602.b3lyp_6-31g(d).qchem.inp (generated)

004102602.b3lyp_6-31g(d).gjf (generated)

004102602.b3lyp_6-31g(d).firefly.inp (generated)

004102602.b3lyp_6-31g(d).smash.inp (generated)

004102602.b3lyp_6-31g(d).nwchem.inp (generated) 004102602.b3lyp_6-31g(d).log.xz 004102602.td-b3lyp_6-31g+(d).inp 004102602.td-b3lyp_6-31g+(d).log.xz

004102602.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102602.td-b3lyp_6-31+g(d).gjf (generated)

004102602.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102602.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102602.mol 004102602.PUBCHEM 004102602.mol (via Jmol)
004102606.b3lyp_6-31g(d).inp

004102606.b3lyp_6-31g(d).qchem.inp (generated)

004102606.b3lyp_6-31g(d).gjf (generated)

004102606.b3lyp_6-31g(d).firefly.inp (generated)

004102606.b3lyp_6-31g(d).smash.inp (generated)

004102606.b3lyp_6-31g(d).nwchem.inp (generated) 004102606.b3lyp_6-31g(d).log.xz 004102606.td-b3lyp_6-31g+(d).inp 004102606.td-b3lyp_6-31g+(d).log.xz

004102606.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102606.td-b3lyp_6-31+g(d).gjf (generated)

004102606.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102606.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102606.mol 004102606.PUBCHEM 004102606.mol (via Jmol)
004102607.b3lyp_6-31g(d).inp

004102607.b3lyp_6-31g(d).qchem.inp (generated)

004102607.b3lyp_6-31g(d).gjf (generated)

004102607.b3lyp_6-31g(d).firefly.inp (generated)

004102607.b3lyp_6-31g(d).smash.inp (generated)

004102607.b3lyp_6-31g(d).nwchem.inp (generated) 004102607.b3lyp_6-31g(d).log.xz 004102607.td-b3lyp_6-31g+(d).inp 004102607.td-b3lyp_6-31g+(d).log.xz

004102607.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102607.td-b3lyp_6-31+g(d).gjf (generated)

004102607.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102607.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102607.mol 004102607.PUBCHEM 004102607.mol (via Jmol)
004102671.b3lyp_6-31g(d).inp

004102671.b3lyp_6-31g(d).qchem.inp (generated)

004102671.b3lyp_6-31g(d).gjf (generated)

004102671.b3lyp_6-31g(d).firefly.inp (generated)

004102671.b3lyp_6-31g(d).smash.inp (generated)

004102671.b3lyp_6-31g(d).nwchem.inp (generated) 004102671.b3lyp_6-31g(d).log.xz 004102671.td-b3lyp_6-31g+(d).inp 004102671.td-b3lyp_6-31g+(d).log.xz

004102671.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102671.td-b3lyp_6-31+g(d).gjf (generated)

004102671.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102671.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102671.mol 004102671.PUBCHEM 004102671.mol (via Jmol)
004102680.b3lyp_6-31g(d).inp

004102680.b3lyp_6-31g(d).qchem.inp (generated)

004102680.b3lyp_6-31g(d).gjf (generated)

004102680.b3lyp_6-31g(d).firefly.inp (generated)

004102680.b3lyp_6-31g(d).smash.inp (generated)

004102680.b3lyp_6-31g(d).nwchem.inp (generated) 004102680.b3lyp_6-31g(d).log.xz 004102680.td-b3lyp_6-31g+(d).inp 004102680.td-b3lyp_6-31g+(d).log.xz

004102680.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102680.td-b3lyp_6-31+g(d).gjf (generated)

004102680.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102680.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102680.mol 004102680.PUBCHEM 004102680.mol (via Jmol)
004102684.b3lyp_6-31g(d).inp

004102684.b3lyp_6-31g(d).qchem.inp (generated)

004102684.b3lyp_6-31g(d).gjf (generated)

004102684.b3lyp_6-31g(d).firefly.inp (generated)

004102684.b3lyp_6-31g(d).smash.inp (generated)

004102684.b3lyp_6-31g(d).nwchem.inp (generated) 004102684.b3lyp_6-31g(d).log.xz 004102684.td-b3lyp_6-31g+(d).inp 004102684.td-b3lyp_6-31g+(d).log.xz

004102684.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102684.td-b3lyp_6-31+g(d).gjf (generated)

004102684.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102684.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102684.mol 004102684.PUBCHEM 004102684.mol (via Jmol)
004102778.b3lyp_6-31g(d).inp

004102778.b3lyp_6-31g(d).qchem.inp (generated)

004102778.b3lyp_6-31g(d).gjf (generated)

004102778.b3lyp_6-31g(d).firefly.inp (generated)

004102778.b3lyp_6-31g(d).smash.inp (generated)

004102778.b3lyp_6-31g(d).nwchem.inp (generated) 004102778.b3lyp_6-31g(d).log.xz 004102778.td-b3lyp_6-31g+(d).inp 004102778.td-b3lyp_6-31g+(d).log.xz

004102778.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102778.td-b3lyp_6-31+g(d).gjf (generated)

004102778.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102778.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102778.mol 004102778.PUBCHEM 004102778.mol (via Jmol)
004102796.b3lyp_6-31g(d).inp

004102796.b3lyp_6-31g(d).qchem.inp (generated)

004102796.b3lyp_6-31g(d).gjf (generated)

004102796.b3lyp_6-31g(d).firefly.inp (generated)

004102796.b3lyp_6-31g(d).smash.inp (generated)

004102796.b3lyp_6-31g(d).nwchem.inp (generated) 004102796.b3lyp_6-31g(d).log.xz 004102796.mol 004102796.PUBCHEM 004102796.mol (via Jmol)
004102801.b3lyp_6-31g(d).inp

004102801.b3lyp_6-31g(d).qchem.inp (generated)

004102801.b3lyp_6-31g(d).gjf (generated)

004102801.b3lyp_6-31g(d).firefly.inp (generated)

004102801.b3lyp_6-31g(d).smash.inp (generated)

004102801.b3lyp_6-31g(d).nwchem.inp (generated) 004102801.b3lyp_6-31g(d).log.xz 004102801.td-b3lyp_6-31g+(d).inp 004102801.td-b3lyp_6-31g+(d).log.xz

004102801.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102801.td-b3lyp_6-31+g(d).gjf (generated)

004102801.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102801.mol 004102801.PUBCHEM 004102801.mol (via Jmol)
004102816.b3lyp_6-31g(d).inp

004102816.b3lyp_6-31g(d).qchem.inp (generated)

004102816.b3lyp_6-31g(d).gjf (generated)

004102816.b3lyp_6-31g(d).firefly.inp (generated)

004102816.b3lyp_6-31g(d).smash.inp (generated)

004102816.b3lyp_6-31g(d).nwchem.inp (generated) 004102816.b3lyp_6-31g(d).log.xz 004102816.mol 004102816.PUBCHEM 004102816.mol (via Jmol)
004102833.b3lyp_6-31g(d).inp

004102833.b3lyp_6-31g(d).qchem.inp (generated)

004102833.b3lyp_6-31g(d).gjf (generated)

004102833.b3lyp_6-31g(d).firefly.inp (generated)

004102833.b3lyp_6-31g(d).smash.inp (generated)

004102833.b3lyp_6-31g(d).nwchem.inp (generated) 004102833.b3lyp_6-31g(d).log.xz 004102833.td-b3lyp_6-31g+(d).inp 004102833.td-b3lyp_6-31g+(d).log.xz

004102833.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102833.td-b3lyp_6-31+g(d).gjf (generated)

004102833.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102833.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102833.mol 004102833.PUBCHEM 004102833.mol (via Jmol)
004102910.b3lyp_6-31g(d).inp

004102910.b3lyp_6-31g(d).qchem.inp (generated)

004102910.b3lyp_6-31g(d).gjf (generated)

004102910.b3lyp_6-31g(d).firefly.inp (generated)

004102910.b3lyp_6-31g(d).smash.inp (generated)

004102910.b3lyp_6-31g(d).nwchem.inp (generated) 004102910.b3lyp_6-31g(d).log.xz 004102910.td-b3lyp_6-31g+(d).inp 004102910.td-b3lyp_6-31g+(d).log.xz

004102910.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102910.td-b3lyp_6-31+g(d).gjf (generated)

004102910.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102910.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102910.mol 004102910.PUBCHEM 004102910.mol (via Jmol)
004102912.b3lyp_6-31g(d).inp

004102912.b3lyp_6-31g(d).qchem.inp (generated)

004102912.b3lyp_6-31g(d).gjf (generated)

004102912.b3lyp_6-31g(d).firefly.inp (generated)

004102912.b3lyp_6-31g(d).smash.inp (generated)

004102912.b3lyp_6-31g(d).nwchem.inp (generated) 004102912.b3lyp_6-31g(d).log.xz 004102912.mol 004102912.PUBCHEM 004102912.mol (via Jmol)
004102948.b3lyp_6-31g(d).inp

004102948.b3lyp_6-31g(d).qchem.inp (generated)

004102948.b3lyp_6-31g(d).gjf (generated)

004102948.b3lyp_6-31g(d).firefly.inp (generated)

004102948.b3lyp_6-31g(d).smash.inp (generated)

004102948.b3lyp_6-31g(d).nwchem.inp (generated) 004102948.b3lyp_6-31g(d).log.xz 004102948.td-b3lyp_6-31g+(d).inp 004102948.td-b3lyp_6-31g+(d).log.xz

004102948.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102948.td-b3lyp_6-31+g(d).gjf (generated)

004102948.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102948.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102948.mol 004102948.PUBCHEM 004102948.mol (via Jmol)
004102982.b3lyp_6-31g(d).inp

004102982.b3lyp_6-31g(d).qchem.inp (generated)

004102982.b3lyp_6-31g(d).gjf (generated)

004102982.b3lyp_6-31g(d).firefly.inp (generated)

004102982.b3lyp_6-31g(d).smash.inp (generated)

004102982.b3lyp_6-31g(d).nwchem.inp (generated) 004102982.b3lyp_6-31g(d).log.xz 004102982.td-b3lyp_6-31g+(d).inp 004102982.td-b3lyp_6-31g+(d).log.xz

004102982.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102982.td-b3lyp_6-31+g(d).gjf (generated)

004102982.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102982.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102982.mol 004102982.PUBCHEM 004102982.mol (via Jmol)
004102983.b3lyp_6-31g(d).inp

004102983.b3lyp_6-31g(d).qchem.inp (generated)

004102983.b3lyp_6-31g(d).gjf (generated)

004102983.b3lyp_6-31g(d).firefly.inp (generated)

004102983.b3lyp_6-31g(d).smash.inp (generated)

004102983.b3lyp_6-31g(d).nwchem.inp (generated) 004102983.b3lyp_6-31g(d).log.xz 004102983.td-b3lyp_6-31g+(d).inp 004102983.td-b3lyp_6-31g+(d).log.xz

004102983.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102983.td-b3lyp_6-31+g(d).gjf (generated)

004102983.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102983.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102983.mol 004102983.PUBCHEM 004102983.mol (via Jmol)
004102984.b3lyp_6-31g(d).inp

004102984.b3lyp_6-31g(d).qchem.inp (generated)

004102984.b3lyp_6-31g(d).gjf (generated)

004102984.b3lyp_6-31g(d).firefly.inp (generated)

004102984.b3lyp_6-31g(d).smash.inp (generated)

004102984.b3lyp_6-31g(d).nwchem.inp (generated) 004102984.b3lyp_6-31g(d).log.xz 004102984.td-b3lyp_6-31g+(d).inp 004102984.td-b3lyp_6-31g+(d).log.xz

004102984.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102984.td-b3lyp_6-31+g(d).gjf (generated)

004102984.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102984.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102984.mol 004102984.PUBCHEM 004102984.mol (via Jmol)
004102985.b3lyp_6-31g(d).inp

004102985.b3lyp_6-31g(d).qchem.inp (generated)

004102985.b3lyp_6-31g(d).gjf (generated)

004102985.b3lyp_6-31g(d).firefly.inp (generated)

004102985.b3lyp_6-31g(d).smash.inp (generated)

004102985.b3lyp_6-31g(d).nwchem.inp (generated) 004102985.b3lyp_6-31g(d).log.xz 004102985.td-b3lyp_6-31g+(d).inp 004102985.td-b3lyp_6-31g+(d).log.xz

004102985.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102985.td-b3lyp_6-31+g(d).gjf (generated)

004102985.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102985.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102985.mol 004102985.PUBCHEM 004102985.mol (via Jmol)
004102998.b3lyp_6-31g(d).inp

004102998.b3lyp_6-31g(d).qchem.inp (generated)

004102998.b3lyp_6-31g(d).gjf (generated)

004102998.b3lyp_6-31g(d).firefly.inp (generated)

004102998.b3lyp_6-31g(d).smash.inp (generated)

004102998.b3lyp_6-31g(d).nwchem.inp (generated) 004102998.b3lyp_6-31g(d).log.xz 004102998.td-b3lyp_6-31g+(d).inp 004102998.td-b3lyp_6-31g+(d).log.xz

004102998.td-b3lyp_6-31+g(d).qchem.inp (generated)

004102998.td-b3lyp_6-31+g(d).gjf (generated)

004102998.td-b3lyp_6-31+g(d).firefly.inp (generated)

004102998.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004102998.mol 004102998.PUBCHEM 004102998.mol (via Jmol)
004103029.b3lyp_6-31g(d).inp

004103029.b3lyp_6-31g(d).qchem.inp (generated)

004103029.b3lyp_6-31g(d).gjf (generated)

004103029.b3lyp_6-31g(d).firefly.inp (generated)

004103029.b3lyp_6-31g(d).smash.inp (generated)

004103029.b3lyp_6-31g(d).nwchem.inp (generated) 004103029.b3lyp_6-31g(d).log.xz 004103029.td-b3lyp_6-31g+(d).inp 004103029.td-b3lyp_6-31g+(d).log.xz

004103029.td-b3lyp_6-31+g(d).qchem.inp (generated)

004103029.td-b3lyp_6-31+g(d).gjf (generated)

004103029.td-b3lyp_6-31+g(d).firefly.inp (generated)

004103029.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004103029.mol 004103029.PUBCHEM 004103029.mol (via Jmol)
004103033.b3lyp_6-31g(d).inp

004103033.b3lyp_6-31g(d).qchem.inp (generated)

004103033.b3lyp_6-31g(d).gjf (generated)

004103033.b3lyp_6-31g(d).firefly.inp (generated)

004103033.b3lyp_6-31g(d).smash.inp (generated)

004103033.b3lyp_6-31g(d).nwchem.inp (generated) 004103033.b3lyp_6-31g(d).log.xz 004103033.td-b3lyp_6-31g+(d).inp 004103033.td-b3lyp_6-31g+(d).log.xz

004103033.td-b3lyp_6-31+g(d).qchem.inp (generated)

004103033.td-b3lyp_6-31+g(d).gjf (generated)

004103033.td-b3lyp_6-31+g(d).firefly.inp (generated)

004103033.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004103033.mol 004103033.PUBCHEM 004103033.mol (via Jmol)
004103041.b3lyp_6-31g(d).inp

004103041.b3lyp_6-31g(d).qchem.inp (generated)

004103041.b3lyp_6-31g(d).gjf (generated)

004103041.b3lyp_6-31g(d).firefly.inp (generated)

004103041.b3lyp_6-31g(d).smash.inp (generated)

004103041.b3lyp_6-31g(d).nwchem.inp (generated) 004103041.b3lyp_6-31g(d).log.xz 004103041.td-b3lyp_6-31g+(d).inp 004103041.td-b3lyp_6-31g+(d).log.xz

004103041.td-b3lyp_6-31+g(d).qchem.inp (generated)

004103041.td-b3lyp_6-31+g(d).gjf (generated)

004103041.td-b3lyp_6-31+g(d).firefly.inp (generated)

004103041.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004103041.mol 004103041.PUBCHEM 004103041.mol (via Jmol)
004103064.b3lyp_6-31g(d).inp

004103064.b3lyp_6-31g(d).qchem.inp (generated)

004103064.b3lyp_6-31g(d).gjf (generated)

004103064.b3lyp_6-31g(d).firefly.inp (generated)

004103064.b3lyp_6-31g(d).smash.inp (generated)

004103064.b3lyp_6-31g(d).nwchem.inp (generated) 004103064.b3lyp_6-31g(d).log.xz 004103064.td-b3lyp_6-31g+(d).inp 004103064.td-b3lyp_6-31g+(d).log.xz

004103064.td-b3lyp_6-31+g(d).qchem.inp (generated)

004103064.td-b3lyp_6-31+g(d).gjf (generated)

004103064.td-b3lyp_6-31+g(d).firefly.inp (generated)

004103064.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004103064.mol 004103064.PUBCHEM 004103064.mol (via Jmol)
004103066.b3lyp_6-31g(d).inp

004103066.b3lyp_6-31g(d).qchem.inp (generated)

004103066.b3lyp_6-31g(d).gjf (generated)

004103066.b3lyp_6-31g(d).firefly.inp (generated)

004103066.b3lyp_6-31g(d).smash.inp (generated)

004103066.b3lyp_6-31g(d).nwchem.inp (generated) 004103066.b3lyp_6-31g(d).log.xz 004103066.td-b3lyp_6-31g+(d).inp 004103066.td-b3lyp_6-31g+(d).log.xz

004103066.td-b3lyp_6-31+g(d).qchem.inp (generated)

004103066.td-b3lyp_6-31+g(d).gjf (generated)

004103066.td-b3lyp_6-31+g(d).firefly.inp (generated)

004103066.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004103066.mol 004103066.PUBCHEM 004103066.mol (via Jmol)
004103096.b3lyp_6-31g(d).inp

004103096.b3lyp_6-31g(d).qchem.inp (generated)

004103096.b3lyp_6-31g(d).gjf (generated)

004103096.b3lyp_6-31g(d).firefly.inp (generated)

004103096.b3lyp_6-31g(d).smash.inp (generated)

004103096.b3lyp_6-31g(d).nwchem.inp (generated) 004103096.b3lyp_6-31g(d).log.xz 004103096.mol 004103096.PUBCHEM 004103096.mol (via Jmol)
004103137.b3lyp_6-31g(d).inp

004103137.b3lyp_6-31g(d).qchem.inp (generated)

004103137.b3lyp_6-31g(d).gjf (generated)

004103137.b3lyp_6-31g(d).firefly.inp (generated)

004103137.b3lyp_6-31g(d).smash.inp (generated)

004103137.b3lyp_6-31g(d).nwchem.inp (generated) 004103137.b3lyp_6-31g(d).log.xz 004103137.td-b3lyp_6-31g+(d).inp 004103137.td-b3lyp_6-31g+(d).log.xz

004103137.td-b3lyp_6-31+g(d).qchem.inp (generated)

004103137.td-b3lyp_6-31+g(d).gjf (generated)

004103137.td-b3lyp_6-31+g(d).firefly.inp (generated)

004103137.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004103137.mol 004103137.PUBCHEM 004103137.mol (via Jmol)
004103141.b3lyp_6-31g(d).inp

004103141.b3lyp_6-31g(d).qchem.inp (generated)

004103141.b3lyp_6-31g(d).gjf (generated)

004103141.b3lyp_6-31g(d).firefly.inp (generated)

004103141.b3lyp_6-31g(d).smash.inp (generated)

004103141.b3lyp_6-31g(d).nwchem.inp (generated) 004103141.b3lyp_6-31g(d).log.xz 004103141.td-b3lyp_6-31g+(d).inp 004103141.td-b3lyp_6-31g+(d).log.xz

004103141.td-b3lyp_6-31+g(d).qchem.inp (generated)

004103141.td-b3lyp_6-31+g(d).gjf (generated)

004103141.td-b3lyp_6-31+g(d).firefly.inp (generated)

004103141.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004103141.mol 004103141.PUBCHEM 004103141.mol (via Jmol)
004103151.b3lyp_6-31g(d).inp

004103151.b3lyp_6-31g(d).qchem.inp (generated)

004103151.b3lyp_6-31g(d).gjf (generated)

004103151.b3lyp_6-31g(d).firefly.inp (generated)

004103151.b3lyp_6-31g(d).smash.inp (generated)

004103151.b3lyp_6-31g(d).nwchem.inp (generated) 004103151.b3lyp_6-31g(d).log.xz 004103151.td-b3lyp_6-31g+(d).inp 004103151.td-b3lyp_6-31g+(d).log.xz

004103151.td-b3lyp_6-31+g(d).qchem.inp (generated)

004103151.td-b3lyp_6-31+g(d).gjf (generated)

004103151.td-b3lyp_6-31+g(d).firefly.inp (generated)

004103151.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004103151.mol 004103151.PUBCHEM 004103151.mol (via Jmol)
004103154.b3lyp_6-31g(d).inp

004103154.b3lyp_6-31g(d).qchem.inp (generated)

004103154.b3lyp_6-31g(d).gjf (generated)

004103154.b3lyp_6-31g(d).firefly.inp (generated)

004103154.b3lyp_6-31g(d).smash.inp (generated)

004103154.b3lyp_6-31g(d).nwchem.inp (generated) 004103154.b3lyp_6-31g(d).log.xz 004103154.td-b3lyp_6-31g+(d).inp 004103154.td-b3lyp_6-31g+(d).log.xz

004103154.td-b3lyp_6-31+g(d).qchem.inp (generated)

004103154.td-b3lyp_6-31+g(d).gjf (generated)

004103154.td-b3lyp_6-31+g(d).firefly.inp (generated)

004103154.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004103154.mol 004103154.PUBCHEM 004103154.mol (via Jmol)
004103193.b3lyp_6-31g(d).inp

004103193.b3lyp_6-31g(d).qchem.inp (generated)

004103193.b3lyp_6-31g(d).gjf (generated)

004103193.b3lyp_6-31g(d).firefly.inp (generated)

004103193.b3lyp_6-31g(d).smash.inp (generated)

004103193.b3lyp_6-31g(d).nwchem.inp (generated) 004103193.b3lyp_6-31g(d).log.xz 004103193.td-b3lyp_6-31g+(d).inp 004103193.td-b3lyp_6-31g+(d).log.xz

004103193.td-b3lyp_6-31+g(d).qchem.inp (generated)

004103193.td-b3lyp_6-31+g(d).gjf (generated)

004103193.td-b3lyp_6-31+g(d).firefly.inp (generated)

004103193.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004103193.mol 004103193.PUBCHEM 004103193.mol (via Jmol)
004103197.b3lyp_6-31g(d).inp

004103197.b3lyp_6-31g(d).qchem.inp (generated)

004103197.b3lyp_6-31g(d).gjf (generated)

004103197.b3lyp_6-31g(d).firefly.inp (generated)

004103197.b3lyp_6-31g(d).smash.inp (generated)

004103197.b3lyp_6-31g(d).nwchem.inp (generated) 004103197.b3lyp_6-31g(d).log.xz 004103197.td-b3lyp_6-31g+(d).inp 004103197.td-b3lyp_6-31g+(d).log.xz

004103197.td-b3lyp_6-31+g(d).qchem.inp (generated)

004103197.td-b3lyp_6-31+g(d).gjf (generated)

004103197.td-b3lyp_6-31+g(d).firefly.inp (generated)

004103197.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004103197.mol 004103197.PUBCHEM 004103197.mol (via Jmol)
004103338.b3lyp_6-31g(d).inp

004103338.b3lyp_6-31g(d).qchem.inp (generated)

004103338.b3lyp_6-31g(d).gjf (generated)

004103338.b3lyp_6-31g(d).firefly.inp (generated)

004103338.b3lyp_6-31g(d).smash.inp (generated)

004103338.b3lyp_6-31g(d).nwchem.inp (generated) 004103338.b3lyp_6-31g(d).log.xz 004103338.mol 004103338.PUBCHEM 004103338.mol (via Jmol)
004103354.b3lyp_6-31g(d).inp

004103354.b3lyp_6-31g(d).qchem.inp (generated)

004103354.b3lyp_6-31g(d).gjf (generated)

004103354.b3lyp_6-31g(d).firefly.inp (generated)

004103354.b3lyp_6-31g(d).smash.inp (generated)

004103354.b3lyp_6-31g(d).nwchem.inp (generated) 004103354.b3lyp_6-31g(d).log.xz 004103354.td-b3lyp_6-31g+(d).inp 004103354.td-b3lyp_6-31g+(d).log.xz

004103354.td-b3lyp_6-31+g(d).qchem.inp (generated)

004103354.td-b3lyp_6-31+g(d).gjf (generated)

004103354.td-b3lyp_6-31+g(d).firefly.inp (generated)

004103354.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004103354.mol 004103354.PUBCHEM 004103354.mol (via Jmol)
004103388.b3lyp_6-31g(d).inp

004103388.b3lyp_6-31g(d).qchem.inp (generated)

004103388.b3lyp_6-31g(d).gjf (generated)

004103388.b3lyp_6-31g(d).firefly.inp (generated)

004103388.b3lyp_6-31g(d).smash.inp (generated)

004103388.b3lyp_6-31g(d).nwchem.inp (generated) 004103388.b3lyp_6-31g(d).log.xz 004103388.td-b3lyp_6-31g+(d).inp 004103388.td-b3lyp_6-31g+(d).log.xz

004103388.td-b3lyp_6-31+g(d).qchem.inp (generated)

004103388.td-b3lyp_6-31+g(d).gjf (generated)

004103388.td-b3lyp_6-31+g(d).firefly.inp (generated)

004103388.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004103388.mol 004103388.PUBCHEM 004103388.mol (via Jmol)
004103459.b3lyp_6-31g(d).inp

004103459.b3lyp_6-31g(d).qchem.inp (generated)

004103459.b3lyp_6-31g(d).gjf (generated)

004103459.b3lyp_6-31g(d).firefly.inp (generated)

004103459.b3lyp_6-31g(d).smash.inp (generated)

004103459.b3lyp_6-31g(d).nwchem.inp (generated) 004103459.b3lyp_6-31g(d).log.xz 004103459.td-b3lyp_6-31g+(d).inp 004103459.td-b3lyp_6-31g+(d).log.xz

004103459.td-b3lyp_6-31+g(d).qchem.inp (generated)

004103459.td-b3lyp_6-31+g(d).gjf (generated)

004103459.td-b3lyp_6-31+g(d).firefly.inp (generated)

004103459.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004103459.mol 004103459.PUBCHEM 004103459.mol (via Jmol)
004103463.b3lyp_6-31g(d).inp

004103463.b3lyp_6-31g(d).qchem.inp (generated)

004103463.b3lyp_6-31g(d).gjf (generated)

004103463.b3lyp_6-31g(d).firefly.inp (generated)

004103463.b3lyp_6-31g(d).smash.inp (generated)

004103463.b3lyp_6-31g(d).nwchem.inp (generated) 004103463.b3lyp_6-31g(d).log.xz 004103463.mol 004103463.PUBCHEM 004103463.mol (via Jmol)
004103470.b3lyp_6-31g(d).inp

004103470.b3lyp_6-31g(d).qchem.inp (generated)

004103470.b3lyp_6-31g(d).gjf (generated)

004103470.b3lyp_6-31g(d).firefly.inp (generated)

004103470.b3lyp_6-31g(d).smash.inp (generated)

004103470.b3lyp_6-31g(d).nwchem.inp (generated) 004103470.b3lyp_6-31g(d).log.xz 004103470.td-b3lyp_6-31g+(d).inp 004103470.td-b3lyp_6-31g+(d).log.xz

004103470.td-b3lyp_6-31+g(d).qchem.inp (generated)

004103470.td-b3lyp_6-31+g(d).gjf (generated)

004103470.td-b3lyp_6-31+g(d).firefly.inp (generated)

004103470.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004103470.mol 004103470.PUBCHEM 004103470.mol (via Jmol)
004103528.b3lyp_6-31g(d).inp

004103528.b3lyp_6-31g(d).qchem.inp (generated)

004103528.b3lyp_6-31g(d).gjf (generated)

004103528.b3lyp_6-31g(d).firefly.inp (generated)

004103528.b3lyp_6-31g(d).smash.inp (generated)

004103528.b3lyp_6-31g(d).nwchem.inp (generated) 004103528.b3lyp_6-31g(d).log.xz 004103528.td-b3lyp_6-31g+(d).inp 004103528.td-b3lyp_6-31g+(d).log.xz

004103528.td-b3lyp_6-31+g(d).qchem.inp (generated)

004103528.td-b3lyp_6-31+g(d).gjf (generated)

004103528.td-b3lyp_6-31+g(d).firefly.inp (generated)

004103528.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004103528.mol 004103528.PUBCHEM 004103528.mol (via Jmol)
004103590.b3lyp_6-31g(d).inp

004103590.b3lyp_6-31g(d).qchem.inp (generated)

004103590.b3lyp_6-31g(d).gjf (generated)

004103590.b3lyp_6-31g(d).firefly.inp (generated)

004103590.b3lyp_6-31g(d).smash.inp (generated)

004103590.b3lyp_6-31g(d).nwchem.inp (generated) 004103590.b3lyp_6-31g(d).log.xz 004103590.td-b3lyp_6-31g+(d).inp 004103590.td-b3lyp_6-31g+(d).log.xz

004103590.td-b3lyp_6-31+g(d).qchem.inp (generated)

004103590.td-b3lyp_6-31+g(d).gjf (generated)

004103590.td-b3lyp_6-31+g(d).firefly.inp (generated)

004103590.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004103590.mol 004103590.PUBCHEM 004103590.mol (via Jmol)
004103598.b3lyp_6-31g(d).inp

004103598.b3lyp_6-31g(d).qchem.inp (generated)

004103598.b3lyp_6-31g(d).gjf (generated)

004103598.b3lyp_6-31g(d).firefly.inp (generated)

004103598.b3lyp_6-31g(d).smash.inp (generated)

004103598.b3lyp_6-31g(d).nwchem.inp (generated) 004103598.b3lyp_6-31g(d).log.xz 004103598.td-b3lyp_6-31g+(d).inp 004103598.td-b3lyp_6-31g+(d).log.xz

004103598.td-b3lyp_6-31+g(d).qchem.inp (generated)

004103598.td-b3lyp_6-31+g(d).gjf (generated)

004103598.td-b3lyp_6-31+g(d).firefly.inp (generated)

004103598.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004103598.mol 004103598.PUBCHEM 004103598.mol (via Jmol)
004103610.b3lyp_6-31g(d).inp

004103610.b3lyp_6-31g(d).qchem.inp (generated)

004103610.b3lyp_6-31g(d).gjf (generated)

004103610.b3lyp_6-31g(d).firefly.inp (generated)

004103610.b3lyp_6-31g(d).smash.inp (generated)

004103610.b3lyp_6-31g(d).nwchem.inp (generated) 004103610.b3lyp_6-31g(d).log.xz 004103610.td-b3lyp_6-31g+(d).inp 004103610.td-b3lyp_6-31g+(d).log.xz

004103610.td-b3lyp_6-31+g(d).qchem.inp (generated)

004103610.td-b3lyp_6-31+g(d).gjf (generated)

004103610.td-b3lyp_6-31+g(d).firefly.inp (generated)

004103610.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004103610.mol 004103610.PUBCHEM 004103610.mol (via Jmol)
004103792.b3lyp_6-31g(d).inp

004103792.b3lyp_6-31g(d).qchem.inp (generated)

004103792.b3lyp_6-31g(d).gjf (generated)

004103792.b3lyp_6-31g(d).firefly.inp (generated)

004103792.b3lyp_6-31g(d).smash.inp (generated)

004103792.b3lyp_6-31g(d).nwchem.inp (generated) 004103792.b3lyp_6-31g(d).log.xz 004103792.mol 004103792.PUBCHEM 004103792.mol (via Jmol)
004103963.b3lyp_6-31g(d).inp

004103963.b3lyp_6-31g(d).qchem.inp (generated)

004103963.b3lyp_6-31g(d).gjf (generated)

004103963.b3lyp_6-31g(d).firefly.inp (generated)

004103963.b3lyp_6-31g(d).smash.inp (generated)

004103963.b3lyp_6-31g(d).nwchem.inp (generated) 004103963.b3lyp_6-31g(d).log.xz 004103963.td-b3lyp_6-31g+(d).inp 004103963.td-b3lyp_6-31g+(d).log.xz

004103963.td-b3lyp_6-31+g(d).qchem.inp (generated)

004103963.td-b3lyp_6-31+g(d).gjf (generated)

004103963.td-b3lyp_6-31+g(d).firefly.inp (generated)

004103963.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004103963.mol 004103963.PUBCHEM 004103963.mol (via Jmol)
004104028.b3lyp_6-31g(d).inp

004104028.b3lyp_6-31g(d).qchem.inp (generated)

004104028.b3lyp_6-31g(d).gjf (generated)

004104028.b3lyp_6-31g(d).firefly.inp (generated)

004104028.b3lyp_6-31g(d).smash.inp (generated)

004104028.b3lyp_6-31g(d).nwchem.inp (generated) 004104028.b3lyp_6-31g(d).log.xz 004104028.td-b3lyp_6-31g+(d).inp 004104028.td-b3lyp_6-31g+(d).log.xz

004104028.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104028.td-b3lyp_6-31+g(d).gjf (generated)

004104028.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104028.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104028.mol 004104028.PUBCHEM 004104028.mol (via Jmol)
004104099.b3lyp_6-31g(d).inp

004104099.b3lyp_6-31g(d).qchem.inp (generated)

004104099.b3lyp_6-31g(d).gjf (generated)

004104099.b3lyp_6-31g(d).firefly.inp (generated)

004104099.b3lyp_6-31g(d).smash.inp (generated)

004104099.b3lyp_6-31g(d).nwchem.inp (generated) 004104099.b3lyp_6-31g(d).log.xz 004104099.td-b3lyp_6-31g+(d).inp 004104099.td-b3lyp_6-31g+(d).log.xz

004104099.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104099.td-b3lyp_6-31+g(d).gjf (generated)

004104099.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104099.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104099.mol 004104099.PUBCHEM 004104099.mol (via Jmol)
004104135.b3lyp_6-31g(d).inp

004104135.b3lyp_6-31g(d).qchem.inp (generated)

004104135.b3lyp_6-31g(d).gjf (generated)

004104135.b3lyp_6-31g(d).firefly.inp (generated)

004104135.b3lyp_6-31g(d).smash.inp (generated)

004104135.b3lyp_6-31g(d).nwchem.inp (generated) 004104135.b3lyp_6-31g(d).log.xz 004104135.td-b3lyp_6-31g+(d).inp 004104135.td-b3lyp_6-31g+(d).log.xz

004104135.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104135.td-b3lyp_6-31+g(d).gjf (generated)

004104135.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104135.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104135.mol 004104135.PUBCHEM 004104135.mol (via Jmol)
004104171.b3lyp_6-31g(d).inp

004104171.b3lyp_6-31g(d).qchem.inp (generated)

004104171.b3lyp_6-31g(d).gjf (generated)

004104171.b3lyp_6-31g(d).firefly.inp (generated)

004104171.b3lyp_6-31g(d).smash.inp (generated)

004104171.b3lyp_6-31g(d).nwchem.inp (generated) 004104171.b3lyp_6-31g(d).log.xz 004104171.td-b3lyp_6-31g+(d).inp 004104171.td-b3lyp_6-31g+(d).log.xz

004104171.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104171.td-b3lyp_6-31+g(d).gjf (generated)

004104171.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104171.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104171.mol 004104171.PUBCHEM 004104171.mol (via Jmol)
004104183.b3lyp_6-31g(d).inp

004104183.b3lyp_6-31g(d).qchem.inp (generated)

004104183.b3lyp_6-31g(d).gjf (generated)

004104183.b3lyp_6-31g(d).firefly.inp (generated)

004104183.b3lyp_6-31g(d).smash.inp (generated)

004104183.b3lyp_6-31g(d).nwchem.inp (generated) 004104183.b3lyp_6-31g(d).log.xz 004104183.td-b3lyp_6-31g+(d).inp 004104183.td-b3lyp_6-31g+(d).log.xz

004104183.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104183.td-b3lyp_6-31+g(d).gjf (generated)

004104183.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104183.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104183.mol 004104183.PUBCHEM 004104183.mol (via Jmol)
004104237.b3lyp_6-31g(d).inp

004104237.b3lyp_6-31g(d).qchem.inp (generated)

004104237.b3lyp_6-31g(d).gjf (generated)

004104237.b3lyp_6-31g(d).firefly.inp (generated)

004104237.b3lyp_6-31g(d).smash.inp (generated)

004104237.b3lyp_6-31g(d).nwchem.inp (generated) 004104237.b3lyp_6-31g(d).log.xz 004104237.td-b3lyp_6-31g+(d).inp 004104237.td-b3lyp_6-31g+(d).log.xz

004104237.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104237.td-b3lyp_6-31+g(d).gjf (generated)

004104237.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104237.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104237.mol 004104237.PUBCHEM 004104237.mol (via Jmol)
004104338.b3lyp_6-31g(d).inp

004104338.b3lyp_6-31g(d).qchem.inp (generated)

004104338.b3lyp_6-31g(d).gjf (generated)

004104338.b3lyp_6-31g(d).firefly.inp (generated)

004104338.b3lyp_6-31g(d).smash.inp (generated)

004104338.b3lyp_6-31g(d).nwchem.inp (generated) 004104338.b3lyp_6-31g(d).log.xz 004104338.td-b3lyp_6-31g+(d).inp 004104338.td-b3lyp_6-31g+(d).log.xz

004104338.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104338.td-b3lyp_6-31+g(d).gjf (generated)

004104338.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104338.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104338.mol 004104338.PUBCHEM 004104338.mol (via Jmol)
004104437.b3lyp_6-31g(d).inp

004104437.b3lyp_6-31g(d).qchem.inp (generated)

004104437.b3lyp_6-31g(d).gjf (generated)

004104437.b3lyp_6-31g(d).firefly.inp (generated)

004104437.b3lyp_6-31g(d).smash.inp (generated)

004104437.b3lyp_6-31g(d).nwchem.inp (generated) 004104437.b3lyp_6-31g(d).log.xz 004104437.mol 004104437.PUBCHEM 004104437.mol (via Jmol)
004104450.b3lyp_6-31g(d).inp

004104450.b3lyp_6-31g(d).qchem.inp (generated)

004104450.b3lyp_6-31g(d).gjf (generated)

004104450.b3lyp_6-31g(d).firefly.inp (generated)

004104450.b3lyp_6-31g(d).smash.inp (generated)

004104450.b3lyp_6-31g(d).nwchem.inp (generated) 004104450.b3lyp_6-31g(d).log.xz 004104450.td-b3lyp_6-31g+(d).inp 004104450.td-b3lyp_6-31g+(d).log.xz

004104450.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104450.td-b3lyp_6-31+g(d).gjf (generated)

004104450.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104450.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104450.mol 004104450.PUBCHEM 004104450.mol (via Jmol)
004104467.b3lyp_6-31g(d).inp

004104467.b3lyp_6-31g(d).qchem.inp (generated)

004104467.b3lyp_6-31g(d).gjf (generated)

004104467.b3lyp_6-31g(d).firefly.inp (generated)

004104467.b3lyp_6-31g(d).smash.inp (generated)

004104467.b3lyp_6-31g(d).nwchem.inp (generated) 004104467.b3lyp_6-31g(d).log.xz 004104467.td-b3lyp_6-31g+(d).inp 004104467.td-b3lyp_6-31g+(d).log.xz

004104467.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104467.td-b3lyp_6-31+g(d).gjf (generated)

004104467.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104467.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104467.mol 004104467.PUBCHEM 004104467.mol (via Jmol)
004104500.b3lyp_6-31g(d).inp

004104500.b3lyp_6-31g(d).qchem.inp (generated)

004104500.b3lyp_6-31g(d).gjf (generated)

004104500.b3lyp_6-31g(d).firefly.inp (generated)

004104500.b3lyp_6-31g(d).smash.inp (generated)

004104500.b3lyp_6-31g(d).nwchem.inp (generated) 004104500.b3lyp_6-31g(d).log.xz 004104500.td-b3lyp_6-31g+(d).inp 004104500.td-b3lyp_6-31g+(d).log.xz

004104500.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104500.td-b3lyp_6-31+g(d).gjf (generated)

004104500.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104500.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104500.mol 004104500.PUBCHEM 004104500.mol (via Jmol)
004104522.b3lyp_6-31g(d).inp

004104522.b3lyp_6-31g(d).qchem.inp (generated)

004104522.b3lyp_6-31g(d).gjf (generated)

004104522.b3lyp_6-31g(d).firefly.inp (generated)

004104522.b3lyp_6-31g(d).smash.inp (generated)

004104522.b3lyp_6-31g(d).nwchem.inp (generated) 004104522.b3lyp_6-31g(d).log.xz 004104522.td-b3lyp_6-31g+(d).inp 004104522.td-b3lyp_6-31g+(d).log.xz

004104522.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104522.td-b3lyp_6-31+g(d).gjf (generated)

004104522.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104522.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104522.mol 004104522.PUBCHEM 004104522.mol (via Jmol)
004104523.b3lyp_6-31g(d).inp

004104523.b3lyp_6-31g(d).qchem.inp (generated)

004104523.b3lyp_6-31g(d).gjf (generated)

004104523.b3lyp_6-31g(d).firefly.inp (generated)

004104523.b3lyp_6-31g(d).smash.inp (generated)

004104523.b3lyp_6-31g(d).nwchem.inp (generated) 004104523.b3lyp_6-31g(d).log.xz 004104523.mol 004104523.PUBCHEM 004104523.mol (via Jmol)
004104530.b3lyp_6-31g(d).inp

004104530.b3lyp_6-31g(d).qchem.inp (generated)

004104530.b3lyp_6-31g(d).gjf (generated)

004104530.b3lyp_6-31g(d).firefly.inp (generated)

004104530.b3lyp_6-31g(d).smash.inp (generated)

004104530.b3lyp_6-31g(d).nwchem.inp (generated) 004104530.b3lyp_6-31g(d).log.xz 004104530.td-b3lyp_6-31g+(d).inp 004104530.td-b3lyp_6-31g+(d).log.xz

004104530.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104530.td-b3lyp_6-31+g(d).gjf (generated)

004104530.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104530.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104530.mol 004104530.PUBCHEM 004104530.mol (via Jmol)
004104534.b3lyp_6-31g(d).inp

004104534.b3lyp_6-31g(d).qchem.inp (generated)

004104534.b3lyp_6-31g(d).gjf (generated)

004104534.b3lyp_6-31g(d).firefly.inp (generated)

004104534.b3lyp_6-31g(d).smash.inp (generated)

004104534.b3lyp_6-31g(d).nwchem.inp (generated) 004104534.b3lyp_6-31g(d).log.xz 004104534.td-b3lyp_6-31g+(d).inp 004104534.td-b3lyp_6-31g+(d).log.xz

004104534.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104534.td-b3lyp_6-31+g(d).gjf (generated)

004104534.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104534.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104534.mol 004104534.PUBCHEM 004104534.mol (via Jmol)
004104535.b3lyp_6-31g(d).inp

004104535.b3lyp_6-31g(d).qchem.inp (generated)

004104535.b3lyp_6-31g(d).gjf (generated)

004104535.b3lyp_6-31g(d).firefly.inp (generated)

004104535.b3lyp_6-31g(d).smash.inp (generated)

004104535.b3lyp_6-31g(d).nwchem.inp (generated) 004104535.b3lyp_6-31g(d).log.xz 004104535.td-b3lyp_6-31g+(d).inp 004104535.td-b3lyp_6-31g+(d).log.xz

004104535.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104535.td-b3lyp_6-31+g(d).gjf (generated)

004104535.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104535.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104535.mol 004104535.PUBCHEM 004104535.mol (via Jmol)
004104550.b3lyp_6-31g(d).inp

004104550.b3lyp_6-31g(d).qchem.inp (generated)

004104550.b3lyp_6-31g(d).gjf (generated)

004104550.b3lyp_6-31g(d).firefly.inp (generated)

004104550.b3lyp_6-31g(d).smash.inp (generated)

004104550.b3lyp_6-31g(d).nwchem.inp (generated) 004104550.b3lyp_6-31g(d).log.xz 004104550.td-b3lyp_6-31g+(d).inp 004104550.td-b3lyp_6-31g+(d).log.xz

004104550.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104550.td-b3lyp_6-31+g(d).gjf (generated)

004104550.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104550.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104550.mol 004104550.PUBCHEM 004104550.mol (via Jmol)
004104650.b3lyp_6-31g(d).inp

004104650.b3lyp_6-31g(d).qchem.inp (generated)

004104650.b3lyp_6-31g(d).gjf (generated)

004104650.b3lyp_6-31g(d).firefly.inp (generated)

004104650.b3lyp_6-31g(d).smash.inp (generated)

004104650.b3lyp_6-31g(d).nwchem.inp (generated) 004104650.b3lyp_6-31g(d).log.xz 004104650.td-b3lyp_6-31g+(d).inp 004104650.td-b3lyp_6-31g+(d).log.xz

004104650.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104650.td-b3lyp_6-31+g(d).gjf (generated)

004104650.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104650.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104650.mol 004104650.PUBCHEM 004104650.mol (via Jmol)
004104720.b3lyp_6-31g(d).inp

004104720.b3lyp_6-31g(d).qchem.inp (generated)

004104720.b3lyp_6-31g(d).gjf (generated)

004104720.b3lyp_6-31g(d).firefly.inp (generated)

004104720.b3lyp_6-31g(d).smash.inp (generated)

004104720.b3lyp_6-31g(d).nwchem.inp (generated) 004104720.b3lyp_6-31g(d).log.xz 004104720.td-b3lyp_6-31g+(d).inp 004104720.td-b3lyp_6-31g+(d).log.xz

004104720.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104720.td-b3lyp_6-31+g(d).gjf (generated)

004104720.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104720.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104720.mol 004104720.PUBCHEM 004104720.mol (via Jmol)
004104798.b3lyp_6-31g(d).inp

004104798.b3lyp_6-31g(d).qchem.inp (generated)

004104798.b3lyp_6-31g(d).gjf (generated)

004104798.b3lyp_6-31g(d).firefly.inp (generated)

004104798.b3lyp_6-31g(d).smash.inp (generated)

004104798.b3lyp_6-31g(d).nwchem.inp (generated) 004104798.b3lyp_6-31g(d).log.xz 004104798.td-b3lyp_6-31g+(d).inp 004104798.td-b3lyp_6-31g+(d).log.xz

004104798.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104798.td-b3lyp_6-31+g(d).gjf (generated)

004104798.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104798.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104798.mol 004104798.PUBCHEM 004104798.mol (via Jmol)
004104802.b3lyp_6-31g(d).inp

004104802.b3lyp_6-31g(d).qchem.inp (generated)

004104802.b3lyp_6-31g(d).gjf (generated)

004104802.b3lyp_6-31g(d).firefly.inp (generated)

004104802.b3lyp_6-31g(d).smash.inp (generated)

004104802.b3lyp_6-31g(d).nwchem.inp (generated) 004104802.b3lyp_6-31g(d).log.xz 004104802.td-b3lyp_6-31g+(d).inp 004104802.td-b3lyp_6-31g+(d).log.xz

004104802.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104802.td-b3lyp_6-31+g(d).gjf (generated)

004104802.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104802.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104802.mol 004104802.PUBCHEM 004104802.mol (via Jmol)
004104812.b3lyp_6-31g(d).inp

004104812.b3lyp_6-31g(d).qchem.inp (generated)

004104812.b3lyp_6-31g(d).gjf (generated)

004104812.b3lyp_6-31g(d).firefly.inp (generated)

004104812.b3lyp_6-31g(d).smash.inp (generated)

004104812.b3lyp_6-31g(d).nwchem.inp (generated) 004104812.b3lyp_6-31g(d).log.xz 004104812.td-b3lyp_6-31g+(d).inp 004104812.td-b3lyp_6-31g+(d).log.xz

004104812.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104812.td-b3lyp_6-31+g(d).gjf (generated)

004104812.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104812.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104812.mol 004104812.PUBCHEM 004104812.mol (via Jmol)
004104819.b3lyp_6-31g(d).inp

004104819.b3lyp_6-31g(d).qchem.inp (generated)

004104819.b3lyp_6-31g(d).gjf (generated)

004104819.b3lyp_6-31g(d).firefly.inp (generated)

004104819.b3lyp_6-31g(d).smash.inp (generated)

004104819.b3lyp_6-31g(d).nwchem.inp (generated) 004104819.b3lyp_6-31g(d).log.xz 004104819.td-b3lyp_6-31g+(d).inp 004104819.td-b3lyp_6-31g+(d).log.xz

004104819.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104819.td-b3lyp_6-31+g(d).gjf (generated)

004104819.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104819.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104819.mol 004104819.PUBCHEM 004104819.mol (via Jmol)
004104849.b3lyp_6-31g(d).inp

004104849.b3lyp_6-31g(d).qchem.inp (generated)

004104849.b3lyp_6-31g(d).gjf (generated)

004104849.b3lyp_6-31g(d).firefly.inp (generated)

004104849.b3lyp_6-31g(d).smash.inp (generated)

004104849.b3lyp_6-31g(d).nwchem.inp (generated) 004104849.b3lyp_6-31g(d).log.xz 004104849.mol 004104849.PUBCHEM 004104849.mol (via Jmol)
004104851.b3lyp_6-31g(d).inp

004104851.b3lyp_6-31g(d).qchem.inp (generated)

004104851.b3lyp_6-31g(d).gjf (generated)

004104851.b3lyp_6-31g(d).firefly.inp (generated)

004104851.b3lyp_6-31g(d).smash.inp (generated)

004104851.b3lyp_6-31g(d).nwchem.inp (generated) 004104851.b3lyp_6-31g(d).log.xz 004104851.td-b3lyp_6-31g+(d).inp 004104851.td-b3lyp_6-31g+(d).log.xz

004104851.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104851.td-b3lyp_6-31+g(d).gjf (generated)

004104851.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104851.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104851.mol 004104851.PUBCHEM 004104851.mol (via Jmol)
004104852.b3lyp_6-31g(d).inp

004104852.b3lyp_6-31g(d).qchem.inp (generated)

004104852.b3lyp_6-31g(d).gjf (generated)

004104852.b3lyp_6-31g(d).firefly.inp (generated)

004104852.b3lyp_6-31g(d).smash.inp (generated)

004104852.b3lyp_6-31g(d).nwchem.inp (generated) 004104852.b3lyp_6-31g(d).log.xz 004104852.td-b3lyp_6-31g+(d).inp 004104852.td-b3lyp_6-31g+(d).log.xz

004104852.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104852.td-b3lyp_6-31+g(d).gjf (generated)

004104852.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104852.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104852.mol 004104852.PUBCHEM 004104852.mol (via Jmol)
004104875.b3lyp_6-31g(d).inp

004104875.b3lyp_6-31g(d).qchem.inp (generated)

004104875.b3lyp_6-31g(d).gjf (generated)

004104875.b3lyp_6-31g(d).firefly.inp (generated)

004104875.b3lyp_6-31g(d).smash.inp (generated)

004104875.b3lyp_6-31g(d).nwchem.inp (generated) 004104875.b3lyp_6-31g(d).log.xz 004104875.mol 004104875.PUBCHEM 004104875.mol (via Jmol)
004104954.b3lyp_6-31g(d).inp

004104954.b3lyp_6-31g(d).qchem.inp (generated)

004104954.b3lyp_6-31g(d).gjf (generated)

004104954.b3lyp_6-31g(d).firefly.inp (generated)

004104954.b3lyp_6-31g(d).smash.inp (generated)

004104954.b3lyp_6-31g(d).nwchem.inp (generated) 004104954.b3lyp_6-31g(d).log.xz 004104954.td-b3lyp_6-31g+(d).inp 004104954.td-b3lyp_6-31g+(d).log.xz

004104954.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104954.td-b3lyp_6-31+g(d).gjf (generated)

004104954.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104954.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104954.mol 004104954.PUBCHEM 004104954.mol (via Jmol)
004104980.b3lyp_6-31g(d).inp

004104980.b3lyp_6-31g(d).qchem.inp (generated)

004104980.b3lyp_6-31g(d).gjf (generated)

004104980.b3lyp_6-31g(d).firefly.inp (generated)

004104980.b3lyp_6-31g(d).smash.inp (generated)

004104980.b3lyp_6-31g(d).nwchem.inp (generated) 004104980.b3lyp_6-31g(d).log.xz 004104980.td-b3lyp_6-31g+(d).inp 004104980.td-b3lyp_6-31g+(d).log.xz

004104980.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104980.td-b3lyp_6-31+g(d).gjf (generated)

004104980.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104980.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104980.mol 004104980.PUBCHEM 004104980.mol (via Jmol)
004104992.b3lyp_6-31g(d).inp

004104992.b3lyp_6-31g(d).qchem.inp (generated)

004104992.b3lyp_6-31g(d).gjf (generated)

004104992.b3lyp_6-31g(d).firefly.inp (generated)

004104992.b3lyp_6-31g(d).smash.inp (generated)

004104992.b3lyp_6-31g(d).nwchem.inp (generated) 004104992.b3lyp_6-31g(d).log.xz 004104992.td-b3lyp_6-31g+(d).inp 004104992.td-b3lyp_6-31g+(d).log.xz

004104992.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104992.td-b3lyp_6-31+g(d).gjf (generated)

004104992.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104992.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104992.mol 004104992.PUBCHEM 004104992.mol (via Jmol)
004104996.b3lyp_6-31g(d).inp

004104996.b3lyp_6-31g(d).qchem.inp (generated)

004104996.b3lyp_6-31g(d).gjf (generated)

004104996.b3lyp_6-31g(d).firefly.inp (generated)

004104996.b3lyp_6-31g(d).smash.inp (generated)

004104996.b3lyp_6-31g(d).nwchem.inp (generated) 004104996.b3lyp_6-31g(d).log.xz 004104996.td-b3lyp_6-31g+(d).inp 004104996.td-b3lyp_6-31g+(d).log.xz

004104996.td-b3lyp_6-31+g(d).qchem.inp (generated)

004104996.td-b3lyp_6-31+g(d).gjf (generated)

004104996.td-b3lyp_6-31+g(d).firefly.inp (generated)

004104996.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004104996.mol 004104996.PUBCHEM 004104996.mol (via Jmol)
004105000.b3lyp_6-31g(d).inp

004105000.b3lyp_6-31g(d).qchem.inp (generated)

004105000.b3lyp_6-31g(d).gjf (generated)

004105000.b3lyp_6-31g(d).firefly.inp (generated)

004105000.b3lyp_6-31g(d).smash.inp (generated)

004105000.b3lyp_6-31g(d).nwchem.inp (generated) 004105000.b3lyp_6-31g(d).log.xz 004105000.td-b3lyp_6-31g+(d).inp 004105000.td-b3lyp_6-31g+(d).log.xz

004105000.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105000.td-b3lyp_6-31+g(d).gjf (generated)

004105000.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105000.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105000.mol 004105000.PUBCHEM 004105000.mol (via Jmol)
004105104.b3lyp_6-31g(d).inp

004105104.b3lyp_6-31g(d).qchem.inp (generated)

004105104.b3lyp_6-31g(d).gjf (generated)

004105104.b3lyp_6-31g(d).firefly.inp (generated)

004105104.b3lyp_6-31g(d).smash.inp (generated)

004105104.b3lyp_6-31g(d).nwchem.inp (generated) 004105104.b3lyp_6-31g(d).log.xz 004105104.td-b3lyp_6-31g+(d).inp 004105104.td-b3lyp_6-31g+(d).log.xz

004105104.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105104.td-b3lyp_6-31+g(d).gjf (generated)

004105104.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105104.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105104.mol 004105104.PUBCHEM 004105104.mol (via Jmol)
004105135.b3lyp_6-31g(d).inp

004105135.b3lyp_6-31g(d).qchem.inp (generated)

004105135.b3lyp_6-31g(d).gjf (generated)

004105135.b3lyp_6-31g(d).firefly.inp (generated)

004105135.b3lyp_6-31g(d).smash.inp (generated)

004105135.b3lyp_6-31g(d).nwchem.inp (generated) 004105135.b3lyp_6-31g(d).log.xz 004105135.td-b3lyp_6-31g+(d).inp 004105135.td-b3lyp_6-31g+(d).log.xz

004105135.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105135.td-b3lyp_6-31+g(d).gjf (generated)

004105135.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105135.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105135.mol 004105135.PUBCHEM 004105135.mol (via Jmol)
004105138.b3lyp_6-31g(d).inp

004105138.b3lyp_6-31g(d).qchem.inp (generated)

004105138.b3lyp_6-31g(d).gjf (generated)

004105138.b3lyp_6-31g(d).firefly.inp (generated)

004105138.b3lyp_6-31g(d).smash.inp (generated)

004105138.b3lyp_6-31g(d).nwchem.inp (generated) 004105138.b3lyp_6-31g(d).log.xz 004105138.td-b3lyp_6-31g+(d).inp 004105138.td-b3lyp_6-31g+(d).log.xz

004105138.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105138.td-b3lyp_6-31+g(d).gjf (generated)

004105138.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105138.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105138.mol 004105138.PUBCHEM 004105138.mol (via Jmol)
004105139.b3lyp_6-31g(d).inp

004105139.b3lyp_6-31g(d).qchem.inp (generated)

004105139.b3lyp_6-31g(d).gjf (generated)

004105139.b3lyp_6-31g(d).firefly.inp (generated)

004105139.b3lyp_6-31g(d).smash.inp (generated)

004105139.b3lyp_6-31g(d).nwchem.inp (generated) 004105139.b3lyp_6-31g(d).log.xz 004105139.td-b3lyp_6-31g+(d).inp 004105139.td-b3lyp_6-31g+(d).log.xz

004105139.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105139.td-b3lyp_6-31+g(d).gjf (generated)

004105139.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105139.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105139.mol 004105139.PUBCHEM 004105139.mol (via Jmol)
004105194.b3lyp_6-31g(d).inp

004105194.b3lyp_6-31g(d).qchem.inp (generated)

004105194.b3lyp_6-31g(d).gjf (generated)

004105194.b3lyp_6-31g(d).firefly.inp (generated)

004105194.b3lyp_6-31g(d).smash.inp (generated)

004105194.b3lyp_6-31g(d).nwchem.inp (generated) 004105194.b3lyp_6-31g(d).log.xz 004105194.td-b3lyp_6-31g+(d).inp 004105194.td-b3lyp_6-31g+(d).log.xz

004105194.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105194.td-b3lyp_6-31+g(d).gjf (generated)

004105194.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105194.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105194.mol 004105194.PUBCHEM 004105194.mol (via Jmol)
004105256.b3lyp_6-31g(d).inp

004105256.b3lyp_6-31g(d).qchem.inp (generated)

004105256.b3lyp_6-31g(d).gjf (generated)

004105256.b3lyp_6-31g(d).firefly.inp (generated)

004105256.b3lyp_6-31g(d).smash.inp (generated)

004105256.b3lyp_6-31g(d).nwchem.inp (generated) 004105256.b3lyp_6-31g(d).log.xz 004105256.mol 004105256.PUBCHEM 004105256.mol (via Jmol)
004105260.b3lyp_6-31g(d).inp

004105260.b3lyp_6-31g(d).qchem.inp (generated)

004105260.b3lyp_6-31g(d).gjf (generated)

004105260.b3lyp_6-31g(d).firefly.inp (generated)

004105260.b3lyp_6-31g(d).smash.inp (generated)

004105260.b3lyp_6-31g(d).nwchem.inp (generated) 004105260.b3lyp_6-31g(d).log.xz 004105260.td-b3lyp_6-31g+(d).inp 004105260.td-b3lyp_6-31g+(d).log.xz

004105260.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105260.td-b3lyp_6-31+g(d).gjf (generated)

004105260.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105260.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105260.mol 004105260.PUBCHEM 004105260.mol (via Jmol)
004105317.b3lyp_6-31g(d).inp

004105317.b3lyp_6-31g(d).qchem.inp (generated)

004105317.b3lyp_6-31g(d).gjf (generated)

004105317.b3lyp_6-31g(d).firefly.inp (generated)

004105317.b3lyp_6-31g(d).smash.inp (generated)

004105317.b3lyp_6-31g(d).nwchem.inp (generated) 004105317.b3lyp_6-31g(d).log.xz 004105317.td-b3lyp_6-31g+(d).inp 004105317.td-b3lyp_6-31g+(d).log.xz

004105317.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105317.td-b3lyp_6-31+g(d).gjf (generated)

004105317.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105317.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105317.mol 004105317.PUBCHEM 004105317.mol (via Jmol)
004105349.b3lyp_6-31g(d).inp

004105349.b3lyp_6-31g(d).qchem.inp (generated)

004105349.b3lyp_6-31g(d).gjf (generated)

004105349.b3lyp_6-31g(d).firefly.inp (generated)

004105349.b3lyp_6-31g(d).smash.inp (generated)

004105349.b3lyp_6-31g(d).nwchem.inp (generated) 004105349.b3lyp_6-31g(d).log.xz 004105349.td-b3lyp_6-31g+(d).inp 004105349.td-b3lyp_6-31g+(d).log.xz

004105349.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105349.td-b3lyp_6-31+g(d).gjf (generated)

004105349.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105349.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105349.mol 004105349.PUBCHEM 004105349.mol (via Jmol)
004105367.b3lyp_6-31g(d).inp

004105367.b3lyp_6-31g(d).qchem.inp (generated)

004105367.b3lyp_6-31g(d).gjf (generated)

004105367.b3lyp_6-31g(d).firefly.inp (generated)

004105367.b3lyp_6-31g(d).smash.inp (generated)

004105367.b3lyp_6-31g(d).nwchem.inp (generated) 004105367.b3lyp_6-31g(d).log.xz 004105367.mol 004105367.PUBCHEM 004105367.mol (via Jmol)
004105389.b3lyp_6-31g(d).inp

004105389.b3lyp_6-31g(d).qchem.inp (generated)

004105389.b3lyp_6-31g(d).gjf (generated)

004105389.b3lyp_6-31g(d).firefly.inp (generated)

004105389.b3lyp_6-31g(d).smash.inp (generated)

004105389.b3lyp_6-31g(d).nwchem.inp (generated) 004105389.b3lyp_6-31g(d).log.xz 004105389.td-b3lyp_6-31g+(d).inp 004105389.td-b3lyp_6-31g+(d).log.xz

004105389.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105389.td-b3lyp_6-31+g(d).gjf (generated)

004105389.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105389.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105389.mol 004105389.PUBCHEM 004105389.mol (via Jmol)
004105392.b3lyp_6-31g(d).inp

004105392.b3lyp_6-31g(d).qchem.inp (generated)

004105392.b3lyp_6-31g(d).gjf (generated)

004105392.b3lyp_6-31g(d).firefly.inp (generated)

004105392.b3lyp_6-31g(d).smash.inp (generated)

004105392.b3lyp_6-31g(d).nwchem.inp (generated) 004105392.b3lyp_6-31g(d).log.xz 004105392.td-b3lyp_6-31g+(d).inp 004105392.td-b3lyp_6-31g+(d).log.xz

004105392.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105392.td-b3lyp_6-31+g(d).gjf (generated)

004105392.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105392.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105392.mol 004105392.PUBCHEM 004105392.mol (via Jmol)
004105398.b3lyp_6-31g(d).inp

004105398.b3lyp_6-31g(d).qchem.inp (generated)

004105398.b3lyp_6-31g(d).gjf (generated)

004105398.b3lyp_6-31g(d).firefly.inp (generated)

004105398.b3lyp_6-31g(d).smash.inp (generated)

004105398.b3lyp_6-31g(d).nwchem.inp (generated) 004105398.b3lyp_6-31g(d).log.xz 004105398.td-b3lyp_6-31g+(d).inp 004105398.td-b3lyp_6-31g+(d).log.xz

004105398.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105398.td-b3lyp_6-31+g(d).gjf (generated)

004105398.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105398.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105398.mol 004105398.PUBCHEM 004105398.mol (via Jmol)
004105436.b3lyp_6-31g(d).inp

004105436.b3lyp_6-31g(d).qchem.inp (generated)

004105436.b3lyp_6-31g(d).gjf (generated)

004105436.b3lyp_6-31g(d).firefly.inp (generated)

004105436.b3lyp_6-31g(d).smash.inp (generated)

004105436.b3lyp_6-31g(d).nwchem.inp (generated) 004105436.b3lyp_6-31g(d).log.xz 004105436.td-b3lyp_6-31g+(d).inp 004105436.td-b3lyp_6-31g+(d).log.xz

004105436.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105436.td-b3lyp_6-31+g(d).gjf (generated)

004105436.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105436.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105436.mol 004105436.PUBCHEM 004105436.mol (via Jmol)
004105437.b3lyp_6-31g(d).inp

004105437.b3lyp_6-31g(d).qchem.inp (generated)

004105437.b3lyp_6-31g(d).gjf (generated)

004105437.b3lyp_6-31g(d).firefly.inp (generated)

004105437.b3lyp_6-31g(d).smash.inp (generated)

004105437.b3lyp_6-31g(d).nwchem.inp (generated) 004105437.b3lyp_6-31g(d).log.xz 004105437.td-b3lyp_6-31g+(d).inp 004105437.td-b3lyp_6-31g+(d).log.xz

004105437.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105437.td-b3lyp_6-31+g(d).gjf (generated)

004105437.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105437.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105437.mol 004105437.PUBCHEM 004105437.mol (via Jmol)
004105450.b3lyp_6-31g(d).inp

004105450.b3lyp_6-31g(d).qchem.inp (generated)

004105450.b3lyp_6-31g(d).gjf (generated)

004105450.b3lyp_6-31g(d).firefly.inp (generated)

004105450.b3lyp_6-31g(d).smash.inp (generated)

004105450.b3lyp_6-31g(d).nwchem.inp (generated) 004105450.b3lyp_6-31g(d).log.xz 004105450.td-b3lyp_6-31g+(d).inp 004105450.td-b3lyp_6-31g+(d).log.xz

004105450.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105450.td-b3lyp_6-31+g(d).gjf (generated)

004105450.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105450.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105450.mol 004105450.PUBCHEM 004105450.mol (via Jmol)
004105453.b3lyp_6-31g(d).inp

004105453.b3lyp_6-31g(d).qchem.inp (generated)

004105453.b3lyp_6-31g(d).gjf (generated)

004105453.b3lyp_6-31g(d).firefly.inp (generated)

004105453.b3lyp_6-31g(d).smash.inp (generated)

004105453.b3lyp_6-31g(d).nwchem.inp (generated) 004105453.b3lyp_6-31g(d).log.xz 004105453.td-b3lyp_6-31g+(d).inp 004105453.td-b3lyp_6-31g+(d).log.xz

004105453.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105453.td-b3lyp_6-31+g(d).gjf (generated)

004105453.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105453.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105453.mol 004105453.PUBCHEM 004105453.mol (via Jmol)
004105492.b3lyp_6-31g(d).inp

004105492.b3lyp_6-31g(d).qchem.inp (generated)

004105492.b3lyp_6-31g(d).gjf (generated)

004105492.b3lyp_6-31g(d).firefly.inp (generated)

004105492.b3lyp_6-31g(d).smash.inp (generated)

004105492.b3lyp_6-31g(d).nwchem.inp (generated) 004105492.b3lyp_6-31g(d).log.xz 004105492.td-b3lyp_6-31g+(d).inp 004105492.td-b3lyp_6-31g+(d).log.xz

004105492.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105492.td-b3lyp_6-31+g(d).gjf (generated)

004105492.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105492.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105492.mol 004105492.PUBCHEM 004105492.mol (via Jmol)
004105497.b3lyp_6-31g(d).inp

004105497.b3lyp_6-31g(d).qchem.inp (generated)

004105497.b3lyp_6-31g(d).gjf (generated)

004105497.b3lyp_6-31g(d).firefly.inp (generated)

004105497.b3lyp_6-31g(d).smash.inp (generated)

004105497.b3lyp_6-31g(d).nwchem.inp (generated) 004105497.b3lyp_6-31g(d).log.xz 004105497.td-b3lyp_6-31g+(d).inp 004105497.td-b3lyp_6-31g+(d).log.xz

004105497.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105497.td-b3lyp_6-31+g(d).gjf (generated)

004105497.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105497.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105497.mol 004105497.PUBCHEM 004105497.mol (via Jmol)
004105561.b3lyp_6-31g(d).inp

004105561.b3lyp_6-31g(d).qchem.inp (generated)

004105561.b3lyp_6-31g(d).gjf (generated)

004105561.b3lyp_6-31g(d).firefly.inp (generated)

004105561.b3lyp_6-31g(d).smash.inp (generated)

004105561.b3lyp_6-31g(d).nwchem.inp (generated) 004105561.b3lyp_6-31g(d).log.xz 004105561.td-b3lyp_6-31g+(d).inp 004105561.td-b3lyp_6-31g+(d).log.xz

004105561.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105561.td-b3lyp_6-31+g(d).gjf (generated)

004105561.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105561.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105561.mol 004105561.PUBCHEM 004105561.mol (via Jmol)
004105623.b3lyp_6-31g(d).inp

004105623.b3lyp_6-31g(d).qchem.inp (generated)

004105623.b3lyp_6-31g(d).gjf (generated)

004105623.b3lyp_6-31g(d).firefly.inp (generated)

004105623.b3lyp_6-31g(d).smash.inp (generated)

004105623.b3lyp_6-31g(d).nwchem.inp (generated) 004105623.b3lyp_6-31g(d).log.xz 004105623.td-b3lyp_6-31g+(d).inp 004105623.td-b3lyp_6-31g+(d).log.xz

004105623.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105623.td-b3lyp_6-31+g(d).gjf (generated)

004105623.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105623.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105623.mol 004105623.PUBCHEM 004105623.mol (via Jmol)
004105646.b3lyp_6-31g(d).inp

004105646.b3lyp_6-31g(d).qchem.inp (generated)

004105646.b3lyp_6-31g(d).gjf (generated)

004105646.b3lyp_6-31g(d).firefly.inp (generated)

004105646.b3lyp_6-31g(d).smash.inp (generated)

004105646.b3lyp_6-31g(d).nwchem.inp (generated) 004105646.b3lyp_6-31g(d).log.xz 004105646.td-b3lyp_6-31g+(d).inp 004105646.td-b3lyp_6-31g+(d).log.xz

004105646.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105646.td-b3lyp_6-31+g(d).gjf (generated)

004105646.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105646.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105646.mol 004105646.PUBCHEM 004105646.mol (via Jmol)
004105650.b3lyp_6-31g(d).inp

004105650.b3lyp_6-31g(d).qchem.inp (generated)

004105650.b3lyp_6-31g(d).gjf (generated)

004105650.b3lyp_6-31g(d).firefly.inp (generated)

004105650.b3lyp_6-31g(d).smash.inp (generated)

004105650.b3lyp_6-31g(d).nwchem.inp (generated) 004105650.b3lyp_6-31g(d).log.xz 004105650.td-b3lyp_6-31g+(d).inp 004105650.td-b3lyp_6-31g+(d).log.xz

004105650.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105650.td-b3lyp_6-31+g(d).gjf (generated)

004105650.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105650.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105650.mol 004105650.PUBCHEM 004105650.mol (via Jmol)
004105655.b3lyp_6-31g(d).inp

004105655.b3lyp_6-31g(d).qchem.inp (generated)

004105655.b3lyp_6-31g(d).gjf (generated)

004105655.b3lyp_6-31g(d).firefly.inp (generated)

004105655.b3lyp_6-31g(d).smash.inp (generated)

004105655.b3lyp_6-31g(d).nwchem.inp (generated) 004105655.b3lyp_6-31g(d).log.xz 004105655.td-b3lyp_6-31g+(d).inp 004105655.td-b3lyp_6-31g+(d).log.xz

004105655.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105655.td-b3lyp_6-31+g(d).gjf (generated)

004105655.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105655.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105655.mol 004105655.PUBCHEM 004105655.mol (via Jmol)
004105673.b3lyp_6-31g(d).inp

004105673.b3lyp_6-31g(d).qchem.inp (generated)

004105673.b3lyp_6-31g(d).gjf (generated)

004105673.b3lyp_6-31g(d).firefly.inp (generated)

004105673.b3lyp_6-31g(d).smash.inp (generated)

004105673.b3lyp_6-31g(d).nwchem.inp (generated) 004105673.b3lyp_6-31g(d).log.xz 004105673.td-b3lyp_6-31g+(d).inp 004105673.td-b3lyp_6-31g+(d).log.xz

004105673.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105673.td-b3lyp_6-31+g(d).gjf (generated)

004105673.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105673.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105673.mol 004105673.PUBCHEM 004105673.mol (via Jmol)
004105718.b3lyp_6-31g(d).inp

004105718.b3lyp_6-31g(d).qchem.inp (generated)

004105718.b3lyp_6-31g(d).gjf (generated)

004105718.b3lyp_6-31g(d).firefly.inp (generated)

004105718.b3lyp_6-31g(d).smash.inp (generated)

004105718.b3lyp_6-31g(d).nwchem.inp (generated) 004105718.b3lyp_6-31g(d).log.xz 004105718.td-b3lyp_6-31g+(d).inp 004105718.td-b3lyp_6-31g+(d).log.xz

004105718.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105718.td-b3lyp_6-31+g(d).gjf (generated)

004105718.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105718.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105718.mol 004105718.PUBCHEM 004105718.mol (via Jmol)
004105730.b3lyp_6-31g(d).inp

004105730.b3lyp_6-31g(d).qchem.inp (generated)

004105730.b3lyp_6-31g(d).gjf (generated)

004105730.b3lyp_6-31g(d).firefly.inp (generated)

004105730.b3lyp_6-31g(d).smash.inp (generated)

004105730.b3lyp_6-31g(d).nwchem.inp (generated) 004105730.b3lyp_6-31g(d).log.xz 004105730.td-b3lyp_6-31g+(d).inp 004105730.td-b3lyp_6-31g+(d).log.xz

004105730.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105730.td-b3lyp_6-31+g(d).gjf (generated)

004105730.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105730.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105730.mol 004105730.PUBCHEM 004105730.mol (via Jmol)
004105765.b3lyp_6-31g(d).inp

004105765.b3lyp_6-31g(d).qchem.inp (generated)

004105765.b3lyp_6-31g(d).gjf (generated)

004105765.b3lyp_6-31g(d).firefly.inp (generated)

004105765.b3lyp_6-31g(d).smash.inp (generated)

004105765.b3lyp_6-31g(d).nwchem.inp (generated) 004105765.b3lyp_6-31g(d).log.xz 004105765.td-b3lyp_6-31g+(d).inp 004105765.td-b3lyp_6-31g+(d).log.xz

004105765.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105765.td-b3lyp_6-31+g(d).gjf (generated)

004105765.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105765.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105765.mol 004105765.PUBCHEM 004105765.mol (via Jmol)
004105799.b3lyp_6-31g(d).inp

004105799.b3lyp_6-31g(d).qchem.inp (generated)

004105799.b3lyp_6-31g(d).gjf (generated)

004105799.b3lyp_6-31g(d).firefly.inp (generated)

004105799.b3lyp_6-31g(d).smash.inp (generated)

004105799.b3lyp_6-31g(d).nwchem.inp (generated) 004105799.b3lyp_6-31g(d).log.xz 004105799.td-b3lyp_6-31g+(d).inp 004105799.td-b3lyp_6-31g+(d).log.xz

004105799.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105799.td-b3lyp_6-31+g(d).gjf (generated)

004105799.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105799.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105799.mol 004105799.PUBCHEM 004105799.mol (via Jmol)
004105803.b3lyp_6-31g(d).inp

004105803.b3lyp_6-31g(d).qchem.inp (generated)

004105803.b3lyp_6-31g(d).gjf (generated)

004105803.b3lyp_6-31g(d).firefly.inp (generated)

004105803.b3lyp_6-31g(d).smash.inp (generated)

004105803.b3lyp_6-31g(d).nwchem.inp (generated) 004105803.b3lyp_6-31g(d).log.xz 004105803.td-b3lyp_6-31g+(d).inp 004105803.td-b3lyp_6-31g+(d).log.xz

004105803.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105803.td-b3lyp_6-31+g(d).gjf (generated)

004105803.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105803.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105803.mol 004105803.PUBCHEM 004105803.mol (via Jmol)
004105804.b3lyp_6-31g(d).inp

004105804.b3lyp_6-31g(d).qchem.inp (generated)

004105804.b3lyp_6-31g(d).gjf (generated)

004105804.b3lyp_6-31g(d).firefly.inp (generated)

004105804.b3lyp_6-31g(d).smash.inp (generated)

004105804.b3lyp_6-31g(d).nwchem.inp (generated) 004105804.b3lyp_6-31g(d).log.xz 004105804.mol 004105804.PUBCHEM 004105804.mol (via Jmol)
004105807.b3lyp_6-31g(d).inp

004105807.b3lyp_6-31g(d).qchem.inp (generated)

004105807.b3lyp_6-31g(d).gjf (generated)

004105807.b3lyp_6-31g(d).firefly.inp (generated)

004105807.b3lyp_6-31g(d).smash.inp (generated)

004105807.b3lyp_6-31g(d).nwchem.inp (generated) 004105807.b3lyp_6-31g(d).log.xz 004105807.mol 004105807.PUBCHEM 004105807.mol (via Jmol)
004105822.b3lyp_6-31g(d).inp

004105822.b3lyp_6-31g(d).qchem.inp (generated)

004105822.b3lyp_6-31g(d).gjf (generated)

004105822.b3lyp_6-31g(d).firefly.inp (generated)

004105822.b3lyp_6-31g(d).smash.inp (generated)

004105822.b3lyp_6-31g(d).nwchem.inp (generated) 004105822.b3lyp_6-31g(d).log.xz 004105822.td-b3lyp_6-31g+(d).inp 004105822.td-b3lyp_6-31g+(d).log.xz

004105822.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105822.td-b3lyp_6-31+g(d).gjf (generated)

004105822.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105822.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105822.mol 004105822.PUBCHEM 004105822.mol (via Jmol)
004105833.b3lyp_6-31g(d).inp

004105833.b3lyp_6-31g(d).qchem.inp (generated)

004105833.b3lyp_6-31g(d).gjf (generated)

004105833.b3lyp_6-31g(d).firefly.inp (generated)

004105833.b3lyp_6-31g(d).smash.inp (generated)

004105833.b3lyp_6-31g(d).nwchem.inp (generated) 004105833.b3lyp_6-31g(d).log.xz 004105833.mol 004105833.PUBCHEM 004105833.mol (via Jmol)
004105900.b3lyp_6-31g(d).inp

004105900.b3lyp_6-31g(d).qchem.inp (generated)

004105900.b3lyp_6-31g(d).gjf (generated)

004105900.b3lyp_6-31g(d).firefly.inp (generated)

004105900.b3lyp_6-31g(d).smash.inp (generated)

004105900.b3lyp_6-31g(d).nwchem.inp (generated) 004105900.b3lyp_6-31g(d).log.xz 004105900.td-b3lyp_6-31g+(d).inp 004105900.td-b3lyp_6-31g+(d).log.xz

004105900.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105900.td-b3lyp_6-31+g(d).gjf (generated)

004105900.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105900.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105900.mol 004105900.PUBCHEM 004105900.mol (via Jmol)
004105903.b3lyp_6-31g(d).inp

004105903.b3lyp_6-31g(d).qchem.inp (generated)

004105903.b3lyp_6-31g(d).gjf (generated)

004105903.b3lyp_6-31g(d).firefly.inp (generated)

004105903.b3lyp_6-31g(d).smash.inp (generated)

004105903.b3lyp_6-31g(d).nwchem.inp (generated) 004105903.b3lyp_6-31g(d).log.xz 004105903.td-b3lyp_6-31g+(d).inp 004105903.td-b3lyp_6-31g+(d).log.xz

004105903.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105903.td-b3lyp_6-31+g(d).gjf (generated)

004105903.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105903.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105903.mol 004105903.PUBCHEM 004105903.mol (via Jmol)
004105927.b3lyp_6-31g(d).inp

004105927.b3lyp_6-31g(d).qchem.inp (generated)

004105927.b3lyp_6-31g(d).gjf (generated)

004105927.b3lyp_6-31g(d).firefly.inp (generated)

004105927.b3lyp_6-31g(d).smash.inp (generated)

004105927.b3lyp_6-31g(d).nwchem.inp (generated) 004105927.b3lyp_6-31g(d).log.xz 004105927.td-b3lyp_6-31g+(d).inp 004105927.td-b3lyp_6-31g+(d).log.xz

004105927.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105927.td-b3lyp_6-31+g(d).gjf (generated)

004105927.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105927.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105927.mol 004105927.PUBCHEM 004105927.mol (via Jmol)
004105928.b3lyp_6-31g(d).inp

004105928.b3lyp_6-31g(d).qchem.inp (generated)

004105928.b3lyp_6-31g(d).gjf (generated)

004105928.b3lyp_6-31g(d).firefly.inp (generated)

004105928.b3lyp_6-31g(d).smash.inp (generated)

004105928.b3lyp_6-31g(d).nwchem.inp (generated) 004105928.b3lyp_6-31g(d).log.xz 004105928.td-b3lyp_6-31g+(d).inp 004105928.td-b3lyp_6-31g+(d).log.xz

004105928.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105928.td-b3lyp_6-31+g(d).gjf (generated)

004105928.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105928.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105928.mol 004105928.PUBCHEM 004105928.mol (via Jmol)
004105955.b3lyp_6-31g(d).inp

004105955.b3lyp_6-31g(d).qchem.inp (generated)

004105955.b3lyp_6-31g(d).gjf (generated)

004105955.b3lyp_6-31g(d).firefly.inp (generated)

004105955.b3lyp_6-31g(d).smash.inp (generated)

004105955.b3lyp_6-31g(d).nwchem.inp (generated) 004105955.b3lyp_6-31g(d).log.xz 004105955.td-b3lyp_6-31g+(d).inp 004105955.td-b3lyp_6-31g+(d).log.xz

004105955.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105955.td-b3lyp_6-31+g(d).gjf (generated)

004105955.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105955.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105955.mol 004105955.PUBCHEM 004105955.mol (via Jmol)
004105970.b3lyp_6-31g(d).inp

004105970.b3lyp_6-31g(d).qchem.inp (generated)

004105970.b3lyp_6-31g(d).gjf (generated)

004105970.b3lyp_6-31g(d).firefly.inp (generated)

004105970.b3lyp_6-31g(d).smash.inp (generated)

004105970.b3lyp_6-31g(d).nwchem.inp (generated) 004105970.b3lyp_6-31g(d).log.xz 004105970.mol 004105970.PUBCHEM 004105970.mol (via Jmol)
004105973.b3lyp_6-31g(d).inp

004105973.b3lyp_6-31g(d).qchem.inp (generated)

004105973.b3lyp_6-31g(d).gjf (generated)

004105973.b3lyp_6-31g(d).firefly.inp (generated)

004105973.b3lyp_6-31g(d).smash.inp (generated)

004105973.b3lyp_6-31g(d).nwchem.inp (generated) 004105973.b3lyp_6-31g(d).log.xz 004105973.mol 004105973.PUBCHEM 004105973.mol (via Jmol)
004105977.b3lyp_6-31g(d).inp

004105977.b3lyp_6-31g(d).qchem.inp (generated)

004105977.b3lyp_6-31g(d).gjf (generated)

004105977.b3lyp_6-31g(d).firefly.inp (generated)

004105977.b3lyp_6-31g(d).smash.inp (generated)

004105977.b3lyp_6-31g(d).nwchem.inp (generated) 004105977.b3lyp_6-31g(d).log.xz 004105977.td-b3lyp_6-31g+(d).inp 004105977.td-b3lyp_6-31g+(d).log.xz

004105977.td-b3lyp_6-31+g(d).qchem.inp (generated)

004105977.td-b3lyp_6-31+g(d).gjf (generated)

004105977.td-b3lyp_6-31+g(d).firefly.inp (generated)

004105977.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004105977.mol 004105977.PUBCHEM 004105977.mol (via Jmol)
004106050.b3lyp_6-31g(d).inp

004106050.b3lyp_6-31g(d).qchem.inp (generated)

004106050.b3lyp_6-31g(d).gjf (generated)

004106050.b3lyp_6-31g(d).firefly.inp (generated)

004106050.b3lyp_6-31g(d).smash.inp (generated)

004106050.b3lyp_6-31g(d).nwchem.inp (generated) 004106050.b3lyp_6-31g(d).log.xz 004106050.td-b3lyp_6-31g+(d).inp 004106050.td-b3lyp_6-31g+(d).log.xz

004106050.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106050.td-b3lyp_6-31+g(d).gjf (generated)

004106050.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106050.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106050.mol 004106050.PUBCHEM 004106050.mol (via Jmol)
004106056.b3lyp_6-31g(d).inp

004106056.b3lyp_6-31g(d).qchem.inp (generated)

004106056.b3lyp_6-31g(d).gjf (generated)

004106056.b3lyp_6-31g(d).firefly.inp (generated)

004106056.b3lyp_6-31g(d).smash.inp (generated)

004106056.b3lyp_6-31g(d).nwchem.inp (generated) 004106056.b3lyp_6-31g(d).log.xz 004106056.td-b3lyp_6-31g+(d).inp 004106056.td-b3lyp_6-31g+(d).log.xz

004106056.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106056.td-b3lyp_6-31+g(d).gjf (generated)

004106056.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106056.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106056.mol 004106056.PUBCHEM 004106056.mol (via Jmol)
004106072.b3lyp_6-31g(d).inp

004106072.b3lyp_6-31g(d).qchem.inp (generated)

004106072.b3lyp_6-31g(d).gjf (generated)

004106072.b3lyp_6-31g(d).firefly.inp (generated)

004106072.b3lyp_6-31g(d).smash.inp (generated)

004106072.b3lyp_6-31g(d).nwchem.inp (generated) 004106072.b3lyp_6-31g(d).log.xz 004106072.mol 004106072.PUBCHEM 004106072.mol (via Jmol)
004106127.b3lyp_6-31g(d).inp

004106127.b3lyp_6-31g(d).qchem.inp (generated)

004106127.b3lyp_6-31g(d).gjf (generated)

004106127.b3lyp_6-31g(d).firefly.inp (generated)

004106127.b3lyp_6-31g(d).smash.inp (generated)

004106127.b3lyp_6-31g(d).nwchem.inp (generated) 004106127.b3lyp_6-31g(d).log.xz 004106127.td-b3lyp_6-31g+(d).inp 004106127.td-b3lyp_6-31g+(d).log.xz

004106127.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106127.td-b3lyp_6-31+g(d).gjf (generated)

004106127.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106127.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106127.mol 004106127.PUBCHEM 004106127.mol (via Jmol)
004106143.b3lyp_6-31g(d).inp

004106143.b3lyp_6-31g(d).qchem.inp (generated)

004106143.b3lyp_6-31g(d).gjf (generated)

004106143.b3lyp_6-31g(d).firefly.inp (generated)

004106143.b3lyp_6-31g(d).smash.inp (generated)

004106143.b3lyp_6-31g(d).nwchem.inp (generated) 004106143.b3lyp_6-31g(d).log.xz 004106143.td-b3lyp_6-31g+(d).inp 004106143.td-b3lyp_6-31g+(d).log.xz

004106143.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106143.td-b3lyp_6-31+g(d).gjf (generated)

004106143.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106143.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106143.mol 004106143.PUBCHEM 004106143.mol (via Jmol)
004106147.b3lyp_6-31g(d).inp

004106147.b3lyp_6-31g(d).qchem.inp (generated)

004106147.b3lyp_6-31g(d).gjf (generated)

004106147.b3lyp_6-31g(d).firefly.inp (generated)

004106147.b3lyp_6-31g(d).smash.inp (generated)

004106147.b3lyp_6-31g(d).nwchem.inp (generated) 004106147.b3lyp_6-31g(d).log.xz 004106147.td-b3lyp_6-31g+(d).inp 004106147.td-b3lyp_6-31g+(d).log.xz

004106147.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106147.td-b3lyp_6-31+g(d).gjf (generated)

004106147.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106147.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106147.mol 004106147.PUBCHEM 004106147.mol (via Jmol)
004106165.b3lyp_6-31g(d).inp

004106165.b3lyp_6-31g(d).qchem.inp (generated)

004106165.b3lyp_6-31g(d).gjf (generated)

004106165.b3lyp_6-31g(d).firefly.inp (generated)

004106165.b3lyp_6-31g(d).smash.inp (generated)

004106165.b3lyp_6-31g(d).nwchem.inp (generated) 004106165.b3lyp_6-31g(d).log.xz 004106165.td-b3lyp_6-31g+(d).inp 004106165.td-b3lyp_6-31g+(d).log.xz

004106165.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106165.td-b3lyp_6-31+g(d).gjf (generated)

004106165.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106165.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106165.mol 004106165.PUBCHEM 004106165.mol (via Jmol)
004106174.b3lyp_6-31g(d).inp

004106174.b3lyp_6-31g(d).qchem.inp (generated)

004106174.b3lyp_6-31g(d).gjf (generated)

004106174.b3lyp_6-31g(d).firefly.inp (generated)

004106174.b3lyp_6-31g(d).smash.inp (generated)

004106174.b3lyp_6-31g(d).nwchem.inp (generated) 004106174.b3lyp_6-31g(d).log.xz 004106174.td-b3lyp_6-31g+(d).inp 004106174.td-b3lyp_6-31g+(d).log.xz

004106174.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106174.td-b3lyp_6-31+g(d).gjf (generated)

004106174.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106174.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106174.mol 004106174.PUBCHEM 004106174.mol (via Jmol)
004106176.b3lyp_6-31g(d).inp

004106176.b3lyp_6-31g(d).qchem.inp (generated)

004106176.b3lyp_6-31g(d).gjf (generated)

004106176.b3lyp_6-31g(d).firefly.inp (generated)

004106176.b3lyp_6-31g(d).smash.inp (generated)

004106176.b3lyp_6-31g(d).nwchem.inp (generated) 004106176.b3lyp_6-31g(d).log.xz 004106176.td-b3lyp_6-31g+(d).inp 004106176.td-b3lyp_6-31g+(d).log.xz

004106176.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106176.td-b3lyp_6-31+g(d).gjf (generated)

004106176.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106176.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106176.mol 004106176.PUBCHEM 004106176.mol (via Jmol)
004106178.b3lyp_6-31g(d).inp

004106178.b3lyp_6-31g(d).qchem.inp (generated)

004106178.b3lyp_6-31g(d).gjf (generated)

004106178.b3lyp_6-31g(d).firefly.inp (generated)

004106178.b3lyp_6-31g(d).smash.inp (generated)

004106178.b3lyp_6-31g(d).nwchem.inp (generated) 004106178.b3lyp_6-31g(d).log.xz 004106178.td-b3lyp_6-31g+(d).inp 004106178.td-b3lyp_6-31g+(d).log.xz

004106178.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106178.td-b3lyp_6-31+g(d).gjf (generated)

004106178.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106178.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106178.mol 004106178.PUBCHEM 004106178.mol (via Jmol)
004106219.b3lyp_6-31g(d).inp

004106219.b3lyp_6-31g(d).qchem.inp (generated)

004106219.b3lyp_6-31g(d).gjf (generated)

004106219.b3lyp_6-31g(d).firefly.inp (generated)

004106219.b3lyp_6-31g(d).smash.inp (generated)

004106219.b3lyp_6-31g(d).nwchem.inp (generated) 004106219.b3lyp_6-31g(d).log.xz 004106219.td-b3lyp_6-31g+(d).inp 004106219.td-b3lyp_6-31g+(d).log.xz

004106219.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106219.td-b3lyp_6-31+g(d).gjf (generated)

004106219.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106219.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106219.mol 004106219.PUBCHEM 004106219.mol (via Jmol)
004106353.b3lyp_6-31g(d).inp

004106353.b3lyp_6-31g(d).qchem.inp (generated)

004106353.b3lyp_6-31g(d).gjf (generated)

004106353.b3lyp_6-31g(d).firefly.inp (generated)

004106353.b3lyp_6-31g(d).smash.inp (generated)

004106353.b3lyp_6-31g(d).nwchem.inp (generated) 004106353.b3lyp_6-31g(d).log.xz 004106353.td-b3lyp_6-31g+(d).inp 004106353.td-b3lyp_6-31g+(d).log.xz

004106353.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106353.td-b3lyp_6-31+g(d).gjf (generated)

004106353.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106353.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106353.mol 004106353.PUBCHEM 004106353.mol (via Jmol)
004106355.b3lyp_6-31g(d).inp

004106355.b3lyp_6-31g(d).qchem.inp (generated)

004106355.b3lyp_6-31g(d).gjf (generated)

004106355.b3lyp_6-31g(d).firefly.inp (generated)

004106355.b3lyp_6-31g(d).smash.inp (generated)

004106355.b3lyp_6-31g(d).nwchem.inp (generated) 004106355.b3lyp_6-31g(d).log.xz 004106355.td-b3lyp_6-31g+(d).inp 004106355.td-b3lyp_6-31g+(d).log.xz

004106355.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106355.td-b3lyp_6-31+g(d).gjf (generated)

004106355.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106355.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106355.mol 004106355.PUBCHEM 004106355.mol (via Jmol)
004106381.b3lyp_6-31g(d).inp

004106381.b3lyp_6-31g(d).qchem.inp (generated)

004106381.b3lyp_6-31g(d).gjf (generated)

004106381.b3lyp_6-31g(d).firefly.inp (generated)

004106381.b3lyp_6-31g(d).smash.inp (generated)

004106381.b3lyp_6-31g(d).nwchem.inp (generated) 004106381.b3lyp_6-31g(d).log.xz 004106381.td-b3lyp_6-31g+(d).inp 004106381.td-b3lyp_6-31g+(d).log.xz

004106381.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106381.td-b3lyp_6-31+g(d).gjf (generated)

004106381.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106381.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106381.mol 004106381.PUBCHEM 004106381.mol (via Jmol)
004106394.b3lyp_6-31g(d).inp

004106394.b3lyp_6-31g(d).qchem.inp (generated)

004106394.b3lyp_6-31g(d).gjf (generated)

004106394.b3lyp_6-31g(d).firefly.inp (generated)

004106394.b3lyp_6-31g(d).smash.inp (generated)

004106394.b3lyp_6-31g(d).nwchem.inp (generated) 004106394.b3lyp_6-31g(d).log.xz 004106394.td-b3lyp_6-31g+(d).inp 004106394.td-b3lyp_6-31g+(d).log.xz

004106394.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106394.td-b3lyp_6-31+g(d).gjf (generated)

004106394.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106394.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106394.mol 004106394.PUBCHEM 004106394.mol (via Jmol)
004106460.b3lyp_6-31g(d).inp

004106460.b3lyp_6-31g(d).qchem.inp (generated)

004106460.b3lyp_6-31g(d).gjf (generated)

004106460.b3lyp_6-31g(d).firefly.inp (generated)

004106460.b3lyp_6-31g(d).smash.inp (generated)

004106460.b3lyp_6-31g(d).nwchem.inp (generated) 004106460.b3lyp_6-31g(d).log.xz 004106460.td-b3lyp_6-31g+(d).inp 004106460.td-b3lyp_6-31g+(d).log.xz

004106460.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106460.td-b3lyp_6-31+g(d).gjf (generated)

004106460.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106460.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106460.mol 004106460.PUBCHEM 004106460.mol (via Jmol)
004106514.b3lyp_6-31g(d).inp

004106514.b3lyp_6-31g(d).qchem.inp (generated)

004106514.b3lyp_6-31g(d).gjf (generated)

004106514.b3lyp_6-31g(d).firefly.inp (generated)

004106514.b3lyp_6-31g(d).smash.inp (generated)

004106514.b3lyp_6-31g(d).nwchem.inp (generated) 004106514.b3lyp_6-31g(d).log.xz 004106514.td-b3lyp_6-31g+(d).inp 004106514.td-b3lyp_6-31g+(d).log.xz

004106514.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106514.td-b3lyp_6-31+g(d).gjf (generated)

004106514.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106514.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106514.mol 004106514.PUBCHEM 004106514.mol (via Jmol)
004106516.b3lyp_6-31g(d).inp

004106516.b3lyp_6-31g(d).qchem.inp (generated)

004106516.b3lyp_6-31g(d).gjf (generated)

004106516.b3lyp_6-31g(d).firefly.inp (generated)

004106516.b3lyp_6-31g(d).smash.inp (generated)

004106516.b3lyp_6-31g(d).nwchem.inp (generated) 004106516.b3lyp_6-31g(d).log.xz 004106516.td-b3lyp_6-31g+(d).inp 004106516.td-b3lyp_6-31g+(d).log.xz

004106516.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106516.td-b3lyp_6-31+g(d).gjf (generated)

004106516.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106516.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106516.mol 004106516.PUBCHEM 004106516.mol (via Jmol)
004106527.b3lyp_6-31g(d).inp

004106527.b3lyp_6-31g(d).qchem.inp (generated)

004106527.b3lyp_6-31g(d).gjf (generated)

004106527.b3lyp_6-31g(d).firefly.inp (generated)

004106527.b3lyp_6-31g(d).smash.inp (generated)

004106527.b3lyp_6-31g(d).nwchem.inp (generated) 004106527.b3lyp_6-31g(d).log.xz 004106527.td-b3lyp_6-31g+(d).inp 004106527.td-b3lyp_6-31g+(d).log.xz

004106527.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106527.td-b3lyp_6-31+g(d).gjf (generated)

004106527.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106527.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106527.mol 004106527.PUBCHEM 004106527.mol (via Jmol)
004106556.b3lyp_6-31g(d).inp

004106556.b3lyp_6-31g(d).qchem.inp (generated)

004106556.b3lyp_6-31g(d).gjf (generated)

004106556.b3lyp_6-31g(d).firefly.inp (generated)

004106556.b3lyp_6-31g(d).smash.inp (generated)

004106556.b3lyp_6-31g(d).nwchem.inp (generated) 004106556.b3lyp_6-31g(d).log.xz 004106556.td-b3lyp_6-31g+(d).inp 004106556.td-b3lyp_6-31g+(d).log.xz

004106556.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106556.td-b3lyp_6-31+g(d).gjf (generated)

004106556.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106556.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106556.mol 004106556.PUBCHEM 004106556.mol (via Jmol)
004106607.b3lyp_6-31g(d).inp

004106607.b3lyp_6-31g(d).qchem.inp (generated)

004106607.b3lyp_6-31g(d).gjf (generated)

004106607.b3lyp_6-31g(d).firefly.inp (generated)

004106607.b3lyp_6-31g(d).smash.inp (generated)

004106607.b3lyp_6-31g(d).nwchem.inp (generated) 004106607.b3lyp_6-31g(d).log.xz 004106607.td-b3lyp_6-31g+(d).inp 004106607.td-b3lyp_6-31g+(d).log.xz

004106607.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106607.td-b3lyp_6-31+g(d).gjf (generated)

004106607.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106607.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106607.mol 004106607.PUBCHEM 004106607.mol (via Jmol)
004106636.b3lyp_6-31g(d).inp

004106636.b3lyp_6-31g(d).qchem.inp (generated)

004106636.b3lyp_6-31g(d).gjf (generated)

004106636.b3lyp_6-31g(d).firefly.inp (generated)

004106636.b3lyp_6-31g(d).smash.inp (generated)

004106636.b3lyp_6-31g(d).nwchem.inp (generated) 004106636.b3lyp_6-31g(d).log.xz 004106636.mol 004106636.PUBCHEM 004106636.mol (via Jmol)
004106715.b3lyp_6-31g(d).inp

004106715.b3lyp_6-31g(d).qchem.inp (generated)

004106715.b3lyp_6-31g(d).gjf (generated)

004106715.b3lyp_6-31g(d).firefly.inp (generated)

004106715.b3lyp_6-31g(d).smash.inp (generated)

004106715.b3lyp_6-31g(d).nwchem.inp (generated) 004106715.b3lyp_6-31g(d).log.xz 004106715.td-b3lyp_6-31g+(d).inp 004106715.td-b3lyp_6-31g+(d).log.xz

004106715.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106715.td-b3lyp_6-31+g(d).gjf (generated)

004106715.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106715.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106715.mol 004106715.PUBCHEM 004106715.mol (via Jmol)
004106744.b3lyp_6-31g(d).inp

004106744.b3lyp_6-31g(d).qchem.inp (generated)

004106744.b3lyp_6-31g(d).gjf (generated)

004106744.b3lyp_6-31g(d).firefly.inp (generated)

004106744.b3lyp_6-31g(d).smash.inp (generated)

004106744.b3lyp_6-31g(d).nwchem.inp (generated) 004106744.b3lyp_6-31g(d).log.xz 004106744.td-b3lyp_6-31g+(d).inp 004106744.td-b3lyp_6-31g+(d).log.xz

004106744.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106744.td-b3lyp_6-31+g(d).gjf (generated)

004106744.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106744.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106744.mol 004106744.PUBCHEM 004106744.mol (via Jmol)
004106752.b3lyp_6-31g(d).inp

004106752.b3lyp_6-31g(d).qchem.inp (generated)

004106752.b3lyp_6-31g(d).gjf (generated)

004106752.b3lyp_6-31g(d).firefly.inp (generated)

004106752.b3lyp_6-31g(d).smash.inp (generated)

004106752.b3lyp_6-31g(d).nwchem.inp (generated) 004106752.b3lyp_6-31g(d).log.xz 004106752.td-b3lyp_6-31g+(d).inp 004106752.td-b3lyp_6-31g+(d).log.xz

004106752.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106752.td-b3lyp_6-31+g(d).gjf (generated)

004106752.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106752.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106752.mol 004106752.PUBCHEM 004106752.mol (via Jmol)
004106783.b3lyp_6-31g(d).inp

004106783.b3lyp_6-31g(d).qchem.inp (generated)

004106783.b3lyp_6-31g(d).gjf (generated)

004106783.b3lyp_6-31g(d).firefly.inp (generated)

004106783.b3lyp_6-31g(d).smash.inp (generated)

004106783.b3lyp_6-31g(d).nwchem.inp (generated) 004106783.b3lyp_6-31g(d).log.xz 004106783.td-b3lyp_6-31g+(d).inp 004106783.td-b3lyp_6-31g+(d).log.xz

004106783.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106783.td-b3lyp_6-31+g(d).gjf (generated)

004106783.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106783.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106783.mol 004106783.PUBCHEM 004106783.mol (via Jmol)
004106784.b3lyp_6-31g(d).inp

004106784.b3lyp_6-31g(d).qchem.inp (generated)

004106784.b3lyp_6-31g(d).gjf (generated)

004106784.b3lyp_6-31g(d).firefly.inp (generated)

004106784.b3lyp_6-31g(d).smash.inp (generated)

004106784.b3lyp_6-31g(d).nwchem.inp (generated) 004106784.b3lyp_6-31g(d).log.xz 004106784.td-b3lyp_6-31g+(d).inp 004106784.td-b3lyp_6-31g+(d).log.xz

004106784.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106784.td-b3lyp_6-31+g(d).gjf (generated)

004106784.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106784.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106784.mol 004106784.PUBCHEM 004106784.mol (via Jmol)
004106815.b3lyp_6-31g(d).inp

004106815.b3lyp_6-31g(d).qchem.inp (generated)

004106815.b3lyp_6-31g(d).gjf (generated)

004106815.b3lyp_6-31g(d).firefly.inp (generated)

004106815.b3lyp_6-31g(d).smash.inp (generated)

004106815.b3lyp_6-31g(d).nwchem.inp (generated) 004106815.b3lyp_6-31g(d).log.xz 004106815.td-b3lyp_6-31g+(d).inp 004106815.td-b3lyp_6-31g+(d).log.xz

004106815.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106815.td-b3lyp_6-31+g(d).gjf (generated)

004106815.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106815.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106815.mol 004106815.PUBCHEM 004106815.mol (via Jmol)
004106837.b3lyp_6-31g(d).inp

004106837.b3lyp_6-31g(d).qchem.inp (generated)

004106837.b3lyp_6-31g(d).gjf (generated)

004106837.b3lyp_6-31g(d).firefly.inp (generated)

004106837.b3lyp_6-31g(d).smash.inp (generated)

004106837.b3lyp_6-31g(d).nwchem.inp (generated) 004106837.b3lyp_6-31g(d).log.xz 004106837.td-b3lyp_6-31g+(d).inp 004106837.td-b3lyp_6-31g+(d).log.xz

004106837.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106837.td-b3lyp_6-31+g(d).gjf (generated)

004106837.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106837.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106837.mol 004106837.PUBCHEM 004106837.mol (via Jmol)
004106853.b3lyp_6-31g(d).inp

004106853.b3lyp_6-31g(d).qchem.inp (generated)

004106853.b3lyp_6-31g(d).gjf (generated)

004106853.b3lyp_6-31g(d).firefly.inp (generated)

004106853.b3lyp_6-31g(d).smash.inp (generated)

004106853.b3lyp_6-31g(d).nwchem.inp (generated) 004106853.b3lyp_6-31g(d).log.xz 004106853.mol 004106853.PUBCHEM 004106853.mol (via Jmol)
004106858.b3lyp_6-31g(d).inp

004106858.b3lyp_6-31g(d).qchem.inp (generated)

004106858.b3lyp_6-31g(d).gjf (generated)

004106858.b3lyp_6-31g(d).firefly.inp (generated)

004106858.b3lyp_6-31g(d).smash.inp (generated)

004106858.b3lyp_6-31g(d).nwchem.inp (generated) 004106858.b3lyp_6-31g(d).log.xz 004106858.td-b3lyp_6-31g+(d).inp 004106858.td-b3lyp_6-31g+(d).log.xz

004106858.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106858.td-b3lyp_6-31+g(d).gjf (generated)

004106858.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106858.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106858.mol 004106858.PUBCHEM 004106858.mol (via Jmol)
004106859.b3lyp_6-31g(d).inp

004106859.b3lyp_6-31g(d).qchem.inp (generated)

004106859.b3lyp_6-31g(d).gjf (generated)

004106859.b3lyp_6-31g(d).firefly.inp (generated)

004106859.b3lyp_6-31g(d).smash.inp (generated)

004106859.b3lyp_6-31g(d).nwchem.inp (generated) 004106859.b3lyp_6-31g(d).log.xz 004106859.td-b3lyp_6-31g+(d).inp 004106859.td-b3lyp_6-31g+(d).log.xz

004106859.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106859.td-b3lyp_6-31+g(d).gjf (generated)

004106859.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106859.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106859.mol 004106859.PUBCHEM 004106859.mol (via Jmol)
004106883.b3lyp_6-31g(d).inp

004106883.b3lyp_6-31g(d).qchem.inp (generated)

004106883.b3lyp_6-31g(d).gjf (generated)

004106883.b3lyp_6-31g(d).firefly.inp (generated)

004106883.b3lyp_6-31g(d).smash.inp (generated)

004106883.b3lyp_6-31g(d).nwchem.inp (generated) 004106883.b3lyp_6-31g(d).log.xz 004106883.td-b3lyp_6-31g+(d).inp 004106883.td-b3lyp_6-31g+(d).log.xz

004106883.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106883.td-b3lyp_6-31+g(d).gjf (generated)

004106883.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106883.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106883.mol 004106883.PUBCHEM 004106883.mol (via Jmol)
004106891.b3lyp_6-31g(d).inp

004106891.b3lyp_6-31g(d).qchem.inp (generated)

004106891.b3lyp_6-31g(d).gjf (generated)

004106891.b3lyp_6-31g(d).firefly.inp (generated)

004106891.b3lyp_6-31g(d).smash.inp (generated)

004106891.b3lyp_6-31g(d).nwchem.inp (generated) 004106891.b3lyp_6-31g(d).log.xz 004106891.mol 004106891.PUBCHEM 004106891.mol (via Jmol)
004106892.b3lyp_6-31g(d).inp

004106892.b3lyp_6-31g(d).qchem.inp (generated)

004106892.b3lyp_6-31g(d).gjf (generated)

004106892.b3lyp_6-31g(d).firefly.inp (generated)

004106892.b3lyp_6-31g(d).smash.inp (generated)

004106892.b3lyp_6-31g(d).nwchem.inp (generated) 004106892.b3lyp_6-31g(d).log.xz 004106892.mol 004106892.PUBCHEM 004106892.mol (via Jmol)
004106895.b3lyp_6-31g(d).inp

004106895.b3lyp_6-31g(d).qchem.inp (generated)

004106895.b3lyp_6-31g(d).gjf (generated)

004106895.b3lyp_6-31g(d).firefly.inp (generated)

004106895.b3lyp_6-31g(d).smash.inp (generated)

004106895.b3lyp_6-31g(d).nwchem.inp (generated) 004106895.b3lyp_6-31g(d).log.xz 004106895.td-b3lyp_6-31g+(d).inp 004106895.td-b3lyp_6-31g+(d).log.xz

004106895.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106895.td-b3lyp_6-31+g(d).gjf (generated)

004106895.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106895.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106895.mol 004106895.PUBCHEM 004106895.mol (via Jmol)
004106926.b3lyp_6-31g(d).inp

004106926.b3lyp_6-31g(d).qchem.inp (generated)

004106926.b3lyp_6-31g(d).gjf (generated)

004106926.b3lyp_6-31g(d).firefly.inp (generated)

004106926.b3lyp_6-31g(d).smash.inp (generated)

004106926.b3lyp_6-31g(d).nwchem.inp (generated) 004106926.b3lyp_6-31g(d).log.xz 004106926.td-b3lyp_6-31g+(d).inp 004106926.td-b3lyp_6-31g+(d).log.xz

004106926.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106926.td-b3lyp_6-31+g(d).gjf (generated)

004106926.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106926.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106926.mol 004106926.PUBCHEM 004106926.mol (via Jmol)
004106945.b3lyp_6-31g(d).inp

004106945.b3lyp_6-31g(d).qchem.inp (generated)

004106945.b3lyp_6-31g(d).gjf (generated)

004106945.b3lyp_6-31g(d).firefly.inp (generated)

004106945.b3lyp_6-31g(d).smash.inp (generated)

004106945.b3lyp_6-31g(d).nwchem.inp (generated) 004106945.b3lyp_6-31g(d).log.xz 004106945.td-b3lyp_6-31g+(d).inp 004106945.td-b3lyp_6-31g+(d).log.xz

004106945.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106945.td-b3lyp_6-31+g(d).gjf (generated)

004106945.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106945.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106945.mol 004106945.PUBCHEM 004106945.mol (via Jmol)
004106946.b3lyp_6-31g(d).inp

004106946.b3lyp_6-31g(d).qchem.inp (generated)

004106946.b3lyp_6-31g(d).gjf (generated)

004106946.b3lyp_6-31g(d).firefly.inp (generated)

004106946.b3lyp_6-31g(d).smash.inp (generated)

004106946.b3lyp_6-31g(d).nwchem.inp (generated) 004106946.b3lyp_6-31g(d).log.xz 004106946.td-b3lyp_6-31g+(d).inp 004106946.td-b3lyp_6-31g+(d).log.xz

004106946.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106946.td-b3lyp_6-31+g(d).gjf (generated)

004106946.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106946.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106946.mol 004106946.PUBCHEM 004106946.mol (via Jmol)
004106991.b3lyp_6-31g(d).inp

004106991.b3lyp_6-31g(d).qchem.inp (generated)

004106991.b3lyp_6-31g(d).gjf (generated)

004106991.b3lyp_6-31g(d).firefly.inp (generated)

004106991.b3lyp_6-31g(d).smash.inp (generated)

004106991.b3lyp_6-31g(d).nwchem.inp (generated) 004106991.b3lyp_6-31g(d).log.xz 004106991.td-b3lyp_6-31g+(d).inp 004106991.td-b3lyp_6-31g+(d).log.xz

004106991.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106991.td-b3lyp_6-31+g(d).gjf (generated)

004106991.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106991.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106991.mol 004106991.PUBCHEM 004106991.mol (via Jmol)
004106996.b3lyp_6-31g(d).inp

004106996.b3lyp_6-31g(d).qchem.inp (generated)

004106996.b3lyp_6-31g(d).gjf (generated)

004106996.b3lyp_6-31g(d).firefly.inp (generated)

004106996.b3lyp_6-31g(d).smash.inp (generated)

004106996.b3lyp_6-31g(d).nwchem.inp (generated) 004106996.b3lyp_6-31g(d).log.xz 004106996.td-b3lyp_6-31g+(d).inp 004106996.td-b3lyp_6-31g+(d).log.xz

004106996.td-b3lyp_6-31+g(d).qchem.inp (generated)

004106996.td-b3lyp_6-31+g(d).gjf (generated)

004106996.td-b3lyp_6-31+g(d).firefly.inp (generated)

004106996.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004106996.mol 004106996.PUBCHEM 004106996.mol (via Jmol)
004107025.b3lyp_6-31g(d).inp

004107025.b3lyp_6-31g(d).qchem.inp (generated)

004107025.b3lyp_6-31g(d).gjf (generated)

004107025.b3lyp_6-31g(d).firefly.inp (generated)

004107025.b3lyp_6-31g(d).smash.inp (generated)

004107025.b3lyp_6-31g(d).nwchem.inp (generated) 004107025.b3lyp_6-31g(d).log.xz 004107025.td-b3lyp_6-31g+(d).inp 004107025.td-b3lyp_6-31g+(d).log.xz

004107025.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107025.td-b3lyp_6-31+g(d).gjf (generated)

004107025.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107025.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107025.mol 004107025.PUBCHEM 004107025.mol (via Jmol)
004107026.b3lyp_6-31g(d).inp

004107026.b3lyp_6-31g(d).qchem.inp (generated)

004107026.b3lyp_6-31g(d).gjf (generated)

004107026.b3lyp_6-31g(d).firefly.inp (generated)

004107026.b3lyp_6-31g(d).smash.inp (generated)

004107026.b3lyp_6-31g(d).nwchem.inp (generated) 004107026.b3lyp_6-31g(d).log.xz 004107026.td-b3lyp_6-31g+(d).inp 004107026.td-b3lyp_6-31g+(d).log.xz

004107026.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107026.td-b3lyp_6-31+g(d).gjf (generated)

004107026.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107026.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107026.mol 004107026.PUBCHEM 004107026.mol (via Jmol)
004107048.b3lyp_6-31g(d).inp

004107048.b3lyp_6-31g(d).qchem.inp (generated)

004107048.b3lyp_6-31g(d).gjf (generated)

004107048.b3lyp_6-31g(d).firefly.inp (generated)

004107048.b3lyp_6-31g(d).smash.inp (generated)

004107048.b3lyp_6-31g(d).nwchem.inp (generated) 004107048.b3lyp_6-31g(d).log.xz 004107048.mol 004107048.PUBCHEM 004107048.mol (via Jmol)
004107069.b3lyp_6-31g(d).inp

004107069.b3lyp_6-31g(d).qchem.inp (generated)

004107069.b3lyp_6-31g(d).gjf (generated)

004107069.b3lyp_6-31g(d).firefly.inp (generated)

004107069.b3lyp_6-31g(d).smash.inp (generated)

004107069.b3lyp_6-31g(d).nwchem.inp (generated) 004107069.b3lyp_6-31g(d).log.xz 004107069.td-b3lyp_6-31g+(d).inp 004107069.td-b3lyp_6-31g+(d).log.xz

004107069.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107069.td-b3lyp_6-31+g(d).gjf (generated)

004107069.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107069.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107069.mol 004107069.PUBCHEM 004107069.mol (via Jmol)
004107078.b3lyp_6-31g(d).inp

004107078.b3lyp_6-31g(d).qchem.inp (generated)

004107078.b3lyp_6-31g(d).gjf (generated)

004107078.b3lyp_6-31g(d).firefly.inp (generated)

004107078.b3lyp_6-31g(d).smash.inp (generated)

004107078.b3lyp_6-31g(d).nwchem.inp (generated) 004107078.b3lyp_6-31g(d).log.xz 004107078.td-b3lyp_6-31g+(d).inp 004107078.td-b3lyp_6-31g+(d).log.xz

004107078.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107078.td-b3lyp_6-31+g(d).gjf (generated)

004107078.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107078.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107078.mol 004107078.PUBCHEM 004107078.mol (via Jmol)
004107113.b3lyp_6-31g(d).inp

004107113.b3lyp_6-31g(d).qchem.inp (generated)

004107113.b3lyp_6-31g(d).gjf (generated)

004107113.b3lyp_6-31g(d).firefly.inp (generated)

004107113.b3lyp_6-31g(d).smash.inp (generated)

004107113.b3lyp_6-31g(d).nwchem.inp (generated) 004107113.b3lyp_6-31g(d).log.xz 004107113.td-b3lyp_6-31g+(d).inp 004107113.td-b3lyp_6-31g+(d).log.xz

004107113.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107113.td-b3lyp_6-31+g(d).gjf (generated)

004107113.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107113.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107113.mol 004107113.PUBCHEM 004107113.mol (via Jmol)
004107149.b3lyp_6-31g(d).inp

004107149.b3lyp_6-31g(d).qchem.inp (generated)

004107149.b3lyp_6-31g(d).gjf (generated)

004107149.b3lyp_6-31g(d).firefly.inp (generated)

004107149.b3lyp_6-31g(d).smash.inp (generated)

004107149.b3lyp_6-31g(d).nwchem.inp (generated) 004107149.b3lyp_6-31g(d).log.xz 004107149.mol 004107149.PUBCHEM 004107149.mol (via Jmol)
004107248.b3lyp_6-31g(d).inp

004107248.b3lyp_6-31g(d).qchem.inp (generated)

004107248.b3lyp_6-31g(d).gjf (generated)

004107248.b3lyp_6-31g(d).firefly.inp (generated)

004107248.b3lyp_6-31g(d).smash.inp (generated)

004107248.b3lyp_6-31g(d).nwchem.inp (generated) 004107248.b3lyp_6-31g(d).log.xz 004107248.td-b3lyp_6-31g+(d).inp 004107248.td-b3lyp_6-31g+(d).log.xz

004107248.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107248.td-b3lyp_6-31+g(d).gjf (generated)

004107248.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107248.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107248.mol 004107248.PUBCHEM 004107248.mol (via Jmol)
004107251.b3lyp_6-31g(d).inp

004107251.b3lyp_6-31g(d).qchem.inp (generated)

004107251.b3lyp_6-31g(d).gjf (generated)

004107251.b3lyp_6-31g(d).firefly.inp (generated)

004107251.b3lyp_6-31g(d).smash.inp (generated)

004107251.b3lyp_6-31g(d).nwchem.inp (generated) 004107251.b3lyp_6-31g(d).log.xz 004107251.td-b3lyp_6-31g+(d).inp 004107251.td-b3lyp_6-31g+(d).log.xz

004107251.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107251.td-b3lyp_6-31+g(d).gjf (generated)

004107251.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107251.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107251.mol 004107251.PUBCHEM 004107251.mol (via Jmol)
004107262.b3lyp_6-31g(d).inp

004107262.b3lyp_6-31g(d).qchem.inp (generated)

004107262.b3lyp_6-31g(d).gjf (generated)

004107262.b3lyp_6-31g(d).firefly.inp (generated)

004107262.b3lyp_6-31g(d).smash.inp (generated)

004107262.b3lyp_6-31g(d).nwchem.inp (generated) 004107262.b3lyp_6-31g(d).log.xz 004107262.td-b3lyp_6-31g+(d).inp 004107262.td-b3lyp_6-31g+(d).log.xz

004107262.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107262.td-b3lyp_6-31+g(d).gjf (generated)

004107262.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107262.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107262.mol 004107262.PUBCHEM 004107262.mol (via Jmol)
004107274.b3lyp_6-31g(d).inp

004107274.b3lyp_6-31g(d).qchem.inp (generated)

004107274.b3lyp_6-31g(d).gjf (generated)

004107274.b3lyp_6-31g(d).firefly.inp (generated)

004107274.b3lyp_6-31g(d).smash.inp (generated)

004107274.b3lyp_6-31g(d).nwchem.inp (generated) 004107274.b3lyp_6-31g(d).log.xz 004107274.mol 004107274.PUBCHEM 004107274.mol (via Jmol)
004107287.b3lyp_6-31g(d).inp

004107287.b3lyp_6-31g(d).qchem.inp (generated)

004107287.b3lyp_6-31g(d).gjf (generated)

004107287.b3lyp_6-31g(d).firefly.inp (generated)

004107287.b3lyp_6-31g(d).smash.inp (generated)

004107287.b3lyp_6-31g(d).nwchem.inp (generated) 004107287.b3lyp_6-31g(d).log.xz 004107287.td-b3lyp_6-31g+(d).inp 004107287.td-b3lyp_6-31g+(d).log.xz

004107287.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107287.td-b3lyp_6-31+g(d).gjf (generated)

004107287.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107287.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107287.mol 004107287.PUBCHEM 004107287.mol (via Jmol)
004107296.b3lyp_6-31g(d).inp

004107296.b3lyp_6-31g(d).qchem.inp (generated)

004107296.b3lyp_6-31g(d).gjf (generated)

004107296.b3lyp_6-31g(d).firefly.inp (generated)

004107296.b3lyp_6-31g(d).smash.inp (generated)

004107296.b3lyp_6-31g(d).nwchem.inp (generated) 004107296.b3lyp_6-31g(d).log.xz 004107296.td-b3lyp_6-31g+(d).inp 004107296.td-b3lyp_6-31g+(d).log.xz

004107296.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107296.td-b3lyp_6-31+g(d).gjf (generated)

004107296.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107296.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107296.mol 004107296.PUBCHEM 004107296.mol (via Jmol)
004107363.b3lyp_6-31g(d).inp

004107363.b3lyp_6-31g(d).qchem.inp (generated)

004107363.b3lyp_6-31g(d).gjf (generated)

004107363.b3lyp_6-31g(d).firefly.inp (generated)

004107363.b3lyp_6-31g(d).smash.inp (generated)

004107363.b3lyp_6-31g(d).nwchem.inp (generated) 004107363.b3lyp_6-31g(d).log.xz 004107363.td-b3lyp_6-31g+(d).inp 004107363.td-b3lyp_6-31g+(d).log.xz

004107363.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107363.td-b3lyp_6-31+g(d).gjf (generated)

004107363.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107363.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107363.mol 004107363.PUBCHEM 004107363.mol (via Jmol)
004107370.b3lyp_6-31g(d).inp

004107370.b3lyp_6-31g(d).qchem.inp (generated)

004107370.b3lyp_6-31g(d).gjf (generated)

004107370.b3lyp_6-31g(d).firefly.inp (generated)

004107370.b3lyp_6-31g(d).smash.inp (generated)

004107370.b3lyp_6-31g(d).nwchem.inp (generated) 004107370.b3lyp_6-31g(d).log.xz 004107370.mol 004107370.PUBCHEM 004107370.mol (via Jmol)
004107425.b3lyp_6-31g(d).inp

004107425.b3lyp_6-31g(d).qchem.inp (generated)

004107425.b3lyp_6-31g(d).gjf (generated)

004107425.b3lyp_6-31g(d).firefly.inp (generated)

004107425.b3lyp_6-31g(d).smash.inp (generated)

004107425.b3lyp_6-31g(d).nwchem.inp (generated) 004107425.b3lyp_6-31g(d).log.xz 004107425.td-b3lyp_6-31g+(d).inp 004107425.td-b3lyp_6-31g+(d).log.xz

004107425.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107425.td-b3lyp_6-31+g(d).gjf (generated)

004107425.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107425.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107425.mol 004107425.PUBCHEM 004107425.mol (via Jmol)
004107453.b3lyp_6-31g(d).inp

004107453.b3lyp_6-31g(d).qchem.inp (generated)

004107453.b3lyp_6-31g(d).gjf (generated)

004107453.b3lyp_6-31g(d).firefly.inp (generated)

004107453.b3lyp_6-31g(d).smash.inp (generated)

004107453.b3lyp_6-31g(d).nwchem.inp (generated) 004107453.b3lyp_6-31g(d).log.xz 004107453.td-b3lyp_6-31g+(d).inp 004107453.td-b3lyp_6-31g+(d).log.xz

004107453.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107453.td-b3lyp_6-31+g(d).gjf (generated)

004107453.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107453.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107453.mol 004107453.PUBCHEM 004107453.mol (via Jmol)
004107494.b3lyp_6-31g(d).inp

004107494.b3lyp_6-31g(d).qchem.inp (generated)

004107494.b3lyp_6-31g(d).gjf (generated)

004107494.b3lyp_6-31g(d).firefly.inp (generated)

004107494.b3lyp_6-31g(d).smash.inp (generated)

004107494.b3lyp_6-31g(d).nwchem.inp (generated) 004107494.b3lyp_6-31g(d).log.xz 004107494.td-b3lyp_6-31g+(d).inp 004107494.td-b3lyp_6-31g+(d).log.xz

004107494.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107494.td-b3lyp_6-31+g(d).gjf (generated)

004107494.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107494.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107494.mol 004107494.PUBCHEM 004107494.mol (via Jmol)
004107529.b3lyp_6-31g(d).inp

004107529.b3lyp_6-31g(d).qchem.inp (generated)

004107529.b3lyp_6-31g(d).gjf (generated)

004107529.b3lyp_6-31g(d).firefly.inp (generated)

004107529.b3lyp_6-31g(d).smash.inp (generated)

004107529.b3lyp_6-31g(d).nwchem.inp (generated) 004107529.b3lyp_6-31g(d).log.xz 004107529.td-b3lyp_6-31g+(d).inp 004107529.td-b3lyp_6-31g+(d).log.xz

004107529.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107529.td-b3lyp_6-31+g(d).gjf (generated)

004107529.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107529.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107529.mol 004107529.PUBCHEM 004107529.mol (via Jmol)
004107533.b3lyp_6-31g(d).inp

004107533.b3lyp_6-31g(d).qchem.inp (generated)

004107533.b3lyp_6-31g(d).gjf (generated)

004107533.b3lyp_6-31g(d).firefly.inp (generated)

004107533.b3lyp_6-31g(d).smash.inp (generated)

004107533.b3lyp_6-31g(d).nwchem.inp (generated) 004107533.b3lyp_6-31g(d).log.xz 004107533.td-b3lyp_6-31g+(d).inp 004107533.td-b3lyp_6-31g+(d).log.xz

004107533.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107533.td-b3lyp_6-31+g(d).gjf (generated)

004107533.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107533.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107533.mol 004107533.PUBCHEM 004107533.mol (via Jmol)
004107558.b3lyp_6-31g(d).inp

004107558.b3lyp_6-31g(d).qchem.inp (generated)

004107558.b3lyp_6-31g(d).gjf (generated)

004107558.b3lyp_6-31g(d).firefly.inp (generated)

004107558.b3lyp_6-31g(d).smash.inp (generated)

004107558.b3lyp_6-31g(d).nwchem.inp (generated) 004107558.b3lyp_6-31g(d).log.xz 004107558.mol 004107558.PUBCHEM 004107558.mol (via Jmol)
004107560.b3lyp_6-31g(d).inp

004107560.b3lyp_6-31g(d).qchem.inp (generated)

004107560.b3lyp_6-31g(d).gjf (generated)

004107560.b3lyp_6-31g(d).firefly.inp (generated)

004107560.b3lyp_6-31g(d).smash.inp (generated)

004107560.b3lyp_6-31g(d).nwchem.inp (generated) 004107560.b3lyp_6-31g(d).log.xz 004107560.td-b3lyp_6-31g+(d).inp 004107560.td-b3lyp_6-31g+(d).log.xz

004107560.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107560.td-b3lyp_6-31+g(d).gjf (generated)

004107560.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107560.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107560.mol 004107560.PUBCHEM 004107560.mol (via Jmol)
004107631.b3lyp_6-31g(d).inp

004107631.b3lyp_6-31g(d).qchem.inp (generated)

004107631.b3lyp_6-31g(d).gjf (generated)

004107631.b3lyp_6-31g(d).firefly.inp (generated)

004107631.b3lyp_6-31g(d).smash.inp (generated)

004107631.b3lyp_6-31g(d).nwchem.inp (generated) 004107631.b3lyp_6-31g(d).log.xz 004107631.td-b3lyp_6-31g+(d).inp 004107631.td-b3lyp_6-31g+(d).log.xz

004107631.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107631.td-b3lyp_6-31+g(d).gjf (generated)

004107631.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107631.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107631.mol 004107631.PUBCHEM 004107631.mol (via Jmol)
004107646.b3lyp_6-31g(d).inp

004107646.b3lyp_6-31g(d).qchem.inp (generated)

004107646.b3lyp_6-31g(d).gjf (generated)

004107646.b3lyp_6-31g(d).firefly.inp (generated)

004107646.b3lyp_6-31g(d).smash.inp (generated)

004107646.b3lyp_6-31g(d).nwchem.inp (generated) 004107646.b3lyp_6-31g(d).log.xz 004107646.td-b3lyp_6-31g+(d).inp 004107646.td-b3lyp_6-31g+(d).log.xz

004107646.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107646.td-b3lyp_6-31+g(d).gjf (generated)

004107646.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107646.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107646.mol 004107646.PUBCHEM 004107646.mol (via Jmol)
004107676.b3lyp_6-31g(d).inp

004107676.b3lyp_6-31g(d).qchem.inp (generated)

004107676.b3lyp_6-31g(d).gjf (generated)

004107676.b3lyp_6-31g(d).firefly.inp (generated)

004107676.b3lyp_6-31g(d).smash.inp (generated)

004107676.b3lyp_6-31g(d).nwchem.inp (generated) 004107676.b3lyp_6-31g(d).log.xz 004107676.td-b3lyp_6-31g+(d).inp 004107676.td-b3lyp_6-31g+(d).log.xz

004107676.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107676.td-b3lyp_6-31+g(d).gjf (generated)

004107676.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107676.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107676.mol 004107676.PUBCHEM 004107676.mol (via Jmol)
004107679.b3lyp_6-31g(d).inp

004107679.b3lyp_6-31g(d).qchem.inp (generated)

004107679.b3lyp_6-31g(d).gjf (generated)

004107679.b3lyp_6-31g(d).firefly.inp (generated)

004107679.b3lyp_6-31g(d).smash.inp (generated)

004107679.b3lyp_6-31g(d).nwchem.inp (generated) 004107679.b3lyp_6-31g(d).log.xz 004107679.td-b3lyp_6-31g+(d).inp 004107679.td-b3lyp_6-31g+(d).log.xz

004107679.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107679.td-b3lyp_6-31+g(d).gjf (generated)

004107679.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107679.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107679.mol 004107679.PUBCHEM 004107679.mol (via Jmol)
004107687.b3lyp_6-31g(d).inp

004107687.b3lyp_6-31g(d).qchem.inp (generated)

004107687.b3lyp_6-31g(d).gjf (generated)

004107687.b3lyp_6-31g(d).firefly.inp (generated)

004107687.b3lyp_6-31g(d).smash.inp (generated)

004107687.b3lyp_6-31g(d).nwchem.inp (generated) 004107687.b3lyp_6-31g(d).log.xz 004107687.td-b3lyp_6-31g+(d).inp 004107687.td-b3lyp_6-31g+(d).log.xz

004107687.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107687.td-b3lyp_6-31+g(d).gjf (generated)

004107687.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107687.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107687.mol 004107687.PUBCHEM 004107687.mol (via Jmol)
004107688.b3lyp_6-31g(d).inp

004107688.b3lyp_6-31g(d).qchem.inp (generated)

004107688.b3lyp_6-31g(d).gjf (generated)

004107688.b3lyp_6-31g(d).firefly.inp (generated)

004107688.b3lyp_6-31g(d).smash.inp (generated)

004107688.b3lyp_6-31g(d).nwchem.inp (generated) 004107688.b3lyp_6-31g(d).log.xz 004107688.td-b3lyp_6-31g+(d).inp 004107688.td-b3lyp_6-31g+(d).log.xz

004107688.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107688.td-b3lyp_6-31+g(d).gjf (generated)

004107688.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107688.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107688.mol 004107688.PUBCHEM 004107688.mol (via Jmol)
004107694.b3lyp_6-31g(d).inp

004107694.b3lyp_6-31g(d).qchem.inp (generated)

004107694.b3lyp_6-31g(d).gjf (generated)

004107694.b3lyp_6-31g(d).firefly.inp (generated)

004107694.b3lyp_6-31g(d).smash.inp (generated)

004107694.b3lyp_6-31g(d).nwchem.inp (generated) 004107694.b3lyp_6-31g(d).log.xz 004107694.td-b3lyp_6-31g+(d).inp 004107694.td-b3lyp_6-31g+(d).log.xz

004107694.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107694.td-b3lyp_6-31+g(d).gjf (generated)

004107694.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107694.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107694.mol 004107694.PUBCHEM 004107694.mol (via Jmol)
004107838.b3lyp_6-31g(d).inp

004107838.b3lyp_6-31g(d).qchem.inp (generated)

004107838.b3lyp_6-31g(d).gjf (generated)

004107838.b3lyp_6-31g(d).firefly.inp (generated)

004107838.b3lyp_6-31g(d).smash.inp (generated)

004107838.b3lyp_6-31g(d).nwchem.inp (generated) 004107838.b3lyp_6-31g(d).log.xz 004107838.mol 004107838.PUBCHEM 004107838.mol (via Jmol)
004107841.b3lyp_6-31g(d).inp

004107841.b3lyp_6-31g(d).qchem.inp (generated)

004107841.b3lyp_6-31g(d).gjf (generated)

004107841.b3lyp_6-31g(d).firefly.inp (generated)

004107841.b3lyp_6-31g(d).smash.inp (generated)

004107841.b3lyp_6-31g(d).nwchem.inp (generated) 004107841.b3lyp_6-31g(d).log.xz 004107841.td-b3lyp_6-31g+(d).inp 004107841.td-b3lyp_6-31g+(d).log.xz

004107841.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107841.td-b3lyp_6-31+g(d).gjf (generated)

004107841.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107841.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107841.mol 004107841.PUBCHEM 004107841.mol (via Jmol)
004107891.b3lyp_6-31g(d).inp

004107891.b3lyp_6-31g(d).qchem.inp (generated)

004107891.b3lyp_6-31g(d).gjf (generated)

004107891.b3lyp_6-31g(d).firefly.inp (generated)

004107891.b3lyp_6-31g(d).smash.inp (generated)

004107891.b3lyp_6-31g(d).nwchem.inp (generated) 004107891.b3lyp_6-31g(d).log.xz 004107891.td-b3lyp_6-31g+(d).inp 004107891.td-b3lyp_6-31g+(d).log.xz

004107891.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107891.td-b3lyp_6-31+g(d).gjf (generated)

004107891.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107891.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107891.mol 004107891.PUBCHEM 004107891.mol (via Jmol)
004107923.b3lyp_6-31g(d).inp

004107923.b3lyp_6-31g(d).qchem.inp (generated)

004107923.b3lyp_6-31g(d).gjf (generated)

004107923.b3lyp_6-31g(d).firefly.inp (generated)

004107923.b3lyp_6-31g(d).smash.inp (generated)

004107923.b3lyp_6-31g(d).nwchem.inp (generated) 004107923.b3lyp_6-31g(d).log.xz 004107923.td-b3lyp_6-31g+(d).inp 004107923.td-b3lyp_6-31g+(d).log.xz

004107923.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107923.td-b3lyp_6-31+g(d).gjf (generated)

004107923.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107923.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107923.mol 004107923.PUBCHEM 004107923.mol (via Jmol)
004107945.b3lyp_6-31g(d).inp

004107945.b3lyp_6-31g(d).qchem.inp (generated)

004107945.b3lyp_6-31g(d).gjf (generated)

004107945.b3lyp_6-31g(d).firefly.inp (generated)

004107945.b3lyp_6-31g(d).smash.inp (generated)

004107945.b3lyp_6-31g(d).nwchem.inp (generated) 004107945.b3lyp_6-31g(d).log.xz 004107945.mol 004107945.PUBCHEM 004107945.mol (via Jmol)
004107971.b3lyp_6-31g(d).inp

004107971.b3lyp_6-31g(d).qchem.inp (generated)

004107971.b3lyp_6-31g(d).gjf (generated)

004107971.b3lyp_6-31g(d).firefly.inp (generated)

004107971.b3lyp_6-31g(d).smash.inp (generated)

004107971.b3lyp_6-31g(d).nwchem.inp (generated) 004107971.b3lyp_6-31g(d).log.xz 004107971.td-b3lyp_6-31g+(d).inp 004107971.td-b3lyp_6-31g+(d).log.xz

004107971.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107971.td-b3lyp_6-31+g(d).gjf (generated)

004107971.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107971.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107971.mol 004107971.PUBCHEM 004107971.mol (via Jmol)
004107989.b3lyp_6-31g(d).inp

004107989.b3lyp_6-31g(d).qchem.inp (generated)

004107989.b3lyp_6-31g(d).gjf (generated)

004107989.b3lyp_6-31g(d).firefly.inp (generated)

004107989.b3lyp_6-31g(d).smash.inp (generated)

004107989.b3lyp_6-31g(d).nwchem.inp (generated) 004107989.b3lyp_6-31g(d).log.xz 004107989.td-b3lyp_6-31g+(d).inp 004107989.td-b3lyp_6-31g+(d).log.xz

004107989.td-b3lyp_6-31+g(d).qchem.inp (generated)

004107989.td-b3lyp_6-31+g(d).gjf (generated)

004107989.td-b3lyp_6-31+g(d).firefly.inp (generated)

004107989.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004107989.mol 004107989.PUBCHEM 004107989.mol (via Jmol)
004108001.b3lyp_6-31g(d).inp

004108001.b3lyp_6-31g(d).qchem.inp (generated)

004108001.b3lyp_6-31g(d).gjf (generated)

004108001.b3lyp_6-31g(d).firefly.inp (generated)

004108001.b3lyp_6-31g(d).smash.inp (generated)

004108001.b3lyp_6-31g(d).nwchem.inp (generated) 004108001.b3lyp_6-31g(d).log.xz 004108001.td-b3lyp_6-31g+(d).inp 004108001.td-b3lyp_6-31g+(d).log.xz

004108001.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108001.td-b3lyp_6-31+g(d).gjf (generated)

004108001.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108001.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108001.mol 004108001.PUBCHEM 004108001.mol (via Jmol)
004108035.b3lyp_6-31g(d).inp

004108035.b3lyp_6-31g(d).qchem.inp (generated)

004108035.b3lyp_6-31g(d).gjf (generated)

004108035.b3lyp_6-31g(d).firefly.inp (generated)

004108035.b3lyp_6-31g(d).smash.inp (generated)

004108035.b3lyp_6-31g(d).nwchem.inp (generated) 004108035.b3lyp_6-31g(d).log.xz 004108035.td-b3lyp_6-31g+(d).inp 004108035.td-b3lyp_6-31g+(d).log.xz

004108035.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108035.td-b3lyp_6-31+g(d).gjf (generated)

004108035.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108035.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108035.mol 004108035.PUBCHEM 004108035.mol (via Jmol)
004108070.b3lyp_6-31g(d).inp

004108070.b3lyp_6-31g(d).qchem.inp (generated)

004108070.b3lyp_6-31g(d).gjf (generated)

004108070.b3lyp_6-31g(d).firefly.inp (generated)

004108070.b3lyp_6-31g(d).smash.inp (generated)

004108070.b3lyp_6-31g(d).nwchem.inp (generated) 004108070.b3lyp_6-31g(d).log.xz 004108070.td-b3lyp_6-31g+(d).inp 004108070.td-b3lyp_6-31g+(d).log.xz

004108070.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108070.td-b3lyp_6-31+g(d).gjf (generated)

004108070.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108070.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108070.mol 004108070.PUBCHEM 004108070.mol (via Jmol)
004108109.b3lyp_6-31g(d).inp

004108109.b3lyp_6-31g(d).qchem.inp (generated)

004108109.b3lyp_6-31g(d).gjf (generated)

004108109.b3lyp_6-31g(d).firefly.inp (generated)

004108109.b3lyp_6-31g(d).smash.inp (generated)

004108109.b3lyp_6-31g(d).nwchem.inp (generated) 004108109.b3lyp_6-31g(d).log.xz 004108109.mol 004108109.PUBCHEM 004108109.mol (via Jmol)
004108127.b3lyp_6-31g(d).inp

004108127.b3lyp_6-31g(d).qchem.inp (generated)

004108127.b3lyp_6-31g(d).gjf (generated)

004108127.b3lyp_6-31g(d).firefly.inp (generated)

004108127.b3lyp_6-31g(d).smash.inp (generated)

004108127.b3lyp_6-31g(d).nwchem.inp (generated) 004108127.b3lyp_6-31g(d).log.xz 004108127.td-b3lyp_6-31g+(d).inp 004108127.td-b3lyp_6-31g+(d).log.xz

004108127.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108127.td-b3lyp_6-31+g(d).gjf (generated)

004108127.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108127.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108127.mol 004108127.PUBCHEM 004108127.mol (via Jmol)
004108137.b3lyp_6-31g(d).inp

004108137.b3lyp_6-31g(d).qchem.inp (generated)

004108137.b3lyp_6-31g(d).gjf (generated)

004108137.b3lyp_6-31g(d).firefly.inp (generated)

004108137.b3lyp_6-31g(d).smash.inp (generated)

004108137.b3lyp_6-31g(d).nwchem.inp (generated) 004108137.b3lyp_6-31g(d).log.xz 004108137.td-b3lyp_6-31g+(d).inp 004108137.td-b3lyp_6-31g+(d).log.xz

004108137.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108137.td-b3lyp_6-31+g(d).gjf (generated)

004108137.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108137.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108137.mol 004108137.PUBCHEM 004108137.mol (via Jmol)
004108138.b3lyp_6-31g(d).inp

004108138.b3lyp_6-31g(d).qchem.inp (generated)

004108138.b3lyp_6-31g(d).gjf (generated)

004108138.b3lyp_6-31g(d).firefly.inp (generated)

004108138.b3lyp_6-31g(d).smash.inp (generated)

004108138.b3lyp_6-31g(d).nwchem.inp (generated) 004108138.b3lyp_6-31g(d).log.xz 004108138.td-b3lyp_6-31g+(d).inp 004108138.td-b3lyp_6-31g+(d).log.xz

004108138.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108138.td-b3lyp_6-31+g(d).gjf (generated)

004108138.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108138.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108138.mol 004108138.PUBCHEM 004108138.mol (via Jmol)
004108226.b3lyp_6-31g(d).inp

004108226.b3lyp_6-31g(d).qchem.inp (generated)

004108226.b3lyp_6-31g(d).gjf (generated)

004108226.b3lyp_6-31g(d).firefly.inp (generated)

004108226.b3lyp_6-31g(d).smash.inp (generated)

004108226.b3lyp_6-31g(d).nwchem.inp (generated) 004108226.b3lyp_6-31g(d).log.xz 004108226.td-b3lyp_6-31g+(d).inp 004108226.td-b3lyp_6-31g+(d).log.xz

004108226.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108226.td-b3lyp_6-31+g(d).gjf (generated)

004108226.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108226.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108226.mol 004108226.PUBCHEM 004108226.mol (via Jmol)
004108322.b3lyp_6-31g(d).inp

004108322.b3lyp_6-31g(d).qchem.inp (generated)

004108322.b3lyp_6-31g(d).gjf (generated)

004108322.b3lyp_6-31g(d).firefly.inp (generated)

004108322.b3lyp_6-31g(d).smash.inp (generated)

004108322.b3lyp_6-31g(d).nwchem.inp (generated) 004108322.b3lyp_6-31g(d).log.xz 004108322.td-b3lyp_6-31g+(d).inp 004108322.td-b3lyp_6-31g+(d).log.xz

004108322.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108322.td-b3lyp_6-31+g(d).gjf (generated)

004108322.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108322.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108322.mol 004108322.PUBCHEM 004108322.mol (via Jmol)
004108406.b3lyp_6-31g(d).inp

004108406.b3lyp_6-31g(d).qchem.inp (generated)

004108406.b3lyp_6-31g(d).gjf (generated)

004108406.b3lyp_6-31g(d).firefly.inp (generated)

004108406.b3lyp_6-31g(d).smash.inp (generated)

004108406.b3lyp_6-31g(d).nwchem.inp (generated) 004108406.b3lyp_6-31g(d).log.xz 004108406.td-b3lyp_6-31g+(d).inp 004108406.td-b3lyp_6-31g+(d).log.xz

004108406.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108406.td-b3lyp_6-31+g(d).gjf (generated)

004108406.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108406.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108406.mol 004108406.PUBCHEM 004108406.mol (via Jmol)
004108412.b3lyp_6-31g(d).inp

004108412.b3lyp_6-31g(d).qchem.inp (generated)

004108412.b3lyp_6-31g(d).gjf (generated)

004108412.b3lyp_6-31g(d).firefly.inp (generated)

004108412.b3lyp_6-31g(d).smash.inp (generated)

004108412.b3lyp_6-31g(d).nwchem.inp (generated) 004108412.b3lyp_6-31g(d).log.xz 004108412.td-b3lyp_6-31g+(d).inp 004108412.td-b3lyp_6-31g+(d).log.xz

004108412.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108412.td-b3lyp_6-31+g(d).gjf (generated)

004108412.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108412.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108412.mol 004108412.PUBCHEM 004108412.mol (via Jmol)
004108468.b3lyp_6-31g(d).inp

004108468.b3lyp_6-31g(d).qchem.inp (generated)

004108468.b3lyp_6-31g(d).gjf (generated)

004108468.b3lyp_6-31g(d).firefly.inp (generated)

004108468.b3lyp_6-31g(d).smash.inp (generated)

004108468.b3lyp_6-31g(d).nwchem.inp (generated) 004108468.b3lyp_6-31g(d).log.xz 004108468.td-b3lyp_6-31g+(d).inp 004108468.td-b3lyp_6-31g+(d).log.xz

004108468.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108468.td-b3lyp_6-31+g(d).gjf (generated)

004108468.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108468.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108468.mol 004108468.PUBCHEM 004108468.mol (via Jmol)
004108469.b3lyp_6-31g(d).inp

004108469.b3lyp_6-31g(d).qchem.inp (generated)

004108469.b3lyp_6-31g(d).gjf (generated)

004108469.b3lyp_6-31g(d).firefly.inp (generated)

004108469.b3lyp_6-31g(d).smash.inp (generated)

004108469.b3lyp_6-31g(d).nwchem.inp (generated) 004108469.b3lyp_6-31g(d).log.xz 004108469.td-b3lyp_6-31g+(d).inp 004108469.td-b3lyp_6-31g+(d).log.xz

004108469.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108469.td-b3lyp_6-31+g(d).gjf (generated)

004108469.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108469.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108469.mol 004108469.PUBCHEM 004108469.mol (via Jmol)
004108486.b3lyp_6-31g(d).inp

004108486.b3lyp_6-31g(d).qchem.inp (generated)

004108486.b3lyp_6-31g(d).gjf (generated)

004108486.b3lyp_6-31g(d).firefly.inp (generated)

004108486.b3lyp_6-31g(d).smash.inp (generated)

004108486.b3lyp_6-31g(d).nwchem.inp (generated) 004108486.b3lyp_6-31g(d).log.xz 004108486.td-b3lyp_6-31g+(d).inp 004108486.td-b3lyp_6-31g+(d).log.xz

004108486.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108486.td-b3lyp_6-31+g(d).gjf (generated)

004108486.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108486.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108486.mol 004108486.PUBCHEM 004108486.mol (via Jmol)
004108533.b3lyp_6-31g(d).inp

004108533.b3lyp_6-31g(d).qchem.inp (generated)

004108533.b3lyp_6-31g(d).gjf (generated)

004108533.b3lyp_6-31g(d).firefly.inp (generated)

004108533.b3lyp_6-31g(d).smash.inp (generated)

004108533.b3lyp_6-31g(d).nwchem.inp (generated) 004108533.b3lyp_6-31g(d).log.xz 004108533.td-b3lyp_6-31g+(d).inp 004108533.td-b3lyp_6-31g+(d).log.xz

004108533.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108533.td-b3lyp_6-31+g(d).gjf (generated)

004108533.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108533.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108533.mol 004108533.PUBCHEM 004108533.mol (via Jmol)
004108536.b3lyp_6-31g(d).inp

004108536.b3lyp_6-31g(d).qchem.inp (generated)

004108536.b3lyp_6-31g(d).gjf (generated)

004108536.b3lyp_6-31g(d).firefly.inp (generated)

004108536.b3lyp_6-31g(d).smash.inp (generated)

004108536.b3lyp_6-31g(d).nwchem.inp (generated) 004108536.b3lyp_6-31g(d).log.xz 004108536.td-b3lyp_6-31g+(d).inp 004108536.td-b3lyp_6-31g+(d).log.xz

004108536.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108536.td-b3lyp_6-31+g(d).gjf (generated)

004108536.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108536.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108536.mol 004108536.PUBCHEM 004108536.mol (via Jmol)
004108588.b3lyp_6-31g(d).inp

004108588.b3lyp_6-31g(d).qchem.inp (generated)

004108588.b3lyp_6-31g(d).gjf (generated)

004108588.b3lyp_6-31g(d).firefly.inp (generated)

004108588.b3lyp_6-31g(d).smash.inp (generated)

004108588.b3lyp_6-31g(d).nwchem.inp (generated) 004108588.b3lyp_6-31g(d).log.xz 004108588.td-b3lyp_6-31g+(d).inp 004108588.td-b3lyp_6-31g+(d).log.xz

004108588.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108588.td-b3lyp_6-31+g(d).gjf (generated)

004108588.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108588.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108588.mol 004108588.PUBCHEM 004108588.mol (via Jmol)
004108589.b3lyp_6-31g(d).inp

004108589.b3lyp_6-31g(d).qchem.inp (generated)

004108589.b3lyp_6-31g(d).gjf (generated)

004108589.b3lyp_6-31g(d).firefly.inp (generated)

004108589.b3lyp_6-31g(d).smash.inp (generated)

004108589.b3lyp_6-31g(d).nwchem.inp (generated) 004108589.b3lyp_6-31g(d).log.xz 004108589.td-b3lyp_6-31g+(d).inp 004108589.td-b3lyp_6-31g+(d).log.xz

004108589.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108589.td-b3lyp_6-31+g(d).gjf (generated)

004108589.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108589.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108589.mol 004108589.PUBCHEM 004108589.mol (via Jmol)
004108622.b3lyp_6-31g(d).inp

004108622.b3lyp_6-31g(d).qchem.inp (generated)

004108622.b3lyp_6-31g(d).gjf (generated)

004108622.b3lyp_6-31g(d).firefly.inp (generated)

004108622.b3lyp_6-31g(d).smash.inp (generated)

004108622.b3lyp_6-31g(d).nwchem.inp (generated) 004108622.b3lyp_6-31g(d).log.xz 004108622.td-b3lyp_6-31g+(d).inp 004108622.td-b3lyp_6-31g+(d).log.xz

004108622.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108622.td-b3lyp_6-31+g(d).gjf (generated)

004108622.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108622.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108622.mol 004108622.PUBCHEM 004108622.mol (via Jmol)
004108623.b3lyp_6-31g(d).inp

004108623.b3lyp_6-31g(d).qchem.inp (generated)

004108623.b3lyp_6-31g(d).gjf (generated)

004108623.b3lyp_6-31g(d).firefly.inp (generated)

004108623.b3lyp_6-31g(d).smash.inp (generated)

004108623.b3lyp_6-31g(d).nwchem.inp (generated) 004108623.b3lyp_6-31g(d).log.xz 004108623.td-b3lyp_6-31g+(d).inp 004108623.td-b3lyp_6-31g+(d).log.xz

004108623.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108623.td-b3lyp_6-31+g(d).gjf (generated)

004108623.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108623.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108623.mol 004108623.PUBCHEM 004108623.mol (via Jmol)
004108625.b3lyp_6-31g(d).inp

004108625.b3lyp_6-31g(d).qchem.inp (generated)

004108625.b3lyp_6-31g(d).gjf (generated)

004108625.b3lyp_6-31g(d).firefly.inp (generated)

004108625.b3lyp_6-31g(d).smash.inp (generated)

004108625.b3lyp_6-31g(d).nwchem.inp (generated) 004108625.b3lyp_6-31g(d).log.xz 004108625.td-b3lyp_6-31g+(d).inp 004108625.td-b3lyp_6-31g+(d).log.xz

004108625.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108625.td-b3lyp_6-31+g(d).gjf (generated)

004108625.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108625.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108625.mol 004108625.PUBCHEM 004108625.mol (via Jmol)
004108629.b3lyp_6-31g(d).inp

004108629.b3lyp_6-31g(d).qchem.inp (generated)

004108629.b3lyp_6-31g(d).gjf (generated)

004108629.b3lyp_6-31g(d).firefly.inp (generated)

004108629.b3lyp_6-31g(d).smash.inp (generated)

004108629.b3lyp_6-31g(d).nwchem.inp (generated) 004108629.b3lyp_6-31g(d).log.xz 004108629.mol 004108629.PUBCHEM 004108629.mol (via Jmol)
004108630.b3lyp_6-31g(d).inp

004108630.b3lyp_6-31g(d).qchem.inp (generated)

004108630.b3lyp_6-31g(d).gjf (generated)

004108630.b3lyp_6-31g(d).firefly.inp (generated)

004108630.b3lyp_6-31g(d).smash.inp (generated)

004108630.b3lyp_6-31g(d).nwchem.inp (generated) 004108630.b3lyp_6-31g(d).log.xz 004108630.td-b3lyp_6-31g+(d).inp 004108630.td-b3lyp_6-31g+(d).log.xz

004108630.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108630.td-b3lyp_6-31+g(d).gjf (generated)

004108630.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108630.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108630.mol 004108630.PUBCHEM 004108630.mol (via Jmol)
004108636.b3lyp_6-31g(d).inp

004108636.b3lyp_6-31g(d).qchem.inp (generated)

004108636.b3lyp_6-31g(d).gjf (generated)

004108636.b3lyp_6-31g(d).firefly.inp (generated)

004108636.b3lyp_6-31g(d).smash.inp (generated)

004108636.b3lyp_6-31g(d).nwchem.inp (generated) 004108636.b3lyp_6-31g(d).log.xz 004108636.td-b3lyp_6-31g+(d).inp 004108636.td-b3lyp_6-31g+(d).log.xz

004108636.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108636.td-b3lyp_6-31+g(d).gjf (generated)

004108636.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108636.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108636.mol 004108636.PUBCHEM 004108636.mol (via Jmol)
004108671.b3lyp_6-31g(d).inp

004108671.b3lyp_6-31g(d).qchem.inp (generated)

004108671.b3lyp_6-31g(d).gjf (generated)

004108671.b3lyp_6-31g(d).firefly.inp (generated)

004108671.b3lyp_6-31g(d).smash.inp (generated)

004108671.b3lyp_6-31g(d).nwchem.inp (generated) 004108671.b3lyp_6-31g(d).log.xz 004108671.td-b3lyp_6-31g+(d).inp 004108671.td-b3lyp_6-31g+(d).log.xz

004108671.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108671.td-b3lyp_6-31+g(d).gjf (generated)

004108671.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108671.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108671.mol 004108671.PUBCHEM 004108671.mol (via Jmol)
004108827.b3lyp_6-31g(d).inp

004108827.b3lyp_6-31g(d).qchem.inp (generated)

004108827.b3lyp_6-31g(d).gjf (generated)

004108827.b3lyp_6-31g(d).firefly.inp (generated)

004108827.b3lyp_6-31g(d).smash.inp (generated)

004108827.b3lyp_6-31g(d).nwchem.inp (generated) 004108827.b3lyp_6-31g(d).log.xz 004108827.td-b3lyp_6-31g+(d).inp 004108827.td-b3lyp_6-31g+(d).log.xz

004108827.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108827.td-b3lyp_6-31+g(d).gjf (generated)

004108827.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108827.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108827.mol 004108827.PUBCHEM 004108827.mol (via Jmol)
004108877.b3lyp_6-31g(d).inp

004108877.b3lyp_6-31g(d).qchem.inp (generated)

004108877.b3lyp_6-31g(d).gjf (generated)

004108877.b3lyp_6-31g(d).firefly.inp (generated)

004108877.b3lyp_6-31g(d).smash.inp (generated)

004108877.b3lyp_6-31g(d).nwchem.inp (generated) 004108877.b3lyp_6-31g(d).log.xz 004108877.td-b3lyp_6-31g+(d).inp 004108877.td-b3lyp_6-31g+(d).log.xz

004108877.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108877.td-b3lyp_6-31+g(d).gjf (generated)

004108877.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108877.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108877.mol 004108877.PUBCHEM 004108877.mol (via Jmol)
004108889.b3lyp_6-31g(d).inp

004108889.b3lyp_6-31g(d).qchem.inp (generated)

004108889.b3lyp_6-31g(d).gjf (generated)

004108889.b3lyp_6-31g(d).firefly.inp (generated)

004108889.b3lyp_6-31g(d).smash.inp (generated)

004108889.b3lyp_6-31g(d).nwchem.inp (generated) 004108889.b3lyp_6-31g(d).log.xz 004108889.td-b3lyp_6-31g+(d).inp 004108889.td-b3lyp_6-31g+(d).log.xz

004108889.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108889.td-b3lyp_6-31+g(d).gjf (generated)

004108889.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108889.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108889.mol 004108889.PUBCHEM 004108889.mol (via Jmol)
004108918.b3lyp_6-31g(d).inp

004108918.b3lyp_6-31g(d).qchem.inp (generated)

004108918.b3lyp_6-31g(d).gjf (generated)

004108918.b3lyp_6-31g(d).firefly.inp (generated)

004108918.b3lyp_6-31g(d).smash.inp (generated)

004108918.b3lyp_6-31g(d).nwchem.inp (generated) 004108918.b3lyp_6-31g(d).log.xz 004108918.td-b3lyp_6-31g+(d).inp 004108918.td-b3lyp_6-31g+(d).log.xz

004108918.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108918.td-b3lyp_6-31+g(d).gjf (generated)

004108918.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108918.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108918.mol 004108918.PUBCHEM 004108918.mol (via Jmol)
004108958.b3lyp_6-31g(d).inp

004108958.b3lyp_6-31g(d).qchem.inp (generated)

004108958.b3lyp_6-31g(d).gjf (generated)

004108958.b3lyp_6-31g(d).firefly.inp (generated)

004108958.b3lyp_6-31g(d).smash.inp (generated)

004108958.b3lyp_6-31g(d).nwchem.inp (generated) 004108958.b3lyp_6-31g(d).log.xz 004108958.mol 004108958.PUBCHEM 004108958.mol (via Jmol)
004108965.b3lyp_6-31g(d).inp

004108965.b3lyp_6-31g(d).qchem.inp (generated)

004108965.b3lyp_6-31g(d).gjf (generated)

004108965.b3lyp_6-31g(d).firefly.inp (generated)

004108965.b3lyp_6-31g(d).smash.inp (generated)

004108965.b3lyp_6-31g(d).nwchem.inp (generated) 004108965.b3lyp_6-31g(d).log.xz 004108965.td-b3lyp_6-31g+(d).inp 004108965.td-b3lyp_6-31g+(d).log.xz

004108965.td-b3lyp_6-31+g(d).qchem.inp (generated)

004108965.td-b3lyp_6-31+g(d).gjf (generated)

004108965.td-b3lyp_6-31+g(d).firefly.inp (generated)

004108965.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004108965.mol 004108965.PUBCHEM 004108965.mol (via Jmol)
004108971.b3lyp_6-31g(d).inp

004108971.b3lyp_6-31g(d).qchem.inp (generated)

004108971.b3lyp_6-31g(d).gjf (generated)

004108971.b3lyp_6-31g(d).firefly.inp (generated)

004108971.b3lyp_6-31g(d).smash.inp (generated)

004108971.b3lyp_6-31g(d).nwchem.inp (generated) 004108971.b3lyp_6-31g(d).log.xz 004108971.mol 004108971.PUBCHEM 004108971.mol (via Jmol)
004108974.b3lyp_6-31g(d).inp

004108974.b3lyp_6-31g(d).qchem.inp (generated)

004108974.b3lyp_6-31g(d).gjf (generated)

004108974.b3lyp_6-31g(d).firefly.inp (generated)

004108974.b3lyp_6-31g(d).smash.inp (generated)

004108974.b3lyp_6-31g(d).nwchem.inp (generated) 004108974.b3lyp_6-31g(d).log.xz 004108974.mol 004108974.PUBCHEM 004108974.mol (via Jmol)
004109001.b3lyp_6-31g(d).inp

004109001.b3lyp_6-31g(d).qchem.inp (generated)

004109001.b3lyp_6-31g(d).gjf (generated)

004109001.b3lyp_6-31g(d).firefly.inp (generated)

004109001.b3lyp_6-31g(d).smash.inp (generated)

004109001.b3lyp_6-31g(d).nwchem.inp (generated) 004109001.b3lyp_6-31g(d).log.xz 004109001.td-b3lyp_6-31g+(d).inp 004109001.td-b3lyp_6-31g+(d).log.xz

004109001.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109001.td-b3lyp_6-31+g(d).gjf (generated)

004109001.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109001.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109001.mol 004109001.PUBCHEM 004109001.mol (via Jmol)
004109019.b3lyp_6-31g(d).inp

004109019.b3lyp_6-31g(d).qchem.inp (generated)

004109019.b3lyp_6-31g(d).gjf (generated)

004109019.b3lyp_6-31g(d).firefly.inp (generated)

004109019.b3lyp_6-31g(d).smash.inp (generated)

004109019.b3lyp_6-31g(d).nwchem.inp (generated) 004109019.b3lyp_6-31g(d).log.xz 004109019.mol 004109019.PUBCHEM 004109019.mol (via Jmol)
004109051.b3lyp_6-31g(d).inp

004109051.b3lyp_6-31g(d).qchem.inp (generated)

004109051.b3lyp_6-31g(d).gjf (generated)

004109051.b3lyp_6-31g(d).firefly.inp (generated)

004109051.b3lyp_6-31g(d).smash.inp (generated)

004109051.b3lyp_6-31g(d).nwchem.inp (generated) 004109051.b3lyp_6-31g(d).log.xz 004109051.td-b3lyp_6-31g+(d).inp 004109051.td-b3lyp_6-31g+(d).log.xz

004109051.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109051.td-b3lyp_6-31+g(d).gjf (generated)

004109051.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109051.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109051.mol 004109051.PUBCHEM 004109051.mol (via Jmol)
004109079.b3lyp_6-31g(d).inp

004109079.b3lyp_6-31g(d).qchem.inp (generated)

004109079.b3lyp_6-31g(d).gjf (generated)

004109079.b3lyp_6-31g(d).firefly.inp (generated)

004109079.b3lyp_6-31g(d).smash.inp (generated)

004109079.b3lyp_6-31g(d).nwchem.inp (generated) 004109079.b3lyp_6-31g(d).log.xz 004109079.td-b3lyp_6-31g+(d).inp 004109079.td-b3lyp_6-31g+(d).log.xz

004109079.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109079.td-b3lyp_6-31+g(d).gjf (generated)

004109079.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109079.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109079.mol 004109079.PUBCHEM 004109079.mol (via Jmol)
004109088.b3lyp_6-31g(d).inp

004109088.b3lyp_6-31g(d).qchem.inp (generated)

004109088.b3lyp_6-31g(d).gjf (generated)

004109088.b3lyp_6-31g(d).firefly.inp (generated)

004109088.b3lyp_6-31g(d).smash.inp (generated)

004109088.b3lyp_6-31g(d).nwchem.inp (generated) 004109088.b3lyp_6-31g(d).log.xz 004109088.td-b3lyp_6-31g+(d).inp 004109088.td-b3lyp_6-31g+(d).log.xz

004109088.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109088.td-b3lyp_6-31+g(d).gjf (generated)

004109088.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109088.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109088.mol 004109088.PUBCHEM 004109088.mol (via Jmol)
004109153.b3lyp_6-31g(d).inp

004109153.b3lyp_6-31g(d).qchem.inp (generated)

004109153.b3lyp_6-31g(d).gjf (generated)

004109153.b3lyp_6-31g(d).firefly.inp (generated)

004109153.b3lyp_6-31g(d).smash.inp (generated)

004109153.b3lyp_6-31g(d).nwchem.inp (generated) 004109153.b3lyp_6-31g(d).log.xz 004109153.td-b3lyp_6-31g+(d).inp 004109153.td-b3lyp_6-31g+(d).log.xz

004109153.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109153.td-b3lyp_6-31+g(d).gjf (generated)

004109153.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109153.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109153.mol 004109153.PUBCHEM 004109153.mol (via Jmol)
004109157.b3lyp_6-31g(d).inp

004109157.b3lyp_6-31g(d).qchem.inp (generated)

004109157.b3lyp_6-31g(d).gjf (generated)

004109157.b3lyp_6-31g(d).firefly.inp (generated)

004109157.b3lyp_6-31g(d).smash.inp (generated)

004109157.b3lyp_6-31g(d).nwchem.inp (generated) 004109157.b3lyp_6-31g(d).log.xz 004109157.td-b3lyp_6-31g+(d).inp 004109157.td-b3lyp_6-31g+(d).log.xz

004109157.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109157.td-b3lyp_6-31+g(d).gjf (generated)

004109157.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109157.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109157.mol 004109157.PUBCHEM 004109157.mol (via Jmol)
004109158.b3lyp_6-31g(d).inp

004109158.b3lyp_6-31g(d).qchem.inp (generated)

004109158.b3lyp_6-31g(d).gjf (generated)

004109158.b3lyp_6-31g(d).firefly.inp (generated)

004109158.b3lyp_6-31g(d).smash.inp (generated)

004109158.b3lyp_6-31g(d).nwchem.inp (generated) 004109158.b3lyp_6-31g(d).log.xz 004109158.mol 004109158.PUBCHEM 004109158.mol (via Jmol)
004109159.b3lyp_6-31g(d).inp

004109159.b3lyp_6-31g(d).qchem.inp (generated)

004109159.b3lyp_6-31g(d).gjf (generated)

004109159.b3lyp_6-31g(d).firefly.inp (generated)

004109159.b3lyp_6-31g(d).smash.inp (generated)

004109159.b3lyp_6-31g(d).nwchem.inp (generated) 004109159.b3lyp_6-31g(d).log.xz 004109159.td-b3lyp_6-31g+(d).inp 004109159.td-b3lyp_6-31g+(d).log.xz

004109159.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109159.td-b3lyp_6-31+g(d).gjf (generated)

004109159.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109159.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109159.mol 004109159.PUBCHEM 004109159.mol (via Jmol)
004109205.b3lyp_6-31g(d).inp

004109205.b3lyp_6-31g(d).qchem.inp (generated)

004109205.b3lyp_6-31g(d).gjf (generated)

004109205.b3lyp_6-31g(d).firefly.inp (generated)

004109205.b3lyp_6-31g(d).smash.inp (generated)

004109205.b3lyp_6-31g(d).nwchem.inp (generated) 004109205.b3lyp_6-31g(d).log.xz 004109205.td-b3lyp_6-31g+(d).inp 004109205.td-b3lyp_6-31g+(d).log.xz

004109205.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109205.td-b3lyp_6-31+g(d).gjf (generated)

004109205.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109205.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109205.mol 004109205.PUBCHEM 004109205.mol (via Jmol)
004109212.b3lyp_6-31g(d).inp

004109212.b3lyp_6-31g(d).qchem.inp (generated)

004109212.b3lyp_6-31g(d).gjf (generated)

004109212.b3lyp_6-31g(d).firefly.inp (generated)

004109212.b3lyp_6-31g(d).smash.inp (generated)

004109212.b3lyp_6-31g(d).nwchem.inp (generated) 004109212.b3lyp_6-31g(d).log.xz 004109212.td-b3lyp_6-31g+(d).inp 004109212.td-b3lyp_6-31g+(d).log.xz

004109212.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109212.td-b3lyp_6-31+g(d).gjf (generated)

004109212.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109212.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109212.mol 004109212.PUBCHEM 004109212.mol (via Jmol)
004109335.b3lyp_6-31g(d).inp

004109335.b3lyp_6-31g(d).qchem.inp (generated)

004109335.b3lyp_6-31g(d).gjf (generated)

004109335.b3lyp_6-31g(d).firefly.inp (generated)

004109335.b3lyp_6-31g(d).smash.inp (generated)

004109335.b3lyp_6-31g(d).nwchem.inp (generated) 004109335.b3lyp_6-31g(d).log.xz 004109335.td-b3lyp_6-31g+(d).inp 004109335.td-b3lyp_6-31g+(d).log.xz

004109335.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109335.td-b3lyp_6-31+g(d).gjf (generated)

004109335.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109335.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109335.mol 004109335.PUBCHEM 004109335.mol (via Jmol)
004109336.b3lyp_6-31g(d).inp

004109336.b3lyp_6-31g(d).qchem.inp (generated)

004109336.b3lyp_6-31g(d).gjf (generated)

004109336.b3lyp_6-31g(d).firefly.inp (generated)

004109336.b3lyp_6-31g(d).smash.inp (generated)

004109336.b3lyp_6-31g(d).nwchem.inp (generated) 004109336.b3lyp_6-31g(d).log.xz 004109336.td-b3lyp_6-31g+(d).inp 004109336.td-b3lyp_6-31g+(d).log.xz

004109336.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109336.td-b3lyp_6-31+g(d).gjf (generated)

004109336.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109336.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109336.mol 004109336.PUBCHEM 004109336.mol (via Jmol)
004109337.b3lyp_6-31g(d).inp

004109337.b3lyp_6-31g(d).qchem.inp (generated)

004109337.b3lyp_6-31g(d).gjf (generated)

004109337.b3lyp_6-31g(d).firefly.inp (generated)

004109337.b3lyp_6-31g(d).smash.inp (generated)

004109337.b3lyp_6-31g(d).nwchem.inp (generated) 004109337.b3lyp_6-31g(d).log.xz 004109337.td-b3lyp_6-31g+(d).inp 004109337.td-b3lyp_6-31g+(d).log.xz

004109337.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109337.td-b3lyp_6-31+g(d).gjf (generated)

004109337.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109337.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109337.mol 004109337.PUBCHEM 004109337.mol (via Jmol)
004109339.b3lyp_6-31g(d).inp

004109339.b3lyp_6-31g(d).qchem.inp (generated)

004109339.b3lyp_6-31g(d).gjf (generated)

004109339.b3lyp_6-31g(d).firefly.inp (generated)

004109339.b3lyp_6-31g(d).smash.inp (generated)

004109339.b3lyp_6-31g(d).nwchem.inp (generated) 004109339.b3lyp_6-31g(d).log.xz 004109339.td-b3lyp_6-31g+(d).inp 004109339.td-b3lyp_6-31g+(d).log.xz

004109339.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109339.td-b3lyp_6-31+g(d).gjf (generated)

004109339.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109339.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109339.mol 004109339.PUBCHEM 004109339.mol (via Jmol)
004109340.b3lyp_6-31g(d).inp

004109340.b3lyp_6-31g(d).qchem.inp (generated)

004109340.b3lyp_6-31g(d).gjf (generated)

004109340.b3lyp_6-31g(d).firefly.inp (generated)

004109340.b3lyp_6-31g(d).smash.inp (generated)

004109340.b3lyp_6-31g(d).nwchem.inp (generated) 004109340.b3lyp_6-31g(d).log.xz 004109340.td-b3lyp_6-31g+(d).inp 004109340.td-b3lyp_6-31g+(d).log.xz

004109340.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109340.td-b3lyp_6-31+g(d).gjf (generated)

004109340.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109340.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109340.mol 004109340.PUBCHEM 004109340.mol (via Jmol)
004109343.b3lyp_6-31g(d).inp

004109343.b3lyp_6-31g(d).qchem.inp (generated)

004109343.b3lyp_6-31g(d).gjf (generated)

004109343.b3lyp_6-31g(d).firefly.inp (generated)

004109343.b3lyp_6-31g(d).smash.inp (generated)

004109343.b3lyp_6-31g(d).nwchem.inp (generated) 004109343.b3lyp_6-31g(d).log.xz 004109343.td-b3lyp_6-31g+(d).inp 004109343.td-b3lyp_6-31g+(d).log.xz

004109343.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109343.td-b3lyp_6-31+g(d).gjf (generated)

004109343.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109343.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109343.mol 004109343.PUBCHEM 004109343.mol (via Jmol)
004109369.b3lyp_6-31g(d).inp

004109369.b3lyp_6-31g(d).qchem.inp (generated)

004109369.b3lyp_6-31g(d).gjf (generated)

004109369.b3lyp_6-31g(d).firefly.inp (generated)

004109369.b3lyp_6-31g(d).smash.inp (generated)

004109369.b3lyp_6-31g(d).nwchem.inp (generated) 004109369.b3lyp_6-31g(d).log.xz 004109369.td-b3lyp_6-31g+(d).inp 004109369.td-b3lyp_6-31g+(d).log.xz

004109369.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109369.td-b3lyp_6-31+g(d).gjf (generated)

004109369.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109369.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109369.mol 004109369.PUBCHEM 004109369.mol (via Jmol)
004109392.b3lyp_6-31g(d).inp

004109392.b3lyp_6-31g(d).qchem.inp (generated)

004109392.b3lyp_6-31g(d).gjf (generated)

004109392.b3lyp_6-31g(d).firefly.inp (generated)

004109392.b3lyp_6-31g(d).smash.inp (generated)

004109392.b3lyp_6-31g(d).nwchem.inp (generated) 004109392.b3lyp_6-31g(d).log.xz 004109392.mol 004109392.PUBCHEM 004109392.mol (via Jmol)
004109435.b3lyp_6-31g(d).inp

004109435.b3lyp_6-31g(d).qchem.inp (generated)

004109435.b3lyp_6-31g(d).gjf (generated)

004109435.b3lyp_6-31g(d).firefly.inp (generated)

004109435.b3lyp_6-31g(d).smash.inp (generated)

004109435.b3lyp_6-31g(d).nwchem.inp (generated) 004109435.b3lyp_6-31g(d).log.xz 004109435.td-b3lyp_6-31g+(d).inp 004109435.td-b3lyp_6-31g+(d).log.xz

004109435.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109435.td-b3lyp_6-31+g(d).gjf (generated)

004109435.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109435.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109435.mol 004109435.PUBCHEM 004109435.mol (via Jmol)
004109472.b3lyp_6-31g(d).inp

004109472.b3lyp_6-31g(d).qchem.inp (generated)

004109472.b3lyp_6-31g(d).gjf (generated)

004109472.b3lyp_6-31g(d).firefly.inp (generated)

004109472.b3lyp_6-31g(d).smash.inp (generated)

004109472.b3lyp_6-31g(d).nwchem.inp (generated) 004109472.b3lyp_6-31g(d).log.xz 004109472.td-b3lyp_6-31g+(d).inp 004109472.td-b3lyp_6-31g+(d).log.xz

004109472.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109472.td-b3lyp_6-31+g(d).gjf (generated)

004109472.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109472.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109472.mol 004109472.PUBCHEM 004109472.mol (via Jmol)
004109491.b3lyp_6-31g(d).inp

004109491.b3lyp_6-31g(d).qchem.inp (generated)

004109491.b3lyp_6-31g(d).gjf (generated)

004109491.b3lyp_6-31g(d).firefly.inp (generated)

004109491.b3lyp_6-31g(d).smash.inp (generated)

004109491.b3lyp_6-31g(d).nwchem.inp (generated) 004109491.b3lyp_6-31g(d).log.xz 004109491.td-b3lyp_6-31g+(d).inp 004109491.td-b3lyp_6-31g+(d).log.xz

004109491.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109491.td-b3lyp_6-31+g(d).gjf (generated)

004109491.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109491.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109491.mol 004109491.PUBCHEM 004109491.mol (via Jmol)
004109559.b3lyp_6-31g(d).inp

004109559.b3lyp_6-31g(d).qchem.inp (generated)

004109559.b3lyp_6-31g(d).gjf (generated)

004109559.b3lyp_6-31g(d).firefly.inp (generated)

004109559.b3lyp_6-31g(d).smash.inp (generated)

004109559.b3lyp_6-31g(d).nwchem.inp (generated) 004109559.b3lyp_6-31g(d).log.xz 004109559.mol 004109559.PUBCHEM 004109559.mol (via Jmol)
004109575.b3lyp_6-31g(d).inp

004109575.b3lyp_6-31g(d).qchem.inp (generated)

004109575.b3lyp_6-31g(d).gjf (generated)

004109575.b3lyp_6-31g(d).firefly.inp (generated)

004109575.b3lyp_6-31g(d).smash.inp (generated)

004109575.b3lyp_6-31g(d).nwchem.inp (generated) 004109575.b3lyp_6-31g(d).log.xz 004109575.mol 004109575.PUBCHEM 004109575.mol (via Jmol)
004109733.b3lyp_6-31g(d).inp

004109733.b3lyp_6-31g(d).qchem.inp (generated)

004109733.b3lyp_6-31g(d).gjf (generated)

004109733.b3lyp_6-31g(d).firefly.inp (generated)

004109733.b3lyp_6-31g(d).smash.inp (generated)

004109733.b3lyp_6-31g(d).nwchem.inp (generated) 004109733.b3lyp_6-31g(d).log.xz 004109733.mol 004109733.PUBCHEM 004109733.mol (via Jmol)
004109743.b3lyp_6-31g(d).inp

004109743.b3lyp_6-31g(d).qchem.inp (generated)

004109743.b3lyp_6-31g(d).gjf (generated)

004109743.b3lyp_6-31g(d).firefly.inp (generated)

004109743.b3lyp_6-31g(d).smash.inp (generated)

004109743.b3lyp_6-31g(d).nwchem.inp (generated) 004109743.b3lyp_6-31g(d).log.xz 004109743.td-b3lyp_6-31g+(d).inp 004109743.td-b3lyp_6-31g+(d).log.xz

004109743.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109743.td-b3lyp_6-31+g(d).gjf (generated)

004109743.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109743.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109743.mol 004109743.PUBCHEM 004109743.mol (via Jmol)
004109768.b3lyp_6-31g(d).inp

004109768.b3lyp_6-31g(d).qchem.inp (generated)

004109768.b3lyp_6-31g(d).gjf (generated)

004109768.b3lyp_6-31g(d).firefly.inp (generated)

004109768.b3lyp_6-31g(d).smash.inp (generated)

004109768.b3lyp_6-31g(d).nwchem.inp (generated) 004109768.b3lyp_6-31g(d).log.xz 004109768.td-b3lyp_6-31g+(d).inp 004109768.td-b3lyp_6-31g+(d).log.xz

004109768.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109768.td-b3lyp_6-31+g(d).gjf (generated)

004109768.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109768.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109768.mol 004109768.PUBCHEM 004109768.mol (via Jmol)
004109781.b3lyp_6-31g(d).inp

004109781.b3lyp_6-31g(d).qchem.inp (generated)

004109781.b3lyp_6-31g(d).gjf (generated)

004109781.b3lyp_6-31g(d).firefly.inp (generated)

004109781.b3lyp_6-31g(d).smash.inp (generated)

004109781.b3lyp_6-31g(d).nwchem.inp (generated) 004109781.b3lyp_6-31g(d).log.xz 004109781.td-b3lyp_6-31g+(d).inp 004109781.td-b3lyp_6-31g+(d).log.xz

004109781.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109781.td-b3lyp_6-31+g(d).gjf (generated)

004109781.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109781.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109781.mol 004109781.PUBCHEM 004109781.mol (via Jmol)
004109796.b3lyp_6-31g(d).inp

004109796.b3lyp_6-31g(d).qchem.inp (generated)

004109796.b3lyp_6-31g(d).gjf (generated)

004109796.b3lyp_6-31g(d).firefly.inp (generated)

004109796.b3lyp_6-31g(d).smash.inp (generated)

004109796.b3lyp_6-31g(d).nwchem.inp (generated) 004109796.b3lyp_6-31g(d).log.xz 004109796.td-b3lyp_6-31g+(d).inp 004109796.td-b3lyp_6-31g+(d).log.xz

004109796.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109796.td-b3lyp_6-31+g(d).gjf (generated)

004109796.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109796.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109796.mol 004109796.PUBCHEM 004109796.mol (via Jmol)
004109869.b3lyp_6-31g(d).inp

004109869.b3lyp_6-31g(d).qchem.inp (generated)

004109869.b3lyp_6-31g(d).gjf (generated)

004109869.b3lyp_6-31g(d).firefly.inp (generated)

004109869.b3lyp_6-31g(d).smash.inp (generated)

004109869.b3lyp_6-31g(d).nwchem.inp (generated) 004109869.b3lyp_6-31g(d).log.xz 004109869.td-b3lyp_6-31g+(d).inp 004109869.td-b3lyp_6-31g+(d).log.xz

004109869.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109869.td-b3lyp_6-31+g(d).gjf (generated)

004109869.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109869.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109869.mol 004109869.PUBCHEM 004109869.mol (via Jmol)
004109870.b3lyp_6-31g(d).inp

004109870.b3lyp_6-31g(d).qchem.inp (generated)

004109870.b3lyp_6-31g(d).gjf (generated)

004109870.b3lyp_6-31g(d).firefly.inp (generated)

004109870.b3lyp_6-31g(d).smash.inp (generated)

004109870.b3lyp_6-31g(d).nwchem.inp (generated) 004109870.b3lyp_6-31g(d).log.xz 004109870.td-b3lyp_6-31g+(d).inp 004109870.td-b3lyp_6-31g+(d).log.xz

004109870.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109870.td-b3lyp_6-31+g(d).gjf (generated)

004109870.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109870.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109870.mol 004109870.PUBCHEM 004109870.mol (via Jmol)
004109969.b3lyp_6-31g(d).inp

004109969.b3lyp_6-31g(d).qchem.inp (generated)

004109969.b3lyp_6-31g(d).gjf (generated)

004109969.b3lyp_6-31g(d).firefly.inp (generated)

004109969.b3lyp_6-31g(d).smash.inp (generated)

004109969.b3lyp_6-31g(d).nwchem.inp (generated) 004109969.b3lyp_6-31g(d).log.xz 004109969.mol 004109969.PUBCHEM 004109969.mol (via Jmol)
004109998.b3lyp_6-31g(d).inp

004109998.b3lyp_6-31g(d).qchem.inp (generated)

004109998.b3lyp_6-31g(d).gjf (generated)

004109998.b3lyp_6-31g(d).firefly.inp (generated)

004109998.b3lyp_6-31g(d).smash.inp (generated)

004109998.b3lyp_6-31g(d).nwchem.inp (generated) 004109998.b3lyp_6-31g(d).log.xz 004109998.td-b3lyp_6-31g+(d).inp 004109998.td-b3lyp_6-31g+(d).log.xz

004109998.td-b3lyp_6-31+g(d).qchem.inp (generated)

004109998.td-b3lyp_6-31+g(d).gjf (generated)

004109998.td-b3lyp_6-31+g(d).firefly.inp (generated)

004109998.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004109998.mol 004109998.PUBCHEM 004109998.mol (via Jmol)
004110035.b3lyp_6-31g(d).inp

004110035.b3lyp_6-31g(d).qchem.inp (generated)

004110035.b3lyp_6-31g(d).gjf (generated)

004110035.b3lyp_6-31g(d).firefly.inp (generated)

004110035.b3lyp_6-31g(d).smash.inp (generated)

004110035.b3lyp_6-31g(d).nwchem.inp (generated) 004110035.b3lyp_6-31g(d).log.xz 004110035.td-b3lyp_6-31g+(d).inp 004110035.td-b3lyp_6-31g+(d).log.xz

004110035.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110035.td-b3lyp_6-31+g(d).gjf (generated)

004110035.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110035.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110035.mol 004110035.PUBCHEM 004110035.mol (via Jmol)
004110086.b3lyp_6-31g(d).inp

004110086.b3lyp_6-31g(d).qchem.inp (generated)

004110086.b3lyp_6-31g(d).gjf (generated)

004110086.b3lyp_6-31g(d).firefly.inp (generated)

004110086.b3lyp_6-31g(d).smash.inp (generated)

004110086.b3lyp_6-31g(d).nwchem.inp (generated) 004110086.b3lyp_6-31g(d).log.xz 004110086.td-b3lyp_6-31g+(d).inp 004110086.td-b3lyp_6-31g+(d).log.xz

004110086.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110086.td-b3lyp_6-31+g(d).gjf (generated)

004110086.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110086.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110086.mol 004110086.PUBCHEM 004110086.mol (via Jmol)
004110110.b3lyp_6-31g(d).inp

004110110.b3lyp_6-31g(d).qchem.inp (generated)

004110110.b3lyp_6-31g(d).gjf (generated)

004110110.b3lyp_6-31g(d).firefly.inp (generated)

004110110.b3lyp_6-31g(d).smash.inp (generated)

004110110.b3lyp_6-31g(d).nwchem.inp (generated) 004110110.b3lyp_6-31g(d).log.xz 004110110.mol 004110110.PUBCHEM 004110110.mol (via Jmol)
004110129.b3lyp_6-31g(d).inp

004110129.b3lyp_6-31g(d).qchem.inp (generated)

004110129.b3lyp_6-31g(d).gjf (generated)

004110129.b3lyp_6-31g(d).firefly.inp (generated)

004110129.b3lyp_6-31g(d).smash.inp (generated)

004110129.b3lyp_6-31g(d).nwchem.inp (generated) 004110129.b3lyp_6-31g(d).log.xz 004110129.td-b3lyp_6-31g+(d).inp 004110129.td-b3lyp_6-31g+(d).log.xz

004110129.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110129.td-b3lyp_6-31+g(d).gjf (generated)

004110129.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110129.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110129.mol 004110129.PUBCHEM 004110129.mol (via Jmol)
004110144.b3lyp_6-31g(d).inp

004110144.b3lyp_6-31g(d).qchem.inp (generated)

004110144.b3lyp_6-31g(d).gjf (generated)

004110144.b3lyp_6-31g(d).firefly.inp (generated)

004110144.b3lyp_6-31g(d).smash.inp (generated)

004110144.b3lyp_6-31g(d).nwchem.inp (generated) 004110144.b3lyp_6-31g(d).log.xz 004110144.td-b3lyp_6-31g+(d).inp 004110144.td-b3lyp_6-31g+(d).log.xz

004110144.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110144.td-b3lyp_6-31+g(d).gjf (generated)

004110144.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110144.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110144.mol 004110144.PUBCHEM 004110144.mol (via Jmol)
004110184.b3lyp_6-31g(d).inp

004110184.b3lyp_6-31g(d).qchem.inp (generated)

004110184.b3lyp_6-31g(d).gjf (generated)

004110184.b3lyp_6-31g(d).firefly.inp (generated)

004110184.b3lyp_6-31g(d).smash.inp (generated)

004110184.b3lyp_6-31g(d).nwchem.inp (generated) 004110184.b3lyp_6-31g(d).log.xz 004110184.mol 004110184.PUBCHEM 004110184.mol (via Jmol)
004110186.b3lyp_6-31g(d).inp

004110186.b3lyp_6-31g(d).qchem.inp (generated)

004110186.b3lyp_6-31g(d).gjf (generated)

004110186.b3lyp_6-31g(d).firefly.inp (generated)

004110186.b3lyp_6-31g(d).smash.inp (generated)

004110186.b3lyp_6-31g(d).nwchem.inp (generated) 004110186.b3lyp_6-31g(d).log.xz 004110186.mol 004110186.PUBCHEM 004110186.mol (via Jmol)
004110204.b3lyp_6-31g(d).inp

004110204.b3lyp_6-31g(d).qchem.inp (generated)

004110204.b3lyp_6-31g(d).gjf (generated)

004110204.b3lyp_6-31g(d).firefly.inp (generated)

004110204.b3lyp_6-31g(d).smash.inp (generated)

004110204.b3lyp_6-31g(d).nwchem.inp (generated) 004110204.b3lyp_6-31g(d).log.xz 004110204.td-b3lyp_6-31g+(d).inp 004110204.td-b3lyp_6-31g+(d).log.xz

004110204.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110204.td-b3lyp_6-31+g(d).gjf (generated)

004110204.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110204.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110204.mol 004110204.PUBCHEM 004110204.mol (via Jmol)
004110216.b3lyp_6-31g(d).inp

004110216.b3lyp_6-31g(d).qchem.inp (generated)

004110216.b3lyp_6-31g(d).gjf (generated)

004110216.b3lyp_6-31g(d).firefly.inp (generated)

004110216.b3lyp_6-31g(d).smash.inp (generated)

004110216.b3lyp_6-31g(d).nwchem.inp (generated) 004110216.b3lyp_6-31g(d).log.xz 004110216.td-b3lyp_6-31g+(d).inp 004110216.td-b3lyp_6-31g+(d).log.xz

004110216.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110216.td-b3lyp_6-31+g(d).gjf (generated)

004110216.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110216.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110216.mol 004110216.PUBCHEM 004110216.mol (via Jmol)
004110218.b3lyp_6-31g(d).inp

004110218.b3lyp_6-31g(d).qchem.inp (generated)

004110218.b3lyp_6-31g(d).gjf (generated)

004110218.b3lyp_6-31g(d).firefly.inp (generated)

004110218.b3lyp_6-31g(d).smash.inp (generated)

004110218.b3lyp_6-31g(d).nwchem.inp (generated) 004110218.b3lyp_6-31g(d).log.xz 004110218.td-b3lyp_6-31g+(d).inp 004110218.td-b3lyp_6-31g+(d).log.xz

004110218.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110218.td-b3lyp_6-31+g(d).gjf (generated)

004110218.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110218.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110218.mol 004110218.PUBCHEM 004110218.mol (via Jmol)
004110251.b3lyp_6-31g(d).inp

004110251.b3lyp_6-31g(d).qchem.inp (generated)

004110251.b3lyp_6-31g(d).gjf (generated)

004110251.b3lyp_6-31g(d).firefly.inp (generated)

004110251.b3lyp_6-31g(d).smash.inp (generated)

004110251.b3lyp_6-31g(d).nwchem.inp (generated) 004110251.b3lyp_6-31g(d).log.xz 004110251.td-b3lyp_6-31g+(d).inp 004110251.td-b3lyp_6-31g+(d).log.xz

004110251.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110251.td-b3lyp_6-31+g(d).gjf (generated)

004110251.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110251.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110251.mol 004110251.PUBCHEM 004110251.mol (via Jmol)
004110255.b3lyp_6-31g(d).inp

004110255.b3lyp_6-31g(d).qchem.inp (generated)

004110255.b3lyp_6-31g(d).gjf (generated)

004110255.b3lyp_6-31g(d).firefly.inp (generated)

004110255.b3lyp_6-31g(d).smash.inp (generated)

004110255.b3lyp_6-31g(d).nwchem.inp (generated) 004110255.b3lyp_6-31g(d).log.xz 004110255.td-b3lyp_6-31g+(d).inp 004110255.td-b3lyp_6-31g+(d).log.xz

004110255.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110255.td-b3lyp_6-31+g(d).gjf (generated)

004110255.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110255.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110255.mol 004110255.PUBCHEM 004110255.mol (via Jmol)
004110280.b3lyp_6-31g(d).inp

004110280.b3lyp_6-31g(d).qchem.inp (generated)

004110280.b3lyp_6-31g(d).gjf (generated)

004110280.b3lyp_6-31g(d).firefly.inp (generated)

004110280.b3lyp_6-31g(d).smash.inp (generated)

004110280.b3lyp_6-31g(d).nwchem.inp (generated) 004110280.b3lyp_6-31g(d).log.xz 004110280.td-b3lyp_6-31g+(d).inp 004110280.td-b3lyp_6-31g+(d).log.xz

004110280.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110280.td-b3lyp_6-31+g(d).gjf (generated)

004110280.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110280.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110280.mol 004110280.PUBCHEM 004110280.mol (via Jmol)
004110284.b3lyp_6-31g(d).inp

004110284.b3lyp_6-31g(d).qchem.inp (generated)

004110284.b3lyp_6-31g(d).gjf (generated)

004110284.b3lyp_6-31g(d).firefly.inp (generated)

004110284.b3lyp_6-31g(d).smash.inp (generated)

004110284.b3lyp_6-31g(d).nwchem.inp (generated) 004110284.b3lyp_6-31g(d).log.xz 004110284.td-b3lyp_6-31g+(d).inp 004110284.td-b3lyp_6-31g+(d).log.xz

004110284.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110284.td-b3lyp_6-31+g(d).gjf (generated)

004110284.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110284.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110284.mol 004110284.PUBCHEM 004110284.mol (via Jmol)
004110319.b3lyp_6-31g(d).inp

004110319.b3lyp_6-31g(d).qchem.inp (generated)

004110319.b3lyp_6-31g(d).gjf (generated)

004110319.b3lyp_6-31g(d).firefly.inp (generated)

004110319.b3lyp_6-31g(d).smash.inp (generated)

004110319.b3lyp_6-31g(d).nwchem.inp (generated) 004110319.b3lyp_6-31g(d).log.xz 004110319.td-b3lyp_6-31g+(d).inp 004110319.td-b3lyp_6-31g+(d).log.xz

004110319.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110319.td-b3lyp_6-31+g(d).gjf (generated)

004110319.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110319.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110319.mol 004110319.PUBCHEM 004110319.mol (via Jmol)
004110339.b3lyp_6-31g(d).inp

004110339.b3lyp_6-31g(d).qchem.inp (generated)

004110339.b3lyp_6-31g(d).gjf (generated)

004110339.b3lyp_6-31g(d).firefly.inp (generated)

004110339.b3lyp_6-31g(d).smash.inp (generated)

004110339.b3lyp_6-31g(d).nwchem.inp (generated) 004110339.b3lyp_6-31g(d).log.xz 004110339.td-b3lyp_6-31g+(d).inp 004110339.td-b3lyp_6-31g+(d).log.xz

004110339.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110339.td-b3lyp_6-31+g(d).gjf (generated)

004110339.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110339.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110339.mol 004110339.PUBCHEM 004110339.mol (via Jmol)
004110374.b3lyp_6-31g(d).inp

004110374.b3lyp_6-31g(d).qchem.inp (generated)

004110374.b3lyp_6-31g(d).gjf (generated)

004110374.b3lyp_6-31g(d).firefly.inp (generated)

004110374.b3lyp_6-31g(d).smash.inp (generated)

004110374.b3lyp_6-31g(d).nwchem.inp (generated) 004110374.b3lyp_6-31g(d).log.xz 004110374.td-b3lyp_6-31g+(d).inp 004110374.td-b3lyp_6-31g+(d).log.xz

004110374.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110374.td-b3lyp_6-31+g(d).gjf (generated)

004110374.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110374.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110374.mol 004110374.PUBCHEM 004110374.mol (via Jmol)
004110375.b3lyp_6-31g(d).inp

004110375.b3lyp_6-31g(d).qchem.inp (generated)

004110375.b3lyp_6-31g(d).gjf (generated)

004110375.b3lyp_6-31g(d).firefly.inp (generated)

004110375.b3lyp_6-31g(d).smash.inp (generated)

004110375.b3lyp_6-31g(d).nwchem.inp (generated) 004110375.b3lyp_6-31g(d).log.xz 004110375.td-b3lyp_6-31g+(d).inp 004110375.td-b3lyp_6-31g+(d).log.xz

004110375.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110375.td-b3lyp_6-31+g(d).gjf (generated)

004110375.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110375.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110375.mol 004110375.PUBCHEM 004110375.mol (via Jmol)
004110380.b3lyp_6-31g(d).inp

004110380.b3lyp_6-31g(d).qchem.inp (generated)

004110380.b3lyp_6-31g(d).gjf (generated)

004110380.b3lyp_6-31g(d).firefly.inp (generated)

004110380.b3lyp_6-31g(d).smash.inp (generated)

004110380.b3lyp_6-31g(d).nwchem.inp (generated) 004110380.b3lyp_6-31g(d).log.xz 004110380.td-b3lyp_6-31g+(d).inp 004110380.td-b3lyp_6-31g+(d).log.xz

004110380.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110380.td-b3lyp_6-31+g(d).gjf (generated)

004110380.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110380.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110380.mol 004110380.PUBCHEM 004110380.mol (via Jmol)
004110398.b3lyp_6-31g(d).inp

004110398.b3lyp_6-31g(d).qchem.inp (generated)

004110398.b3lyp_6-31g(d).gjf (generated)

004110398.b3lyp_6-31g(d).firefly.inp (generated)

004110398.b3lyp_6-31g(d).smash.inp (generated)

004110398.b3lyp_6-31g(d).nwchem.inp (generated) 004110398.b3lyp_6-31g(d).log.xz 004110398.td-b3lyp_6-31g+(d).inp 004110398.td-b3lyp_6-31g+(d).log.xz

004110398.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110398.td-b3lyp_6-31+g(d).gjf (generated)

004110398.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110398.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110398.mol 004110398.PUBCHEM 004110398.mol (via Jmol)
004110437.b3lyp_6-31g(d).inp

004110437.b3lyp_6-31g(d).qchem.inp (generated)

004110437.b3lyp_6-31g(d).gjf (generated)

004110437.b3lyp_6-31g(d).firefly.inp (generated)

004110437.b3lyp_6-31g(d).smash.inp (generated)

004110437.b3lyp_6-31g(d).nwchem.inp (generated) 004110437.b3lyp_6-31g(d).log.xz 004110437.td-b3lyp_6-31g+(d).inp 004110437.td-b3lyp_6-31g+(d).log.xz

004110437.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110437.td-b3lyp_6-31+g(d).gjf (generated)

004110437.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110437.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110437.mol 004110437.PUBCHEM 004110437.mol (via Jmol)
004110465.b3lyp_6-31g(d).inp

004110465.b3lyp_6-31g(d).qchem.inp (generated)

004110465.b3lyp_6-31g(d).gjf (generated)

004110465.b3lyp_6-31g(d).firefly.inp (generated)

004110465.b3lyp_6-31g(d).smash.inp (generated)

004110465.b3lyp_6-31g(d).nwchem.inp (generated) 004110465.b3lyp_6-31g(d).log.xz 004110465.td-b3lyp_6-31g+(d).inp 004110465.td-b3lyp_6-31g+(d).log.xz

004110465.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110465.td-b3lyp_6-31+g(d).gjf (generated)

004110465.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110465.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110465.mol 004110465.PUBCHEM 004110465.mol (via Jmol)
004110502.b3lyp_6-31g(d).inp

004110502.b3lyp_6-31g(d).qchem.inp (generated)

004110502.b3lyp_6-31g(d).gjf (generated)

004110502.b3lyp_6-31g(d).firefly.inp (generated)

004110502.b3lyp_6-31g(d).smash.inp (generated)

004110502.b3lyp_6-31g(d).nwchem.inp (generated) 004110502.b3lyp_6-31g(d).log.xz 004110502.mol 004110502.PUBCHEM 004110502.mol (via Jmol)
004110565.b3lyp_6-31g(d).inp

004110565.b3lyp_6-31g(d).qchem.inp (generated)

004110565.b3lyp_6-31g(d).gjf (generated)

004110565.b3lyp_6-31g(d).firefly.inp (generated)

004110565.b3lyp_6-31g(d).smash.inp (generated)

004110565.b3lyp_6-31g(d).nwchem.inp (generated) 004110565.b3lyp_6-31g(d).log.xz 004110565.td-b3lyp_6-31g+(d).inp 004110565.td-b3lyp_6-31g+(d).log.xz

004110565.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110565.td-b3lyp_6-31+g(d).gjf (generated)

004110565.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110565.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110565.mol 004110565.PUBCHEM 004110565.mol (via Jmol)
004110658.b3lyp_6-31g(d).inp

004110658.b3lyp_6-31g(d).qchem.inp (generated)

004110658.b3lyp_6-31g(d).gjf (generated)

004110658.b3lyp_6-31g(d).firefly.inp (generated)

004110658.b3lyp_6-31g(d).smash.inp (generated)

004110658.b3lyp_6-31g(d).nwchem.inp (generated) 004110658.b3lyp_6-31g(d).log.xz 004110658.td-b3lyp_6-31g+(d).inp 004110658.td-b3lyp_6-31g+(d).log.xz

004110658.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110658.td-b3lyp_6-31+g(d).gjf (generated)

004110658.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110658.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110658.mol 004110658.PUBCHEM 004110658.mol (via Jmol)
004110668.b3lyp_6-31g(d).inp

004110668.b3lyp_6-31g(d).qchem.inp (generated)

004110668.b3lyp_6-31g(d).gjf (generated)

004110668.b3lyp_6-31g(d).firefly.inp (generated)

004110668.b3lyp_6-31g(d).smash.inp (generated)

004110668.b3lyp_6-31g(d).nwchem.inp (generated) 004110668.b3lyp_6-31g(d).log.xz 004110668.td-b3lyp_6-31g+(d).inp 004110668.td-b3lyp_6-31g+(d).log.xz

004110668.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110668.td-b3lyp_6-31+g(d).gjf (generated)

004110668.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110668.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110668.mol 004110668.PUBCHEM 004110668.mol (via Jmol)
004110669.b3lyp_6-31g(d).inp

004110669.b3lyp_6-31g(d).qchem.inp (generated)

004110669.b3lyp_6-31g(d).gjf (generated)

004110669.b3lyp_6-31g(d).firefly.inp (generated)

004110669.b3lyp_6-31g(d).smash.inp (generated)

004110669.b3lyp_6-31g(d).nwchem.inp (generated) 004110669.b3lyp_6-31g(d).log.xz 004110669.td-b3lyp_6-31g+(d).inp 004110669.td-b3lyp_6-31g+(d).log.xz

004110669.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110669.td-b3lyp_6-31+g(d).gjf (generated)

004110669.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110669.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110669.mol 004110669.PUBCHEM 004110669.mol (via Jmol)
004110679.b3lyp_6-31g(d).inp

004110679.b3lyp_6-31g(d).qchem.inp (generated)

004110679.b3lyp_6-31g(d).gjf (generated)

004110679.b3lyp_6-31g(d).firefly.inp (generated)

004110679.b3lyp_6-31g(d).smash.inp (generated)

004110679.b3lyp_6-31g(d).nwchem.inp (generated) 004110679.b3lyp_6-31g(d).log.xz 004110679.td-b3lyp_6-31g+(d).inp 004110679.td-b3lyp_6-31g+(d).log.xz

004110679.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110679.td-b3lyp_6-31+g(d).gjf (generated)

004110679.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110679.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110679.mol 004110679.PUBCHEM 004110679.mol (via Jmol)
004110684.b3lyp_6-31g(d).inp

004110684.b3lyp_6-31g(d).qchem.inp (generated)

004110684.b3lyp_6-31g(d).gjf (generated)

004110684.b3lyp_6-31g(d).firefly.inp (generated)

004110684.b3lyp_6-31g(d).smash.inp (generated)

004110684.b3lyp_6-31g(d).nwchem.inp (generated) 004110684.b3lyp_6-31g(d).log.xz 004110684.td-b3lyp_6-31g+(d).inp 004110684.td-b3lyp_6-31g+(d).log.xz

004110684.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110684.td-b3lyp_6-31+g(d).gjf (generated)

004110684.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110684.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110684.mol 004110684.PUBCHEM 004110684.mol (via Jmol)
004110710.b3lyp_6-31g(d).inp

004110710.b3lyp_6-31g(d).qchem.inp (generated)

004110710.b3lyp_6-31g(d).gjf (generated)

004110710.b3lyp_6-31g(d).firefly.inp (generated)

004110710.b3lyp_6-31g(d).smash.inp (generated)

004110710.b3lyp_6-31g(d).nwchem.inp (generated) 004110710.b3lyp_6-31g(d).log.xz 004110710.td-b3lyp_6-31g+(d).inp 004110710.td-b3lyp_6-31g+(d).log.xz

004110710.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110710.td-b3lyp_6-31+g(d).gjf (generated)

004110710.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110710.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110710.mol 004110710.PUBCHEM 004110710.mol (via Jmol)
004110712.b3lyp_6-31g(d).inp

004110712.b3lyp_6-31g(d).qchem.inp (generated)

004110712.b3lyp_6-31g(d).gjf (generated)

004110712.b3lyp_6-31g(d).firefly.inp (generated)

004110712.b3lyp_6-31g(d).smash.inp (generated)

004110712.b3lyp_6-31g(d).nwchem.inp (generated) 004110712.b3lyp_6-31g(d).log.xz 004110712.td-b3lyp_6-31g+(d).inp 004110712.td-b3lyp_6-31g+(d).log.xz

004110712.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110712.td-b3lyp_6-31+g(d).gjf (generated)

004110712.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110712.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110712.mol 004110712.PUBCHEM 004110712.mol (via Jmol)
004110785.b3lyp_6-31g(d).inp

004110785.b3lyp_6-31g(d).qchem.inp (generated)

004110785.b3lyp_6-31g(d).gjf (generated)

004110785.b3lyp_6-31g(d).firefly.inp (generated)

004110785.b3lyp_6-31g(d).smash.inp (generated)

004110785.b3lyp_6-31g(d).nwchem.inp (generated) 004110785.b3lyp_6-31g(d).log.xz 004110785.td-b3lyp_6-31g+(d).inp 004110785.td-b3lyp_6-31g+(d).log.xz

004110785.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110785.td-b3lyp_6-31+g(d).gjf (generated)

004110785.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110785.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110785.mol 004110785.PUBCHEM 004110785.mol (via Jmol)
004110919.b3lyp_6-31g(d).inp

004110919.b3lyp_6-31g(d).qchem.inp (generated)

004110919.b3lyp_6-31g(d).gjf (generated)

004110919.b3lyp_6-31g(d).firefly.inp (generated)

004110919.b3lyp_6-31g(d).smash.inp (generated)

004110919.b3lyp_6-31g(d).nwchem.inp (generated) 004110919.b3lyp_6-31g(d).log.xz 004110919.td-b3lyp_6-31g+(d).inp 004110919.td-b3lyp_6-31g+(d).log.xz

004110919.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110919.td-b3lyp_6-31+g(d).gjf (generated)

004110919.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110919.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110919.mol 004110919.PUBCHEM 004110919.mol (via Jmol)
004110949.b3lyp_6-31g(d).inp

004110949.b3lyp_6-31g(d).qchem.inp (generated)

004110949.b3lyp_6-31g(d).gjf (generated)

004110949.b3lyp_6-31g(d).firefly.inp (generated)

004110949.b3lyp_6-31g(d).smash.inp (generated)

004110949.b3lyp_6-31g(d).nwchem.inp (generated) 004110949.b3lyp_6-31g(d).log.xz 004110949.td-b3lyp_6-31g+(d).inp 004110949.td-b3lyp_6-31g+(d).log.xz

004110949.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110949.td-b3lyp_6-31+g(d).gjf (generated)

004110949.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110949.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110949.mol 004110949.PUBCHEM 004110949.mol (via Jmol)
004110964.b3lyp_6-31g(d).inp

004110964.b3lyp_6-31g(d).qchem.inp (generated)

004110964.b3lyp_6-31g(d).gjf (generated)

004110964.b3lyp_6-31g(d).firefly.inp (generated)

004110964.b3lyp_6-31g(d).smash.inp (generated)

004110964.b3lyp_6-31g(d).nwchem.inp (generated) 004110964.b3lyp_6-31g(d).log.xz 004110964.td-b3lyp_6-31g+(d).inp 004110964.td-b3lyp_6-31g+(d).log.xz

004110964.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110964.td-b3lyp_6-31+g(d).gjf (generated)

004110964.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110964.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110964.mol 004110964.PUBCHEM 004110964.mol (via Jmol)
004110975.b3lyp_6-31g(d).inp

004110975.b3lyp_6-31g(d).qchem.inp (generated)

004110975.b3lyp_6-31g(d).gjf (generated)

004110975.b3lyp_6-31g(d).firefly.inp (generated)

004110975.b3lyp_6-31g(d).smash.inp (generated)

004110975.b3lyp_6-31g(d).nwchem.inp (generated) 004110975.b3lyp_6-31g(d).log.xz 004110975.td-b3lyp_6-31g+(d).inp 004110975.td-b3lyp_6-31g+(d).log.xz

004110975.td-b3lyp_6-31+g(d).qchem.inp (generated)

004110975.td-b3lyp_6-31+g(d).gjf (generated)

004110975.td-b3lyp_6-31+g(d).firefly.inp (generated)

004110975.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004110975.mol 004110975.PUBCHEM 004110975.mol (via Jmol)
004111095.b3lyp_6-31g(d).inp

004111095.b3lyp_6-31g(d).qchem.inp (generated)

004111095.b3lyp_6-31g(d).gjf (generated)

004111095.b3lyp_6-31g(d).firefly.inp (generated)

004111095.b3lyp_6-31g(d).smash.inp (generated)

004111095.b3lyp_6-31g(d).nwchem.inp (generated) 004111095.b3lyp_6-31g(d).log.xz 004111095.mol 004111095.PUBCHEM 004111095.mol (via Jmol)
004111098.b3lyp_6-31g(d).inp

004111098.b3lyp_6-31g(d).qchem.inp (generated)

004111098.b3lyp_6-31g(d).gjf (generated)

004111098.b3lyp_6-31g(d).firefly.inp (generated)

004111098.b3lyp_6-31g(d).smash.inp (generated)

004111098.b3lyp_6-31g(d).nwchem.inp (generated) 004111098.b3lyp_6-31g(d).log.xz 004111098.td-b3lyp_6-31g+(d).inp 004111098.td-b3lyp_6-31g+(d).log.xz

004111098.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111098.td-b3lyp_6-31+g(d).gjf (generated)

004111098.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111098.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111098.mol 004111098.PUBCHEM 004111098.mol (via Jmol)
004111099.b3lyp_6-31g(d).inp

004111099.b3lyp_6-31g(d).qchem.inp (generated)

004111099.b3lyp_6-31g(d).gjf (generated)

004111099.b3lyp_6-31g(d).firefly.inp (generated)

004111099.b3lyp_6-31g(d).smash.inp (generated)

004111099.b3lyp_6-31g(d).nwchem.inp (generated) 004111099.b3lyp_6-31g(d).log.xz 004111099.td-b3lyp_6-31g+(d).inp 004111099.td-b3lyp_6-31g+(d).log.xz

004111099.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111099.td-b3lyp_6-31+g(d).gjf (generated)

004111099.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111099.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111099.mol 004111099.PUBCHEM 004111099.mol (via Jmol)
004111106.b3lyp_6-31g(d).inp

004111106.b3lyp_6-31g(d).qchem.inp (generated)

004111106.b3lyp_6-31g(d).gjf (generated)

004111106.b3lyp_6-31g(d).firefly.inp (generated)

004111106.b3lyp_6-31g(d).smash.inp (generated)

004111106.b3lyp_6-31g(d).nwchem.inp (generated) 004111106.b3lyp_6-31g(d).log.xz 004111106.mol 004111106.PUBCHEM 004111106.mol (via Jmol)
004111109.b3lyp_6-31g(d).inp

004111109.b3lyp_6-31g(d).qchem.inp (generated)

004111109.b3lyp_6-31g(d).gjf (generated)

004111109.b3lyp_6-31g(d).firefly.inp (generated)

004111109.b3lyp_6-31g(d).smash.inp (generated)

004111109.b3lyp_6-31g(d).nwchem.inp (generated) 004111109.b3lyp_6-31g(d).log.xz 004111109.td-b3lyp_6-31g+(d).inp 004111109.td-b3lyp_6-31g+(d).log.xz

004111109.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111109.td-b3lyp_6-31+g(d).gjf (generated)

004111109.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111109.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111109.mol 004111109.PUBCHEM 004111109.mol (via Jmol)
004111110.b3lyp_6-31g(d).inp

004111110.b3lyp_6-31g(d).qchem.inp (generated)

004111110.b3lyp_6-31g(d).gjf (generated)

004111110.b3lyp_6-31g(d).firefly.inp (generated)

004111110.b3lyp_6-31g(d).smash.inp (generated)

004111110.b3lyp_6-31g(d).nwchem.inp (generated) 004111110.b3lyp_6-31g(d).log.xz 004111110.td-b3lyp_6-31g+(d).inp 004111110.td-b3lyp_6-31g+(d).log.xz

004111110.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111110.td-b3lyp_6-31+g(d).gjf (generated)

004111110.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111110.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111110.mol 004111110.PUBCHEM 004111110.mol (via Jmol)
004111111.b3lyp_6-31g(d).inp

004111111.b3lyp_6-31g(d).qchem.inp (generated)

004111111.b3lyp_6-31g(d).gjf (generated)

004111111.b3lyp_6-31g(d).firefly.inp (generated)

004111111.b3lyp_6-31g(d).smash.inp (generated)

004111111.b3lyp_6-31g(d).nwchem.inp (generated) 004111111.b3lyp_6-31g(d).log.xz 004111111.td-b3lyp_6-31g+(d).inp 004111111.td-b3lyp_6-31g+(d).log.xz

004111111.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111111.td-b3lyp_6-31+g(d).gjf (generated)

004111111.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111111.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111111.mol 004111111.PUBCHEM 004111111.mol (via Jmol)
004111131.b3lyp_6-31g(d).inp

004111131.b3lyp_6-31g(d).qchem.inp (generated)

004111131.b3lyp_6-31g(d).gjf (generated)

004111131.b3lyp_6-31g(d).firefly.inp (generated)

004111131.b3lyp_6-31g(d).smash.inp (generated)

004111131.b3lyp_6-31g(d).nwchem.inp (generated) 004111131.b3lyp_6-31g(d).log.xz 004111131.mol 004111131.PUBCHEM 004111131.mol (via Jmol)
004111143.b3lyp_6-31g(d).inp

004111143.b3lyp_6-31g(d).qchem.inp (generated)

004111143.b3lyp_6-31g(d).gjf (generated)

004111143.b3lyp_6-31g(d).firefly.inp (generated)

004111143.b3lyp_6-31g(d).smash.inp (generated)

004111143.b3lyp_6-31g(d).nwchem.inp (generated) 004111143.b3lyp_6-31g(d).log.xz 004111143.td-b3lyp_6-31g+(d).inp 004111143.td-b3lyp_6-31g+(d).log.xz

004111143.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111143.td-b3lyp_6-31+g(d).gjf (generated)

004111143.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111143.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111143.mol 004111143.PUBCHEM 004111143.mol (via Jmol)
004111195.b3lyp_6-31g(d).inp

004111195.b3lyp_6-31g(d).qchem.inp (generated)

004111195.b3lyp_6-31g(d).gjf (generated)

004111195.b3lyp_6-31g(d).firefly.inp (generated)

004111195.b3lyp_6-31g(d).smash.inp (generated)

004111195.b3lyp_6-31g(d).nwchem.inp (generated) 004111195.b3lyp_6-31g(d).log.xz 004111195.td-b3lyp_6-31g+(d).inp 004111195.td-b3lyp_6-31g+(d).log.xz

004111195.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111195.td-b3lyp_6-31+g(d).gjf (generated)

004111195.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111195.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111195.mol 004111195.PUBCHEM 004111195.mol (via Jmol)
004111215.b3lyp_6-31g(d).inp

004111215.b3lyp_6-31g(d).qchem.inp (generated)

004111215.b3lyp_6-31g(d).gjf (generated)

004111215.b3lyp_6-31g(d).firefly.inp (generated)

004111215.b3lyp_6-31g(d).smash.inp (generated)

004111215.b3lyp_6-31g(d).nwchem.inp (generated) 004111215.b3lyp_6-31g(d).log.xz 004111215.td-b3lyp_6-31g+(d).inp 004111215.td-b3lyp_6-31g+(d).log.xz

004111215.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111215.td-b3lyp_6-31+g(d).gjf (generated)

004111215.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111215.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111215.mol 004111215.PUBCHEM 004111215.mol (via Jmol)
004111249.b3lyp_6-31g(d).inp

004111249.b3lyp_6-31g(d).qchem.inp (generated)

004111249.b3lyp_6-31g(d).gjf (generated)

004111249.b3lyp_6-31g(d).firefly.inp (generated)

004111249.b3lyp_6-31g(d).smash.inp (generated)

004111249.b3lyp_6-31g(d).nwchem.inp (generated) 004111249.b3lyp_6-31g(d).log.xz 004111249.td-b3lyp_6-31g+(d).inp 004111249.td-b3lyp_6-31g+(d).log.xz

004111249.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111249.td-b3lyp_6-31+g(d).gjf (generated)

004111249.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111249.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111249.mol 004111249.PUBCHEM 004111249.mol (via Jmol)
004111260.b3lyp_6-31g(d).inp

004111260.b3lyp_6-31g(d).qchem.inp (generated)

004111260.b3lyp_6-31g(d).gjf (generated)

004111260.b3lyp_6-31g(d).firefly.inp (generated)

004111260.b3lyp_6-31g(d).smash.inp (generated)

004111260.b3lyp_6-31g(d).nwchem.inp (generated) 004111260.b3lyp_6-31g(d).log.xz 004111260.td-b3lyp_6-31g+(d).inp 004111260.td-b3lyp_6-31g+(d).log.xz

004111260.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111260.td-b3lyp_6-31+g(d).gjf (generated)

004111260.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111260.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111260.mol 004111260.PUBCHEM 004111260.mol (via Jmol)
004111267.b3lyp_6-31g(d).inp

004111267.b3lyp_6-31g(d).qchem.inp (generated)

004111267.b3lyp_6-31g(d).gjf (generated)

004111267.b3lyp_6-31g(d).firefly.inp (generated)

004111267.b3lyp_6-31g(d).smash.inp (generated)

004111267.b3lyp_6-31g(d).nwchem.inp (generated) 004111267.b3lyp_6-31g(d).log.xz 004111267.td-b3lyp_6-31g+(d).inp 004111267.td-b3lyp_6-31g+(d).log.xz

004111267.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111267.td-b3lyp_6-31+g(d).gjf (generated)

004111267.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111267.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111267.mol 004111267.PUBCHEM 004111267.mol (via Jmol)
004111288.b3lyp_6-31g(d).inp

004111288.b3lyp_6-31g(d).qchem.inp (generated)

004111288.b3lyp_6-31g(d).gjf (generated)

004111288.b3lyp_6-31g(d).firefly.inp (generated)

004111288.b3lyp_6-31g(d).smash.inp (generated)

004111288.b3lyp_6-31g(d).nwchem.inp (generated) 004111288.b3lyp_6-31g(d).log.xz 004111288.td-b3lyp_6-31g+(d).inp 004111288.td-b3lyp_6-31g+(d).log.xz

004111288.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111288.td-b3lyp_6-31+g(d).gjf (generated)

004111288.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111288.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111288.mol 004111288.PUBCHEM 004111288.mol (via Jmol)
004111298.b3lyp_6-31g(d).inp

004111298.b3lyp_6-31g(d).qchem.inp (generated)

004111298.b3lyp_6-31g(d).gjf (generated)

004111298.b3lyp_6-31g(d).firefly.inp (generated)

004111298.b3lyp_6-31g(d).smash.inp (generated)

004111298.b3lyp_6-31g(d).nwchem.inp (generated) 004111298.b3lyp_6-31g(d).log.xz 004111298.td-b3lyp_6-31g+(d).inp 004111298.td-b3lyp_6-31g+(d).log.xz

004111298.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111298.td-b3lyp_6-31+g(d).gjf (generated)

004111298.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111298.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111298.mol 004111298.PUBCHEM 004111298.mol (via Jmol)
004111323.b3lyp_6-31g(d).inp

004111323.b3lyp_6-31g(d).qchem.inp (generated)

004111323.b3lyp_6-31g(d).gjf (generated)

004111323.b3lyp_6-31g(d).firefly.inp (generated)

004111323.b3lyp_6-31g(d).smash.inp (generated)

004111323.b3lyp_6-31g(d).nwchem.inp (generated) 004111323.b3lyp_6-31g(d).log.xz 004111323.td-b3lyp_6-31g+(d).inp 004111323.td-b3lyp_6-31g+(d).log.xz

004111323.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111323.td-b3lyp_6-31+g(d).gjf (generated)

004111323.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111323.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111323.mol 004111323.PUBCHEM 004111323.mol (via Jmol)
004111324.b3lyp_6-31g(d).inp

004111324.b3lyp_6-31g(d).qchem.inp (generated)

004111324.b3lyp_6-31g(d).gjf (generated)

004111324.b3lyp_6-31g(d).firefly.inp (generated)

004111324.b3lyp_6-31g(d).smash.inp (generated)

004111324.b3lyp_6-31g(d).nwchem.inp (generated) 004111324.b3lyp_6-31g(d).log.xz 004111324.td-b3lyp_6-31g+(d).inp 004111324.td-b3lyp_6-31g+(d).log.xz

004111324.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111324.td-b3lyp_6-31+g(d).gjf (generated)

004111324.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111324.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111324.mol 004111324.PUBCHEM 004111324.mol (via Jmol)
004111363.b3lyp_6-31g(d).inp

004111363.b3lyp_6-31g(d).qchem.inp (generated)

004111363.b3lyp_6-31g(d).gjf (generated)

004111363.b3lyp_6-31g(d).firefly.inp (generated)

004111363.b3lyp_6-31g(d).smash.inp (generated)

004111363.b3lyp_6-31g(d).nwchem.inp (generated) 004111363.b3lyp_6-31g(d).log.xz 004111363.td-b3lyp_6-31g+(d).inp 004111363.td-b3lyp_6-31g+(d).log.xz

004111363.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111363.td-b3lyp_6-31+g(d).gjf (generated)

004111363.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111363.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111363.mol 004111363.PUBCHEM 004111363.mol (via Jmol)
004111365.b3lyp_6-31g(d).inp

004111365.b3lyp_6-31g(d).qchem.inp (generated)

004111365.b3lyp_6-31g(d).gjf (generated)

004111365.b3lyp_6-31g(d).firefly.inp (generated)

004111365.b3lyp_6-31g(d).smash.inp (generated)

004111365.b3lyp_6-31g(d).nwchem.inp (generated) 004111365.b3lyp_6-31g(d).log.xz 004111365.mol 004111365.PUBCHEM 004111365.mol (via Jmol)
004111425.b3lyp_6-31g(d).inp

004111425.b3lyp_6-31g(d).qchem.inp (generated)

004111425.b3lyp_6-31g(d).gjf (generated)

004111425.b3lyp_6-31g(d).firefly.inp (generated)

004111425.b3lyp_6-31g(d).smash.inp (generated)

004111425.b3lyp_6-31g(d).nwchem.inp (generated) 004111425.b3lyp_6-31g(d).log.xz 004111425.td-b3lyp_6-31g+(d).inp 004111425.td-b3lyp_6-31g+(d).log.xz

004111425.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111425.td-b3lyp_6-31+g(d).gjf (generated)

004111425.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111425.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111425.mol 004111425.PUBCHEM 004111425.mol (via Jmol)
004111448.b3lyp_6-31g(d).inp

004111448.b3lyp_6-31g(d).qchem.inp (generated)

004111448.b3lyp_6-31g(d).gjf (generated)

004111448.b3lyp_6-31g(d).firefly.inp (generated)

004111448.b3lyp_6-31g(d).smash.inp (generated)

004111448.b3lyp_6-31g(d).nwchem.inp (generated) 004111448.b3lyp_6-31g(d).log.xz 004111448.td-b3lyp_6-31g+(d).inp 004111448.td-b3lyp_6-31g+(d).log.xz

004111448.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111448.td-b3lyp_6-31+g(d).gjf (generated)

004111448.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111448.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111448.mol 004111448.PUBCHEM 004111448.mol (via Jmol)
004111451.b3lyp_6-31g(d).inp

004111451.b3lyp_6-31g(d).qchem.inp (generated)

004111451.b3lyp_6-31g(d).gjf (generated)

004111451.b3lyp_6-31g(d).firefly.inp (generated)

004111451.b3lyp_6-31g(d).smash.inp (generated)

004111451.b3lyp_6-31g(d).nwchem.inp (generated) 004111451.b3lyp_6-31g(d).log.xz 004111451.mol 004111451.PUBCHEM 004111451.mol (via Jmol)
004111453.b3lyp_6-31g(d).inp

004111453.b3lyp_6-31g(d).qchem.inp (generated)

004111453.b3lyp_6-31g(d).gjf (generated)

004111453.b3lyp_6-31g(d).firefly.inp (generated)

004111453.b3lyp_6-31g(d).smash.inp (generated)

004111453.b3lyp_6-31g(d).nwchem.inp (generated) 004111453.b3lyp_6-31g(d).log.xz 004111453.td-b3lyp_6-31g+(d).inp 004111453.td-b3lyp_6-31g+(d).log.xz

004111453.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111453.td-b3lyp_6-31+g(d).gjf (generated)

004111453.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111453.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111453.mol 004111453.PUBCHEM 004111453.mol (via Jmol)
004111498.b3lyp_6-31g(d).inp

004111498.b3lyp_6-31g(d).qchem.inp (generated)

004111498.b3lyp_6-31g(d).gjf (generated)

004111498.b3lyp_6-31g(d).firefly.inp (generated)

004111498.b3lyp_6-31g(d).smash.inp (generated)

004111498.b3lyp_6-31g(d).nwchem.inp (generated) 004111498.b3lyp_6-31g(d).log.xz 004111498.td-b3lyp_6-31g+(d).inp 004111498.td-b3lyp_6-31g+(d).log.xz

004111498.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111498.td-b3lyp_6-31+g(d).gjf (generated)

004111498.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111498.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111498.mol 004111498.PUBCHEM 004111498.mol (via Jmol)
004111521.b3lyp_6-31g(d).inp

004111521.b3lyp_6-31g(d).qchem.inp (generated)

004111521.b3lyp_6-31g(d).gjf (generated)

004111521.b3lyp_6-31g(d).firefly.inp (generated)

004111521.b3lyp_6-31g(d).smash.inp (generated)

004111521.b3lyp_6-31g(d).nwchem.inp (generated) 004111521.b3lyp_6-31g(d).log.xz 004111521.td-b3lyp_6-31g+(d).inp 004111521.td-b3lyp_6-31g+(d).log.xz

004111521.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111521.td-b3lyp_6-31+g(d).gjf (generated)

004111521.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111521.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111521.mol 004111521.PUBCHEM 004111521.mol (via Jmol)
004111532.b3lyp_6-31g(d).inp

004111532.b3lyp_6-31g(d).qchem.inp (generated)

004111532.b3lyp_6-31g(d).gjf (generated)

004111532.b3lyp_6-31g(d).firefly.inp (generated)

004111532.b3lyp_6-31g(d).smash.inp (generated)

004111532.b3lyp_6-31g(d).nwchem.inp (generated) 004111532.b3lyp_6-31g(d).log.xz 004111532.mol 004111532.PUBCHEM 004111532.mol (via Jmol)
004111533.b3lyp_6-31g(d).inp

004111533.b3lyp_6-31g(d).qchem.inp (generated)

004111533.b3lyp_6-31g(d).gjf (generated)

004111533.b3lyp_6-31g(d).firefly.inp (generated)

004111533.b3lyp_6-31g(d).smash.inp (generated)

004111533.b3lyp_6-31g(d).nwchem.inp (generated) 004111533.b3lyp_6-31g(d).log.xz 004111533.td-b3lyp_6-31g+(d).inp 004111533.td-b3lyp_6-31g+(d).log.xz

004111533.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111533.td-b3lyp_6-31+g(d).gjf (generated)

004111533.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111533.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111533.mol 004111533.PUBCHEM 004111533.mol (via Jmol)
004111541.b3lyp_6-31g(d).inp

004111541.b3lyp_6-31g(d).qchem.inp (generated)

004111541.b3lyp_6-31g(d).gjf (generated)

004111541.b3lyp_6-31g(d).firefly.inp (generated)

004111541.b3lyp_6-31g(d).smash.inp (generated)

004111541.b3lyp_6-31g(d).nwchem.inp (generated) 004111541.b3lyp_6-31g(d).log.xz 004111541.td-b3lyp_6-31g+(d).inp 004111541.td-b3lyp_6-31g+(d).log.xz

004111541.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111541.td-b3lyp_6-31+g(d).gjf (generated)

004111541.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111541.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111541.mol 004111541.PUBCHEM 004111541.mol (via Jmol)
004111576.b3lyp_6-31g(d).inp

004111576.b3lyp_6-31g(d).qchem.inp (generated)

004111576.b3lyp_6-31g(d).gjf (generated)

004111576.b3lyp_6-31g(d).firefly.inp (generated)

004111576.b3lyp_6-31g(d).smash.inp (generated)

004111576.b3lyp_6-31g(d).nwchem.inp (generated) 004111576.b3lyp_6-31g(d).log.xz 004111576.mol 004111576.PUBCHEM 004111576.mol (via Jmol)
004111595.b3lyp_6-31g(d).inp

004111595.b3lyp_6-31g(d).qchem.inp (generated)

004111595.b3lyp_6-31g(d).gjf (generated)

004111595.b3lyp_6-31g(d).firefly.inp (generated)

004111595.b3lyp_6-31g(d).smash.inp (generated)

004111595.b3lyp_6-31g(d).nwchem.inp (generated) 004111595.b3lyp_6-31g(d).log.xz 004111595.td-b3lyp_6-31g+(d).inp 004111595.td-b3lyp_6-31g+(d).log.xz

004111595.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111595.td-b3lyp_6-31+g(d).gjf (generated)

004111595.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111595.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111595.mol 004111595.PUBCHEM 004111595.mol (via Jmol)
004111639.b3lyp_6-31g(d).inp

004111639.b3lyp_6-31g(d).qchem.inp (generated)

004111639.b3lyp_6-31g(d).gjf (generated)

004111639.b3lyp_6-31g(d).firefly.inp (generated)

004111639.b3lyp_6-31g(d).smash.inp (generated)

004111639.b3lyp_6-31g(d).nwchem.inp (generated) 004111639.b3lyp_6-31g(d).log.xz 004111639.td-b3lyp_6-31g+(d).inp 004111639.td-b3lyp_6-31g+(d).log.xz

004111639.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111639.td-b3lyp_6-31+g(d).gjf (generated)

004111639.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111639.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111639.mol 004111639.PUBCHEM 004111639.mol (via Jmol)
004111642.b3lyp_6-31g(d).inp

004111642.b3lyp_6-31g(d).qchem.inp (generated)

004111642.b3lyp_6-31g(d).gjf (generated)

004111642.b3lyp_6-31g(d).firefly.inp (generated)

004111642.b3lyp_6-31g(d).smash.inp (generated)

004111642.b3lyp_6-31g(d).nwchem.inp (generated) 004111642.b3lyp_6-31g(d).log.xz 004111642.td-b3lyp_6-31g+(d).inp 004111642.td-b3lyp_6-31g+(d).log.xz

004111642.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111642.td-b3lyp_6-31+g(d).gjf (generated)

004111642.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111642.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111642.mol 004111642.PUBCHEM 004111642.mol (via Jmol)
004111647.b3lyp_6-31g(d).inp

004111647.b3lyp_6-31g(d).qchem.inp (generated)

004111647.b3lyp_6-31g(d).gjf (generated)

004111647.b3lyp_6-31g(d).firefly.inp (generated)

004111647.b3lyp_6-31g(d).smash.inp (generated)

004111647.b3lyp_6-31g(d).nwchem.inp (generated) 004111647.b3lyp_6-31g(d).log.xz 004111647.td-b3lyp_6-31g+(d).inp 004111647.td-b3lyp_6-31g+(d).log.xz

004111647.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111647.td-b3lyp_6-31+g(d).gjf (generated)

004111647.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111647.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111647.mol 004111647.PUBCHEM 004111647.mol (via Jmol)
004111666.b3lyp_6-31g(d).inp

004111666.b3lyp_6-31g(d).qchem.inp (generated)

004111666.b3lyp_6-31g(d).gjf (generated)

004111666.b3lyp_6-31g(d).firefly.inp (generated)

004111666.b3lyp_6-31g(d).smash.inp (generated)

004111666.b3lyp_6-31g(d).nwchem.inp (generated) 004111666.b3lyp_6-31g(d).log.xz 004111666.td-b3lyp_6-31g+(d).inp 004111666.td-b3lyp_6-31g+(d).log.xz

004111666.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111666.td-b3lyp_6-31+g(d).gjf (generated)

004111666.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111666.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111666.mol 004111666.PUBCHEM 004111666.mol (via Jmol)
004111717.b3lyp_6-31g(d).inp

004111717.b3lyp_6-31g(d).qchem.inp (generated)

004111717.b3lyp_6-31g(d).gjf (generated)

004111717.b3lyp_6-31g(d).firefly.inp (generated)

004111717.b3lyp_6-31g(d).smash.inp (generated)

004111717.b3lyp_6-31g(d).nwchem.inp (generated) 004111717.b3lyp_6-31g(d).log.xz 004111717.td-b3lyp_6-31g+(d).inp 004111717.td-b3lyp_6-31g+(d).log.xz

004111717.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111717.td-b3lyp_6-31+g(d).gjf (generated)

004111717.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111717.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111717.mol 004111717.PUBCHEM 004111717.mol (via Jmol)
004111718.b3lyp_6-31g(d).inp

004111718.b3lyp_6-31g(d).qchem.inp (generated)

004111718.b3lyp_6-31g(d).gjf (generated)

004111718.b3lyp_6-31g(d).firefly.inp (generated)

004111718.b3lyp_6-31g(d).smash.inp (generated)

004111718.b3lyp_6-31g(d).nwchem.inp (generated) 004111718.b3lyp_6-31g(d).log.xz 004111718.td-b3lyp_6-31g+(d).inp 004111718.td-b3lyp_6-31g+(d).log.xz

004111718.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111718.td-b3lyp_6-31+g(d).gjf (generated)

004111718.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111718.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111718.mol 004111718.PUBCHEM 004111718.mol (via Jmol)
004111719.b3lyp_6-31g(d).inp

004111719.b3lyp_6-31g(d).qchem.inp (generated)

004111719.b3lyp_6-31g(d).gjf (generated)

004111719.b3lyp_6-31g(d).firefly.inp (generated)

004111719.b3lyp_6-31g(d).smash.inp (generated)

004111719.b3lyp_6-31g(d).nwchem.inp (generated) 004111719.b3lyp_6-31g(d).log.xz 004111719.td-b3lyp_6-31g+(d).inp 004111719.td-b3lyp_6-31g+(d).log.xz

004111719.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111719.td-b3lyp_6-31+g(d).gjf (generated)

004111719.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111719.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111719.mol 004111719.PUBCHEM 004111719.mol (via Jmol)
004111720.b3lyp_6-31g(d).inp

004111720.b3lyp_6-31g(d).qchem.inp (generated)

004111720.b3lyp_6-31g(d).gjf (generated)

004111720.b3lyp_6-31g(d).firefly.inp (generated)

004111720.b3lyp_6-31g(d).smash.inp (generated)

004111720.b3lyp_6-31g(d).nwchem.inp (generated) 004111720.b3lyp_6-31g(d).log.xz 004111720.mol 004111720.PUBCHEM 004111720.mol (via Jmol)
004111721.b3lyp_6-31g(d).inp

004111721.b3lyp_6-31g(d).qchem.inp (generated)

004111721.b3lyp_6-31g(d).gjf (generated)

004111721.b3lyp_6-31g(d).firefly.inp (generated)

004111721.b3lyp_6-31g(d).smash.inp (generated)

004111721.b3lyp_6-31g(d).nwchem.inp (generated) 004111721.b3lyp_6-31g(d).log.xz 004111721.td-b3lyp_6-31g+(d).inp 004111721.td-b3lyp_6-31g+(d).log.xz

004111721.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111721.td-b3lyp_6-31+g(d).gjf (generated)

004111721.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111721.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111721.mol 004111721.PUBCHEM 004111721.mol (via Jmol)
004111722.b3lyp_6-31g(d).inp

004111722.b3lyp_6-31g(d).qchem.inp (generated)

004111722.b3lyp_6-31g(d).gjf (generated)

004111722.b3lyp_6-31g(d).firefly.inp (generated)

004111722.b3lyp_6-31g(d).smash.inp (generated)

004111722.b3lyp_6-31g(d).nwchem.inp (generated) 004111722.b3lyp_6-31g(d).log.xz 004111722.mol 004111722.PUBCHEM 004111722.mol (via Jmol)
004111730.b3lyp_6-31g(d).inp

004111730.b3lyp_6-31g(d).qchem.inp (generated)

004111730.b3lyp_6-31g(d).gjf (generated)

004111730.b3lyp_6-31g(d).firefly.inp (generated)

004111730.b3lyp_6-31g(d).smash.inp (generated)

004111730.b3lyp_6-31g(d).nwchem.inp (generated) 004111730.b3lyp_6-31g(d).log.xz 004111730.td-b3lyp_6-31g+(d).inp 004111730.td-b3lyp_6-31g+(d).log.xz

004111730.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111730.td-b3lyp_6-31+g(d).gjf (generated)

004111730.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111730.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111730.mol 004111730.PUBCHEM 004111730.mol (via Jmol)
004111732.b3lyp_6-31g(d).inp

004111732.b3lyp_6-31g(d).qchem.inp (generated)

004111732.b3lyp_6-31g(d).gjf (generated)

004111732.b3lyp_6-31g(d).firefly.inp (generated)

004111732.b3lyp_6-31g(d).smash.inp (generated)

004111732.b3lyp_6-31g(d).nwchem.inp (generated) 004111732.b3lyp_6-31g(d).log.xz 004111732.td-b3lyp_6-31g+(d).inp 004111732.td-b3lyp_6-31g+(d).log.xz

004111732.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111732.td-b3lyp_6-31+g(d).gjf (generated)

004111732.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111732.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111732.mol 004111732.PUBCHEM 004111732.mol (via Jmol)
004111740.b3lyp_6-31g(d).inp

004111740.b3lyp_6-31g(d).qchem.inp (generated)

004111740.b3lyp_6-31g(d).gjf (generated)

004111740.b3lyp_6-31g(d).firefly.inp (generated)

004111740.b3lyp_6-31g(d).smash.inp (generated)

004111740.b3lyp_6-31g(d).nwchem.inp (generated) 004111740.b3lyp_6-31g(d).log.xz 004111740.td-b3lyp_6-31g+(d).inp 004111740.td-b3lyp_6-31g+(d).log.xz

004111740.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111740.td-b3lyp_6-31+g(d).gjf (generated)

004111740.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111740.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111740.mol 004111740.PUBCHEM 004111740.mol (via Jmol)
004111754.b3lyp_6-31g(d).inp

004111754.b3lyp_6-31g(d).qchem.inp (generated)

004111754.b3lyp_6-31g(d).gjf (generated)

004111754.b3lyp_6-31g(d).firefly.inp (generated)

004111754.b3lyp_6-31g(d).smash.inp (generated)

004111754.b3lyp_6-31g(d).nwchem.inp (generated) 004111754.b3lyp_6-31g(d).log.xz 004111754.td-b3lyp_6-31g+(d).inp 004111754.td-b3lyp_6-31g+(d).log.xz

004111754.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111754.td-b3lyp_6-31+g(d).gjf (generated)

004111754.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111754.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111754.mol 004111754.PUBCHEM 004111754.mol (via Jmol)
004111755.b3lyp_6-31g(d).inp

004111755.b3lyp_6-31g(d).qchem.inp (generated)

004111755.b3lyp_6-31g(d).gjf (generated)

004111755.b3lyp_6-31g(d).firefly.inp (generated)

004111755.b3lyp_6-31g(d).smash.inp (generated)

004111755.b3lyp_6-31g(d).nwchem.inp (generated) 004111755.b3lyp_6-31g(d).log.xz 004111755.td-b3lyp_6-31g+(d).inp 004111755.td-b3lyp_6-31g+(d).log.xz

004111755.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111755.td-b3lyp_6-31+g(d).gjf (generated)

004111755.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111755.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111755.mol 004111755.PUBCHEM 004111755.mol (via Jmol)
004111794.b3lyp_6-31g(d).inp

004111794.b3lyp_6-31g(d).qchem.inp (generated)

004111794.b3lyp_6-31g(d).gjf (generated)

004111794.b3lyp_6-31g(d).firefly.inp (generated)

004111794.b3lyp_6-31g(d).smash.inp (generated)

004111794.b3lyp_6-31g(d).nwchem.inp (generated) 004111794.b3lyp_6-31g(d).log.xz 004111794.mol 004111794.PUBCHEM 004111794.mol (via Jmol)
004111803.b3lyp_6-31g(d).inp

004111803.b3lyp_6-31g(d).qchem.inp (generated)

004111803.b3lyp_6-31g(d).gjf (generated)

004111803.b3lyp_6-31g(d).firefly.inp (generated)

004111803.b3lyp_6-31g(d).smash.inp (generated)

004111803.b3lyp_6-31g(d).nwchem.inp (generated) 004111803.b3lyp_6-31g(d).log.xz 004111803.td-b3lyp_6-31g+(d).inp 004111803.td-b3lyp_6-31g+(d).log.xz

004111803.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111803.td-b3lyp_6-31+g(d).gjf (generated)

004111803.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111803.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111803.mol 004111803.PUBCHEM 004111803.mol (via Jmol)
004111804.b3lyp_6-31g(d).inp

004111804.b3lyp_6-31g(d).qchem.inp (generated)

004111804.b3lyp_6-31g(d).gjf (generated)

004111804.b3lyp_6-31g(d).firefly.inp (generated)

004111804.b3lyp_6-31g(d).smash.inp (generated)

004111804.b3lyp_6-31g(d).nwchem.inp (generated) 004111804.b3lyp_6-31g(d).log.xz 004111804.td-b3lyp_6-31g+(d).inp 004111804.td-b3lyp_6-31g+(d).log.xz

004111804.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111804.td-b3lyp_6-31+g(d).gjf (generated)

004111804.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111804.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111804.mol 004111804.PUBCHEM 004111804.mol (via Jmol)
004111806.b3lyp_6-31g(d).inp

004111806.b3lyp_6-31g(d).qchem.inp (generated)

004111806.b3lyp_6-31g(d).gjf (generated)

004111806.b3lyp_6-31g(d).firefly.inp (generated)

004111806.b3lyp_6-31g(d).smash.inp (generated)

004111806.b3lyp_6-31g(d).nwchem.inp (generated) 004111806.b3lyp_6-31g(d).log.xz 004111806.td-b3lyp_6-31g+(d).inp 004111806.td-b3lyp_6-31g+(d).log.xz

004111806.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111806.td-b3lyp_6-31+g(d).gjf (generated)

004111806.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111806.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111806.mol 004111806.PUBCHEM 004111806.mol (via Jmol)
004111913.b3lyp_6-31g(d).inp

004111913.b3lyp_6-31g(d).qchem.inp (generated)

004111913.b3lyp_6-31g(d).gjf (generated)

004111913.b3lyp_6-31g(d).firefly.inp (generated)

004111913.b3lyp_6-31g(d).smash.inp (generated)

004111913.b3lyp_6-31g(d).nwchem.inp (generated) 004111913.b3lyp_6-31g(d).log.xz 004111913.td-b3lyp_6-31g+(d).inp 004111913.td-b3lyp_6-31g+(d).log.xz

004111913.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111913.td-b3lyp_6-31+g(d).gjf (generated)

004111913.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111913.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111913.mol 004111913.PUBCHEM 004111913.mol (via Jmol)
004111924.b3lyp_6-31g(d).inp

004111924.b3lyp_6-31g(d).qchem.inp (generated)

004111924.b3lyp_6-31g(d).gjf (generated)

004111924.b3lyp_6-31g(d).firefly.inp (generated)

004111924.b3lyp_6-31g(d).smash.inp (generated)

004111924.b3lyp_6-31g(d).nwchem.inp (generated) 004111924.b3lyp_6-31g(d).log.xz 004111924.td-b3lyp_6-31g+(d).inp 004111924.td-b3lyp_6-31g+(d).log.xz

004111924.td-b3lyp_6-31+g(d).qchem.inp (generated)

004111924.td-b3lyp_6-31+g(d).gjf (generated)

004111924.td-b3lyp_6-31+g(d).firefly.inp (generated)

004111924.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004111924.mol 004111924.PUBCHEM 004111924.mol (via Jmol)
004112085.b3lyp_6-31g(d).inp

004112085.b3lyp_6-31g(d).qchem.inp (generated)

004112085.b3lyp_6-31g(d).gjf (generated)

004112085.b3lyp_6-31g(d).firefly.inp (generated)

004112085.b3lyp_6-31g(d).smash.inp (generated)

004112085.b3lyp_6-31g(d).nwchem.inp (generated) 004112085.b3lyp_6-31g(d).log.xz 004112085.td-b3lyp_6-31g+(d).inp 004112085.td-b3lyp_6-31g+(d).log.xz

004112085.td-b3lyp_6-31+g(d).qchem.inp (generated)

004112085.td-b3lyp_6-31+g(d).gjf (generated)

004112085.td-b3lyp_6-31+g(d).firefly.inp (generated)

004112085.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004112085.mol 004112085.PUBCHEM 004112085.mol (via Jmol)
004112111.b3lyp_6-31g(d).inp

004112111.b3lyp_6-31g(d).qchem.inp (generated)

004112111.b3lyp_6-31g(d).gjf (generated)

004112111.b3lyp_6-31g(d).firefly.inp (generated)

004112111.b3lyp_6-31g(d).smash.inp (generated)

004112111.b3lyp_6-31g(d).nwchem.inp (generated) 004112111.b3lyp_6-31g(d).log.xz 004112111.td-b3lyp_6-31g+(d).inp 004112111.td-b3lyp_6-31g+(d).log.xz

004112111.td-b3lyp_6-31+g(d).qchem.inp (generated)

004112111.td-b3lyp_6-31+g(d).gjf (generated)

004112111.td-b3lyp_6-31+g(d).firefly.inp (generated)

004112111.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004112111.mol 004112111.PUBCHEM 004112111.mol (via Jmol)
004112112.b3lyp_6-31g(d).inp

004112112.b3lyp_6-31g(d).qchem.inp (generated)

004112112.b3lyp_6-31g(d).gjf (generated)

004112112.b3lyp_6-31g(d).firefly.inp (generated)

004112112.b3lyp_6-31g(d).smash.inp (generated)

004112112.b3lyp_6-31g(d).nwchem.inp (generated) 004112112.b3lyp_6-31g(d).log.xz 004112112.mol 004112112.PUBCHEM 004112112.mol (via Jmol)
004112125.b3lyp_6-31g(d).inp

004112125.b3lyp_6-31g(d).qchem.inp (generated)

004112125.b3lyp_6-31g(d).gjf (generated)

004112125.b3lyp_6-31g(d).firefly.inp (generated)

004112125.b3lyp_6-31g(d).smash.inp (generated)

004112125.b3lyp_6-31g(d).nwchem.inp (generated) 004112125.b3lyp_6-31g(d).log.xz 004112125.td-b3lyp_6-31g+(d).inp 004112125.td-b3lyp_6-31g+(d).log.xz

004112125.td-b3lyp_6-31+g(d).qchem.inp (generated)

004112125.td-b3lyp_6-31+g(d).gjf (generated)

004112125.td-b3lyp_6-31+g(d).firefly.inp (generated)

004112125.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004112125.mol 004112125.PUBCHEM 004112125.mol (via Jmol)
004112151.b3lyp_6-31g(d).inp

004112151.b3lyp_6-31g(d).qchem.inp (generated)

004112151.b3lyp_6-31g(d).gjf (generated)

004112151.b3lyp_6-31g(d).firefly.inp (generated)

004112151.b3lyp_6-31g(d).smash.inp (generated)

004112151.b3lyp_6-31g(d).nwchem.inp (generated) 004112151.b3lyp_6-31g(d).log.xz 004112151.td-b3lyp_6-31g+(d).inp 004112151.td-b3lyp_6-31g+(d).log.xz

004112151.td-b3lyp_6-31+g(d).qchem.inp (generated)

004112151.td-b3lyp_6-31+g(d).gjf (generated)

004112151.td-b3lyp_6-31+g(d).firefly.inp (generated)

004112151.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004112151.mol 004112151.PUBCHEM 004112151.mol (via Jmol)
004112205.b3lyp_6-31g(d).inp

004112205.b3lyp_6-31g(d).qchem.inp (generated)

004112205.b3lyp_6-31g(d).gjf (generated)

004112205.b3lyp_6-31g(d).firefly.inp (generated)

004112205.b3lyp_6-31g(d).smash.inp (generated)

004112205.b3lyp_6-31g(d).nwchem.inp (generated) 004112205.b3lyp_6-31g(d).log.xz 004112205.td-b3lyp_6-31g+(d).inp 004112205.td-b3lyp_6-31g+(d).log.xz

004112205.td-b3lyp_6-31+g(d).qchem.inp (generated)

004112205.td-b3lyp_6-31+g(d).gjf (generated)

004112205.td-b3lyp_6-31+g(d).firefly.inp (generated)

004112205.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004112205.mol 004112205.PUBCHEM 004112205.mol (via Jmol)
004112211.b3lyp_6-31g(d).inp

004112211.b3lyp_6-31g(d).qchem.inp (generated)

004112211.b3lyp_6-31g(d).gjf (generated)

004112211.b3lyp_6-31g(d).firefly.inp (generated)

004112211.b3lyp_6-31g(d).smash.inp (generated)

004112211.b3lyp_6-31g(d).nwchem.inp (generated) 004112211.b3lyp_6-31g(d).log.xz 004112211.td-b3lyp_6-31g+(d).inp 004112211.td-b3lyp_6-31g+(d).log.xz

004112211.td-b3lyp_6-31+g(d).qchem.inp (generated)

004112211.td-b3lyp_6-31+g(d).gjf (generated)

004112211.td-b3lyp_6-31+g(d).firefly.inp (generated)

004112211.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004112211.mol 004112211.PUBCHEM 004112211.mol (via Jmol)
004112217.b3lyp_6-31g(d).inp

004112217.b3lyp_6-31g(d).qchem.inp (generated)

004112217.b3lyp_6-31g(d).gjf (generated)

004112217.b3lyp_6-31g(d).firefly.inp (generated)

004112217.b3lyp_6-31g(d).smash.inp (generated)

004112217.b3lyp_6-31g(d).nwchem.inp (generated) 004112217.b3lyp_6-31g(d).log.xz 004112217.mol 004112217.PUBCHEM 004112217.mol (via Jmol)
004112225.b3lyp_6-31g(d).inp

004112225.b3lyp_6-31g(d).qchem.inp (generated)

004112225.b3lyp_6-31g(d).gjf (generated)

004112225.b3lyp_6-31g(d).firefly.inp (generated)

004112225.b3lyp_6-31g(d).smash.inp (generated)

004112225.b3lyp_6-31g(d).nwchem.inp (generated) 004112225.b3lyp_6-31g(d).log.xz 004112225.td-b3lyp_6-31g+(d).inp 004112225.td-b3lyp_6-31g+(d).log.xz

004112225.td-b3lyp_6-31+g(d).qchem.inp (generated)

004112225.td-b3lyp_6-31+g(d).gjf (generated)

004112225.td-b3lyp_6-31+g(d).firefly.inp (generated)

004112225.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004112225.mol 004112225.PUBCHEM 004112225.mol (via Jmol)
004112249.b3lyp_6-31g(d).inp

004112249.b3lyp_6-31g(d).qchem.inp (generated)

004112249.b3lyp_6-31g(d).gjf (generated)

004112249.b3lyp_6-31g(d).firefly.inp (generated)