Index of

Last updated : Thu Jun 22 02:29:55 JST 2017
Total : 923 (810) in this page
012125086.b3lyp_6-31g(d).inp

012125086.b3lyp_6-31g(d).qchem.inp (generated)

012125086.b3lyp_6-31g(d).gjf (generated)

012125086.b3lyp_6-31g(d).firefly.inp (generated)

012125086.b3lyp_6-31g(d).smash.inp (generated)

012125086.b3lyp_6-31g(d).nwchem.inp (generated) 012125086.b3lyp_6-31g(d).log.xz 012125086.td-b3lyp_6-31g+(d).inp 012125086.td-b3lyp_6-31g+(d).log.xz

012125086.td-b3lyp_6-31+g(d).qchem.inp (generated)

012125086.td-b3lyp_6-31+g(d).gjf (generated)

012125086.td-b3lyp_6-31+g(d).firefly.inp (generated)

012125086.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012125086.mol 012125086.PUBCHEM 012125086.mol (via Jmol)
012125343.b3lyp_6-31g(d).inp

012125343.b3lyp_6-31g(d).qchem.inp (generated)

012125343.b3lyp_6-31g(d).gjf (generated)

012125343.b3lyp_6-31g(d).firefly.inp (generated)

012125343.b3lyp_6-31g(d).smash.inp (generated)

012125343.b3lyp_6-31g(d).nwchem.inp (generated) 012125343.b3lyp_6-31g(d).log.xz 012125343.td-b3lyp_6-31g+(d).inp 012125343.td-b3lyp_6-31g+(d).log.xz

012125343.td-b3lyp_6-31+g(d).qchem.inp (generated)

012125343.td-b3lyp_6-31+g(d).gjf (generated)

012125343.td-b3lyp_6-31+g(d).firefly.inp (generated)

012125343.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012125343.mol 012125343.PUBCHEM 012125343.mol (via Jmol)
012125374.b3lyp_6-31g(d).inp

012125374.b3lyp_6-31g(d).qchem.inp (generated)

012125374.b3lyp_6-31g(d).gjf (generated)

012125374.b3lyp_6-31g(d).firefly.inp (generated)

012125374.b3lyp_6-31g(d).smash.inp (generated)

012125374.b3lyp_6-31g(d).nwchem.inp (generated) 012125374.b3lyp_6-31g(d).log.xz 012125374.td-b3lyp_6-31g+(d).inp 012125374.td-b3lyp_6-31g+(d).log.xz

012125374.td-b3lyp_6-31+g(d).qchem.inp (generated)

012125374.td-b3lyp_6-31+g(d).gjf (generated)

012125374.td-b3lyp_6-31+g(d).firefly.inp (generated)

012125374.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012125374.mol 012125374.PUBCHEM 012125374.mol (via Jmol)
012125375.b3lyp_6-31g(d).inp

012125375.b3lyp_6-31g(d).qchem.inp (generated)

012125375.b3lyp_6-31g(d).gjf (generated)

012125375.b3lyp_6-31g(d).firefly.inp (generated)

012125375.b3lyp_6-31g(d).smash.inp (generated)

012125375.b3lyp_6-31g(d).nwchem.inp (generated) 012125375.b3lyp_6-31g(d).log.xz 012125375.td-b3lyp_6-31g+(d).inp 012125375.td-b3lyp_6-31g+(d).log.xz

012125375.td-b3lyp_6-31+g(d).qchem.inp (generated)

012125375.td-b3lyp_6-31+g(d).gjf (generated)

012125375.td-b3lyp_6-31+g(d).firefly.inp (generated)

012125375.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012125375.mol 012125375.PUBCHEM 012125375.mol (via Jmol)
012125376.b3lyp_6-31g(d).inp

012125376.b3lyp_6-31g(d).qchem.inp (generated)

012125376.b3lyp_6-31g(d).gjf (generated)

012125376.b3lyp_6-31g(d).firefly.inp (generated)

012125376.b3lyp_6-31g(d).smash.inp (generated)

012125376.b3lyp_6-31g(d).nwchem.inp (generated) 012125376.b3lyp_6-31g(d).log.xz 012125376.td-b3lyp_6-31g+(d).inp 012125376.td-b3lyp_6-31g+(d).log.xz

012125376.td-b3lyp_6-31+g(d).qchem.inp (generated)

012125376.td-b3lyp_6-31+g(d).gjf (generated)

012125376.td-b3lyp_6-31+g(d).firefly.inp (generated)

012125376.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012125376.mol 012125376.PUBCHEM 012125376.mol (via Jmol)
012125377.b3lyp_6-31g(d).inp

012125377.b3lyp_6-31g(d).qchem.inp (generated)

012125377.b3lyp_6-31g(d).gjf (generated)

012125377.b3lyp_6-31g(d).firefly.inp (generated)

012125377.b3lyp_6-31g(d).smash.inp (generated)

012125377.b3lyp_6-31g(d).nwchem.inp (generated) 012125377.b3lyp_6-31g(d).log.xz 012125377.td-b3lyp_6-31g+(d).inp 012125377.td-b3lyp_6-31g+(d).log.xz

012125377.td-b3lyp_6-31+g(d).qchem.inp (generated)

012125377.td-b3lyp_6-31+g(d).gjf (generated)

012125377.td-b3lyp_6-31+g(d).firefly.inp (generated)

012125377.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012125377.mol 012125377.PUBCHEM 012125377.mol (via Jmol)
012125446.b3lyp_6-31g(d).inp

012125446.b3lyp_6-31g(d).qchem.inp (generated)

012125446.b3lyp_6-31g(d).gjf (generated)

012125446.b3lyp_6-31g(d).firefly.inp (generated)

012125446.b3lyp_6-31g(d).smash.inp (generated)

012125446.b3lyp_6-31g(d).nwchem.inp (generated) 012125446.b3lyp_6-31g(d).log.xz 012125446.td-b3lyp_6-31g+(d).inp 012125446.td-b3lyp_6-31g+(d).log.xz

012125446.td-b3lyp_6-31+g(d).qchem.inp (generated)

012125446.td-b3lyp_6-31+g(d).gjf (generated)

012125446.td-b3lyp_6-31+g(d).firefly.inp (generated)

012125446.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012125446.mol 012125446.PUBCHEM 012125446.mol (via Jmol)
012125450.b3lyp_6-31g(d).inp

012125450.b3lyp_6-31g(d).qchem.inp (generated)

012125450.b3lyp_6-31g(d).gjf (generated)

012125450.b3lyp_6-31g(d).firefly.inp (generated)

012125450.b3lyp_6-31g(d).smash.inp (generated)

012125450.b3lyp_6-31g(d).nwchem.inp (generated) 012125450.b3lyp_6-31g(d).log.xz 012125450.td-b3lyp_6-31g+(d).inp 012125450.td-b3lyp_6-31g+(d).log.xz

012125450.td-b3lyp_6-31+g(d).qchem.inp (generated)

012125450.td-b3lyp_6-31+g(d).gjf (generated)

012125450.td-b3lyp_6-31+g(d).firefly.inp (generated)

012125450.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012125450.mol 012125450.PUBCHEM 012125450.mol (via Jmol)
012125526.b3lyp_6-31g(d).inp

012125526.b3lyp_6-31g(d).qchem.inp (generated)

012125526.b3lyp_6-31g(d).gjf (generated)

012125526.b3lyp_6-31g(d).firefly.inp (generated)

012125526.b3lyp_6-31g(d).smash.inp (generated)

012125526.b3lyp_6-31g(d).nwchem.inp (generated) 012125526.b3lyp_6-31g(d).log.xz 012125526.td-b3lyp_6-31g+(d).inp 012125526.td-b3lyp_6-31g+(d).log.xz

012125526.td-b3lyp_6-31+g(d).qchem.inp (generated)

012125526.td-b3lyp_6-31+g(d).gjf (generated)

012125526.td-b3lyp_6-31+g(d).firefly.inp (generated)

012125526.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012125526.mol 012125526.PUBCHEM 012125526.mol (via Jmol)
012125546.b3lyp_6-31g(d).inp

012125546.b3lyp_6-31g(d).qchem.inp (generated)

012125546.b3lyp_6-31g(d).gjf (generated)

012125546.b3lyp_6-31g(d).firefly.inp (generated)

012125546.b3lyp_6-31g(d).smash.inp (generated)

012125546.b3lyp_6-31g(d).nwchem.inp (generated) 012125546.b3lyp_6-31g(d).log.xz 012125546.td-b3lyp_6-31g+(d).inp 012125546.td-b3lyp_6-31g+(d).log.xz

012125546.td-b3lyp_6-31+g(d).qchem.inp (generated)

012125546.td-b3lyp_6-31+g(d).gjf (generated)

012125546.td-b3lyp_6-31+g(d).firefly.inp (generated)

012125546.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012125546.mol 012125546.PUBCHEM 012125546.mol (via Jmol)
012125548.b3lyp_6-31g(d).inp

012125548.b3lyp_6-31g(d).qchem.inp (generated)

012125548.b3lyp_6-31g(d).gjf (generated)

012125548.b3lyp_6-31g(d).firefly.inp (generated)

012125548.b3lyp_6-31g(d).smash.inp (generated)

012125548.b3lyp_6-31g(d).nwchem.inp (generated) 012125548.b3lyp_6-31g(d).log.xz 012125548.td-b3lyp_6-31g+(d).inp 012125548.td-b3lyp_6-31g+(d).log.xz

012125548.td-b3lyp_6-31+g(d).qchem.inp (generated)

012125548.td-b3lyp_6-31+g(d).gjf (generated)

012125548.td-b3lyp_6-31+g(d).firefly.inp (generated)

012125548.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012125548.mol 012125548.PUBCHEM 012125548.mol (via Jmol)
012125574.b3lyp_6-31g(d).inp

012125574.b3lyp_6-31g(d).qchem.inp (generated)

012125574.b3lyp_6-31g(d).gjf (generated)

012125574.b3lyp_6-31g(d).firefly.inp (generated)

012125574.b3lyp_6-31g(d).smash.inp (generated)

012125574.b3lyp_6-31g(d).nwchem.inp (generated) 012125574.b3lyp_6-31g(d).log.xz 012125574.td-b3lyp_6-31g+(d).inp 012125574.td-b3lyp_6-31g+(d).log.xz

012125574.td-b3lyp_6-31+g(d).qchem.inp (generated)

012125574.td-b3lyp_6-31+g(d).gjf (generated)

012125574.td-b3lyp_6-31+g(d).firefly.inp (generated)

012125574.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012125574.mol 012125574.PUBCHEM 012125574.mol (via Jmol)
012125576.b3lyp_6-31g(d).inp

012125576.b3lyp_6-31g(d).qchem.inp (generated)

012125576.b3lyp_6-31g(d).gjf (generated)

012125576.b3lyp_6-31g(d).firefly.inp (generated)

012125576.b3lyp_6-31g(d).smash.inp (generated)

012125576.b3lyp_6-31g(d).nwchem.inp (generated) 012125576.b3lyp_6-31g(d).log.xz 012125576.td-b3lyp_6-31g+(d).inp 012125576.td-b3lyp_6-31g+(d).log.xz

012125576.td-b3lyp_6-31+g(d).qchem.inp (generated)

012125576.td-b3lyp_6-31+g(d).gjf (generated)

012125576.td-b3lyp_6-31+g(d).firefly.inp (generated)

012125576.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012125576.mol 012125576.PUBCHEM 012125576.mol (via Jmol)
012125588.b3lyp_6-31g(d).inp

012125588.b3lyp_6-31g(d).qchem.inp (generated)

012125588.b3lyp_6-31g(d).gjf (generated)

012125588.b3lyp_6-31g(d).firefly.inp (generated)

012125588.b3lyp_6-31g(d).smash.inp (generated)

012125588.b3lyp_6-31g(d).nwchem.inp (generated) 012125588.b3lyp_6-31g(d).log.xz 012125588.mol 012125588.PUBCHEM 012125588.mol (via Jmol)
012125622.b3lyp_6-31g(d).inp

012125622.b3lyp_6-31g(d).qchem.inp (generated)

012125622.b3lyp_6-31g(d).gjf (generated)

012125622.b3lyp_6-31g(d).firefly.inp (generated)

012125622.b3lyp_6-31g(d).smash.inp (generated)

012125622.b3lyp_6-31g(d).nwchem.inp (generated) 012125622.b3lyp_6-31g(d).log.xz 012125622.td-b3lyp_6-31g+(d).inp 012125622.td-b3lyp_6-31g+(d).log.xz

012125622.td-b3lyp_6-31+g(d).qchem.inp (generated)

012125622.td-b3lyp_6-31+g(d).gjf (generated)

012125622.td-b3lyp_6-31+g(d).firefly.inp (generated)

012125622.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012125622.mol 012125622.PUBCHEM 012125622.mol (via Jmol)
012125627.b3lyp_6-31g(d).inp

012125627.b3lyp_6-31g(d).qchem.inp (generated)

012125627.b3lyp_6-31g(d).gjf (generated)

012125627.b3lyp_6-31g(d).firefly.inp (generated)

012125627.b3lyp_6-31g(d).smash.inp (generated)

012125627.b3lyp_6-31g(d).nwchem.inp (generated) 012125627.b3lyp_6-31g(d).log.xz 012125627.td-b3lyp_6-31g+(d).inp 012125627.td-b3lyp_6-31g+(d).log.xz

012125627.td-b3lyp_6-31+g(d).qchem.inp (generated)

012125627.td-b3lyp_6-31+g(d).gjf (generated)

012125627.td-b3lyp_6-31+g(d).firefly.inp (generated)

012125627.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012125627.mol 012125627.PUBCHEM 012125627.mol (via Jmol)
012125633.b3lyp_6-31g(d).inp

012125633.b3lyp_6-31g(d).qchem.inp (generated)

012125633.b3lyp_6-31g(d).gjf (generated)

012125633.b3lyp_6-31g(d).firefly.inp (generated)

012125633.b3lyp_6-31g(d).smash.inp (generated)

012125633.b3lyp_6-31g(d).nwchem.inp (generated) 012125633.b3lyp_6-31g(d).log.xz 012125633.td-b3lyp_6-31g+(d).inp 012125633.td-b3lyp_6-31g+(d).log.xz

012125633.td-b3lyp_6-31+g(d).qchem.inp (generated)

012125633.td-b3lyp_6-31+g(d).gjf (generated)

012125633.td-b3lyp_6-31+g(d).firefly.inp (generated)

012125633.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012125633.mol 012125633.PUBCHEM 012125633.mol (via Jmol)
012125634.b3lyp_6-31g(d).inp

012125634.b3lyp_6-31g(d).qchem.inp (generated)

012125634.b3lyp_6-31g(d).gjf (generated)

012125634.b3lyp_6-31g(d).firefly.inp (generated)

012125634.b3lyp_6-31g(d).smash.inp (generated)

012125634.b3lyp_6-31g(d).nwchem.inp (generated) 012125634.b3lyp_6-31g(d).log.xz 012125634.td-b3lyp_6-31g+(d).inp 012125634.td-b3lyp_6-31g+(d).log.xz

012125634.td-b3lyp_6-31+g(d).qchem.inp (generated)

012125634.td-b3lyp_6-31+g(d).gjf (generated)

012125634.td-b3lyp_6-31+g(d).firefly.inp (generated)

012125634.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012125634.mol 012125634.PUBCHEM 012125634.mol (via Jmol)
012125645.b3lyp_6-31g(d).inp

012125645.b3lyp_6-31g(d).qchem.inp (generated)

012125645.b3lyp_6-31g(d).gjf (generated)

012125645.b3lyp_6-31g(d).firefly.inp (generated)

012125645.b3lyp_6-31g(d).smash.inp (generated)

012125645.b3lyp_6-31g(d).nwchem.inp (generated) 012125645.b3lyp_6-31g(d).log.xz 012125645.td-b3lyp_6-31g+(d).inp 012125645.td-b3lyp_6-31g+(d).log.xz

012125645.td-b3lyp_6-31+g(d).qchem.inp (generated)

012125645.td-b3lyp_6-31+g(d).gjf (generated)

012125645.td-b3lyp_6-31+g(d).firefly.inp (generated)

012125645.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012125645.mol 012125645.PUBCHEM 012125645.mol (via Jmol)
012125716.b3lyp_6-31g(d).inp

012125716.b3lyp_6-31g(d).qchem.inp (generated)

012125716.b3lyp_6-31g(d).gjf (generated)

012125716.b3lyp_6-31g(d).firefly.inp (generated)

012125716.b3lyp_6-31g(d).smash.inp (generated)

012125716.b3lyp_6-31g(d).nwchem.inp (generated) 012125716.b3lyp_6-31g(d).log.xz 012125716.td-b3lyp_6-31g+(d).inp 012125716.td-b3lyp_6-31g+(d).log.xz

012125716.td-b3lyp_6-31+g(d).qchem.inp (generated)

012125716.td-b3lyp_6-31+g(d).gjf (generated)

012125716.td-b3lyp_6-31+g(d).firefly.inp (generated)

012125716.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012125716.mol 012125716.PUBCHEM 012125716.mol (via Jmol)
012125774.b3lyp_6-31g(d).inp

012125774.b3lyp_6-31g(d).qchem.inp (generated)

012125774.b3lyp_6-31g(d).gjf (generated)

012125774.b3lyp_6-31g(d).firefly.inp (generated)

012125774.b3lyp_6-31g(d).smash.inp (generated)

012125774.b3lyp_6-31g(d).nwchem.inp (generated) 012125774.b3lyp_6-31g(d).log.xz 012125774.td-b3lyp_6-31g+(d).inp 012125774.td-b3lyp_6-31g+(d).log.xz

012125774.td-b3lyp_6-31+g(d).qchem.inp (generated)

012125774.td-b3lyp_6-31+g(d).gjf (generated)

012125774.td-b3lyp_6-31+g(d).firefly.inp (generated)

012125774.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012125774.mol 012125774.PUBCHEM 012125774.mol (via Jmol)
012125784.b3lyp_6-31g(d).inp

012125784.b3lyp_6-31g(d).qchem.inp (generated)

012125784.b3lyp_6-31g(d).gjf (generated)

012125784.b3lyp_6-31g(d).firefly.inp (generated)

012125784.b3lyp_6-31g(d).smash.inp (generated)

012125784.b3lyp_6-31g(d).nwchem.inp (generated) 012125784.b3lyp_6-31g(d).log.xz 012125784.td-b3lyp_6-31g+(d).inp 012125784.td-b3lyp_6-31g+(d).log.xz

012125784.td-b3lyp_6-31+g(d).qchem.inp (generated)

012125784.td-b3lyp_6-31+g(d).gjf (generated)

012125784.td-b3lyp_6-31+g(d).firefly.inp (generated)

012125784.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012125784.mol 012125784.PUBCHEM 012125784.mol (via Jmol)
012125816.b3lyp_6-31g(d).inp

012125816.b3lyp_6-31g(d).qchem.inp (generated)

012125816.b3lyp_6-31g(d).gjf (generated)

012125816.b3lyp_6-31g(d).firefly.inp (generated)

012125816.b3lyp_6-31g(d).smash.inp (generated)

012125816.b3lyp_6-31g(d).nwchem.inp (generated) 012125816.b3lyp_6-31g(d).log.xz 012125816.td-b3lyp_6-31g+(d).inp 012125816.td-b3lyp_6-31g+(d).log.xz

012125816.td-b3lyp_6-31+g(d).qchem.inp (generated)

012125816.td-b3lyp_6-31+g(d).gjf (generated)

012125816.td-b3lyp_6-31+g(d).firefly.inp (generated)

012125816.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012125816.mol 012125816.PUBCHEM 012125816.mol (via Jmol)
012125834.b3lyp_6-31g(d).inp

012125834.b3lyp_6-31g(d).qchem.inp (generated)

012125834.b3lyp_6-31g(d).gjf (generated)

012125834.b3lyp_6-31g(d).firefly.inp (generated)

012125834.b3lyp_6-31g(d).smash.inp (generated)

012125834.b3lyp_6-31g(d).nwchem.inp (generated) 012125834.b3lyp_6-31g(d).log.xz 012125834.mol 012125834.PUBCHEM 012125834.mol (via Jmol)
012125898.b3lyp_6-31g(d).inp

012125898.b3lyp_6-31g(d).qchem.inp (generated)

012125898.b3lyp_6-31g(d).gjf (generated)

012125898.b3lyp_6-31g(d).firefly.inp (generated)

012125898.b3lyp_6-31g(d).smash.inp (generated)

012125898.b3lyp_6-31g(d).nwchem.inp (generated) 012125898.b3lyp_6-31g(d).log.xz 012125898.td-b3lyp_6-31g+(d).inp 012125898.td-b3lyp_6-31g+(d).log.xz

012125898.td-b3lyp_6-31+g(d).qchem.inp (generated)

012125898.td-b3lyp_6-31+g(d).gjf (generated)

012125898.td-b3lyp_6-31+g(d).firefly.inp (generated)

012125898.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012125898.mol 012125898.PUBCHEM 012125898.mol (via Jmol)
012125962.b3lyp_6-31g(d).inp

012125962.b3lyp_6-31g(d).qchem.inp (generated)

012125962.b3lyp_6-31g(d).gjf (generated)

012125962.b3lyp_6-31g(d).firefly.inp (generated)

012125962.b3lyp_6-31g(d).smash.inp (generated)

012125962.b3lyp_6-31g(d).nwchem.inp (generated) 012125962.b3lyp_6-31g(d).log.xz 012125962.td-b3lyp_6-31g+(d).inp 012125962.td-b3lyp_6-31g+(d).log.xz

012125962.td-b3lyp_6-31+g(d).qchem.inp (generated)

012125962.td-b3lyp_6-31+g(d).gjf (generated)

012125962.td-b3lyp_6-31+g(d).firefly.inp (generated)

012125962.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012125962.mol 012125962.PUBCHEM 012125962.mol (via Jmol)
012126064.b3lyp_6-31g(d).inp

012126064.b3lyp_6-31g(d).qchem.inp (generated)

012126064.b3lyp_6-31g(d).gjf (generated)

012126064.b3lyp_6-31g(d).firefly.inp (generated)

012126064.b3lyp_6-31g(d).smash.inp (generated)

012126064.b3lyp_6-31g(d).nwchem.inp (generated) 012126064.b3lyp_6-31g(d).log.xz 012126064.td-b3lyp_6-31g+(d).inp 012126064.td-b3lyp_6-31g+(d).log.xz

012126064.td-b3lyp_6-31+g(d).qchem.inp (generated)

012126064.td-b3lyp_6-31+g(d).gjf (generated)

012126064.td-b3lyp_6-31+g(d).firefly.inp (generated)

012126064.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012126064.mol 012126064.PUBCHEM 012126064.mol (via Jmol)
012126105.b3lyp_6-31g(d).inp

012126105.b3lyp_6-31g(d).qchem.inp (generated)

012126105.b3lyp_6-31g(d).gjf (generated)

012126105.b3lyp_6-31g(d).firefly.inp (generated)

012126105.b3lyp_6-31g(d).smash.inp (generated)

012126105.b3lyp_6-31g(d).nwchem.inp (generated) 012126105.b3lyp_6-31g(d).log.xz 012126105.td-b3lyp_6-31g+(d).inp 012126105.td-b3lyp_6-31g+(d).log.xz

012126105.td-b3lyp_6-31+g(d).qchem.inp (generated)

012126105.td-b3lyp_6-31+g(d).gjf (generated)

012126105.td-b3lyp_6-31+g(d).firefly.inp (generated)

012126105.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012126105.mol 012126105.PUBCHEM 012126105.mol (via Jmol)
012126183.b3lyp_6-31g(d).inp

012126183.b3lyp_6-31g(d).qchem.inp (generated)

012126183.b3lyp_6-31g(d).gjf (generated)

012126183.b3lyp_6-31g(d).firefly.inp (generated)

012126183.b3lyp_6-31g(d).smash.inp (generated)

012126183.b3lyp_6-31g(d).nwchem.inp (generated) 012126183.b3lyp_6-31g(d).log.xz 012126183.td-b3lyp_6-31g+(d).inp 012126183.td-b3lyp_6-31g+(d).log.xz

012126183.td-b3lyp_6-31+g(d).qchem.inp (generated)

012126183.td-b3lyp_6-31+g(d).gjf (generated)

012126183.td-b3lyp_6-31+g(d).firefly.inp (generated)

012126183.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012126183.mol 012126183.PUBCHEM 012126183.mol (via Jmol)
012126188.b3lyp_6-31g(d).inp

012126188.b3lyp_6-31g(d).qchem.inp (generated)

012126188.b3lyp_6-31g(d).gjf (generated)

012126188.b3lyp_6-31g(d).firefly.inp (generated)

012126188.b3lyp_6-31g(d).smash.inp (generated)

012126188.b3lyp_6-31g(d).nwchem.inp (generated) 012126188.b3lyp_6-31g(d).log.xz 012126188.td-b3lyp_6-31g+(d).inp 012126188.td-b3lyp_6-31g+(d).log.xz

012126188.td-b3lyp_6-31+g(d).qchem.inp (generated)

012126188.td-b3lyp_6-31+g(d).gjf (generated)

012126188.td-b3lyp_6-31+g(d).firefly.inp (generated)

012126188.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012126188.mol 012126188.PUBCHEM 012126188.mol (via Jmol)
012126363.b3lyp_6-31g(d).inp

012126363.b3lyp_6-31g(d).qchem.inp (generated)

012126363.b3lyp_6-31g(d).gjf (generated)

012126363.b3lyp_6-31g(d).firefly.inp (generated)

012126363.b3lyp_6-31g(d).smash.inp (generated)

012126363.b3lyp_6-31g(d).nwchem.inp (generated) 012126363.b3lyp_6-31g(d).log.xz 012126363.td-b3lyp_6-31g+(d).inp 012126363.td-b3lyp_6-31g+(d).log.xz

012126363.td-b3lyp_6-31+g(d).qchem.inp (generated)

012126363.td-b3lyp_6-31+g(d).gjf (generated)

012126363.td-b3lyp_6-31+g(d).firefly.inp (generated)

012126363.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012126363.mol 012126363.PUBCHEM 012126363.mol (via Jmol)
012126412.b3lyp_6-31g(d).inp

012126412.b3lyp_6-31g(d).qchem.inp (generated)

012126412.b3lyp_6-31g(d).gjf (generated)

012126412.b3lyp_6-31g(d).firefly.inp (generated)

012126412.b3lyp_6-31g(d).smash.inp (generated)

012126412.b3lyp_6-31g(d).nwchem.inp (generated) 012126412.b3lyp_6-31g(d).log.xz 012126412.td-b3lyp_6-31g+(d).inp 012126412.td-b3lyp_6-31g+(d).log.xz

012126412.td-b3lyp_6-31+g(d).qchem.inp (generated)

012126412.td-b3lyp_6-31+g(d).gjf (generated)

012126412.td-b3lyp_6-31+g(d).firefly.inp (generated)

012126412.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012126412.mol 012126412.PUBCHEM 012126412.mol (via Jmol)
012126496.b3lyp_6-31g(d).inp

012126496.b3lyp_6-31g(d).qchem.inp (generated)

012126496.b3lyp_6-31g(d).gjf (generated)

012126496.b3lyp_6-31g(d).firefly.inp (generated)

012126496.b3lyp_6-31g(d).smash.inp (generated)

012126496.b3lyp_6-31g(d).nwchem.inp (generated) 012126496.b3lyp_6-31g(d).log.xz 012126496.td-b3lyp_6-31g+(d).inp 012126496.td-b3lyp_6-31g+(d).log.xz

012126496.td-b3lyp_6-31+g(d).qchem.inp (generated)

012126496.td-b3lyp_6-31+g(d).gjf (generated)

012126496.td-b3lyp_6-31+g(d).firefly.inp (generated)

012126496.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012126496.mol 012126496.PUBCHEM 012126496.mol (via Jmol)
012126651.b3lyp_6-31g(d).inp

012126651.b3lyp_6-31g(d).qchem.inp (generated)

012126651.b3lyp_6-31g(d).gjf (generated)

012126651.b3lyp_6-31g(d).firefly.inp (generated)

012126651.b3lyp_6-31g(d).smash.inp (generated)

012126651.b3lyp_6-31g(d).nwchem.inp (generated) 012126651.b3lyp_6-31g(d).log.xz 012126651.mol 012126651.PUBCHEM 012126651.mol (via Jmol)
012126666.b3lyp_6-31g(d).inp

012126666.b3lyp_6-31g(d).qchem.inp (generated)

012126666.b3lyp_6-31g(d).gjf (generated)

012126666.b3lyp_6-31g(d).firefly.inp (generated)

012126666.b3lyp_6-31g(d).smash.inp (generated)

012126666.b3lyp_6-31g(d).nwchem.inp (generated) 012126666.b3lyp_6-31g(d).log.xz 012126666.td-b3lyp_6-31g+(d).inp 012126666.td-b3lyp_6-31g+(d).log.xz

012126666.td-b3lyp_6-31+g(d).qchem.inp (generated)

012126666.td-b3lyp_6-31+g(d).gjf (generated)

012126666.td-b3lyp_6-31+g(d).firefly.inp (generated)

012126666.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012126666.mol 012126666.PUBCHEM 012126666.mol (via Jmol)
012126668.b3lyp_6-31g(d).inp

012126668.b3lyp_6-31g(d).qchem.inp (generated)

012126668.b3lyp_6-31g(d).gjf (generated)

012126668.b3lyp_6-31g(d).firefly.inp (generated)

012126668.b3lyp_6-31g(d).smash.inp (generated)

012126668.b3lyp_6-31g(d).nwchem.inp (generated) 012126668.b3lyp_6-31g(d).log.xz 012126668.td-b3lyp_6-31g+(d).inp 012126668.td-b3lyp_6-31g+(d).log.xz

012126668.td-b3lyp_6-31+g(d).qchem.inp (generated)

012126668.td-b3lyp_6-31+g(d).gjf (generated)

012126668.td-b3lyp_6-31+g(d).firefly.inp (generated)

012126668.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012126668.mol 012126668.PUBCHEM 012126668.mol (via Jmol)
012126679.b3lyp_6-31g(d).inp

012126679.b3lyp_6-31g(d).qchem.inp (generated)

012126679.b3lyp_6-31g(d).gjf (generated)

012126679.b3lyp_6-31g(d).firefly.inp (generated)

012126679.b3lyp_6-31g(d).smash.inp (generated)

012126679.b3lyp_6-31g(d).nwchem.inp (generated) 012126679.b3lyp_6-31g(d).log.xz 012126679.td-b3lyp_6-31g+(d).inp 012126679.td-b3lyp_6-31g+(d).log.xz

012126679.td-b3lyp_6-31+g(d).qchem.inp (generated)

012126679.td-b3lyp_6-31+g(d).gjf (generated)

012126679.td-b3lyp_6-31+g(d).firefly.inp (generated)

012126679.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012126679.mol 012126679.PUBCHEM 012126679.mol (via Jmol)
012126747.b3lyp_6-31g(d).inp

012126747.b3lyp_6-31g(d).qchem.inp (generated)

012126747.b3lyp_6-31g(d).gjf (generated)

012126747.b3lyp_6-31g(d).firefly.inp (generated)

012126747.b3lyp_6-31g(d).smash.inp (generated)

012126747.b3lyp_6-31g(d).nwchem.inp (generated) 012126747.b3lyp_6-31g(d).log.xz 012126747.td-b3lyp_6-31g+(d).inp 012126747.td-b3lyp_6-31g+(d).log.xz

012126747.td-b3lyp_6-31+g(d).qchem.inp (generated)

012126747.td-b3lyp_6-31+g(d).gjf (generated)

012126747.td-b3lyp_6-31+g(d).firefly.inp (generated)

012126747.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012126747.mol 012126747.PUBCHEM 012126747.mol (via Jmol)
012126834.b3lyp_6-31g(d).inp

012126834.b3lyp_6-31g(d).qchem.inp (generated)

012126834.b3lyp_6-31g(d).gjf (generated)

012126834.b3lyp_6-31g(d).firefly.inp (generated)

012126834.b3lyp_6-31g(d).smash.inp (generated)

012126834.b3lyp_6-31g(d).nwchem.inp (generated) 012126834.b3lyp_6-31g(d).log.xz 012126834.td-b3lyp_6-31g+(d).inp 012126834.td-b3lyp_6-31g+(d).log.xz

012126834.td-b3lyp_6-31+g(d).qchem.inp (generated)

012126834.td-b3lyp_6-31+g(d).gjf (generated)

012126834.td-b3lyp_6-31+g(d).firefly.inp (generated)

012126834.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012126834.mol 012126834.PUBCHEM 012126834.mol (via Jmol)
012126899.b3lyp_6-31g(d).inp

012126899.b3lyp_6-31g(d).qchem.inp (generated)

012126899.b3lyp_6-31g(d).gjf (generated)

012126899.b3lyp_6-31g(d).firefly.inp (generated)

012126899.b3lyp_6-31g(d).smash.inp (generated)

012126899.b3lyp_6-31g(d).nwchem.inp (generated) 012126899.b3lyp_6-31g(d).log.xz 012126899.td-b3lyp_6-31g+(d).inp 012126899.td-b3lyp_6-31g+(d).log.xz

012126899.td-b3lyp_6-31+g(d).qchem.inp (generated)

012126899.td-b3lyp_6-31+g(d).gjf (generated)

012126899.td-b3lyp_6-31+g(d).firefly.inp (generated)

012126899.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012126899.mol 012126899.PUBCHEM 012126899.mol (via Jmol)
012126977.b3lyp_6-31g(d).inp

012126977.b3lyp_6-31g(d).qchem.inp (generated)

012126977.b3lyp_6-31g(d).gjf (generated)

012126977.b3lyp_6-31g(d).firefly.inp (generated)

012126977.b3lyp_6-31g(d).smash.inp (generated)

012126977.b3lyp_6-31g(d).nwchem.inp (generated) 012126977.b3lyp_6-31g(d).log.xz 012126977.td-b3lyp_6-31g+(d).inp 012126977.td-b3lyp_6-31g+(d).log.xz

012126977.td-b3lyp_6-31+g(d).qchem.inp (generated)

012126977.td-b3lyp_6-31+g(d).gjf (generated)

012126977.td-b3lyp_6-31+g(d).firefly.inp (generated)

012126977.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012126977.mol 012126977.PUBCHEM 012126977.mol (via Jmol)
012127004.b3lyp_6-31g(d).inp

012127004.b3lyp_6-31g(d).qchem.inp (generated)

012127004.b3lyp_6-31g(d).gjf (generated)

012127004.b3lyp_6-31g(d).firefly.inp (generated)

012127004.b3lyp_6-31g(d).smash.inp (generated)

012127004.b3lyp_6-31g(d).nwchem.inp (generated) 012127004.b3lyp_6-31g(d).log.xz 012127004.td-b3lyp_6-31g+(d).inp 012127004.td-b3lyp_6-31g+(d).log.xz

012127004.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127004.td-b3lyp_6-31+g(d).gjf (generated)

012127004.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127004.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127004.mol 012127004.PUBCHEM 012127004.mol (via Jmol)
012127005.b3lyp_6-31g(d).inp

012127005.b3lyp_6-31g(d).qchem.inp (generated)

012127005.b3lyp_6-31g(d).gjf (generated)

012127005.b3lyp_6-31g(d).firefly.inp (generated)

012127005.b3lyp_6-31g(d).smash.inp (generated)

012127005.b3lyp_6-31g(d).nwchem.inp (generated) 012127005.b3lyp_6-31g(d).log.xz 012127005.td-b3lyp_6-31g+(d).inp 012127005.td-b3lyp_6-31g+(d).log.xz

012127005.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127005.td-b3lyp_6-31+g(d).gjf (generated)

012127005.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127005.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127005.mol 012127005.PUBCHEM 012127005.mol (via Jmol)
012127095.b3lyp_6-31g(d).inp

012127095.b3lyp_6-31g(d).qchem.inp (generated)

012127095.b3lyp_6-31g(d).gjf (generated)

012127095.b3lyp_6-31g(d).firefly.inp (generated)

012127095.b3lyp_6-31g(d).smash.inp (generated)

012127095.b3lyp_6-31g(d).nwchem.inp (generated) 012127095.b3lyp_6-31g(d).log.xz 012127095.td-b3lyp_6-31g+(d).inp 012127095.td-b3lyp_6-31g+(d).log.xz

012127095.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127095.td-b3lyp_6-31+g(d).gjf (generated)

012127095.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127095.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127095.mol 012127095.PUBCHEM 012127095.mol (via Jmol)
012127139.b3lyp_6-31g(d).inp

012127139.b3lyp_6-31g(d).qchem.inp (generated)

012127139.b3lyp_6-31g(d).gjf (generated)

012127139.b3lyp_6-31g(d).firefly.inp (generated)

012127139.b3lyp_6-31g(d).smash.inp (generated)

012127139.b3lyp_6-31g(d).nwchem.inp (generated) 012127139.b3lyp_6-31g(d).log.xz 012127139.td-b3lyp_6-31g+(d).inp 012127139.td-b3lyp_6-31g+(d).log.xz

012127139.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127139.td-b3lyp_6-31+g(d).gjf (generated)

012127139.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127139.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127139.mol 012127139.PUBCHEM 012127139.mol (via Jmol)
012127212.b3lyp_6-31g(d).inp

012127212.b3lyp_6-31g(d).qchem.inp (generated)

012127212.b3lyp_6-31g(d).gjf (generated)

012127212.b3lyp_6-31g(d).firefly.inp (generated)

012127212.b3lyp_6-31g(d).smash.inp (generated)

012127212.b3lyp_6-31g(d).nwchem.inp (generated) 012127212.b3lyp_6-31g(d).log.xz 012127212.td-b3lyp_6-31g+(d).inp 012127212.td-b3lyp_6-31g+(d).log.xz

012127212.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127212.td-b3lyp_6-31+g(d).gjf (generated)

012127212.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127212.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127212.mol 012127212.PUBCHEM 012127212.mol (via Jmol)
012127311.b3lyp_6-31g(d).inp

012127311.b3lyp_6-31g(d).qchem.inp (generated)

012127311.b3lyp_6-31g(d).gjf (generated)

012127311.b3lyp_6-31g(d).firefly.inp (generated)

012127311.b3lyp_6-31g(d).smash.inp (generated)

012127311.b3lyp_6-31g(d).nwchem.inp (generated) 012127311.b3lyp_6-31g(d).log.xz 012127311.td-b3lyp_6-31g+(d).inp 012127311.td-b3lyp_6-31g+(d).log.xz

012127311.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127311.td-b3lyp_6-31+g(d).gjf (generated)

012127311.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127311.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127311.mol 012127311.PUBCHEM 012127311.mol (via Jmol)
012127318.b3lyp_6-31g(d).inp

012127318.b3lyp_6-31g(d).qchem.inp (generated)

012127318.b3lyp_6-31g(d).gjf (generated)

012127318.b3lyp_6-31g(d).firefly.inp (generated)

012127318.b3lyp_6-31g(d).smash.inp (generated)

012127318.b3lyp_6-31g(d).nwchem.inp (generated) 012127318.b3lyp_6-31g(d).log.xz 012127318.td-b3lyp_6-31g+(d).inp 012127318.td-b3lyp_6-31g+(d).log.xz

012127318.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127318.td-b3lyp_6-31+g(d).gjf (generated)

012127318.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127318.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127318.mol 012127318.PUBCHEM 012127318.mol (via Jmol)
012127338.b3lyp_6-31g(d).inp

012127338.b3lyp_6-31g(d).qchem.inp (generated)

012127338.b3lyp_6-31g(d).gjf (generated)

012127338.b3lyp_6-31g(d).firefly.inp (generated)

012127338.b3lyp_6-31g(d).smash.inp (generated)

012127338.b3lyp_6-31g(d).nwchem.inp (generated) 012127338.b3lyp_6-31g(d).log.xz 012127338.td-b3lyp_6-31g+(d).inp 012127338.td-b3lyp_6-31g+(d).log.xz

012127338.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127338.td-b3lyp_6-31+g(d).gjf (generated)

012127338.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127338.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127338.mol 012127338.PUBCHEM 012127338.mol (via Jmol)
012127411.b3lyp_6-31g(d).inp

012127411.b3lyp_6-31g(d).qchem.inp (generated)

012127411.b3lyp_6-31g(d).gjf (generated)

012127411.b3lyp_6-31g(d).firefly.inp (generated)

012127411.b3lyp_6-31g(d).smash.inp (generated)

012127411.b3lyp_6-31g(d).nwchem.inp (generated) 012127411.b3lyp_6-31g(d).log.xz 012127411.td-b3lyp_6-31g+(d).inp 012127411.td-b3lyp_6-31g+(d).log.xz

012127411.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127411.td-b3lyp_6-31+g(d).gjf (generated)

012127411.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127411.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127411.mol 012127411.PUBCHEM 012127411.mol (via Jmol)
012127412.b3lyp_6-31g(d).inp

012127412.b3lyp_6-31g(d).qchem.inp (generated)

012127412.b3lyp_6-31g(d).gjf (generated)

012127412.b3lyp_6-31g(d).firefly.inp (generated)

012127412.b3lyp_6-31g(d).smash.inp (generated)

012127412.b3lyp_6-31g(d).nwchem.inp (generated) 012127412.b3lyp_6-31g(d).log.xz 012127412.mol 012127412.PUBCHEM 012127412.mol (via Jmol)
012127463.b3lyp_6-31g(d).inp

012127463.b3lyp_6-31g(d).qchem.inp (generated)

012127463.b3lyp_6-31g(d).gjf (generated)

012127463.b3lyp_6-31g(d).firefly.inp (generated)

012127463.b3lyp_6-31g(d).smash.inp (generated)

012127463.b3lyp_6-31g(d).nwchem.inp (generated) 012127463.b3lyp_6-31g(d).log.xz 012127463.td-b3lyp_6-31g+(d).inp 012127463.td-b3lyp_6-31g+(d).log.xz

012127463.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127463.td-b3lyp_6-31+g(d).gjf (generated)

012127463.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127463.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127463.mol 012127463.PUBCHEM 012127463.mol (via Jmol)
012127465.b3lyp_6-31g(d).inp

012127465.b3lyp_6-31g(d).qchem.inp (generated)

012127465.b3lyp_6-31g(d).gjf (generated)

012127465.b3lyp_6-31g(d).firefly.inp (generated)

012127465.b3lyp_6-31g(d).smash.inp (generated)

012127465.b3lyp_6-31g(d).nwchem.inp (generated) 012127465.b3lyp_6-31g(d).log.xz 012127465.td-b3lyp_6-31g+(d).inp 012127465.td-b3lyp_6-31g+(d).log.xz

012127465.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127465.td-b3lyp_6-31+g(d).gjf (generated)

012127465.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127465.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127465.mol 012127465.PUBCHEM 012127465.mol (via Jmol)
012127467.b3lyp_6-31g(d).inp

012127467.b3lyp_6-31g(d).qchem.inp (generated)

012127467.b3lyp_6-31g(d).gjf (generated)

012127467.b3lyp_6-31g(d).firefly.inp (generated)

012127467.b3lyp_6-31g(d).smash.inp (generated)

012127467.b3lyp_6-31g(d).nwchem.inp (generated) 012127467.b3lyp_6-31g(d).log.xz 012127467.td-b3lyp_6-31g+(d).inp 012127467.td-b3lyp_6-31g+(d).log.xz

012127467.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127467.td-b3lyp_6-31+g(d).gjf (generated)

012127467.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127467.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127467.mol 012127467.PUBCHEM 012127467.mol (via Jmol)
012127489.b3lyp_6-31g(d).inp

012127489.b3lyp_6-31g(d).qchem.inp (generated)

012127489.b3lyp_6-31g(d).gjf (generated)

012127489.b3lyp_6-31g(d).firefly.inp (generated)

012127489.b3lyp_6-31g(d).smash.inp (generated)

012127489.b3lyp_6-31g(d).nwchem.inp (generated) 012127489.b3lyp_6-31g(d).log.xz 012127489.mol 012127489.PUBCHEM 012127489.mol (via Jmol)
012127490.b3lyp_6-31g(d).inp

012127490.b3lyp_6-31g(d).qchem.inp (generated)

012127490.b3lyp_6-31g(d).gjf (generated)

012127490.b3lyp_6-31g(d).firefly.inp (generated)

012127490.b3lyp_6-31g(d).smash.inp (generated)

012127490.b3lyp_6-31g(d).nwchem.inp (generated) 012127490.b3lyp_6-31g(d).log.xz 012127490.td-b3lyp_6-31g+(d).inp 012127490.td-b3lyp_6-31g+(d).log.xz

012127490.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127490.td-b3lyp_6-31+g(d).gjf (generated)

012127490.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127490.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127490.mol 012127490.PUBCHEM 012127490.mol (via Jmol)
012127498.b3lyp_6-31g(d).inp

012127498.b3lyp_6-31g(d).qchem.inp (generated)

012127498.b3lyp_6-31g(d).gjf (generated)

012127498.b3lyp_6-31g(d).firefly.inp (generated)

012127498.b3lyp_6-31g(d).smash.inp (generated)

012127498.b3lyp_6-31g(d).nwchem.inp (generated) 012127498.b3lyp_6-31g(d).log.xz 012127498.td-b3lyp_6-31g+(d).inp 012127498.td-b3lyp_6-31g+(d).log.xz

012127498.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127498.td-b3lyp_6-31+g(d).gjf (generated)

012127498.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127498.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127498.mol 012127498.PUBCHEM 012127498.mol (via Jmol)
012127502.b3lyp_6-31g(d).inp

012127502.b3lyp_6-31g(d).qchem.inp (generated)

012127502.b3lyp_6-31g(d).gjf (generated)

012127502.b3lyp_6-31g(d).firefly.inp (generated)

012127502.b3lyp_6-31g(d).smash.inp (generated)

012127502.b3lyp_6-31g(d).nwchem.inp (generated) 012127502.b3lyp_6-31g(d).log.xz 012127502.td-b3lyp_6-31g+(d).inp 012127502.td-b3lyp_6-31g+(d).log.xz

012127502.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127502.td-b3lyp_6-31+g(d).gjf (generated)

012127502.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127502.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127502.mol 012127502.PUBCHEM 012127502.mol (via Jmol)
012127709.b3lyp_6-31g(d).inp

012127709.b3lyp_6-31g(d).qchem.inp (generated)

012127709.b3lyp_6-31g(d).gjf (generated)

012127709.b3lyp_6-31g(d).firefly.inp (generated)

012127709.b3lyp_6-31g(d).smash.inp (generated)

012127709.b3lyp_6-31g(d).nwchem.inp (generated) 012127709.b3lyp_6-31g(d).log.xz 012127709.td-b3lyp_6-31g+(d).inp 012127709.td-b3lyp_6-31g+(d).log.xz

012127709.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127709.td-b3lyp_6-31+g(d).gjf (generated)

012127709.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127709.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127709.mol 012127709.PUBCHEM 012127709.mol (via Jmol)
012127753.b3lyp_6-31g(d).inp

012127753.b3lyp_6-31g(d).qchem.inp (generated)

012127753.b3lyp_6-31g(d).gjf (generated)

012127753.b3lyp_6-31g(d).firefly.inp (generated)

012127753.b3lyp_6-31g(d).smash.inp (generated)

012127753.b3lyp_6-31g(d).nwchem.inp (generated) 012127753.b3lyp_6-31g(d).log.xz 012127753.td-b3lyp_6-31g+(d).inp 012127753.td-b3lyp_6-31g+(d).log.xz

012127753.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127753.td-b3lyp_6-31+g(d).gjf (generated)

012127753.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127753.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127753.mol 012127753.PUBCHEM 012127753.mol (via Jmol)
012127818.b3lyp_6-31g(d).inp

012127818.b3lyp_6-31g(d).qchem.inp (generated)

012127818.b3lyp_6-31g(d).gjf (generated)

012127818.b3lyp_6-31g(d).firefly.inp (generated)

012127818.b3lyp_6-31g(d).smash.inp (generated)

012127818.b3lyp_6-31g(d).nwchem.inp (generated) 012127818.b3lyp_6-31g(d).log.xz 012127818.td-b3lyp_6-31g+(d).inp 012127818.td-b3lyp_6-31g+(d).log.xz

012127818.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127818.td-b3lyp_6-31+g(d).gjf (generated)

012127818.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127818.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127818.mol 012127818.PUBCHEM 012127818.mol (via Jmol)
012127821.b3lyp_6-31g(d).inp

012127821.b3lyp_6-31g(d).qchem.inp (generated)

012127821.b3lyp_6-31g(d).gjf (generated)

012127821.b3lyp_6-31g(d).firefly.inp (generated)

012127821.b3lyp_6-31g(d).smash.inp (generated)

012127821.b3lyp_6-31g(d).nwchem.inp (generated) 012127821.b3lyp_6-31g(d).log.xz 012127821.td-b3lyp_6-31g+(d).inp 012127821.td-b3lyp_6-31g+(d).log.xz

012127821.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127821.td-b3lyp_6-31+g(d).gjf (generated)

012127821.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127821.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127821.mol 012127821.PUBCHEM 012127821.mol (via Jmol)
012127823.b3lyp_6-31g(d).inp

012127823.b3lyp_6-31g(d).qchem.inp (generated)

012127823.b3lyp_6-31g(d).gjf (generated)

012127823.b3lyp_6-31g(d).firefly.inp (generated)

012127823.b3lyp_6-31g(d).smash.inp (generated)

012127823.b3lyp_6-31g(d).nwchem.inp (generated) 012127823.b3lyp_6-31g(d).log.xz 012127823.mol 012127823.PUBCHEM 012127823.mol (via Jmol)
012127825.b3lyp_6-31g(d).inp

012127825.b3lyp_6-31g(d).qchem.inp (generated)

012127825.b3lyp_6-31g(d).gjf (generated)

012127825.b3lyp_6-31g(d).firefly.inp (generated)

012127825.b3lyp_6-31g(d).smash.inp (generated)

012127825.b3lyp_6-31g(d).nwchem.inp (generated) 012127825.b3lyp_6-31g(d).log.xz 012127825.td-b3lyp_6-31g+(d).inp 012127825.td-b3lyp_6-31g+(d).log.xz

012127825.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127825.td-b3lyp_6-31+g(d).gjf (generated)

012127825.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127825.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127825.mol 012127825.PUBCHEM 012127825.mol (via Jmol)
012127848.b3lyp_6-31g(d).inp

012127848.b3lyp_6-31g(d).qchem.inp (generated)

012127848.b3lyp_6-31g(d).gjf (generated)

012127848.b3lyp_6-31g(d).firefly.inp (generated)

012127848.b3lyp_6-31g(d).smash.inp (generated)

012127848.b3lyp_6-31g(d).nwchem.inp (generated) 012127848.b3lyp_6-31g(d).log.xz 012127848.td-b3lyp_6-31g+(d).inp 012127848.td-b3lyp_6-31g+(d).log.xz

012127848.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127848.td-b3lyp_6-31+g(d).gjf (generated)

012127848.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127848.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127848.mol 012127848.PUBCHEM 012127848.mol (via Jmol)
012127855.b3lyp_6-31g(d).inp

012127855.b3lyp_6-31g(d).qchem.inp (generated)

012127855.b3lyp_6-31g(d).gjf (generated)

012127855.b3lyp_6-31g(d).firefly.inp (generated)

012127855.b3lyp_6-31g(d).smash.inp (generated)

012127855.b3lyp_6-31g(d).nwchem.inp (generated) 012127855.b3lyp_6-31g(d).log.xz 012127855.td-b3lyp_6-31g+(d).inp 012127855.td-b3lyp_6-31g+(d).log.xz

012127855.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127855.td-b3lyp_6-31+g(d).gjf (generated)

012127855.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127855.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127855.mol 012127855.PUBCHEM 012127855.mol (via Jmol)
012127885.b3lyp_6-31g(d).inp

012127885.b3lyp_6-31g(d).qchem.inp (generated)

012127885.b3lyp_6-31g(d).gjf (generated)

012127885.b3lyp_6-31g(d).firefly.inp (generated)

012127885.b3lyp_6-31g(d).smash.inp (generated)

012127885.b3lyp_6-31g(d).nwchem.inp (generated) 012127885.b3lyp_6-31g(d).log.xz 012127885.td-b3lyp_6-31g+(d).inp 012127885.td-b3lyp_6-31g+(d).log.xz

012127885.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127885.td-b3lyp_6-31+g(d).gjf (generated)

012127885.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127885.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127885.mol 012127885.PUBCHEM 012127885.mol (via Jmol)
012127897.b3lyp_6-31g(d).inp

012127897.b3lyp_6-31g(d).qchem.inp (generated)

012127897.b3lyp_6-31g(d).gjf (generated)

012127897.b3lyp_6-31g(d).firefly.inp (generated)

012127897.b3lyp_6-31g(d).smash.inp (generated)

012127897.b3lyp_6-31g(d).nwchem.inp (generated) 012127897.b3lyp_6-31g(d).log.xz 012127897.td-b3lyp_6-31g+(d).inp 012127897.td-b3lyp_6-31g+(d).log.xz

012127897.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127897.td-b3lyp_6-31+g(d).gjf (generated)

012127897.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127897.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127897.mol 012127897.PUBCHEM 012127897.mol (via Jmol)
012127898.b3lyp_6-31g(d).inp

012127898.b3lyp_6-31g(d).qchem.inp (generated)

012127898.b3lyp_6-31g(d).gjf (generated)

012127898.b3lyp_6-31g(d).firefly.inp (generated)

012127898.b3lyp_6-31g(d).smash.inp (generated)

012127898.b3lyp_6-31g(d).nwchem.inp (generated) 012127898.b3lyp_6-31g(d).log.xz 012127898.td-b3lyp_6-31g+(d).inp 012127898.td-b3lyp_6-31g+(d).log.xz

012127898.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127898.td-b3lyp_6-31+g(d).gjf (generated)

012127898.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127898.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127898.mol 012127898.PUBCHEM 012127898.mol (via Jmol)
012127913.b3lyp_6-31g(d).inp

012127913.b3lyp_6-31g(d).qchem.inp (generated)

012127913.b3lyp_6-31g(d).gjf (generated)

012127913.b3lyp_6-31g(d).firefly.inp (generated)

012127913.b3lyp_6-31g(d).smash.inp (generated)

012127913.b3lyp_6-31g(d).nwchem.inp (generated) 012127913.b3lyp_6-31g(d).log.xz 012127913.td-b3lyp_6-31g+(d).inp 012127913.td-b3lyp_6-31g+(d).log.xz

012127913.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127913.td-b3lyp_6-31+g(d).gjf (generated)

012127913.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127913.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127913.mol 012127913.PUBCHEM 012127913.mol (via Jmol)
012127977.b3lyp_6-31g(d).inp

012127977.b3lyp_6-31g(d).qchem.inp (generated)

012127977.b3lyp_6-31g(d).gjf (generated)

012127977.b3lyp_6-31g(d).firefly.inp (generated)

012127977.b3lyp_6-31g(d).smash.inp (generated)

012127977.b3lyp_6-31g(d).nwchem.inp (generated) 012127977.b3lyp_6-31g(d).log.xz 012127977.td-b3lyp_6-31g+(d).inp 012127977.td-b3lyp_6-31g+(d).log.xz

012127977.td-b3lyp_6-31+g(d).qchem.inp (generated)

012127977.td-b3lyp_6-31+g(d).gjf (generated)

012127977.td-b3lyp_6-31+g(d).firefly.inp (generated)

012127977.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012127977.mol 012127977.PUBCHEM 012127977.mol (via Jmol)
012127978.b3lyp_6-31g(d).inp

012127978.b3lyp_6-31g(d).qchem.inp (generated)

012127978.b3lyp_6-31g(d).gjf (generated)

012127978.b3lyp_6-31g(d).firefly.inp (generated)

012127978.b3lyp_6-31g(d).smash.inp (generated)

012127978.b3lyp_6-31g(d).nwchem.inp (generated) 012127978.b3lyp_6-31g(d).log.xz 012127978.mol 012127978.PUBCHEM 012127978.mol (via Jmol)
012127979.b3lyp_6-31g(d).inp

012127979.b3lyp_6-31g(d).qchem.inp (generated)

012127979.b3lyp_6-31g(d).gjf (generated)

012127979.b3lyp_6-31g(d).firefly.inp (generated)

012127979.b3lyp_6-31g(d).smash.inp (generated)

012127979.b3lyp_6-31g(d).nwchem.inp (generated) 012127979.b3lyp_6-31g(d).log.xz 012127979.mol 012127979.PUBCHEM 012127979.mol (via Jmol)
012128071.b3lyp_6-31g(d).inp

012128071.b3lyp_6-31g(d).qchem.inp (generated)

012128071.b3lyp_6-31g(d).gjf (generated)

012128071.b3lyp_6-31g(d).firefly.inp (generated)

012128071.b3lyp_6-31g(d).smash.inp (generated)

012128071.b3lyp_6-31g(d).nwchem.inp (generated) 012128071.b3lyp_6-31g(d).log.xz 012128071.td-b3lyp_6-31g+(d).inp 012128071.td-b3lyp_6-31g+(d).log.xz

012128071.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128071.td-b3lyp_6-31+g(d).gjf (generated)

012128071.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128071.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128071.mol 012128071.PUBCHEM 012128071.mol (via Jmol)
012128088.b3lyp_6-31g(d).inp

012128088.b3lyp_6-31g(d).qchem.inp (generated)

012128088.b3lyp_6-31g(d).gjf (generated)

012128088.b3lyp_6-31g(d).firefly.inp (generated)

012128088.b3lyp_6-31g(d).smash.inp (generated)

012128088.b3lyp_6-31g(d).nwchem.inp (generated) 012128088.b3lyp_6-31g(d).log.xz 012128088.td-b3lyp_6-31g+(d).inp 012128088.td-b3lyp_6-31g+(d).log.xz

012128088.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128088.td-b3lyp_6-31+g(d).gjf (generated)

012128088.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128088.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128088.mol 012128088.PUBCHEM 012128088.mol (via Jmol)
012128089.b3lyp_6-31g(d).inp

012128089.b3lyp_6-31g(d).qchem.inp (generated)

012128089.b3lyp_6-31g(d).gjf (generated)

012128089.b3lyp_6-31g(d).firefly.inp (generated)

012128089.b3lyp_6-31g(d).smash.inp (generated)

012128089.b3lyp_6-31g(d).nwchem.inp (generated) 012128089.b3lyp_6-31g(d).log.xz 012128089.td-b3lyp_6-31g+(d).inp 012128089.td-b3lyp_6-31g+(d).log.xz

012128089.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128089.td-b3lyp_6-31+g(d).gjf (generated)

012128089.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128089.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128089.mol 012128089.PUBCHEM 012128089.mol (via Jmol)
012128107.b3lyp_6-31g(d).inp

012128107.b3lyp_6-31g(d).qchem.inp (generated)

012128107.b3lyp_6-31g(d).gjf (generated)

012128107.b3lyp_6-31g(d).firefly.inp (generated)

012128107.b3lyp_6-31g(d).smash.inp (generated)

012128107.b3lyp_6-31g(d).nwchem.inp (generated) 012128107.b3lyp_6-31g(d).log.xz 012128107.td-b3lyp_6-31g+(d).inp 012128107.td-b3lyp_6-31g+(d).log.xz

012128107.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128107.td-b3lyp_6-31+g(d).gjf (generated)

012128107.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128107.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128107.mol 012128107.PUBCHEM 012128107.mol (via Jmol)
012128108.b3lyp_6-31g(d).inp

012128108.b3lyp_6-31g(d).qchem.inp (generated)

012128108.b3lyp_6-31g(d).gjf (generated)

012128108.b3lyp_6-31g(d).firefly.inp (generated)

012128108.b3lyp_6-31g(d).smash.inp (generated)

012128108.b3lyp_6-31g(d).nwchem.inp (generated) 012128108.b3lyp_6-31g(d).log.xz 012128108.mol 012128108.PUBCHEM 012128108.mol (via Jmol)
012128109.b3lyp_6-31g(d).inp

012128109.b3lyp_6-31g(d).qchem.inp (generated)

012128109.b3lyp_6-31g(d).gjf (generated)

012128109.b3lyp_6-31g(d).firefly.inp (generated)

012128109.b3lyp_6-31g(d).smash.inp (generated)

012128109.b3lyp_6-31g(d).nwchem.inp (generated) 012128109.b3lyp_6-31g(d).log.xz 012128109.td-b3lyp_6-31g+(d).inp 012128109.td-b3lyp_6-31g+(d).log.xz

012128109.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128109.td-b3lyp_6-31+g(d).gjf (generated)

012128109.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128109.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128109.mol 012128109.PUBCHEM 012128109.mol (via Jmol)
012128110.b3lyp_6-31g(d).inp

012128110.b3lyp_6-31g(d).qchem.inp (generated)

012128110.b3lyp_6-31g(d).gjf (generated)

012128110.b3lyp_6-31g(d).firefly.inp (generated)

012128110.b3lyp_6-31g(d).smash.inp (generated)

012128110.b3lyp_6-31g(d).nwchem.inp (generated) 012128110.b3lyp_6-31g(d).log.xz 012128110.td-b3lyp_6-31g+(d).inp 012128110.td-b3lyp_6-31g+(d).log.xz

012128110.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128110.td-b3lyp_6-31+g(d).gjf (generated)

012128110.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128110.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128110.mol 012128110.PUBCHEM 012128110.mol (via Jmol)
012128112.b3lyp_6-31g(d).inp

012128112.b3lyp_6-31g(d).qchem.inp (generated)

012128112.b3lyp_6-31g(d).gjf (generated)

012128112.b3lyp_6-31g(d).firefly.inp (generated)

012128112.b3lyp_6-31g(d).smash.inp (generated)

012128112.b3lyp_6-31g(d).nwchem.inp (generated) 012128112.b3lyp_6-31g(d).log.xz 012128112.td-b3lyp_6-31g+(d).inp 012128112.td-b3lyp_6-31g+(d).log.xz

012128112.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128112.td-b3lyp_6-31+g(d).gjf (generated)

012128112.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128112.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128112.mol 012128112.PUBCHEM 012128112.mol (via Jmol)
012128114.b3lyp_6-31g(d).inp

012128114.b3lyp_6-31g(d).qchem.inp (generated)

012128114.b3lyp_6-31g(d).gjf (generated)

012128114.b3lyp_6-31g(d).firefly.inp (generated)

012128114.b3lyp_6-31g(d).smash.inp (generated)

012128114.b3lyp_6-31g(d).nwchem.inp (generated) 012128114.b3lyp_6-31g(d).log.xz 012128114.td-b3lyp_6-31g+(d).inp 012128114.td-b3lyp_6-31g+(d).log.xz

012128114.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128114.td-b3lyp_6-31+g(d).gjf (generated)

012128114.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128114.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128114.mol 012128114.PUBCHEM 012128114.mol (via Jmol)
012128168.b3lyp_6-31g(d).inp

012128168.b3lyp_6-31g(d).qchem.inp (generated)

012128168.b3lyp_6-31g(d).gjf (generated)

012128168.b3lyp_6-31g(d).firefly.inp (generated)

012128168.b3lyp_6-31g(d).smash.inp (generated)

012128168.b3lyp_6-31g(d).nwchem.inp (generated) 012128168.b3lyp_6-31g(d).log.xz 012128168.mol 012128168.PUBCHEM 012128168.mol (via Jmol)
012128201.b3lyp_6-31g(d).inp

012128201.b3lyp_6-31g(d).qchem.inp (generated)

012128201.b3lyp_6-31g(d).gjf (generated)

012128201.b3lyp_6-31g(d).firefly.inp (generated)

012128201.b3lyp_6-31g(d).smash.inp (generated)

012128201.b3lyp_6-31g(d).nwchem.inp (generated) 012128201.b3lyp_6-31g(d).log.xz 012128201.td-b3lyp_6-31g+(d).inp 012128201.td-b3lyp_6-31g+(d).log.xz

012128201.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128201.td-b3lyp_6-31+g(d).gjf (generated)

012128201.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128201.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128201.mol 012128201.PUBCHEM 012128201.mol (via Jmol)
012128224.b3lyp_6-31g(d).inp

012128224.b3lyp_6-31g(d).qchem.inp (generated)

012128224.b3lyp_6-31g(d).gjf (generated)

012128224.b3lyp_6-31g(d).firefly.inp (generated)

012128224.b3lyp_6-31g(d).smash.inp (generated)

012128224.b3lyp_6-31g(d).nwchem.inp (generated) 012128224.b3lyp_6-31g(d).log.xz 012128224.td-b3lyp_6-31g+(d).inp 012128224.td-b3lyp_6-31g+(d).log.xz

012128224.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128224.td-b3lyp_6-31+g(d).gjf (generated)

012128224.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128224.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128224.mol 012128224.PUBCHEM 012128224.mol (via Jmol)
012128265.b3lyp_6-31g(d).inp

012128265.b3lyp_6-31g(d).qchem.inp (generated)

012128265.b3lyp_6-31g(d).gjf (generated)

012128265.b3lyp_6-31g(d).firefly.inp (generated)

012128265.b3lyp_6-31g(d).smash.inp (generated)

012128265.b3lyp_6-31g(d).nwchem.inp (generated) 012128265.b3lyp_6-31g(d).log.xz 012128265.td-b3lyp_6-31g+(d).inp 012128265.td-b3lyp_6-31g+(d).log.xz

012128265.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128265.td-b3lyp_6-31+g(d).gjf (generated)

012128265.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128265.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128265.mol 012128265.PUBCHEM 012128265.mol (via Jmol)
012128266.b3lyp_6-31g(d).inp

012128266.b3lyp_6-31g(d).qchem.inp (generated)

012128266.b3lyp_6-31g(d).gjf (generated)

012128266.b3lyp_6-31g(d).firefly.inp (generated)

012128266.b3lyp_6-31g(d).smash.inp (generated)

012128266.b3lyp_6-31g(d).nwchem.inp (generated) 012128266.b3lyp_6-31g(d).log.xz 012128266.td-b3lyp_6-31g+(d).inp 012128266.td-b3lyp_6-31g+(d).log.xz

012128266.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128266.td-b3lyp_6-31+g(d).gjf (generated)

012128266.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128266.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128266.mol 012128266.PUBCHEM 012128266.mol (via Jmol)
012128280.b3lyp_6-31g(d).inp

012128280.b3lyp_6-31g(d).qchem.inp (generated)

012128280.b3lyp_6-31g(d).gjf (generated)

012128280.b3lyp_6-31g(d).firefly.inp (generated)

012128280.b3lyp_6-31g(d).smash.inp (generated)

012128280.b3lyp_6-31g(d).nwchem.inp (generated) 012128280.b3lyp_6-31g(d).log.xz 012128280.td-b3lyp_6-31g+(d).inp 012128280.td-b3lyp_6-31g+(d).log.xz

012128280.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128280.td-b3lyp_6-31+g(d).gjf (generated)

012128280.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128280.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128280.mol 012128280.PUBCHEM 012128280.mol (via Jmol)
012128281.b3lyp_6-31g(d).inp

012128281.b3lyp_6-31g(d).qchem.inp (generated)

012128281.b3lyp_6-31g(d).gjf (generated)

012128281.b3lyp_6-31g(d).firefly.inp (generated)

012128281.b3lyp_6-31g(d).smash.inp (generated)

012128281.b3lyp_6-31g(d).nwchem.inp (generated) 012128281.b3lyp_6-31g(d).log.xz 012128281.td-b3lyp_6-31g+(d).inp 012128281.td-b3lyp_6-31g+(d).log.xz

012128281.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128281.td-b3lyp_6-31+g(d).gjf (generated)

012128281.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128281.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128281.mol 012128281.PUBCHEM 012128281.mol (via Jmol)
012128363.b3lyp_6-31g(d).inp

012128363.b3lyp_6-31g(d).qchem.inp (generated)

012128363.b3lyp_6-31g(d).gjf (generated)

012128363.b3lyp_6-31g(d).firefly.inp (generated)

012128363.b3lyp_6-31g(d).smash.inp (generated)

012128363.b3lyp_6-31g(d).nwchem.inp (generated) 012128363.b3lyp_6-31g(d).log.xz 012128363.td-b3lyp_6-31g+(d).inp 012128363.td-b3lyp_6-31g+(d).log.xz

012128363.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128363.td-b3lyp_6-31+g(d).gjf (generated)

012128363.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128363.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128363.mol 012128363.PUBCHEM 012128363.mol (via Jmol)
012128364.b3lyp_6-31g(d).inp

012128364.b3lyp_6-31g(d).qchem.inp (generated)

012128364.b3lyp_6-31g(d).gjf (generated)

012128364.b3lyp_6-31g(d).firefly.inp (generated)

012128364.b3lyp_6-31g(d).smash.inp (generated)

012128364.b3lyp_6-31g(d).nwchem.inp (generated) 012128364.b3lyp_6-31g(d).log.xz 012128364.td-b3lyp_6-31g+(d).inp 012128364.td-b3lyp_6-31g+(d).log.xz

012128364.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128364.td-b3lyp_6-31+g(d).gjf (generated)

012128364.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128364.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128364.mol 012128364.PUBCHEM 012128364.mol (via Jmol)
012128365.b3lyp_6-31g(d).inp

012128365.b3lyp_6-31g(d).qchem.inp (generated)

012128365.b3lyp_6-31g(d).gjf (generated)

012128365.b3lyp_6-31g(d).firefly.inp (generated)

012128365.b3lyp_6-31g(d).smash.inp (generated)

012128365.b3lyp_6-31g(d).nwchem.inp (generated) 012128365.b3lyp_6-31g(d).log.xz 012128365.td-b3lyp_6-31g+(d).inp 012128365.td-b3lyp_6-31g+(d).log.xz

012128365.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128365.td-b3lyp_6-31+g(d).gjf (generated)

012128365.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128365.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128365.mol 012128365.PUBCHEM 012128365.mol (via Jmol)
012128366.b3lyp_6-31g(d).inp

012128366.b3lyp_6-31g(d).qchem.inp (generated)

012128366.b3lyp_6-31g(d).gjf (generated)

012128366.b3lyp_6-31g(d).firefly.inp (generated)

012128366.b3lyp_6-31g(d).smash.inp (generated)

012128366.b3lyp_6-31g(d).nwchem.inp (generated) 012128366.b3lyp_6-31g(d).log.xz 012128366.td-b3lyp_6-31g+(d).inp 012128366.td-b3lyp_6-31g+(d).log.xz

012128366.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128366.td-b3lyp_6-31+g(d).gjf (generated)

012128366.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128366.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128366.mol 012128366.PUBCHEM 012128366.mol (via Jmol)
012128367.b3lyp_6-31g(d).inp

012128367.b3lyp_6-31g(d).qchem.inp (generated)

012128367.b3lyp_6-31g(d).gjf (generated)

012128367.b3lyp_6-31g(d).firefly.inp (generated)

012128367.b3lyp_6-31g(d).smash.inp (generated)

012128367.b3lyp_6-31g(d).nwchem.inp (generated) 012128367.b3lyp_6-31g(d).log.xz 012128367.td-b3lyp_6-31g+(d).inp 012128367.td-b3lyp_6-31g+(d).log.xz

012128367.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128367.td-b3lyp_6-31+g(d).gjf (generated)

012128367.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128367.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128367.mol 012128367.PUBCHEM 012128367.mol (via Jmol)
012128368.b3lyp_6-31g(d).inp

012128368.b3lyp_6-31g(d).qchem.inp (generated)

012128368.b3lyp_6-31g(d).gjf (generated)

012128368.b3lyp_6-31g(d).firefly.inp (generated)

012128368.b3lyp_6-31g(d).smash.inp (generated)

012128368.b3lyp_6-31g(d).nwchem.inp (generated) 012128368.b3lyp_6-31g(d).log.xz 012128368.td-b3lyp_6-31g+(d).inp 012128368.td-b3lyp_6-31g+(d).log.xz

012128368.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128368.td-b3lyp_6-31+g(d).gjf (generated)

012128368.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128368.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128368.mol 012128368.PUBCHEM 012128368.mol (via Jmol)
012128373.b3lyp_6-31g(d).inp

012128373.b3lyp_6-31g(d).qchem.inp (generated)

012128373.b3lyp_6-31g(d).gjf (generated)

012128373.b3lyp_6-31g(d).firefly.inp (generated)

012128373.b3lyp_6-31g(d).smash.inp (generated)

012128373.b3lyp_6-31g(d).nwchem.inp (generated) 012128373.b3lyp_6-31g(d).log.xz 012128373.td-b3lyp_6-31g+(d).inp 012128373.td-b3lyp_6-31g+(d).log.xz

012128373.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128373.td-b3lyp_6-31+g(d).gjf (generated)

012128373.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128373.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128373.mol 012128373.PUBCHEM 012128373.mol (via Jmol)
012128374.b3lyp_6-31g(d).inp

012128374.b3lyp_6-31g(d).qchem.inp (generated)

012128374.b3lyp_6-31g(d).gjf (generated)

012128374.b3lyp_6-31g(d).firefly.inp (generated)

012128374.b3lyp_6-31g(d).smash.inp (generated)

012128374.b3lyp_6-31g(d).nwchem.inp (generated) 012128374.b3lyp_6-31g(d).log.xz 012128374.mol 012128374.PUBCHEM 012128374.mol (via Jmol)
012128424.b3lyp_6-31g(d).inp

012128424.b3lyp_6-31g(d).qchem.inp (generated)

012128424.b3lyp_6-31g(d).gjf (generated)

012128424.b3lyp_6-31g(d).firefly.inp (generated)

012128424.b3lyp_6-31g(d).smash.inp (generated)

012128424.b3lyp_6-31g(d).nwchem.inp (generated) 012128424.b3lyp_6-31g(d).log.xz 012128424.td-b3lyp_6-31g+(d).inp 012128424.td-b3lyp_6-31g+(d).log.xz

012128424.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128424.td-b3lyp_6-31+g(d).gjf (generated)

012128424.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128424.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128424.mol 012128424.PUBCHEM 012128424.mol (via Jmol)
012128425.b3lyp_6-31g(d).inp

012128425.b3lyp_6-31g(d).qchem.inp (generated)

012128425.b3lyp_6-31g(d).gjf (generated)

012128425.b3lyp_6-31g(d).firefly.inp (generated)

012128425.b3lyp_6-31g(d).smash.inp (generated)

012128425.b3lyp_6-31g(d).nwchem.inp (generated) 012128425.b3lyp_6-31g(d).log.xz 012128425.td-b3lyp_6-31g+(d).inp 012128425.td-b3lyp_6-31g+(d).log.xz

012128425.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128425.td-b3lyp_6-31+g(d).gjf (generated)

012128425.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128425.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128425.mol 012128425.PUBCHEM 012128425.mol (via Jmol)
012128426.b3lyp_6-31g(d).inp

012128426.b3lyp_6-31g(d).qchem.inp (generated)

012128426.b3lyp_6-31g(d).gjf (generated)

012128426.b3lyp_6-31g(d).firefly.inp (generated)

012128426.b3lyp_6-31g(d).smash.inp (generated)

012128426.b3lyp_6-31g(d).nwchem.inp (generated) 012128426.b3lyp_6-31g(d).log.xz 012128426.mol 012128426.PUBCHEM 012128426.mol (via Jmol)
012128441.b3lyp_6-31g(d).inp

012128441.b3lyp_6-31g(d).qchem.inp (generated)

012128441.b3lyp_6-31g(d).gjf (generated)

012128441.b3lyp_6-31g(d).firefly.inp (generated)

012128441.b3lyp_6-31g(d).smash.inp (generated)

012128441.b3lyp_6-31g(d).nwchem.inp (generated) 012128441.b3lyp_6-31g(d).log.xz 012128441.td-b3lyp_6-31g+(d).inp 012128441.td-b3lyp_6-31g+(d).log.xz

012128441.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128441.td-b3lyp_6-31+g(d).gjf (generated)

012128441.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128441.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128441.mol 012128441.PUBCHEM 012128441.mol (via Jmol)
012128442.b3lyp_6-31g(d).inp

012128442.b3lyp_6-31g(d).qchem.inp (generated)

012128442.b3lyp_6-31g(d).gjf (generated)

012128442.b3lyp_6-31g(d).firefly.inp (generated)

012128442.b3lyp_6-31g(d).smash.inp (generated)

012128442.b3lyp_6-31g(d).nwchem.inp (generated) 012128442.b3lyp_6-31g(d).log.xz 012128442.td-b3lyp_6-31g+(d).inp 012128442.td-b3lyp_6-31g+(d).log.xz

012128442.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128442.td-b3lyp_6-31+g(d).gjf (generated)

012128442.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128442.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128442.mol 012128442.PUBCHEM 012128442.mol (via Jmol)
012128444.b3lyp_6-31g(d).inp

012128444.b3lyp_6-31g(d).qchem.inp (generated)

012128444.b3lyp_6-31g(d).gjf (generated)

012128444.b3lyp_6-31g(d).firefly.inp (generated)

012128444.b3lyp_6-31g(d).smash.inp (generated)

012128444.b3lyp_6-31g(d).nwchem.inp (generated) 012128444.b3lyp_6-31g(d).log.xz 012128444.td-b3lyp_6-31g+(d).inp 012128444.td-b3lyp_6-31g+(d).log.xz

012128444.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128444.td-b3lyp_6-31+g(d).gjf (generated)

012128444.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128444.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128444.mol 012128444.PUBCHEM 012128444.mol (via Jmol)
012128494.b3lyp_6-31g(d).inp

012128494.b3lyp_6-31g(d).qchem.inp (generated)

012128494.b3lyp_6-31g(d).gjf (generated)

012128494.b3lyp_6-31g(d).firefly.inp (generated)

012128494.b3lyp_6-31g(d).smash.inp (generated)

012128494.b3lyp_6-31g(d).nwchem.inp (generated) 012128494.b3lyp_6-31g(d).log.xz 012128494.td-b3lyp_6-31g+(d).inp 012128494.td-b3lyp_6-31g+(d).log.xz

012128494.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128494.td-b3lyp_6-31+g(d).gjf (generated)

012128494.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128494.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128494.mol 012128494.PUBCHEM 012128494.mol (via Jmol)
012128497.b3lyp_6-31g(d).inp

012128497.b3lyp_6-31g(d).qchem.inp (generated)

012128497.b3lyp_6-31g(d).gjf (generated)

012128497.b3lyp_6-31g(d).firefly.inp (generated)

012128497.b3lyp_6-31g(d).smash.inp (generated)

012128497.b3lyp_6-31g(d).nwchem.inp (generated) 012128497.b3lyp_6-31g(d).log.xz 012128497.td-b3lyp_6-31g+(d).inp 012128497.td-b3lyp_6-31g+(d).log.xz

012128497.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128497.td-b3lyp_6-31+g(d).gjf (generated)

012128497.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128497.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128497.mol 012128497.PUBCHEM 012128497.mol (via Jmol)
012128500.b3lyp_6-31g(d).inp

012128500.b3lyp_6-31g(d).qchem.inp (generated)

012128500.b3lyp_6-31g(d).gjf (generated)

012128500.b3lyp_6-31g(d).firefly.inp (generated)

012128500.b3lyp_6-31g(d).smash.inp (generated)

012128500.b3lyp_6-31g(d).nwchem.inp (generated) 012128500.b3lyp_6-31g(d).log.xz 012128500.td-b3lyp_6-31g+(d).inp 012128500.td-b3lyp_6-31g+(d).log.xz

012128500.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128500.td-b3lyp_6-31+g(d).gjf (generated)

012128500.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128500.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128500.mol 012128500.PUBCHEM 012128500.mol (via Jmol)
012128504.b3lyp_6-31g(d).inp

012128504.b3lyp_6-31g(d).qchem.inp (generated)

012128504.b3lyp_6-31g(d).gjf (generated)

012128504.b3lyp_6-31g(d).firefly.inp (generated)

012128504.b3lyp_6-31g(d).smash.inp (generated)

012128504.b3lyp_6-31g(d).nwchem.inp (generated) 012128504.b3lyp_6-31g(d).log.xz 012128504.td-b3lyp_6-31g+(d).inp 012128504.td-b3lyp_6-31g+(d).log.xz

012128504.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128504.td-b3lyp_6-31+g(d).gjf (generated)

012128504.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128504.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128504.mol 012128504.PUBCHEM 012128504.mol (via Jmol)
012128560.b3lyp_6-31g(d).inp

012128560.b3lyp_6-31g(d).qchem.inp (generated)

012128560.b3lyp_6-31g(d).gjf (generated)

012128560.b3lyp_6-31g(d).firefly.inp (generated)

012128560.b3lyp_6-31g(d).smash.inp (generated)

012128560.b3lyp_6-31g(d).nwchem.inp (generated) 012128560.b3lyp_6-31g(d).log.xz 012128560.td-b3lyp_6-31g+(d).inp 012128560.td-b3lyp_6-31g+(d).log.xz

012128560.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128560.td-b3lyp_6-31+g(d).gjf (generated)

012128560.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128560.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128560.mol 012128560.PUBCHEM 012128560.mol (via Jmol)
012128576.b3lyp_6-31g(d).inp

012128576.b3lyp_6-31g(d).qchem.inp (generated)

012128576.b3lyp_6-31g(d).gjf (generated)

012128576.b3lyp_6-31g(d).firefly.inp (generated)

012128576.b3lyp_6-31g(d).smash.inp (generated)

012128576.b3lyp_6-31g(d).nwchem.inp (generated) 012128576.b3lyp_6-31g(d).log.xz 012128576.mol 012128576.PUBCHEM 012128576.mol (via Jmol)
012128628.b3lyp_6-31g(d).inp

012128628.b3lyp_6-31g(d).qchem.inp (generated)

012128628.b3lyp_6-31g(d).gjf (generated)

012128628.b3lyp_6-31g(d).firefly.inp (generated)

012128628.b3lyp_6-31g(d).smash.inp (generated)

012128628.b3lyp_6-31g(d).nwchem.inp (generated) 012128628.b3lyp_6-31g(d).log.xz 012128628.td-b3lyp_6-31g+(d).inp 012128628.td-b3lyp_6-31g+(d).log.xz

012128628.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128628.td-b3lyp_6-31+g(d).gjf (generated)

012128628.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128628.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128628.mol 012128628.PUBCHEM 012128628.mol (via Jmol)
012128633.b3lyp_6-31g(d).inp

012128633.b3lyp_6-31g(d).qchem.inp (generated)

012128633.b3lyp_6-31g(d).gjf (generated)

012128633.b3lyp_6-31g(d).firefly.inp (generated)

012128633.b3lyp_6-31g(d).smash.inp (generated)

012128633.b3lyp_6-31g(d).nwchem.inp (generated) 012128633.b3lyp_6-31g(d).log.xz 012128633.mol 012128633.PUBCHEM 012128633.mol (via Jmol)
012128634.b3lyp_6-31g(d).inp

012128634.b3lyp_6-31g(d).qchem.inp (generated)

012128634.b3lyp_6-31g(d).gjf (generated)

012128634.b3lyp_6-31g(d).firefly.inp (generated)

012128634.b3lyp_6-31g(d).smash.inp (generated)

012128634.b3lyp_6-31g(d).nwchem.inp (generated) 012128634.b3lyp_6-31g(d).log.xz 012128634.td-b3lyp_6-31g+(d).inp 012128634.td-b3lyp_6-31g+(d).log.xz

012128634.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128634.td-b3lyp_6-31+g(d).gjf (generated)

012128634.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128634.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128634.mol 012128634.PUBCHEM 012128634.mol (via Jmol)
012128635.b3lyp_6-31g(d).inp

012128635.b3lyp_6-31g(d).qchem.inp (generated)

012128635.b3lyp_6-31g(d).gjf (generated)

012128635.b3lyp_6-31g(d).firefly.inp (generated)

012128635.b3lyp_6-31g(d).smash.inp (generated)

012128635.b3lyp_6-31g(d).nwchem.inp (generated) 012128635.b3lyp_6-31g(d).log.xz 012128635.td-b3lyp_6-31g+(d).inp 012128635.td-b3lyp_6-31g+(d).log.xz

012128635.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128635.td-b3lyp_6-31+g(d).gjf (generated)

012128635.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128635.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128635.mol 012128635.PUBCHEM 012128635.mol (via Jmol)
012128646.b3lyp_6-31g(d).inp

012128646.b3lyp_6-31g(d).qchem.inp (generated)

012128646.b3lyp_6-31g(d).gjf (generated)

012128646.b3lyp_6-31g(d).firefly.inp (generated)

012128646.b3lyp_6-31g(d).smash.inp (generated)

012128646.b3lyp_6-31g(d).nwchem.inp (generated) 012128646.b3lyp_6-31g(d).log.xz 012128646.td-b3lyp_6-31g+(d).inp 012128646.td-b3lyp_6-31g+(d).log.xz

012128646.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128646.td-b3lyp_6-31+g(d).gjf (generated)

012128646.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128646.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128646.mol 012128646.PUBCHEM 012128646.mol (via Jmol)
012128681.b3lyp_6-31g(d).inp

012128681.b3lyp_6-31g(d).qchem.inp (generated)

012128681.b3lyp_6-31g(d).gjf (generated)

012128681.b3lyp_6-31g(d).firefly.inp (generated)

012128681.b3lyp_6-31g(d).smash.inp (generated)

012128681.b3lyp_6-31g(d).nwchem.inp (generated) 012128681.b3lyp_6-31g(d).log.xz 012128681.td-b3lyp_6-31g+(d).inp 012128681.td-b3lyp_6-31g+(d).log.xz

012128681.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128681.td-b3lyp_6-31+g(d).gjf (generated)

012128681.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128681.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128681.mol 012128681.PUBCHEM 012128681.mol (via Jmol)
012128754.b3lyp_6-31g(d).inp

012128754.b3lyp_6-31g(d).qchem.inp (generated)

012128754.b3lyp_6-31g(d).gjf (generated)

012128754.b3lyp_6-31g(d).firefly.inp (generated)

012128754.b3lyp_6-31g(d).smash.inp (generated)

012128754.b3lyp_6-31g(d).nwchem.inp (generated) 012128754.b3lyp_6-31g(d).log.xz 012128754.td-b3lyp_6-31g+(d).inp 012128754.td-b3lyp_6-31g+(d).log.xz

012128754.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128754.td-b3lyp_6-31+g(d).gjf (generated)

012128754.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128754.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128754.mol 012128754.PUBCHEM 012128754.mol (via Jmol)
012128760.b3lyp_6-31g(d).inp

012128760.b3lyp_6-31g(d).qchem.inp (generated)

012128760.b3lyp_6-31g(d).gjf (generated)

012128760.b3lyp_6-31g(d).firefly.inp (generated)

012128760.b3lyp_6-31g(d).smash.inp (generated)

012128760.b3lyp_6-31g(d).nwchem.inp (generated) 012128760.b3lyp_6-31g(d).log.xz 012128760.td-b3lyp_6-31g+(d).inp 012128760.td-b3lyp_6-31g+(d).log.xz

012128760.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128760.td-b3lyp_6-31+g(d).gjf (generated)

012128760.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128760.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128760.mol 012128760.PUBCHEM 012128760.mol (via Jmol)
012128762.b3lyp_6-31g(d).inp

012128762.b3lyp_6-31g(d).qchem.inp (generated)

012128762.b3lyp_6-31g(d).gjf (generated)

012128762.b3lyp_6-31g(d).firefly.inp (generated)

012128762.b3lyp_6-31g(d).smash.inp (generated)

012128762.b3lyp_6-31g(d).nwchem.inp (generated) 012128762.b3lyp_6-31g(d).log.xz 012128762.td-b3lyp_6-31g+(d).inp 012128762.td-b3lyp_6-31g+(d).log.xz

012128762.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128762.td-b3lyp_6-31+g(d).gjf (generated)

012128762.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128762.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128762.mol 012128762.PUBCHEM 012128762.mol (via Jmol)
012128779.b3lyp_6-31g(d).inp

012128779.b3lyp_6-31g(d).qchem.inp (generated)

012128779.b3lyp_6-31g(d).gjf (generated)

012128779.b3lyp_6-31g(d).firefly.inp (generated)

012128779.b3lyp_6-31g(d).smash.inp (generated)

012128779.b3lyp_6-31g(d).nwchem.inp (generated) 012128779.b3lyp_6-31g(d).log.xz 012128779.td-b3lyp_6-31g+(d).inp 012128779.td-b3lyp_6-31g+(d).log.xz

012128779.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128779.td-b3lyp_6-31+g(d).gjf (generated)

012128779.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128779.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128779.mol 012128779.PUBCHEM 012128779.mol (via Jmol)
012128784.b3lyp_6-31g(d).inp

012128784.b3lyp_6-31g(d).qchem.inp (generated)

012128784.b3lyp_6-31g(d).gjf (generated)

012128784.b3lyp_6-31g(d).firefly.inp (generated)

012128784.b3lyp_6-31g(d).smash.inp (generated)

012128784.b3lyp_6-31g(d).nwchem.inp (generated) 012128784.b3lyp_6-31g(d).log.xz 012128784.td-b3lyp_6-31g+(d).inp 012128784.td-b3lyp_6-31g+(d).log.xz

012128784.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128784.td-b3lyp_6-31+g(d).gjf (generated)

012128784.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128784.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128784.mol 012128784.PUBCHEM 012128784.mol (via Jmol)
012128786.b3lyp_6-31g(d).inp

012128786.b3lyp_6-31g(d).qchem.inp (generated)

012128786.b3lyp_6-31g(d).gjf (generated)

012128786.b3lyp_6-31g(d).firefly.inp (generated)

012128786.b3lyp_6-31g(d).smash.inp (generated)

012128786.b3lyp_6-31g(d).nwchem.inp (generated) 012128786.b3lyp_6-31g(d).log.xz 012128786.td-b3lyp_6-31g+(d).inp 012128786.td-b3lyp_6-31g+(d).log.xz

012128786.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128786.td-b3lyp_6-31+g(d).gjf (generated)

012128786.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128786.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128786.mol 012128786.PUBCHEM 012128786.mol (via Jmol)
012128978.b3lyp_6-31g(d).inp

012128978.b3lyp_6-31g(d).qchem.inp (generated)

012128978.b3lyp_6-31g(d).gjf (generated)

012128978.b3lyp_6-31g(d).firefly.inp (generated)

012128978.b3lyp_6-31g(d).smash.inp (generated)

012128978.b3lyp_6-31g(d).nwchem.inp (generated) 012128978.b3lyp_6-31g(d).log.xz 012128978.td-b3lyp_6-31g+(d).inp 012128978.td-b3lyp_6-31g+(d).log.xz

012128978.td-b3lyp_6-31+g(d).qchem.inp (generated)

012128978.td-b3lyp_6-31+g(d).gjf (generated)

012128978.td-b3lyp_6-31+g(d).firefly.inp (generated)

012128978.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012128978.mol 012128978.PUBCHEM 012128978.mol (via Jmol)
012129018.b3lyp_6-31g(d).inp

012129018.b3lyp_6-31g(d).qchem.inp (generated)

012129018.b3lyp_6-31g(d).gjf (generated)

012129018.b3lyp_6-31g(d).firefly.inp (generated)

012129018.b3lyp_6-31g(d).smash.inp (generated)

012129018.b3lyp_6-31g(d).nwchem.inp (generated) 012129018.b3lyp_6-31g(d).log.xz 012129018.td-b3lyp_6-31g+(d).inp 012129018.td-b3lyp_6-31g+(d).log.xz

012129018.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129018.td-b3lyp_6-31+g(d).gjf (generated)

012129018.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129018.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129018.mol 012129018.PUBCHEM 012129018.mol (via Jmol)
012129023.b3lyp_6-31g(d).inp

012129023.b3lyp_6-31g(d).qchem.inp (generated)

012129023.b3lyp_6-31g(d).gjf (generated)

012129023.b3lyp_6-31g(d).firefly.inp (generated)

012129023.b3lyp_6-31g(d).smash.inp (generated)

012129023.b3lyp_6-31g(d).nwchem.inp (generated) 012129023.b3lyp_6-31g(d).log.xz 012129023.td-b3lyp_6-31g+(d).inp 012129023.td-b3lyp_6-31g+(d).log.xz

012129023.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129023.td-b3lyp_6-31+g(d).gjf (generated)

012129023.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129023.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129023.mol 012129023.PUBCHEM 012129023.mol (via Jmol)
012129027.b3lyp_6-31g(d).inp

012129027.b3lyp_6-31g(d).qchem.inp (generated)

012129027.b3lyp_6-31g(d).gjf (generated)

012129027.b3lyp_6-31g(d).firefly.inp (generated)

012129027.b3lyp_6-31g(d).smash.inp (generated)

012129027.b3lyp_6-31g(d).nwchem.inp (generated) 012129027.b3lyp_6-31g(d).log.xz 012129027.td-b3lyp_6-31g+(d).inp 012129027.td-b3lyp_6-31g+(d).log.xz

012129027.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129027.td-b3lyp_6-31+g(d).gjf (generated)

012129027.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129027.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129027.mol 012129027.PUBCHEM 012129027.mol (via Jmol)
012129030.b3lyp_6-31g(d).inp

012129030.b3lyp_6-31g(d).qchem.inp (generated)

012129030.b3lyp_6-31g(d).gjf (generated)

012129030.b3lyp_6-31g(d).firefly.inp (generated)

012129030.b3lyp_6-31g(d).smash.inp (generated)

012129030.b3lyp_6-31g(d).nwchem.inp (generated) 012129030.b3lyp_6-31g(d).log.xz 012129030.td-b3lyp_6-31g+(d).inp 012129030.td-b3lyp_6-31g+(d).log.xz

012129030.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129030.td-b3lyp_6-31+g(d).gjf (generated)

012129030.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129030.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129030.mol 012129030.PUBCHEM 012129030.mol (via Jmol)
012129032.b3lyp_6-31g(d).inp

012129032.b3lyp_6-31g(d).qchem.inp (generated)

012129032.b3lyp_6-31g(d).gjf (generated)

012129032.b3lyp_6-31g(d).firefly.inp (generated)

012129032.b3lyp_6-31g(d).smash.inp (generated)

012129032.b3lyp_6-31g(d).nwchem.inp (generated) 012129032.b3lyp_6-31g(d).log.xz 012129032.td-b3lyp_6-31g+(d).inp 012129032.td-b3lyp_6-31g+(d).log.xz

012129032.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129032.td-b3lyp_6-31+g(d).gjf (generated)

012129032.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129032.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129032.mol 012129032.PUBCHEM 012129032.mol (via Jmol)
012129073.b3lyp_6-31g(d).inp

012129073.b3lyp_6-31g(d).qchem.inp (generated)

012129073.b3lyp_6-31g(d).gjf (generated)

012129073.b3lyp_6-31g(d).firefly.inp (generated)

012129073.b3lyp_6-31g(d).smash.inp (generated)

012129073.b3lyp_6-31g(d).nwchem.inp (generated) 012129073.b3lyp_6-31g(d).log.xz 012129073.td-b3lyp_6-31g+(d).inp 012129073.td-b3lyp_6-31g+(d).log.xz

012129073.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129073.td-b3lyp_6-31+g(d).gjf (generated)

012129073.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129073.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129073.mol 012129073.PUBCHEM 012129073.mol (via Jmol)
012129074.b3lyp_6-31g(d).inp

012129074.b3lyp_6-31g(d).qchem.inp (generated)

012129074.b3lyp_6-31g(d).gjf (generated)

012129074.b3lyp_6-31g(d).firefly.inp (generated)

012129074.b3lyp_6-31g(d).smash.inp (generated)

012129074.b3lyp_6-31g(d).nwchem.inp (generated) 012129074.b3lyp_6-31g(d).log.xz 012129074.td-b3lyp_6-31g+(d).inp 012129074.td-b3lyp_6-31g+(d).log.xz

012129074.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129074.td-b3lyp_6-31+g(d).gjf (generated)

012129074.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129074.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129074.mol 012129074.PUBCHEM 012129074.mol (via Jmol)
012129094.b3lyp_6-31g(d).inp

012129094.b3lyp_6-31g(d).qchem.inp (generated)

012129094.b3lyp_6-31g(d).gjf (generated)

012129094.b3lyp_6-31g(d).firefly.inp (generated)

012129094.b3lyp_6-31g(d).smash.inp (generated)

012129094.b3lyp_6-31g(d).nwchem.inp (generated) 012129094.b3lyp_6-31g(d).log.xz 012129094.td-b3lyp_6-31g+(d).inp 012129094.td-b3lyp_6-31g+(d).log.xz

012129094.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129094.td-b3lyp_6-31+g(d).gjf (generated)

012129094.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129094.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129094.mol 012129094.PUBCHEM 012129094.mol (via Jmol)
012129097.b3lyp_6-31g(d).inp

012129097.b3lyp_6-31g(d).qchem.inp (generated)

012129097.b3lyp_6-31g(d).gjf (generated)

012129097.b3lyp_6-31g(d).firefly.inp (generated)

012129097.b3lyp_6-31g(d).smash.inp (generated)

012129097.b3lyp_6-31g(d).nwchem.inp (generated) 012129097.b3lyp_6-31g(d).log.xz 012129097.td-b3lyp_6-31g+(d).inp 012129097.td-b3lyp_6-31g+(d).log.xz

012129097.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129097.td-b3lyp_6-31+g(d).gjf (generated)

012129097.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129097.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129097.mol 012129097.PUBCHEM 012129097.mol (via Jmol)
012129127.b3lyp_6-31g(d).inp

012129127.b3lyp_6-31g(d).qchem.inp (generated)

012129127.b3lyp_6-31g(d).gjf (generated)

012129127.b3lyp_6-31g(d).firefly.inp (generated)

012129127.b3lyp_6-31g(d).smash.inp (generated)

012129127.b3lyp_6-31g(d).nwchem.inp (generated) 012129127.b3lyp_6-31g(d).log.xz 012129127.td-b3lyp_6-31g+(d).inp 012129127.td-b3lyp_6-31g+(d).log.xz

012129127.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129127.td-b3lyp_6-31+g(d).gjf (generated)

012129127.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129127.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129127.mol 012129127.PUBCHEM 012129127.mol (via Jmol)
012129129.b3lyp_6-31g(d).inp

012129129.b3lyp_6-31g(d).qchem.inp (generated)

012129129.b3lyp_6-31g(d).gjf (generated)

012129129.b3lyp_6-31g(d).firefly.inp (generated)

012129129.b3lyp_6-31g(d).smash.inp (generated)

012129129.b3lyp_6-31g(d).nwchem.inp (generated) 012129129.b3lyp_6-31g(d).log.xz 012129129.td-b3lyp_6-31g+(d).inp 012129129.td-b3lyp_6-31g+(d).log.xz

012129129.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129129.td-b3lyp_6-31+g(d).gjf (generated)

012129129.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129129.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129129.mol 012129129.PUBCHEM 012129129.mol (via Jmol)
012129144.b3lyp_6-31g(d).inp

012129144.b3lyp_6-31g(d).qchem.inp (generated)

012129144.b3lyp_6-31g(d).gjf (generated)

012129144.b3lyp_6-31g(d).firefly.inp (generated)

012129144.b3lyp_6-31g(d).smash.inp (generated)

012129144.b3lyp_6-31g(d).nwchem.inp (generated) 012129144.b3lyp_6-31g(d).log.xz 012129144.mol 012129144.PUBCHEM 012129144.mol (via Jmol)
012129173.b3lyp_6-31g(d).inp

012129173.b3lyp_6-31g(d).qchem.inp (generated)

012129173.b3lyp_6-31g(d).gjf (generated)

012129173.b3lyp_6-31g(d).firefly.inp (generated)

012129173.b3lyp_6-31g(d).smash.inp (generated)

012129173.b3lyp_6-31g(d).nwchem.inp (generated) 012129173.b3lyp_6-31g(d).log.xz 012129173.td-b3lyp_6-31g+(d).inp 012129173.td-b3lyp_6-31g+(d).log.xz

012129173.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129173.td-b3lyp_6-31+g(d).gjf (generated)

012129173.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129173.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129173.mol 012129173.PUBCHEM 012129173.mol (via Jmol)
012129182.b3lyp_6-31g(d).inp

012129182.b3lyp_6-31g(d).qchem.inp (generated)

012129182.b3lyp_6-31g(d).gjf (generated)

012129182.b3lyp_6-31g(d).firefly.inp (generated)

012129182.b3lyp_6-31g(d).smash.inp (generated)

012129182.b3lyp_6-31g(d).nwchem.inp (generated) 012129182.b3lyp_6-31g(d).log.xz 012129182.td-b3lyp_6-31g+(d).inp 012129182.td-b3lyp_6-31g+(d).log.xz

012129182.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129182.td-b3lyp_6-31+g(d).gjf (generated)

012129182.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129182.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129182.mol 012129182.PUBCHEM 012129182.mol (via Jmol)
012129183.b3lyp_6-31g(d).inp

012129183.b3lyp_6-31g(d).qchem.inp (generated)

012129183.b3lyp_6-31g(d).gjf (generated)

012129183.b3lyp_6-31g(d).firefly.inp (generated)

012129183.b3lyp_6-31g(d).smash.inp (generated)

012129183.b3lyp_6-31g(d).nwchem.inp (generated) 012129183.b3lyp_6-31g(d).log.xz 012129183.td-b3lyp_6-31g+(d).inp 012129183.td-b3lyp_6-31g+(d).log.xz

012129183.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129183.td-b3lyp_6-31+g(d).gjf (generated)

012129183.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129183.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129183.mol 012129183.PUBCHEM 012129183.mol (via Jmol)
012129190.b3lyp_6-31g(d).inp

012129190.b3lyp_6-31g(d).qchem.inp (generated)

012129190.b3lyp_6-31g(d).gjf (generated)

012129190.b3lyp_6-31g(d).firefly.inp (generated)

012129190.b3lyp_6-31g(d).smash.inp (generated)

012129190.b3lyp_6-31g(d).nwchem.inp (generated) 012129190.b3lyp_6-31g(d).log.xz 012129190.td-b3lyp_6-31g+(d).inp 012129190.td-b3lyp_6-31g+(d).log.xz

012129190.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129190.td-b3lyp_6-31+g(d).gjf (generated)

012129190.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129190.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129190.mol 012129190.PUBCHEM 012129190.mol (via Jmol)
012129218.b3lyp_6-31g(d).inp

012129218.b3lyp_6-31g(d).qchem.inp (generated)

012129218.b3lyp_6-31g(d).gjf (generated)

012129218.b3lyp_6-31g(d).firefly.inp (generated)

012129218.b3lyp_6-31g(d).smash.inp (generated)

012129218.b3lyp_6-31g(d).nwchem.inp (generated) 012129218.b3lyp_6-31g(d).log.xz 012129218.td-b3lyp_6-31g+(d).inp 012129218.td-b3lyp_6-31g+(d).log.xz

012129218.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129218.td-b3lyp_6-31+g(d).gjf (generated)

012129218.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129218.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129218.mol 012129218.PUBCHEM 012129218.mol (via Jmol)
012129277.b3lyp_6-31g(d).inp

012129277.b3lyp_6-31g(d).qchem.inp (generated)

012129277.b3lyp_6-31g(d).gjf (generated)

012129277.b3lyp_6-31g(d).firefly.inp (generated)

012129277.b3lyp_6-31g(d).smash.inp (generated)

012129277.b3lyp_6-31g(d).nwchem.inp (generated) 012129277.b3lyp_6-31g(d).log.xz 012129277.td-b3lyp_6-31g+(d).inp 012129277.td-b3lyp_6-31g+(d).log.xz

012129277.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129277.td-b3lyp_6-31+g(d).gjf (generated)

012129277.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129277.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129277.mol 012129277.PUBCHEM 012129277.mol (via Jmol)
012129313.b3lyp_6-31g(d).inp

012129313.b3lyp_6-31g(d).qchem.inp (generated)

012129313.b3lyp_6-31g(d).gjf (generated)

012129313.b3lyp_6-31g(d).firefly.inp (generated)

012129313.b3lyp_6-31g(d).smash.inp (generated)

012129313.b3lyp_6-31g(d).nwchem.inp (generated) 012129313.b3lyp_6-31g(d).log.xz 012129313.td-b3lyp_6-31g+(d).inp 012129313.td-b3lyp_6-31g+(d).log.xz

012129313.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129313.td-b3lyp_6-31+g(d).gjf (generated)

012129313.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129313.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129313.mol 012129313.PUBCHEM 012129313.mol (via Jmol)
012129319.b3lyp_6-31g(d).inp

012129319.b3lyp_6-31g(d).qchem.inp (generated)

012129319.b3lyp_6-31g(d).gjf (generated)

012129319.b3lyp_6-31g(d).firefly.inp (generated)

012129319.b3lyp_6-31g(d).smash.inp (generated)

012129319.b3lyp_6-31g(d).nwchem.inp (generated) 012129319.b3lyp_6-31g(d).log.xz 012129319.td-b3lyp_6-31g+(d).inp 012129319.td-b3lyp_6-31g+(d).log.xz

012129319.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129319.td-b3lyp_6-31+g(d).gjf (generated)

012129319.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129319.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129319.mol 012129319.PUBCHEM 012129319.mol (via Jmol)
012129336.b3lyp_6-31g(d).inp

012129336.b3lyp_6-31g(d).qchem.inp (generated)

012129336.b3lyp_6-31g(d).gjf (generated)

012129336.b3lyp_6-31g(d).firefly.inp (generated)

012129336.b3lyp_6-31g(d).smash.inp (generated)

012129336.b3lyp_6-31g(d).nwchem.inp (generated) 012129336.b3lyp_6-31g(d).log.xz 012129336.td-b3lyp_6-31g+(d).inp 012129336.td-b3lyp_6-31g+(d).log.xz

012129336.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129336.td-b3lyp_6-31+g(d).gjf (generated)

012129336.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129336.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129336.mol 012129336.PUBCHEM 012129336.mol (via Jmol)
012129390.b3lyp_6-31g(d).inp

012129390.b3lyp_6-31g(d).qchem.inp (generated)

012129390.b3lyp_6-31g(d).gjf (generated)

012129390.b3lyp_6-31g(d).firefly.inp (generated)

012129390.b3lyp_6-31g(d).smash.inp (generated)

012129390.b3lyp_6-31g(d).nwchem.inp (generated) 012129390.b3lyp_6-31g(d).log.xz 012129390.td-b3lyp_6-31g+(d).inp 012129390.td-b3lyp_6-31g+(d).log.xz

012129390.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129390.td-b3lyp_6-31+g(d).gjf (generated)

012129390.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129390.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129390.mol 012129390.PUBCHEM 012129390.mol (via Jmol)
012129491.b3lyp_6-31g(d).inp

012129491.b3lyp_6-31g(d).qchem.inp (generated)

012129491.b3lyp_6-31g(d).gjf (generated)

012129491.b3lyp_6-31g(d).firefly.inp (generated)

012129491.b3lyp_6-31g(d).smash.inp (generated)

012129491.b3lyp_6-31g(d).nwchem.inp (generated) 012129491.b3lyp_6-31g(d).log.xz 012129491.td-b3lyp_6-31g+(d).inp 012129491.td-b3lyp_6-31g+(d).log.xz

012129491.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129491.td-b3lyp_6-31+g(d).gjf (generated)

012129491.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129491.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129491.mol 012129491.PUBCHEM 012129491.mol (via Jmol)
012129495.b3lyp_6-31g(d).inp

012129495.b3lyp_6-31g(d).qchem.inp (generated)

012129495.b3lyp_6-31g(d).gjf (generated)

012129495.b3lyp_6-31g(d).firefly.inp (generated)

012129495.b3lyp_6-31g(d).smash.inp (generated)

012129495.b3lyp_6-31g(d).nwchem.inp (generated) 012129495.b3lyp_6-31g(d).log.xz 012129495.td-b3lyp_6-31g+(d).inp 012129495.td-b3lyp_6-31g+(d).log.xz

012129495.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129495.td-b3lyp_6-31+g(d).gjf (generated)

012129495.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129495.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129495.mol 012129495.PUBCHEM 012129495.mol (via Jmol)
012129626.b3lyp_6-31g(d).inp

012129626.b3lyp_6-31g(d).qchem.inp (generated)

012129626.b3lyp_6-31g(d).gjf (generated)

012129626.b3lyp_6-31g(d).firefly.inp (generated)

012129626.b3lyp_6-31g(d).smash.inp (generated)

012129626.b3lyp_6-31g(d).nwchem.inp (generated) 012129626.b3lyp_6-31g(d).log.xz 012129626.td-b3lyp_6-31g+(d).inp 012129626.td-b3lyp_6-31g+(d).log.xz

012129626.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129626.td-b3lyp_6-31+g(d).gjf (generated)

012129626.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129626.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129626.mol 012129626.PUBCHEM 012129626.mol (via Jmol)
012129674.b3lyp_6-31g(d).inp

012129674.b3lyp_6-31g(d).qchem.inp (generated)

012129674.b3lyp_6-31g(d).gjf (generated)

012129674.b3lyp_6-31g(d).firefly.inp (generated)

012129674.b3lyp_6-31g(d).smash.inp (generated)

012129674.b3lyp_6-31g(d).nwchem.inp (generated) 012129674.b3lyp_6-31g(d).log.xz 012129674.mol 012129674.PUBCHEM 012129674.mol (via Jmol)
012129771.b3lyp_6-31g(d).inp

012129771.b3lyp_6-31g(d).qchem.inp (generated)

012129771.b3lyp_6-31g(d).gjf (generated)

012129771.b3lyp_6-31g(d).firefly.inp (generated)

012129771.b3lyp_6-31g(d).smash.inp (generated)

012129771.b3lyp_6-31g(d).nwchem.inp (generated) 012129771.b3lyp_6-31g(d).log.xz 012129771.td-b3lyp_6-31g+(d).inp 012129771.td-b3lyp_6-31g+(d).log.xz

012129771.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129771.td-b3lyp_6-31+g(d).gjf (generated)

012129771.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129771.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129771.mol 012129771.PUBCHEM 012129771.mol (via Jmol)
012129808.b3lyp_6-31g(d).inp

012129808.b3lyp_6-31g(d).qchem.inp (generated)

012129808.b3lyp_6-31g(d).gjf (generated)

012129808.b3lyp_6-31g(d).firefly.inp (generated)

012129808.b3lyp_6-31g(d).smash.inp (generated)

012129808.b3lyp_6-31g(d).nwchem.inp (generated) 012129808.b3lyp_6-31g(d).log.xz 012129808.td-b3lyp_6-31g+(d).inp 012129808.td-b3lyp_6-31g+(d).log.xz

012129808.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129808.td-b3lyp_6-31+g(d).gjf (generated)

012129808.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129808.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129808.mol 012129808.PUBCHEM 012129808.mol (via Jmol)
012129860.b3lyp_6-31g(d).inp

012129860.b3lyp_6-31g(d).qchem.inp (generated)

012129860.b3lyp_6-31g(d).gjf (generated)

012129860.b3lyp_6-31g(d).firefly.inp (generated)

012129860.b3lyp_6-31g(d).smash.inp (generated)

012129860.b3lyp_6-31g(d).nwchem.inp (generated) 012129860.b3lyp_6-31g(d).log.xz 012129860.td-b3lyp_6-31g+(d).inp 012129860.td-b3lyp_6-31g+(d).log.xz

012129860.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129860.td-b3lyp_6-31+g(d).gjf (generated)

012129860.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129860.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129860.mol 012129860.PUBCHEM 012129860.mol (via Jmol)
012129869.b3lyp_6-31g(d).inp

012129869.b3lyp_6-31g(d).qchem.inp (generated)

012129869.b3lyp_6-31g(d).gjf (generated)

012129869.b3lyp_6-31g(d).firefly.inp (generated)

012129869.b3lyp_6-31g(d).smash.inp (generated)

012129869.b3lyp_6-31g(d).nwchem.inp (generated) 012129869.b3lyp_6-31g(d).log.xz 012129869.td-b3lyp_6-31g+(d).inp 012129869.td-b3lyp_6-31g+(d).log.xz

012129869.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129869.td-b3lyp_6-31+g(d).gjf (generated)

012129869.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129869.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129869.mol 012129869.PUBCHEM 012129869.mol (via Jmol)
012129870.b3lyp_6-31g(d).inp

012129870.b3lyp_6-31g(d).qchem.inp (generated)

012129870.b3lyp_6-31g(d).gjf (generated)

012129870.b3lyp_6-31g(d).firefly.inp (generated)

012129870.b3lyp_6-31g(d).smash.inp (generated)

012129870.b3lyp_6-31g(d).nwchem.inp (generated) 012129870.b3lyp_6-31g(d).log.xz 012129870.td-b3lyp_6-31g+(d).inp 012129870.td-b3lyp_6-31g+(d).log.xz

012129870.td-b3lyp_6-31+g(d).qchem.inp (generated)

012129870.td-b3lyp_6-31+g(d).gjf (generated)

012129870.td-b3lyp_6-31+g(d).firefly.inp (generated)

012129870.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012129870.mol 012129870.PUBCHEM 012129870.mol (via Jmol)
012130050.b3lyp_6-31g(d).inp

012130050.b3lyp_6-31g(d).qchem.inp (generated)

012130050.b3lyp_6-31g(d).gjf (generated)

012130050.b3lyp_6-31g(d).firefly.inp (generated)

012130050.b3lyp_6-31g(d).smash.inp (generated)

012130050.b3lyp_6-31g(d).nwchem.inp (generated) 012130050.b3lyp_6-31g(d).log.xz 012130050.td-b3lyp_6-31g+(d).inp 012130050.td-b3lyp_6-31g+(d).log.xz

012130050.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130050.td-b3lyp_6-31+g(d).gjf (generated)

012130050.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130050.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130050.mol 012130050.PUBCHEM 012130050.mol (via Jmol)
012130055.b3lyp_6-31g(d).inp

012130055.b3lyp_6-31g(d).qchem.inp (generated)

012130055.b3lyp_6-31g(d).gjf (generated)

012130055.b3lyp_6-31g(d).firefly.inp (generated)

012130055.b3lyp_6-31g(d).smash.inp (generated)

012130055.b3lyp_6-31g(d).nwchem.inp (generated) 012130055.b3lyp_6-31g(d).log.xz 012130055.mol 012130055.PUBCHEM 012130055.mol (via Jmol)
012130056.b3lyp_6-31g(d).inp

012130056.b3lyp_6-31g(d).qchem.inp (generated)

012130056.b3lyp_6-31g(d).gjf (generated)

012130056.b3lyp_6-31g(d).firefly.inp (generated)

012130056.b3lyp_6-31g(d).smash.inp (generated)

012130056.b3lyp_6-31g(d).nwchem.inp (generated) 012130056.b3lyp_6-31g(d).log.xz 012130056.td-b3lyp_6-31g+(d).inp 012130056.td-b3lyp_6-31g+(d).log.xz

012130056.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130056.td-b3lyp_6-31+g(d).gjf (generated)

012130056.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130056.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130056.mol 012130056.PUBCHEM 012130056.mol (via Jmol)
012130058.b3lyp_6-31g(d).inp

012130058.b3lyp_6-31g(d).qchem.inp (generated)

012130058.b3lyp_6-31g(d).gjf (generated)

012130058.b3lyp_6-31g(d).firefly.inp (generated)

012130058.b3lyp_6-31g(d).smash.inp (generated)

012130058.b3lyp_6-31g(d).nwchem.inp (generated) 012130058.b3lyp_6-31g(d).log.xz 012130058.td-b3lyp_6-31g+(d).inp 012130058.td-b3lyp_6-31g+(d).log.xz

012130058.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130058.td-b3lyp_6-31+g(d).gjf (generated)

012130058.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130058.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130058.mol 012130058.PUBCHEM 012130058.mol (via Jmol)
012130083.b3lyp_6-31g(d).inp

012130083.b3lyp_6-31g(d).qchem.inp (generated)

012130083.b3lyp_6-31g(d).gjf (generated)

012130083.b3lyp_6-31g(d).firefly.inp (generated)

012130083.b3lyp_6-31g(d).smash.inp (generated)

012130083.b3lyp_6-31g(d).nwchem.inp (generated) 012130083.b3lyp_6-31g(d).log.xz 012130083.td-b3lyp_6-31g+(d).inp 012130083.td-b3lyp_6-31g+(d).log.xz

012130083.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130083.td-b3lyp_6-31+g(d).gjf (generated)

012130083.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130083.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130083.mol 012130083.PUBCHEM 012130083.mol (via Jmol)
012130085.b3lyp_6-31g(d).inp

012130085.b3lyp_6-31g(d).qchem.inp (generated)

012130085.b3lyp_6-31g(d).gjf (generated)

012130085.b3lyp_6-31g(d).firefly.inp (generated)

012130085.b3lyp_6-31g(d).smash.inp (generated)

012130085.b3lyp_6-31g(d).nwchem.inp (generated) 012130085.b3lyp_6-31g(d).log.xz 012130085.td-b3lyp_6-31g+(d).inp 012130085.td-b3lyp_6-31g+(d).log.xz

012130085.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130085.td-b3lyp_6-31+g(d).gjf (generated)

012130085.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130085.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130085.mol 012130085.PUBCHEM 012130085.mol (via Jmol)
012130087.b3lyp_6-31g(d).inp

012130087.b3lyp_6-31g(d).qchem.inp (generated)

012130087.b3lyp_6-31g(d).gjf (generated)

012130087.b3lyp_6-31g(d).firefly.inp (generated)

012130087.b3lyp_6-31g(d).smash.inp (generated)

012130087.b3lyp_6-31g(d).nwchem.inp (generated) 012130087.b3lyp_6-31g(d).log.xz 012130087.td-b3lyp_6-31g+(d).inp 012130087.td-b3lyp_6-31g+(d).log.xz

012130087.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130087.td-b3lyp_6-31+g(d).gjf (generated)

012130087.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130087.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130087.mol 012130087.PUBCHEM 012130087.mol (via Jmol)
012130115.b3lyp_6-31g(d).inp

012130115.b3lyp_6-31g(d).qchem.inp (generated)

012130115.b3lyp_6-31g(d).gjf (generated)

012130115.b3lyp_6-31g(d).firefly.inp (generated)

012130115.b3lyp_6-31g(d).smash.inp (generated)

012130115.b3lyp_6-31g(d).nwchem.inp (generated) 012130115.b3lyp_6-31g(d).log.xz 012130115.td-b3lyp_6-31g+(d).inp 012130115.td-b3lyp_6-31g+(d).log.xz

012130115.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130115.td-b3lyp_6-31+g(d).gjf (generated)

012130115.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130115.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130115.mol 012130115.PUBCHEM 012130115.mol (via Jmol)
012130142.b3lyp_6-31g(d).inp

012130142.b3lyp_6-31g(d).qchem.inp (generated)

012130142.b3lyp_6-31g(d).gjf (generated)

012130142.b3lyp_6-31g(d).firefly.inp (generated)

012130142.b3lyp_6-31g(d).smash.inp (generated)

012130142.b3lyp_6-31g(d).nwchem.inp (generated) 012130142.b3lyp_6-31g(d).log.xz 012130142.td-b3lyp_6-31g+(d).inp 012130142.td-b3lyp_6-31g+(d).log.xz

012130142.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130142.td-b3lyp_6-31+g(d).gjf (generated)

012130142.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130142.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130142.mol 012130142.PUBCHEM 012130142.mol (via Jmol)
012130143.b3lyp_6-31g(d).inp

012130143.b3lyp_6-31g(d).qchem.inp (generated)

012130143.b3lyp_6-31g(d).gjf (generated)

012130143.b3lyp_6-31g(d).firefly.inp (generated)

012130143.b3lyp_6-31g(d).smash.inp (generated)

012130143.b3lyp_6-31g(d).nwchem.inp (generated) 012130143.b3lyp_6-31g(d).log.xz 012130143.td-b3lyp_6-31g+(d).inp 012130143.td-b3lyp_6-31g+(d).log.xz

012130143.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130143.td-b3lyp_6-31+g(d).gjf (generated)

012130143.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130143.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130143.mol 012130143.PUBCHEM 012130143.mol (via Jmol)
012130145.b3lyp_6-31g(d).inp

012130145.b3lyp_6-31g(d).qchem.inp (generated)

012130145.b3lyp_6-31g(d).gjf (generated)

012130145.b3lyp_6-31g(d).firefly.inp (generated)

012130145.b3lyp_6-31g(d).smash.inp (generated)

012130145.b3lyp_6-31g(d).nwchem.inp (generated) 012130145.b3lyp_6-31g(d).log.xz 012130145.td-b3lyp_6-31g+(d).inp 012130145.td-b3lyp_6-31g+(d).log.xz

012130145.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130145.td-b3lyp_6-31+g(d).gjf (generated)

012130145.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130145.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130145.mol 012130145.PUBCHEM 012130145.mol (via Jmol)
012130146.b3lyp_6-31g(d).inp

012130146.b3lyp_6-31g(d).qchem.inp (generated)

012130146.b3lyp_6-31g(d).gjf (generated)

012130146.b3lyp_6-31g(d).firefly.inp (generated)

012130146.b3lyp_6-31g(d).smash.inp (generated)

012130146.b3lyp_6-31g(d).nwchem.inp (generated) 012130146.b3lyp_6-31g(d).log.xz 012130146.td-b3lyp_6-31g+(d).inp 012130146.td-b3lyp_6-31g+(d).log.xz

012130146.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130146.td-b3lyp_6-31+g(d).gjf (generated)

012130146.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130146.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130146.mol 012130146.PUBCHEM 012130146.mol (via Jmol)
012130147.b3lyp_6-31g(d).inp

012130147.b3lyp_6-31g(d).qchem.inp (generated)

012130147.b3lyp_6-31g(d).gjf (generated)

012130147.b3lyp_6-31g(d).firefly.inp (generated)

012130147.b3lyp_6-31g(d).smash.inp (generated)

012130147.b3lyp_6-31g(d).nwchem.inp (generated) 012130147.b3lyp_6-31g(d).log.xz 012130147.td-b3lyp_6-31g+(d).inp 012130147.td-b3lyp_6-31g+(d).log.xz

012130147.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130147.td-b3lyp_6-31+g(d).gjf (generated)

012130147.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130147.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130147.mol 012130147.PUBCHEM 012130147.mol (via Jmol)
012130210.b3lyp_6-31g(d).inp

012130210.b3lyp_6-31g(d).qchem.inp (generated)

012130210.b3lyp_6-31g(d).gjf (generated)

012130210.b3lyp_6-31g(d).firefly.inp (generated)

012130210.b3lyp_6-31g(d).smash.inp (generated)

012130210.b3lyp_6-31g(d).nwchem.inp (generated) 012130210.b3lyp_6-31g(d).log.xz 012130210.mol 012130210.PUBCHEM 012130210.mol (via Jmol)
012130217.b3lyp_6-31g(d).inp

012130217.b3lyp_6-31g(d).qchem.inp (generated)

012130217.b3lyp_6-31g(d).gjf (generated)

012130217.b3lyp_6-31g(d).firefly.inp (generated)

012130217.b3lyp_6-31g(d).smash.inp (generated)

012130217.b3lyp_6-31g(d).nwchem.inp (generated) 012130217.b3lyp_6-31g(d).log.xz 012130217.td-b3lyp_6-31g+(d).inp 012130217.td-b3lyp_6-31g+(d).log.xz

012130217.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130217.td-b3lyp_6-31+g(d).gjf (generated)

012130217.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130217.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130217.mol 012130217.PUBCHEM 012130217.mol (via Jmol)
012130265.b3lyp_6-31g(d).inp

012130265.b3lyp_6-31g(d).qchem.inp (generated)

012130265.b3lyp_6-31g(d).gjf (generated)

012130265.b3lyp_6-31g(d).firefly.inp (generated)

012130265.b3lyp_6-31g(d).smash.inp (generated)

012130265.b3lyp_6-31g(d).nwchem.inp (generated) 012130265.b3lyp_6-31g(d).log.xz 012130265.td-b3lyp_6-31g+(d).inp 012130265.td-b3lyp_6-31g+(d).log.xz

012130265.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130265.td-b3lyp_6-31+g(d).gjf (generated)

012130265.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130265.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130265.mol 012130265.PUBCHEM 012130265.mol (via Jmol)
012130268.b3lyp_6-31g(d).inp

012130268.b3lyp_6-31g(d).qchem.inp (generated)

012130268.b3lyp_6-31g(d).gjf (generated)

012130268.b3lyp_6-31g(d).firefly.inp (generated)

012130268.b3lyp_6-31g(d).smash.inp (generated)

012130268.b3lyp_6-31g(d).nwchem.inp (generated) 012130268.b3lyp_6-31g(d).log.xz 012130268.td-b3lyp_6-31g+(d).inp 012130268.td-b3lyp_6-31g+(d).log.xz

012130268.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130268.td-b3lyp_6-31+g(d).gjf (generated)

012130268.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130268.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130268.mol 012130268.PUBCHEM 012130268.mol (via Jmol)
012130281.b3lyp_6-31g(d).inp

012130281.b3lyp_6-31g(d).qchem.inp (generated)

012130281.b3lyp_6-31g(d).gjf (generated)

012130281.b3lyp_6-31g(d).firefly.inp (generated)

012130281.b3lyp_6-31g(d).smash.inp (generated)

012130281.b3lyp_6-31g(d).nwchem.inp (generated) 012130281.b3lyp_6-31g(d).log.xz 012130281.td-b3lyp_6-31g+(d).inp 012130281.td-b3lyp_6-31g+(d).log.xz

012130281.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130281.td-b3lyp_6-31+g(d).gjf (generated)

012130281.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130281.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130281.mol 012130281.PUBCHEM 012130281.mol (via Jmol)
012130286.b3lyp_6-31g(d).inp

012130286.b3lyp_6-31g(d).qchem.inp (generated)

012130286.b3lyp_6-31g(d).gjf (generated)

012130286.b3lyp_6-31g(d).firefly.inp (generated)

012130286.b3lyp_6-31g(d).smash.inp (generated)

012130286.b3lyp_6-31g(d).nwchem.inp (generated) 012130286.b3lyp_6-31g(d).log.xz 012130286.td-b3lyp_6-31g+(d).inp 012130286.td-b3lyp_6-31g+(d).log.xz

012130286.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130286.td-b3lyp_6-31+g(d).gjf (generated)

012130286.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130286.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130286.mol 012130286.PUBCHEM 012130286.mol (via Jmol)
012130306.b3lyp_6-31g(d).inp

012130306.b3lyp_6-31g(d).qchem.inp (generated)

012130306.b3lyp_6-31g(d).gjf (generated)

012130306.b3lyp_6-31g(d).firefly.inp (generated)

012130306.b3lyp_6-31g(d).smash.inp (generated)

012130306.b3lyp_6-31g(d).nwchem.inp (generated) 012130306.b3lyp_6-31g(d).log.xz 012130306.td-b3lyp_6-31g+(d).inp 012130306.td-b3lyp_6-31g+(d).log.xz

012130306.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130306.td-b3lyp_6-31+g(d).gjf (generated)

012130306.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130306.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130306.mol 012130306.PUBCHEM 012130306.mol (via Jmol)
012130320.b3lyp_6-31g(d).inp

012130320.b3lyp_6-31g(d).qchem.inp (generated)

012130320.b3lyp_6-31g(d).gjf (generated)

012130320.b3lyp_6-31g(d).firefly.inp (generated)

012130320.b3lyp_6-31g(d).smash.inp (generated)

012130320.b3lyp_6-31g(d).nwchem.inp (generated) 012130320.b3lyp_6-31g(d).log.xz 012130320.td-b3lyp_6-31g+(d).inp 012130320.td-b3lyp_6-31g+(d).log.xz

012130320.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130320.td-b3lyp_6-31+g(d).gjf (generated)

012130320.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130320.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130320.mol 012130320.PUBCHEM 012130320.mol (via Jmol)
012130321.b3lyp_6-31g(d).inp

012130321.b3lyp_6-31g(d).qchem.inp (generated)

012130321.b3lyp_6-31g(d).gjf (generated)

012130321.b3lyp_6-31g(d).firefly.inp (generated)

012130321.b3lyp_6-31g(d).smash.inp (generated)

012130321.b3lyp_6-31g(d).nwchem.inp (generated) 012130321.b3lyp_6-31g(d).log.xz 012130321.td-b3lyp_6-31g+(d).inp 012130321.td-b3lyp_6-31g+(d).log.xz

012130321.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130321.td-b3lyp_6-31+g(d).gjf (generated)

012130321.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130321.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130321.mol 012130321.PUBCHEM 012130321.mol (via Jmol)
012130456.b3lyp_6-31g(d).inp

012130456.b3lyp_6-31g(d).qchem.inp (generated)

012130456.b3lyp_6-31g(d).gjf (generated)

012130456.b3lyp_6-31g(d).firefly.inp (generated)

012130456.b3lyp_6-31g(d).smash.inp (generated)

012130456.b3lyp_6-31g(d).nwchem.inp (generated) 012130456.b3lyp_6-31g(d).log.xz 012130456.mol 012130456.PUBCHEM 012130456.mol (via Jmol)
012130474.b3lyp_6-31g(d).inp

012130474.b3lyp_6-31g(d).qchem.inp (generated)

012130474.b3lyp_6-31g(d).gjf (generated)

012130474.b3lyp_6-31g(d).firefly.inp (generated)

012130474.b3lyp_6-31g(d).smash.inp (generated)

012130474.b3lyp_6-31g(d).nwchem.inp (generated) 012130474.b3lyp_6-31g(d).log.xz 012130474.td-b3lyp_6-31g+(d).inp 012130474.td-b3lyp_6-31g+(d).log.xz

012130474.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130474.td-b3lyp_6-31+g(d).gjf (generated)

012130474.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130474.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130474.mol 012130474.PUBCHEM 012130474.mol (via Jmol)
012130483.b3lyp_6-31g(d).inp

012130483.b3lyp_6-31g(d).qchem.inp (generated)

012130483.b3lyp_6-31g(d).gjf (generated)

012130483.b3lyp_6-31g(d).firefly.inp (generated)

012130483.b3lyp_6-31g(d).smash.inp (generated)

012130483.b3lyp_6-31g(d).nwchem.inp (generated) 012130483.b3lyp_6-31g(d).log.xz 012130483.mol 012130483.PUBCHEM 012130483.mol (via Jmol)
012130491.b3lyp_6-31g(d).inp

012130491.b3lyp_6-31g(d).qchem.inp (generated)

012130491.b3lyp_6-31g(d).gjf (generated)

012130491.b3lyp_6-31g(d).firefly.inp (generated)

012130491.b3lyp_6-31g(d).smash.inp (generated)

012130491.b3lyp_6-31g(d).nwchem.inp (generated) 012130491.b3lyp_6-31g(d).log.xz 012130491.td-b3lyp_6-31g+(d).inp 012130491.td-b3lyp_6-31g+(d).log.xz

012130491.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130491.td-b3lyp_6-31+g(d).gjf (generated)

012130491.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130491.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130491.mol 012130491.PUBCHEM 012130491.mol (via Jmol)
012130493.b3lyp_6-31g(d).inp

012130493.b3lyp_6-31g(d).qchem.inp (generated)

012130493.b3lyp_6-31g(d).gjf (generated)

012130493.b3lyp_6-31g(d).firefly.inp (generated)

012130493.b3lyp_6-31g(d).smash.inp (generated)

012130493.b3lyp_6-31g(d).nwchem.inp (generated) 012130493.b3lyp_6-31g(d).log.xz 012130493.td-b3lyp_6-31g+(d).inp 012130493.td-b3lyp_6-31g+(d).log.xz

012130493.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130493.td-b3lyp_6-31+g(d).gjf (generated)

012130493.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130493.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130493.mol 012130493.PUBCHEM 012130493.mol (via Jmol)
012130495.b3lyp_6-31g(d).inp

012130495.b3lyp_6-31g(d).qchem.inp (generated)

012130495.b3lyp_6-31g(d).gjf (generated)

012130495.b3lyp_6-31g(d).firefly.inp (generated)

012130495.b3lyp_6-31g(d).smash.inp (generated)

012130495.b3lyp_6-31g(d).nwchem.inp (generated) 012130495.b3lyp_6-31g(d).log.xz 012130495.td-b3lyp_6-31g+(d).inp 012130495.td-b3lyp_6-31g+(d).log.xz

012130495.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130495.td-b3lyp_6-31+g(d).gjf (generated)

012130495.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130495.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130495.mol 012130495.PUBCHEM 012130495.mol (via Jmol)
012130503.b3lyp_6-31g(d).inp

012130503.b3lyp_6-31g(d).qchem.inp (generated)

012130503.b3lyp_6-31g(d).gjf (generated)

012130503.b3lyp_6-31g(d).firefly.inp (generated)

012130503.b3lyp_6-31g(d).smash.inp (generated)

012130503.b3lyp_6-31g(d).nwchem.inp (generated) 012130503.b3lyp_6-31g(d).log.xz 012130503.td-b3lyp_6-31g+(d).inp 012130503.td-b3lyp_6-31g+(d).log.xz

012130503.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130503.td-b3lyp_6-31+g(d).gjf (generated)

012130503.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130503.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130503.mol 012130503.PUBCHEM 012130503.mol (via Jmol)
012130563.b3lyp_6-31g(d).inp

012130563.b3lyp_6-31g(d).qchem.inp (generated)

012130563.b3lyp_6-31g(d).gjf (generated)

012130563.b3lyp_6-31g(d).firefly.inp (generated)

012130563.b3lyp_6-31g(d).smash.inp (generated)

012130563.b3lyp_6-31g(d).nwchem.inp (generated) 012130563.b3lyp_6-31g(d).log.xz 012130563.mol 012130563.PUBCHEM 012130563.mol (via Jmol)
012130568.b3lyp_6-31g(d).inp

012130568.b3lyp_6-31g(d).qchem.inp (generated)

012130568.b3lyp_6-31g(d).gjf (generated)

012130568.b3lyp_6-31g(d).firefly.inp (generated)

012130568.b3lyp_6-31g(d).smash.inp (generated)

012130568.b3lyp_6-31g(d).nwchem.inp (generated) 012130568.b3lyp_6-31g(d).log.xz 012130568.td-b3lyp_6-31g+(d).inp 012130568.td-b3lyp_6-31g+(d).log.xz

012130568.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130568.td-b3lyp_6-31+g(d).gjf (generated)

012130568.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130568.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130568.mol 012130568.PUBCHEM 012130568.mol (via Jmol)
012130571.b3lyp_6-31g(d).inp

012130571.b3lyp_6-31g(d).qchem.inp (generated)

012130571.b3lyp_6-31g(d).gjf (generated)

012130571.b3lyp_6-31g(d).firefly.inp (generated)

012130571.b3lyp_6-31g(d).smash.inp (generated)

012130571.b3lyp_6-31g(d).nwchem.inp (generated) 012130571.b3lyp_6-31g(d).log.xz 012130571.td-b3lyp_6-31g+(d).inp 012130571.td-b3lyp_6-31g+(d).log.xz

012130571.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130571.td-b3lyp_6-31+g(d).gjf (generated)

012130571.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130571.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130571.mol 012130571.PUBCHEM 012130571.mol (via Jmol)
012130573.b3lyp_6-31g(d).inp

012130573.b3lyp_6-31g(d).qchem.inp (generated)

012130573.b3lyp_6-31g(d).gjf (generated)

012130573.b3lyp_6-31g(d).firefly.inp (generated)

012130573.b3lyp_6-31g(d).smash.inp (generated)

012130573.b3lyp_6-31g(d).nwchem.inp (generated) 012130573.b3lyp_6-31g(d).log.xz 012130573.td-b3lyp_6-31g+(d).inp 012130573.td-b3lyp_6-31g+(d).log.xz

012130573.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130573.td-b3lyp_6-31+g(d).gjf (generated)

012130573.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130573.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130573.mol 012130573.PUBCHEM 012130573.mol (via Jmol)
012130574.b3lyp_6-31g(d).inp

012130574.b3lyp_6-31g(d).qchem.inp (generated)

012130574.b3lyp_6-31g(d).gjf (generated)

012130574.b3lyp_6-31g(d).firefly.inp (generated)

012130574.b3lyp_6-31g(d).smash.inp (generated)

012130574.b3lyp_6-31g(d).nwchem.inp (generated) 012130574.b3lyp_6-31g(d).log.xz 012130574.mol 012130574.PUBCHEM 012130574.mol (via Jmol)
012130575.b3lyp_6-31g(d).inp

012130575.b3lyp_6-31g(d).qchem.inp (generated)

012130575.b3lyp_6-31g(d).gjf (generated)

012130575.b3lyp_6-31g(d).firefly.inp (generated)

012130575.b3lyp_6-31g(d).smash.inp (generated)

012130575.b3lyp_6-31g(d).nwchem.inp (generated) 012130575.b3lyp_6-31g(d).log.xz 012130575.td-b3lyp_6-31g+(d).inp 012130575.td-b3lyp_6-31g+(d).log.xz

012130575.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130575.td-b3lyp_6-31+g(d).gjf (generated)

012130575.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130575.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130575.mol 012130575.PUBCHEM 012130575.mol (via Jmol)
012130580.b3lyp_6-31g(d).inp

012130580.b3lyp_6-31g(d).qchem.inp (generated)

012130580.b3lyp_6-31g(d).gjf (generated)

012130580.b3lyp_6-31g(d).firefly.inp (generated)

012130580.b3lyp_6-31g(d).smash.inp (generated)

012130580.b3lyp_6-31g(d).nwchem.inp (generated) 012130580.b3lyp_6-31g(d).log.xz 012130580.td-b3lyp_6-31g+(d).inp 012130580.td-b3lyp_6-31g+(d).log.xz

012130580.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130580.td-b3lyp_6-31+g(d).gjf (generated)

012130580.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130580.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130580.mol 012130580.PUBCHEM 012130580.mol (via Jmol)
012130588.b3lyp_6-31g(d).inp

012130588.b3lyp_6-31g(d).qchem.inp (generated)

012130588.b3lyp_6-31g(d).gjf (generated)

012130588.b3lyp_6-31g(d).firefly.inp (generated)

012130588.b3lyp_6-31g(d).smash.inp (generated)

012130588.b3lyp_6-31g(d).nwchem.inp (generated) 012130588.b3lyp_6-31g(d).log.xz 012130588.td-b3lyp_6-31g+(d).inp 012130588.td-b3lyp_6-31g+(d).log.xz

012130588.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130588.td-b3lyp_6-31+g(d).gjf (generated)

012130588.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130588.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130588.mol 012130588.PUBCHEM 012130588.mol (via Jmol)
012130635.b3lyp_6-31g(d).inp

012130635.b3lyp_6-31g(d).qchem.inp (generated)

012130635.b3lyp_6-31g(d).gjf (generated)

012130635.b3lyp_6-31g(d).firefly.inp (generated)

012130635.b3lyp_6-31g(d).smash.inp (generated)

012130635.b3lyp_6-31g(d).nwchem.inp (generated) 012130635.b3lyp_6-31g(d).log.xz 012130635.td-b3lyp_6-31g+(d).inp 012130635.td-b3lyp_6-31g+(d).log.xz

012130635.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130635.td-b3lyp_6-31+g(d).gjf (generated)

012130635.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130635.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130635.mol 012130635.PUBCHEM 012130635.mol (via Jmol)
012130665.b3lyp_6-31g(d).inp

012130665.b3lyp_6-31g(d).qchem.inp (generated)

012130665.b3lyp_6-31g(d).gjf (generated)

012130665.b3lyp_6-31g(d).firefly.inp (generated)

012130665.b3lyp_6-31g(d).smash.inp (generated)

012130665.b3lyp_6-31g(d).nwchem.inp (generated) 012130665.b3lyp_6-31g(d).log.xz 012130665.td-b3lyp_6-31g+(d).inp 012130665.td-b3lyp_6-31g+(d).log.xz

012130665.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130665.td-b3lyp_6-31+g(d).gjf (generated)

012130665.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130665.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130665.mol 012130665.PUBCHEM 012130665.mol (via Jmol)
012130694.b3lyp_6-31g(d).inp

012130694.b3lyp_6-31g(d).qchem.inp (generated)

012130694.b3lyp_6-31g(d).gjf (generated)

012130694.b3lyp_6-31g(d).firefly.inp (generated)

012130694.b3lyp_6-31g(d).smash.inp (generated)

012130694.b3lyp_6-31g(d).nwchem.inp (generated) 012130694.b3lyp_6-31g(d).log.xz 012130694.td-b3lyp_6-31g+(d).inp 012130694.td-b3lyp_6-31g+(d).log.xz

012130694.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130694.td-b3lyp_6-31+g(d).gjf (generated)

012130694.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130694.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130694.mol 012130694.PUBCHEM 012130694.mol (via Jmol)
012130696.b3lyp_6-31g(d).inp

012130696.b3lyp_6-31g(d).qchem.inp (generated)

012130696.b3lyp_6-31g(d).gjf (generated)

012130696.b3lyp_6-31g(d).firefly.inp (generated)

012130696.b3lyp_6-31g(d).smash.inp (generated)

012130696.b3lyp_6-31g(d).nwchem.inp (generated) 012130696.b3lyp_6-31g(d).log.xz 012130696.td-b3lyp_6-31g+(d).inp 012130696.td-b3lyp_6-31g+(d).log.xz

012130696.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130696.td-b3lyp_6-31+g(d).gjf (generated)

012130696.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130696.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130696.mol 012130696.PUBCHEM 012130696.mol (via Jmol)
012130697.b3lyp_6-31g(d).inp

012130697.b3lyp_6-31g(d).qchem.inp (generated)

012130697.b3lyp_6-31g(d).gjf (generated)

012130697.b3lyp_6-31g(d).firefly.inp (generated)

012130697.b3lyp_6-31g(d).smash.inp (generated)

012130697.b3lyp_6-31g(d).nwchem.inp (generated) 012130697.b3lyp_6-31g(d).log.xz 012130697.td-b3lyp_6-31g+(d).inp 012130697.td-b3lyp_6-31g+(d).log.xz

012130697.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130697.td-b3lyp_6-31+g(d).gjf (generated)

012130697.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130697.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130697.mol 012130697.PUBCHEM 012130697.mol (via Jmol)
012130735.b3lyp_6-31g(d).inp

012130735.b3lyp_6-31g(d).qchem.inp (generated)

012130735.b3lyp_6-31g(d).gjf (generated)

012130735.b3lyp_6-31g(d).firefly.inp (generated)

012130735.b3lyp_6-31g(d).smash.inp (generated)

012130735.b3lyp_6-31g(d).nwchem.inp (generated) 012130735.b3lyp_6-31g(d).log.xz 012130735.mol 012130735.PUBCHEM 012130735.mol (via Jmol)
012130771.b3lyp_6-31g(d).inp

012130771.b3lyp_6-31g(d).qchem.inp (generated)

012130771.b3lyp_6-31g(d).gjf (generated)

012130771.b3lyp_6-31g(d).firefly.inp (generated)

012130771.b3lyp_6-31g(d).smash.inp (generated)

012130771.b3lyp_6-31g(d).nwchem.inp (generated) 012130771.b3lyp_6-31g(d).log.xz 012130771.mol 012130771.PUBCHEM 012130771.mol (via Jmol)
012130775.b3lyp_6-31g(d).inp

012130775.b3lyp_6-31g(d).qchem.inp (generated)

012130775.b3lyp_6-31g(d).gjf (generated)

012130775.b3lyp_6-31g(d).firefly.inp (generated)

012130775.b3lyp_6-31g(d).smash.inp (generated)

012130775.b3lyp_6-31g(d).nwchem.inp (generated) 012130775.b3lyp_6-31g(d).log.xz 012130775.td-b3lyp_6-31g+(d).inp 012130775.td-b3lyp_6-31g+(d).log.xz

012130775.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130775.td-b3lyp_6-31+g(d).gjf (generated)

012130775.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130775.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130775.mol 012130775.PUBCHEM 012130775.mol (via Jmol)
012130781.b3lyp_6-31g(d).inp

012130781.b3lyp_6-31g(d).qchem.inp (generated)

012130781.b3lyp_6-31g(d).gjf (generated)

012130781.b3lyp_6-31g(d).firefly.inp (generated)

012130781.b3lyp_6-31g(d).smash.inp (generated)

012130781.b3lyp_6-31g(d).nwchem.inp (generated) 012130781.b3lyp_6-31g(d).log.xz 012130781.td-b3lyp_6-31g+(d).inp 012130781.td-b3lyp_6-31g+(d).log.xz

012130781.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130781.td-b3lyp_6-31+g(d).gjf (generated)

012130781.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130781.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130781.mol 012130781.PUBCHEM 012130781.mol (via Jmol)
012130786.b3lyp_6-31g(d).inp

012130786.b3lyp_6-31g(d).qchem.inp (generated)

012130786.b3lyp_6-31g(d).gjf (generated)

012130786.b3lyp_6-31g(d).firefly.inp (generated)

012130786.b3lyp_6-31g(d).smash.inp (generated)

012130786.b3lyp_6-31g(d).nwchem.inp (generated) 012130786.b3lyp_6-31g(d).log.xz 012130786.td-b3lyp_6-31g+(d).inp 012130786.td-b3lyp_6-31g+(d).log.xz

012130786.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130786.td-b3lyp_6-31+g(d).gjf (generated)

012130786.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130786.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130786.mol 012130786.PUBCHEM 012130786.mol (via Jmol)
012130787.b3lyp_6-31g(d).inp

012130787.b3lyp_6-31g(d).qchem.inp (generated)

012130787.b3lyp_6-31g(d).gjf (generated)

012130787.b3lyp_6-31g(d).firefly.inp (generated)

012130787.b3lyp_6-31g(d).smash.inp (generated)

012130787.b3lyp_6-31g(d).nwchem.inp (generated) 012130787.b3lyp_6-31g(d).log.xz 012130787.td-b3lyp_6-31g+(d).inp 012130787.td-b3lyp_6-31g+(d).log.xz

012130787.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130787.td-b3lyp_6-31+g(d).gjf (generated)

012130787.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130787.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130787.mol 012130787.PUBCHEM 012130787.mol (via Jmol)
012130836.b3lyp_6-31g(d).inp

012130836.b3lyp_6-31g(d).qchem.inp (generated)

012130836.b3lyp_6-31g(d).gjf (generated)

012130836.b3lyp_6-31g(d).firefly.inp (generated)

012130836.b3lyp_6-31g(d).smash.inp (generated)

012130836.b3lyp_6-31g(d).nwchem.inp (generated) 012130836.b3lyp_6-31g(d).log.xz 012130836.td-b3lyp_6-31g+(d).inp 012130836.td-b3lyp_6-31g+(d).log.xz

012130836.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130836.td-b3lyp_6-31+g(d).gjf (generated)

012130836.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130836.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130836.mol 012130836.PUBCHEM 012130836.mol (via Jmol)
012130837.b3lyp_6-31g(d).inp

012130837.b3lyp_6-31g(d).qchem.inp (generated)

012130837.b3lyp_6-31g(d).gjf (generated)

012130837.b3lyp_6-31g(d).firefly.inp (generated)

012130837.b3lyp_6-31g(d).smash.inp (generated)

012130837.b3lyp_6-31g(d).nwchem.inp (generated) 012130837.b3lyp_6-31g(d).log.xz 012130837.td-b3lyp_6-31g+(d).inp 012130837.td-b3lyp_6-31g+(d).log.xz

012130837.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130837.td-b3lyp_6-31+g(d).gjf (generated)

012130837.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130837.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130837.mol 012130837.PUBCHEM 012130837.mol (via Jmol)
012130838.b3lyp_6-31g(d).inp

012130838.b3lyp_6-31g(d).qchem.inp (generated)

012130838.b3lyp_6-31g(d).gjf (generated)

012130838.b3lyp_6-31g(d).firefly.inp (generated)

012130838.b3lyp_6-31g(d).smash.inp (generated)

012130838.b3lyp_6-31g(d).nwchem.inp (generated) 012130838.b3lyp_6-31g(d).log.xz 012130838.td-b3lyp_6-31g+(d).inp 012130838.td-b3lyp_6-31g+(d).log.xz

012130838.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130838.td-b3lyp_6-31+g(d).gjf (generated)

012130838.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130838.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130838.mol 012130838.PUBCHEM 012130838.mol (via Jmol)
012130839.b3lyp_6-31g(d).inp

012130839.b3lyp_6-31g(d).qchem.inp (generated)

012130839.b3lyp_6-31g(d).gjf (generated)

012130839.b3lyp_6-31g(d).firefly.inp (generated)

012130839.b3lyp_6-31g(d).smash.inp (generated)

012130839.b3lyp_6-31g(d).nwchem.inp (generated) 012130839.b3lyp_6-31g(d).log.xz 012130839.td-b3lyp_6-31g+(d).inp 012130839.td-b3lyp_6-31g+(d).log.xz

012130839.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130839.td-b3lyp_6-31+g(d).gjf (generated)

012130839.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130839.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130839.mol 012130839.PUBCHEM 012130839.mol (via Jmol)
012130843.b3lyp_6-31g(d).inp

012130843.b3lyp_6-31g(d).qchem.inp (generated)

012130843.b3lyp_6-31g(d).gjf (generated)

012130843.b3lyp_6-31g(d).firefly.inp (generated)

012130843.b3lyp_6-31g(d).smash.inp (generated)

012130843.b3lyp_6-31g(d).nwchem.inp (generated) 012130843.b3lyp_6-31g(d).log.xz 012130843.td-b3lyp_6-31g+(d).inp 012130843.td-b3lyp_6-31g+(d).log.xz

012130843.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130843.td-b3lyp_6-31+g(d).gjf (generated)

012130843.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130843.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130843.mol 012130843.PUBCHEM 012130843.mol (via Jmol)
012130844.b3lyp_6-31g(d).inp

012130844.b3lyp_6-31g(d).qchem.inp (generated)

012130844.b3lyp_6-31g(d).gjf (generated)

012130844.b3lyp_6-31g(d).firefly.inp (generated)

012130844.b3lyp_6-31g(d).smash.inp (generated)

012130844.b3lyp_6-31g(d).nwchem.inp (generated) 012130844.b3lyp_6-31g(d).log.xz 012130844.td-b3lyp_6-31g+(d).inp 012130844.td-b3lyp_6-31g+(d).log.xz

012130844.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130844.td-b3lyp_6-31+g(d).gjf (generated)

012130844.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130844.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130844.mol 012130844.PUBCHEM 012130844.mol (via Jmol)
012130845.b3lyp_6-31g(d).inp

012130845.b3lyp_6-31g(d).qchem.inp (generated)

012130845.b3lyp_6-31g(d).gjf (generated)

012130845.b3lyp_6-31g(d).firefly.inp (generated)

012130845.b3lyp_6-31g(d).smash.inp (generated)

012130845.b3lyp_6-31g(d).nwchem.inp (generated) 012130845.b3lyp_6-31g(d).log.xz 012130845.td-b3lyp_6-31g+(d).inp 012130845.td-b3lyp_6-31g+(d).log.xz

012130845.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130845.td-b3lyp_6-31+g(d).gjf (generated)

012130845.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130845.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130845.mol 012130845.PUBCHEM 012130845.mol (via Jmol)
012130846.b3lyp_6-31g(d).inp

012130846.b3lyp_6-31g(d).qchem.inp (generated)

012130846.b3lyp_6-31g(d).gjf (generated)

012130846.b3lyp_6-31g(d).firefly.inp (generated)

012130846.b3lyp_6-31g(d).smash.inp (generated)

012130846.b3lyp_6-31g(d).nwchem.inp (generated) 012130846.b3lyp_6-31g(d).log.xz 012130846.td-b3lyp_6-31g+(d).inp 012130846.td-b3lyp_6-31g+(d).log.xz

012130846.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130846.td-b3lyp_6-31+g(d).gjf (generated)

012130846.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130846.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130846.mol 012130846.PUBCHEM 012130846.mol (via Jmol)
012130847.b3lyp_6-31g(d).inp

012130847.b3lyp_6-31g(d).qchem.inp (generated)

012130847.b3lyp_6-31g(d).gjf (generated)

012130847.b3lyp_6-31g(d).firefly.inp (generated)

012130847.b3lyp_6-31g(d).smash.inp (generated)

012130847.b3lyp_6-31g(d).nwchem.inp (generated) 012130847.b3lyp_6-31g(d).log.xz 012130847.td-b3lyp_6-31g+(d).inp 012130847.td-b3lyp_6-31g+(d).log.xz

012130847.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130847.td-b3lyp_6-31+g(d).gjf (generated)

012130847.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130847.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130847.mol 012130847.PUBCHEM 012130847.mol (via Jmol)
012130848.b3lyp_6-31g(d).inp

012130848.b3lyp_6-31g(d).qchem.inp (generated)

012130848.b3lyp_6-31g(d).gjf (generated)

012130848.b3lyp_6-31g(d).firefly.inp (generated)

012130848.b3lyp_6-31g(d).smash.inp (generated)

012130848.b3lyp_6-31g(d).nwchem.inp (generated) 012130848.b3lyp_6-31g(d).log.xz 012130848.td-b3lyp_6-31g+(d).inp 012130848.td-b3lyp_6-31g+(d).log.xz

012130848.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130848.td-b3lyp_6-31+g(d).gjf (generated)

012130848.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130848.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130848.mol 012130848.PUBCHEM 012130848.mol (via Jmol)
012130896.b3lyp_6-31g(d).inp

012130896.b3lyp_6-31g(d).qchem.inp (generated)

012130896.b3lyp_6-31g(d).gjf (generated)

012130896.b3lyp_6-31g(d).firefly.inp (generated)

012130896.b3lyp_6-31g(d).smash.inp (generated)

012130896.b3lyp_6-31g(d).nwchem.inp (generated) 012130896.b3lyp_6-31g(d).log.xz 012130896.td-b3lyp_6-31g+(d).inp 012130896.td-b3lyp_6-31g+(d).log.xz

012130896.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130896.td-b3lyp_6-31+g(d).gjf (generated)

012130896.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130896.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130896.mol 012130896.PUBCHEM 012130896.mol (via Jmol)
012130933.b3lyp_6-31g(d).inp

012130933.b3lyp_6-31g(d).qchem.inp (generated)

012130933.b3lyp_6-31g(d).gjf (generated)

012130933.b3lyp_6-31g(d).firefly.inp (generated)

012130933.b3lyp_6-31g(d).smash.inp (generated)

012130933.b3lyp_6-31g(d).nwchem.inp (generated) 012130933.b3lyp_6-31g(d).log.xz 012130933.td-b3lyp_6-31g+(d).inp 012130933.td-b3lyp_6-31g+(d).log.xz

012130933.td-b3lyp_6-31+g(d).qchem.inp (generated)

012130933.td-b3lyp_6-31+g(d).gjf (generated)

012130933.td-b3lyp_6-31+g(d).firefly.inp (generated)

012130933.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012130933.mol 012130933.PUBCHEM 012130933.mol (via Jmol)
012131095.b3lyp_6-31g(d).inp

012131095.b3lyp_6-31g(d).qchem.inp (generated)

012131095.b3lyp_6-31g(d).gjf (generated)

012131095.b3lyp_6-31g(d).firefly.inp (generated)

012131095.b3lyp_6-31g(d).smash.inp (generated)

012131095.b3lyp_6-31g(d).nwchem.inp (generated) 012131095.b3lyp_6-31g(d).log.xz 012131095.td-b3lyp_6-31g+(d).inp 012131095.td-b3lyp_6-31g+(d).log.xz

012131095.td-b3lyp_6-31+g(d).qchem.inp (generated)

012131095.td-b3lyp_6-31+g(d).gjf (generated)

012131095.td-b3lyp_6-31+g(d).firefly.inp (generated)

012131095.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012131095.mol 012131095.PUBCHEM 012131095.mol (via Jmol)
012131098.b3lyp_6-31g(d).inp

012131098.b3lyp_6-31g(d).qchem.inp (generated)

012131098.b3lyp_6-31g(d).gjf (generated)

012131098.b3lyp_6-31g(d).firefly.inp (generated)

012131098.b3lyp_6-31g(d).smash.inp (generated)

012131098.b3lyp_6-31g(d).nwchem.inp (generated) 012131098.b3lyp_6-31g(d).log.xz 012131098.td-b3lyp_6-31g+(d).inp 012131098.td-b3lyp_6-31g+(d).log.xz

012131098.td-b3lyp_6-31+g(d).qchem.inp (generated)

012131098.td-b3lyp_6-31+g(d).gjf (generated)

012131098.td-b3lyp_6-31+g(d).firefly.inp (generated)

012131098.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012131098.mol 012131098.PUBCHEM 012131098.mol (via Jmol)
012131127.b3lyp_6-31g(d).inp

012131127.b3lyp_6-31g(d).qchem.inp (generated)

012131127.b3lyp_6-31g(d).gjf (generated)

012131127.b3lyp_6-31g(d).firefly.inp (generated)

012131127.b3lyp_6-31g(d).smash.inp (generated)

012131127.b3lyp_6-31g(d).nwchem.inp (generated) 012131127.b3lyp_6-31g(d).log.xz 012131127.td-b3lyp_6-31g+(d).inp 012131127.td-b3lyp_6-31g+(d).log.xz

012131127.td-b3lyp_6-31+g(d).qchem.inp (generated)

012131127.td-b3lyp_6-31+g(d).gjf (generated)

012131127.td-b3lyp_6-31+g(d).firefly.inp (generated)

012131127.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012131127.mol 012131127.PUBCHEM 012131127.mol (via Jmol)
012131181.b3lyp_6-31g(d).inp

012131181.b3lyp_6-31g(d).qchem.inp (generated)

012131181.b3lyp_6-31g(d).gjf (generated)

012131181.b3lyp_6-31g(d).firefly.inp (generated)

012131181.b3lyp_6-31g(d).smash.inp (generated)

012131181.b3lyp_6-31g(d).nwchem.inp (generated) 012131181.b3lyp_6-31g(d).log.xz 012131181.td-b3lyp_6-31g+(d).inp 012131181.td-b3lyp_6-31g+(d).log.xz

012131181.td-b3lyp_6-31+g(d).qchem.inp (generated)

012131181.td-b3lyp_6-31+g(d).gjf (generated)

012131181.td-b3lyp_6-31+g(d).firefly.inp (generated)

012131181.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012131181.mol 012131181.PUBCHEM 012131181.mol (via Jmol)
012131258.b3lyp_6-31g(d).inp

012131258.b3lyp_6-31g(d).qchem.inp (generated)

012131258.b3lyp_6-31g(d).gjf (generated)

012131258.b3lyp_6-31g(d).firefly.inp (generated)

012131258.b3lyp_6-31g(d).smash.inp (generated)

012131258.b3lyp_6-31g(d).nwchem.inp (generated) 012131258.b3lyp_6-31g(d).log.xz 012131258.td-b3lyp_6-31g+(d).inp 012131258.td-b3lyp_6-31g+(d).log.xz

012131258.td-b3lyp_6-31+g(d).qchem.inp (generated)

012131258.td-b3lyp_6-31+g(d).gjf (generated)

012131258.td-b3lyp_6-31+g(d).firefly.inp (generated)

012131258.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012131258.mol 012131258.PUBCHEM 012131258.mol (via Jmol)
012131319.b3lyp_6-31g(d).inp

012131319.b3lyp_6-31g(d).qchem.inp (generated)

012131319.b3lyp_6-31g(d).gjf (generated)

012131319.b3lyp_6-31g(d).firefly.inp (generated)

012131319.b3lyp_6-31g(d).smash.inp (generated)

012131319.b3lyp_6-31g(d).nwchem.inp (generated) 012131319.b3lyp_6-31g(d).log.xz 012131319.td-b3lyp_6-31g+(d).inp 012131319.td-b3lyp_6-31g+(d).log.xz

012131319.td-b3lyp_6-31+g(d).qchem.inp (generated)

012131319.td-b3lyp_6-31+g(d).gjf (generated)

012131319.td-b3lyp_6-31+g(d).firefly.inp (generated)

012131319.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012131319.mol 012131319.PUBCHEM 012131319.mol (via Jmol)
012131338.b3lyp_6-31g(d).inp

012131338.b3lyp_6-31g(d).qchem.inp (generated)

012131338.b3lyp_6-31g(d).gjf (generated)

012131338.b3lyp_6-31g(d).firefly.inp (generated)

012131338.b3lyp_6-31g(d).smash.inp (generated)

012131338.b3lyp_6-31g(d).nwchem.inp (generated) 012131338.b3lyp_6-31g(d).log.xz 012131338.td-b3lyp_6-31g+(d).inp 012131338.td-b3lyp_6-31g+(d).log.xz

012131338.td-b3lyp_6-31+g(d).qchem.inp (generated)

012131338.td-b3lyp_6-31+g(d).gjf (generated)

012131338.td-b3lyp_6-31+g(d).firefly.inp (generated)

012131338.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012131338.mol 012131338.PUBCHEM 012131338.mol (via Jmol)
012131346.b3lyp_6-31g(d).inp

012131346.b3lyp_6-31g(d).qchem.inp (generated)

012131346.b3lyp_6-31g(d).gjf (generated)

012131346.b3lyp_6-31g(d).firefly.inp (generated)

012131346.b3lyp_6-31g(d).smash.inp (generated)

012131346.b3lyp_6-31g(d).nwchem.inp (generated) 012131346.b3lyp_6-31g(d).log.xz 012131346.td-b3lyp_6-31g+(d).inp 012131346.td-b3lyp_6-31g+(d).log.xz

012131346.td-b3lyp_6-31+g(d).qchem.inp (generated)

012131346.td-b3lyp_6-31+g(d).gjf (generated)

012131346.td-b3lyp_6-31+g(d).firefly.inp (generated)

012131346.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012131346.mol 012131346.PUBCHEM 012131346.mol (via Jmol)
012131424.b3lyp_6-31g(d).inp

012131424.b3lyp_6-31g(d).qchem.inp (generated)

012131424.b3lyp_6-31g(d).gjf (generated)

012131424.b3lyp_6-31g(d).firefly.inp (generated)

012131424.b3lyp_6-31g(d).smash.inp (generated)

012131424.b3lyp_6-31g(d).nwchem.inp (generated) 012131424.b3lyp_6-31g(d).log.xz 012131424.td-b3lyp_6-31g+(d).inp 012131424.td-b3lyp_6-31g+(d).log.xz

012131424.td-b3lyp_6-31+g(d).qchem.inp (generated)

012131424.td-b3lyp_6-31+g(d).gjf (generated)

012131424.td-b3lyp_6-31+g(d).firefly.inp (generated)

012131424.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012131424.mol 012131424.PUBCHEM 012131424.mol (via Jmol)
012131481.b3lyp_6-31g(d).inp

012131481.b3lyp_6-31g(d).qchem.inp (generated)

012131481.b3lyp_6-31g(d).gjf (generated)

012131481.b3lyp_6-31g(d).firefly.inp (generated)

012131481.b3lyp_6-31g(d).smash.inp (generated)

012131481.b3lyp_6-31g(d).nwchem.inp (generated) 012131481.b3lyp_6-31g(d).log.xz 012131481.td-b3lyp_6-31g+(d).inp 012131481.td-b3lyp_6-31g+(d).log.xz

012131481.td-b3lyp_6-31+g(d).qchem.inp (generated)

012131481.td-b3lyp_6-31+g(d).gjf (generated)

012131481.td-b3lyp_6-31+g(d).firefly.inp (generated)

012131481.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012131481.mol 012131481.PUBCHEM 012131481.mol (via Jmol)
012131483.b3lyp_6-31g(d).inp

012131483.b3lyp_6-31g(d).qchem.inp (generated)

012131483.b3lyp_6-31g(d).gjf (generated)

012131483.b3lyp_6-31g(d).firefly.inp (generated)

012131483.b3lyp_6-31g(d).smash.inp (generated)

012131483.b3lyp_6-31g(d).nwchem.inp (generated) 012131483.b3lyp_6-31g(d).log.xz 012131483.td-b3lyp_6-31g+(d).inp 012131483.td-b3lyp_6-31g+(d).log.xz

012131483.td-b3lyp_6-31+g(d).qchem.inp (generated)

012131483.td-b3lyp_6-31+g(d).gjf (generated)

012131483.td-b3lyp_6-31+g(d).firefly.inp (generated)

012131483.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012131483.mol 012131483.PUBCHEM 012131483.mol (via Jmol)
012131485.b3lyp_6-31g(d).inp

012131485.b3lyp_6-31g(d).qchem.inp (generated)

012131485.b3lyp_6-31g(d).gjf (generated)

012131485.b3lyp_6-31g(d).firefly.inp (generated)

012131485.b3lyp_6-31g(d).smash.inp (generated)

012131485.b3lyp_6-31g(d).nwchem.inp (generated) 012131485.b3lyp_6-31g(d).log.xz 012131485.mol 012131485.PUBCHEM 012131485.mol (via Jmol)
012131487.b3lyp_6-31g(d).inp

012131487.b3lyp_6-31g(d).qchem.inp (generated)

012131487.b3lyp_6-31g(d).gjf (generated)

012131487.b3lyp_6-31g(d).firefly.inp (generated)

012131487.b3lyp_6-31g(d).smash.inp (generated)

012131487.b3lyp_6-31g(d).nwchem.inp (generated) 012131487.b3lyp_6-31g(d).log.xz 012131487.mol 012131487.PUBCHEM 012131487.mol (via Jmol)
012131489.b3lyp_6-31g(d).inp

012131489.b3lyp_6-31g(d).qchem.inp (generated)

012131489.b3lyp_6-31g(d).gjf (generated)

012131489.b3lyp_6-31g(d).firefly.inp (generated)

012131489.b3lyp_6-31g(d).smash.inp (generated)

012131489.b3lyp_6-31g(d).nwchem.inp (generated) 012131489.b3lyp_6-31g(d).log.xz 012131489.td-b3lyp_6-31g+(d).inp 012131489.td-b3lyp_6-31g+(d).log.xz

012131489.td-b3lyp_6-31+g(d).qchem.inp (generated)

012131489.td-b3lyp_6-31+g(d).gjf (generated)

012131489.td-b3lyp_6-31+g(d).firefly.inp (generated)

012131489.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012131489.mol 012131489.PUBCHEM 012131489.mol (via Jmol)
012131491.b3lyp_6-31g(d).inp

012131491.b3lyp_6-31g(d).qchem.inp (generated)

012131491.b3lyp_6-31g(d).gjf (generated)

012131491.b3lyp_6-31g(d).firefly.inp (generated)

012131491.b3lyp_6-31g(d).smash.inp (generated)

012131491.b3lyp_6-31g(d).nwchem.inp (generated) 012131491.b3lyp_6-31g(d).log.xz 012131491.td-b3lyp_6-31g+(d).inp 012131491.td-b3lyp_6-31g+(d).log.xz

012131491.td-b3lyp_6-31+g(d).qchem.inp (generated)

012131491.td-b3lyp_6-31+g(d).gjf (generated)

012131491.td-b3lyp_6-31+g(d).firefly.inp (generated)

012131491.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012131491.mol 012131491.PUBCHEM 012131491.mol (via Jmol)
012131493.b3lyp_6-31g(d).inp

012131493.b3lyp_6-31g(d).qchem.inp (generated)

012131493.b3lyp_6-31g(d).gjf (generated)

012131493.b3lyp_6-31g(d).firefly.inp (generated)

012131493.b3lyp_6-31g(d).smash.inp (generated)

012131493.b3lyp_6-31g(d).nwchem.inp (generated) 012131493.b3lyp_6-31g(d).log.xz 012131493.mol 012131493.PUBCHEM 012131493.mol (via Jmol)
012131495.b3lyp_6-31g(d).inp

012131495.b3lyp_6-31g(d).qchem.inp (generated)

012131495.b3lyp_6-31g(d).gjf (generated)

012131495.b3lyp_6-31g(d).firefly.inp (generated)

012131495.b3lyp_6-31g(d).smash.inp (generated)

012131495.b3lyp_6-31g(d).nwchem.inp (generated) 012131495.b3lyp_6-31g(d).log.xz 012131495.td-b3lyp_6-31g+(d).inp 012131495.td-b3lyp_6-31g+(d).log.xz

012131495.td-b3lyp_6-31+g(d).qchem.inp (generated)

012131495.td-b3lyp_6-31+g(d).gjf (generated)

012131495.td-b3lyp_6-31+g(d).firefly.inp (generated)

012131495.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012131495.mol 012131495.PUBCHEM 012131495.mol (via Jmol)
012131497.b3lyp_6-31g(d).inp

012131497.b3lyp_6-31g(d).qchem.inp (generated)

012131497.b3lyp_6-31g(d).gjf (generated)

012131497.b3lyp_6-31g(d).firefly.inp (generated)

012131497.b3lyp_6-31g(d).smash.inp (generated)

012131497.b3lyp_6-31g(d).nwchem.inp (generated) 012131497.b3lyp_6-31g(d).log.xz 012131497.td-b3lyp_6-31g+(d).inp 012131497.td-b3lyp_6-31g+(d).log.xz

012131497.td-b3lyp_6-31+g(d).qchem.inp (generated)

012131497.td-b3lyp_6-31+g(d).gjf (generated)

012131497.td-b3lyp_6-31+g(d).firefly.inp (generated)

012131497.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012131497.mol 012131497.PUBCHEM 012131497.mol (via Jmol)
012131499.b3lyp_6-31g(d).inp

012131499.b3lyp_6-31g(d).qchem.inp (generated)

012131499.b3lyp_6-31g(d).gjf (generated)

012131499.b3lyp_6-31g(d).firefly.inp (generated)

012131499.b3lyp_6-31g(d).smash.inp (generated)

012131499.b3lyp_6-31g(d).nwchem.inp (generated) 012131499.b3lyp_6-31g(d).log.xz 012131499.mol 012131499.PUBCHEM 012131499.mol (via Jmol)
012131637.b3lyp_6-31g(d).inp

012131637.b3lyp_6-31g(d).qchem.inp (generated)

012131637.b3lyp_6-31g(d).gjf (generated)

012131637.b3lyp_6-31g(d).firefly.inp (generated)

012131637.b3lyp_6-31g(d).smash.inp (generated)

012131637.b3lyp_6-31g(d).nwchem.inp (generated) 012131637.b3lyp_6-31g(d).log.xz 012131637.td-b3lyp_6-31g+(d).inp 012131637.td-b3lyp_6-31g+(d).log.xz

012131637.td-b3lyp_6-31+g(d).qchem.inp (generated)

012131637.td-b3lyp_6-31+g(d).gjf (generated)

012131637.td-b3lyp_6-31+g(d).firefly.inp (generated)

012131637.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012131637.mol 012131637.PUBCHEM 012131637.mol (via Jmol)
012131705.b3lyp_6-31g(d).inp

012131705.b3lyp_6-31g(d).qchem.inp (generated)

012131705.b3lyp_6-31g(d).gjf (generated)

012131705.b3lyp_6-31g(d).firefly.inp (generated)

012131705.b3lyp_6-31g(d).smash.inp (generated)

012131705.b3lyp_6-31g(d).nwchem.inp (generated) 012131705.b3lyp_6-31g(d).log.xz 012131705.td-b3lyp_6-31g+(d).inp 012131705.td-b3lyp_6-31g+(d).log.xz

012131705.td-b3lyp_6-31+g(d).qchem.inp (generated)

012131705.td-b3lyp_6-31+g(d).gjf (generated)

012131705.td-b3lyp_6-31+g(d).firefly.inp (generated)

012131705.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012131705.mol 012131705.PUBCHEM 012131705.mol (via Jmol)
012131708.b3lyp_6-31g(d).inp

012131708.b3lyp_6-31g(d).qchem.inp (generated)

012131708.b3lyp_6-31g(d).gjf (generated)

012131708.b3lyp_6-31g(d).firefly.inp (generated)

012131708.b3lyp_6-31g(d).smash.inp (generated)

012131708.b3lyp_6-31g(d).nwchem.inp (generated) 012131708.b3lyp_6-31g(d).log.xz 012131708.td-b3lyp_6-31g+(d).inp 012131708.td-b3lyp_6-31g+(d).log.xz

012131708.td-b3lyp_6-31+g(d).qchem.inp (generated)

012131708.td-b3lyp_6-31+g(d).gjf (generated)

012131708.td-b3lyp_6-31+g(d).firefly.inp (generated)

012131708.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012131708.mol 012131708.PUBCHEM 012131708.mol (via Jmol)
012131804.b3lyp_6-31g(d).inp

012131804.b3lyp_6-31g(d).qchem.inp (generated)

012131804.b3lyp_6-31g(d).gjf (generated)

012131804.b3lyp_6-31g(d).firefly.inp (generated)

012131804.b3lyp_6-31g(d).smash.inp (generated)

012131804.b3lyp_6-31g(d).nwchem.inp (generated) 012131804.b3lyp_6-31g(d).log.xz 012131804.mol 012131804.PUBCHEM 012131804.mol (via Jmol)
012131901.b3lyp_6-31g(d).inp

012131901.b3lyp_6-31g(d).qchem.inp (generated)

012131901.b3lyp_6-31g(d).gjf (generated)

012131901.b3lyp_6-31g(d).firefly.inp (generated)

012131901.b3lyp_6-31g(d).smash.inp (generated)

012131901.b3lyp_6-31g(d).nwchem.inp (generated) 012131901.b3lyp_6-31g(d).log.xz 012131901.td-b3lyp_6-31g+(d).inp 012131901.td-b3lyp_6-31g+(d).log.xz

012131901.td-b3lyp_6-31+g(d).qchem.inp (generated)

012131901.td-b3lyp_6-31+g(d).gjf (generated)

012131901.td-b3lyp_6-31+g(d).firefly.inp (generated)

012131901.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012131901.mol 012131901.PUBCHEM 012131901.mol (via Jmol)
012131949.b3lyp_6-31g(d).inp

012131949.b3lyp_6-31g(d).qchem.inp (generated)

012131949.b3lyp_6-31g(d).gjf (generated)

012131949.b3lyp_6-31g(d).firefly.inp (generated)

012131949.b3lyp_6-31g(d).smash.inp (generated)

012131949.b3lyp_6-31g(d).nwchem.inp (generated) 012131949.b3lyp_6-31g(d).log.xz 012131949.td-b3lyp_6-31g+(d).inp 012131949.td-b3lyp_6-31g+(d).log.xz

012131949.td-b3lyp_6-31+g(d).qchem.inp (generated)

012131949.td-b3lyp_6-31+g(d).gjf (generated)

012131949.td-b3lyp_6-31+g(d).firefly.inp (generated)

012131949.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012131949.mol 012131949.PUBCHEM 012131949.mol (via Jmol)
012132004.b3lyp_6-31g(d).inp

012132004.b3lyp_6-31g(d).qchem.inp (generated)

012132004.b3lyp_6-31g(d).gjf (generated)

012132004.b3lyp_6-31g(d).firefly.inp (generated)

012132004.b3lyp_6-31g(d).smash.inp (generated)

012132004.b3lyp_6-31g(d).nwchem.inp (generated) 012132004.b3lyp_6-31g(d).log.xz 012132004.td-b3lyp_6-31g+(d).inp 012132004.td-b3lyp_6-31g+(d).log.xz

012132004.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132004.td-b3lyp_6-31+g(d).gjf (generated)

012132004.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132004.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132004.mol 012132004.PUBCHEM 012132004.mol (via Jmol)
012132020.b3lyp_6-31g(d).inp

012132020.b3lyp_6-31g(d).qchem.inp (generated)

012132020.b3lyp_6-31g(d).gjf (generated)

012132020.b3lyp_6-31g(d).firefly.inp (generated)

012132020.b3lyp_6-31g(d).smash.inp (generated)

012132020.b3lyp_6-31g(d).nwchem.inp (generated) 012132020.b3lyp_6-31g(d).log.xz 012132020.td-b3lyp_6-31g+(d).inp 012132020.td-b3lyp_6-31g+(d).log.xz

012132020.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132020.td-b3lyp_6-31+g(d).gjf (generated)

012132020.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132020.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132020.mol 012132020.PUBCHEM 012132020.mol (via Jmol)
012132051.b3lyp_6-31g(d).inp

012132051.b3lyp_6-31g(d).qchem.inp (generated)

012132051.b3lyp_6-31g(d).gjf (generated)

012132051.b3lyp_6-31g(d).firefly.inp (generated)

012132051.b3lyp_6-31g(d).smash.inp (generated)

012132051.b3lyp_6-31g(d).nwchem.inp (generated) 012132051.b3lyp_6-31g(d).log.xz 012132051.td-b3lyp_6-31g+(d).inp 012132051.td-b3lyp_6-31g+(d).log.xz

012132051.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132051.td-b3lyp_6-31+g(d).gjf (generated)

012132051.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132051.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132051.mol 012132051.PUBCHEM 012132051.mol (via Jmol)
012132053.b3lyp_6-31g(d).inp

012132053.b3lyp_6-31g(d).qchem.inp (generated)

012132053.b3lyp_6-31g(d).gjf (generated)

012132053.b3lyp_6-31g(d).firefly.inp (generated)

012132053.b3lyp_6-31g(d).smash.inp (generated)

012132053.b3lyp_6-31g(d).nwchem.inp (generated) 012132053.b3lyp_6-31g(d).log.xz 012132053.td-b3lyp_6-31g+(d).inp 012132053.td-b3lyp_6-31g+(d).log.xz

012132053.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132053.td-b3lyp_6-31+g(d).gjf (generated)

012132053.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132053.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132053.mol 012132053.PUBCHEM 012132053.mol (via Jmol)
012132054.b3lyp_6-31g(d).inp

012132054.b3lyp_6-31g(d).qchem.inp (generated)

012132054.b3lyp_6-31g(d).gjf (generated)

012132054.b3lyp_6-31g(d).firefly.inp (generated)

012132054.b3lyp_6-31g(d).smash.inp (generated)

012132054.b3lyp_6-31g(d).nwchem.inp (generated) 012132054.b3lyp_6-31g(d).log.xz 012132054.td-b3lyp_6-31g+(d).inp 012132054.td-b3lyp_6-31g+(d).log.xz

012132054.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132054.td-b3lyp_6-31+g(d).gjf (generated)

012132054.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132054.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132054.mol 012132054.PUBCHEM 012132054.mol (via Jmol)
012132137.b3lyp_6-31g(d).inp

012132137.b3lyp_6-31g(d).qchem.inp (generated)

012132137.b3lyp_6-31g(d).gjf (generated)

012132137.b3lyp_6-31g(d).firefly.inp (generated)

012132137.b3lyp_6-31g(d).smash.inp (generated)

012132137.b3lyp_6-31g(d).nwchem.inp (generated) 012132137.b3lyp_6-31g(d).log.xz 012132137.td-b3lyp_6-31g+(d).inp 012132137.td-b3lyp_6-31g+(d).log.xz

012132137.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132137.td-b3lyp_6-31+g(d).gjf (generated)

012132137.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132137.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132137.mol 012132137.PUBCHEM 012132137.mol (via Jmol)
012132138.b3lyp_6-31g(d).inp

012132138.b3lyp_6-31g(d).qchem.inp (generated)

012132138.b3lyp_6-31g(d).gjf (generated)

012132138.b3lyp_6-31g(d).firefly.inp (generated)

012132138.b3lyp_6-31g(d).smash.inp (generated)

012132138.b3lyp_6-31g(d).nwchem.inp (generated) 012132138.b3lyp_6-31g(d).log.xz 012132138.td-b3lyp_6-31g+(d).inp 012132138.td-b3lyp_6-31g+(d).log.xz

012132138.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132138.td-b3lyp_6-31+g(d).gjf (generated)

012132138.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132138.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132138.mol 012132138.PUBCHEM 012132138.mol (via Jmol)
012132241.b3lyp_6-31g(d).inp

012132241.b3lyp_6-31g(d).qchem.inp (generated)

012132241.b3lyp_6-31g(d).gjf (generated)

012132241.b3lyp_6-31g(d).firefly.inp (generated)

012132241.b3lyp_6-31g(d).smash.inp (generated)

012132241.b3lyp_6-31g(d).nwchem.inp (generated) 012132241.b3lyp_6-31g(d).log.xz 012132241.td-b3lyp_6-31g+(d).inp 012132241.td-b3lyp_6-31g+(d).log.xz

012132241.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132241.td-b3lyp_6-31+g(d).gjf (generated)

012132241.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132241.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132241.mol 012132241.PUBCHEM 012132241.mol (via Jmol)
012132313.b3lyp_6-31g(d).inp

012132313.b3lyp_6-31g(d).qchem.inp (generated)

012132313.b3lyp_6-31g(d).gjf (generated)

012132313.b3lyp_6-31g(d).firefly.inp (generated)

012132313.b3lyp_6-31g(d).smash.inp (generated)

012132313.b3lyp_6-31g(d).nwchem.inp (generated) 012132313.b3lyp_6-31g(d).log.xz 012132313.td-b3lyp_6-31g+(d).inp 012132313.td-b3lyp_6-31g+(d).log.xz

012132313.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132313.td-b3lyp_6-31+g(d).gjf (generated)

012132313.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132313.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132313.mol 012132313.PUBCHEM 012132313.mol (via Jmol)
012132375.b3lyp_6-31g(d).inp

012132375.b3lyp_6-31g(d).qchem.inp (generated)

012132375.b3lyp_6-31g(d).gjf (generated)

012132375.b3lyp_6-31g(d).firefly.inp (generated)

012132375.b3lyp_6-31g(d).smash.inp (generated)

012132375.b3lyp_6-31g(d).nwchem.inp (generated) 012132375.b3lyp_6-31g(d).log.xz 012132375.mol 012132375.PUBCHEM 012132375.mol (via Jmol)
012132563.b3lyp_6-31g(d).inp

012132563.b3lyp_6-31g(d).qchem.inp (generated)

012132563.b3lyp_6-31g(d).gjf (generated)

012132563.b3lyp_6-31g(d).firefly.inp (generated)

012132563.b3lyp_6-31g(d).smash.inp (generated)

012132563.b3lyp_6-31g(d).nwchem.inp (generated) 012132563.b3lyp_6-31g(d).log.xz 012132563.td-b3lyp_6-31g+(d).inp 012132563.td-b3lyp_6-31g+(d).log.xz

012132563.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132563.td-b3lyp_6-31+g(d).gjf (generated)

012132563.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132563.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132563.mol 012132563.PUBCHEM 012132563.mol (via Jmol)
012132566.b3lyp_6-31g(d).inp

012132566.b3lyp_6-31g(d).qchem.inp (generated)

012132566.b3lyp_6-31g(d).gjf (generated)

012132566.b3lyp_6-31g(d).firefly.inp (generated)

012132566.b3lyp_6-31g(d).smash.inp (generated)

012132566.b3lyp_6-31g(d).nwchem.inp (generated) 012132566.b3lyp_6-31g(d).log.xz 012132566.mol 012132566.PUBCHEM 012132566.mol (via Jmol)
012132584.b3lyp_6-31g(d).inp

012132584.b3lyp_6-31g(d).qchem.inp (generated)

012132584.b3lyp_6-31g(d).gjf (generated)

012132584.b3lyp_6-31g(d).firefly.inp (generated)

012132584.b3lyp_6-31g(d).smash.inp (generated)

012132584.b3lyp_6-31g(d).nwchem.inp (generated) 012132584.b3lyp_6-31g(d).log.xz 012132584.td-b3lyp_6-31g+(d).inp 012132584.td-b3lyp_6-31g+(d).log.xz

012132584.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132584.td-b3lyp_6-31+g(d).gjf (generated)

012132584.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132584.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132584.mol 012132584.PUBCHEM 012132584.mol (via Jmol)
012132617.b3lyp_6-31g(d).inp

012132617.b3lyp_6-31g(d).qchem.inp (generated)

012132617.b3lyp_6-31g(d).gjf (generated)

012132617.b3lyp_6-31g(d).firefly.inp (generated)

012132617.b3lyp_6-31g(d).smash.inp (generated)

012132617.b3lyp_6-31g(d).nwchem.inp (generated) 012132617.b3lyp_6-31g(d).log.xz 012132617.td-b3lyp_6-31g+(d).inp 012132617.td-b3lyp_6-31g+(d).log.xz

012132617.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132617.td-b3lyp_6-31+g(d).gjf (generated)

012132617.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132617.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132617.mol 012132617.PUBCHEM 012132617.mol (via Jmol)
012132618.b3lyp_6-31g(d).inp

012132618.b3lyp_6-31g(d).qchem.inp (generated)

012132618.b3lyp_6-31g(d).gjf (generated)

012132618.b3lyp_6-31g(d).firefly.inp (generated)

012132618.b3lyp_6-31g(d).smash.inp (generated)

012132618.b3lyp_6-31g(d).nwchem.inp (generated) 012132618.b3lyp_6-31g(d).log.xz 012132618.td-b3lyp_6-31g+(d).inp 012132618.td-b3lyp_6-31g+(d).log.xz

012132618.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132618.td-b3lyp_6-31+g(d).gjf (generated)

012132618.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132618.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132618.mol 012132618.PUBCHEM 012132618.mol (via Jmol)
012132635.b3lyp_6-31g(d).inp

012132635.b3lyp_6-31g(d).qchem.inp (generated)

012132635.b3lyp_6-31g(d).gjf (generated)

012132635.b3lyp_6-31g(d).firefly.inp (generated)

012132635.b3lyp_6-31g(d).smash.inp (generated)

012132635.b3lyp_6-31g(d).nwchem.inp (generated) 012132635.b3lyp_6-31g(d).log.xz 012132635.td-b3lyp_6-31g+(d).inp 012132635.td-b3lyp_6-31g+(d).log.xz

012132635.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132635.td-b3lyp_6-31+g(d).gjf (generated)

012132635.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132635.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132635.mol 012132635.PUBCHEM 012132635.mol (via Jmol)
012132665.b3lyp_6-31g(d).inp

012132665.b3lyp_6-31g(d).qchem.inp (generated)

012132665.b3lyp_6-31g(d).gjf (generated)

012132665.b3lyp_6-31g(d).firefly.inp (generated)

012132665.b3lyp_6-31g(d).smash.inp (generated)

012132665.b3lyp_6-31g(d).nwchem.inp (generated) 012132665.b3lyp_6-31g(d).log.xz 012132665.td-b3lyp_6-31g+(d).inp 012132665.td-b3lyp_6-31g+(d).log.xz

012132665.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132665.td-b3lyp_6-31+g(d).gjf (generated)

012132665.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132665.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132665.mol 012132665.PUBCHEM 012132665.mol (via Jmol)
012132667.b3lyp_6-31g(d).inp

012132667.b3lyp_6-31g(d).qchem.inp (generated)

012132667.b3lyp_6-31g(d).gjf (generated)

012132667.b3lyp_6-31g(d).firefly.inp (generated)

012132667.b3lyp_6-31g(d).smash.inp (generated)

012132667.b3lyp_6-31g(d).nwchem.inp (generated) 012132667.b3lyp_6-31g(d).log.xz 012132667.td-b3lyp_6-31g+(d).inp 012132667.td-b3lyp_6-31g+(d).log.xz

012132667.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132667.td-b3lyp_6-31+g(d).gjf (generated)

012132667.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132667.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132667.mol 012132667.PUBCHEM 012132667.mol (via Jmol)
012132756.b3lyp_6-31g(d).inp

012132756.b3lyp_6-31g(d).qchem.inp (generated)

012132756.b3lyp_6-31g(d).gjf (generated)

012132756.b3lyp_6-31g(d).firefly.inp (generated)

012132756.b3lyp_6-31g(d).smash.inp (generated)

012132756.b3lyp_6-31g(d).nwchem.inp (generated) 012132756.b3lyp_6-31g(d).log.xz 012132756.td-b3lyp_6-31g+(d).inp 012132756.td-b3lyp_6-31g+(d).log.xz

012132756.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132756.td-b3lyp_6-31+g(d).gjf (generated)

012132756.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132756.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132756.mol 012132756.PUBCHEM 012132756.mol (via Jmol)
012132771.b3lyp_6-31g(d).inp

012132771.b3lyp_6-31g(d).qchem.inp (generated)

012132771.b3lyp_6-31g(d).gjf (generated)

012132771.b3lyp_6-31g(d).firefly.inp (generated)

012132771.b3lyp_6-31g(d).smash.inp (generated)

012132771.b3lyp_6-31g(d).nwchem.inp (generated) 012132771.b3lyp_6-31g(d).log.xz 012132771.td-b3lyp_6-31g+(d).inp 012132771.td-b3lyp_6-31g+(d).log.xz

012132771.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132771.td-b3lyp_6-31+g(d).gjf (generated)

012132771.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132771.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132771.mol 012132771.PUBCHEM 012132771.mol (via Jmol)
012132789.b3lyp_6-31g(d).inp

012132789.b3lyp_6-31g(d).qchem.inp (generated)

012132789.b3lyp_6-31g(d).gjf (generated)

012132789.b3lyp_6-31g(d).firefly.inp (generated)

012132789.b3lyp_6-31g(d).smash.inp (generated)

012132789.b3lyp_6-31g(d).nwchem.inp (generated) 012132789.b3lyp_6-31g(d).log.xz 012132789.td-b3lyp_6-31g+(d).inp 012132789.td-b3lyp_6-31g+(d).log.xz

012132789.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132789.td-b3lyp_6-31+g(d).gjf (generated)

012132789.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132789.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132789.mol 012132789.PUBCHEM 012132789.mol (via Jmol)
012132790.b3lyp_6-31g(d).inp

012132790.b3lyp_6-31g(d).qchem.inp (generated)

012132790.b3lyp_6-31g(d).gjf (generated)

012132790.b3lyp_6-31g(d).firefly.inp (generated)

012132790.b3lyp_6-31g(d).smash.inp (generated)

012132790.b3lyp_6-31g(d).nwchem.inp (generated) 012132790.b3lyp_6-31g(d).log.xz 012132790.td-b3lyp_6-31g+(d).inp 012132790.td-b3lyp_6-31g+(d).log.xz

012132790.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132790.td-b3lyp_6-31+g(d).gjf (generated)

012132790.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132790.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132790.mol 012132790.PUBCHEM 012132790.mol (via Jmol)
012132791.b3lyp_6-31g(d).inp

012132791.b3lyp_6-31g(d).qchem.inp (generated)

012132791.b3lyp_6-31g(d).gjf (generated)

012132791.b3lyp_6-31g(d).firefly.inp (generated)

012132791.b3lyp_6-31g(d).smash.inp (generated)

012132791.b3lyp_6-31g(d).nwchem.inp (generated) 012132791.b3lyp_6-31g(d).log.xz 012132791.td-b3lyp_6-31g+(d).inp 012132791.td-b3lyp_6-31g+(d).log.xz

012132791.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132791.td-b3lyp_6-31+g(d).gjf (generated)

012132791.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132791.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132791.mol 012132791.PUBCHEM 012132791.mol (via Jmol)
012132796.b3lyp_6-31g(d).inp

012132796.b3lyp_6-31g(d).qchem.inp (generated)

012132796.b3lyp_6-31g(d).gjf (generated)

012132796.b3lyp_6-31g(d).firefly.inp (generated)

012132796.b3lyp_6-31g(d).smash.inp (generated)

012132796.b3lyp_6-31g(d).nwchem.inp (generated) 012132796.b3lyp_6-31g(d).log.xz 012132796.td-b3lyp_6-31g+(d).inp 012132796.td-b3lyp_6-31g+(d).log.xz

012132796.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132796.td-b3lyp_6-31+g(d).gjf (generated)

012132796.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132796.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132796.mol 012132796.PUBCHEM 012132796.mol (via Jmol)
012132798.b3lyp_6-31g(d).inp

012132798.b3lyp_6-31g(d).qchem.inp (generated)

012132798.b3lyp_6-31g(d).gjf (generated)

012132798.b3lyp_6-31g(d).firefly.inp (generated)

012132798.b3lyp_6-31g(d).smash.inp (generated)

012132798.b3lyp_6-31g(d).nwchem.inp (generated) 012132798.b3lyp_6-31g(d).log.xz 012132798.td-b3lyp_6-31g+(d).inp 012132798.td-b3lyp_6-31g+(d).log.xz

012132798.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132798.td-b3lyp_6-31+g(d).gjf (generated)

012132798.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132798.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132798.mol 012132798.PUBCHEM 012132798.mol (via Jmol)
012132799.b3lyp_6-31g(d).inp

012132799.b3lyp_6-31g(d).qchem.inp (generated)

012132799.b3lyp_6-31g(d).gjf (generated)

012132799.b3lyp_6-31g(d).firefly.inp (generated)

012132799.b3lyp_6-31g(d).smash.inp (generated)

012132799.b3lyp_6-31g(d).nwchem.inp (generated) 012132799.b3lyp_6-31g(d).log.xz 012132799.td-b3lyp_6-31g+(d).inp 012132799.td-b3lyp_6-31g+(d).log.xz

012132799.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132799.td-b3lyp_6-31+g(d).gjf (generated)

012132799.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132799.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132799.mol 012132799.PUBCHEM 012132799.mol (via Jmol)
012132800.b3lyp_6-31g(d).inp

012132800.b3lyp_6-31g(d).qchem.inp (generated)

012132800.b3lyp_6-31g(d).gjf (generated)

012132800.b3lyp_6-31g(d).firefly.inp (generated)

012132800.b3lyp_6-31g(d).smash.inp (generated)

012132800.b3lyp_6-31g(d).nwchem.inp (generated) 012132800.b3lyp_6-31g(d).log.xz 012132800.td-b3lyp_6-31g+(d).inp 012132800.td-b3lyp_6-31g+(d).log.xz

012132800.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132800.td-b3lyp_6-31+g(d).gjf (generated)

012132800.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132800.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132800.mol 012132800.PUBCHEM 012132800.mol (via Jmol)
012132803.b3lyp_6-31g(d).inp

012132803.b3lyp_6-31g(d).qchem.inp (generated)

012132803.b3lyp_6-31g(d).gjf (generated)

012132803.b3lyp_6-31g(d).firefly.inp (generated)

012132803.b3lyp_6-31g(d).smash.inp (generated)

012132803.b3lyp_6-31g(d).nwchem.inp (generated) 012132803.b3lyp_6-31g(d).log.xz 012132803.td-b3lyp_6-31g+(d).inp 012132803.td-b3lyp_6-31g+(d).log.xz

012132803.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132803.td-b3lyp_6-31+g(d).gjf (generated)

012132803.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132803.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132803.mol 012132803.PUBCHEM 012132803.mol (via Jmol)
012132804.b3lyp_6-31g(d).inp

012132804.b3lyp_6-31g(d).qchem.inp (generated)

012132804.b3lyp_6-31g(d).gjf (generated)

012132804.b3lyp_6-31g(d).firefly.inp (generated)

012132804.b3lyp_6-31g(d).smash.inp (generated)

012132804.b3lyp_6-31g(d).nwchem.inp (generated) 012132804.b3lyp_6-31g(d).log.xz 012132804.td-b3lyp_6-31g+(d).inp 012132804.td-b3lyp_6-31g+(d).log.xz

012132804.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132804.td-b3lyp_6-31+g(d).gjf (generated)

012132804.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132804.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132804.mol 012132804.PUBCHEM 012132804.mol (via Jmol)
012132810.b3lyp_6-31g(d).inp

012132810.b3lyp_6-31g(d).qchem.inp (generated)

012132810.b3lyp_6-31g(d).gjf (generated)

012132810.b3lyp_6-31g(d).firefly.inp (generated)

012132810.b3lyp_6-31g(d).smash.inp (generated)

012132810.b3lyp_6-31g(d).nwchem.inp (generated) 012132810.b3lyp_6-31g(d).log.xz 012132810.td-b3lyp_6-31g+(d).inp 012132810.td-b3lyp_6-31g+(d).log.xz

012132810.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132810.td-b3lyp_6-31+g(d).gjf (generated)

012132810.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132810.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132810.mol 012132810.PUBCHEM 012132810.mol (via Jmol)
012132813.b3lyp_6-31g(d).inp

012132813.b3lyp_6-31g(d).qchem.inp (generated)

012132813.b3lyp_6-31g(d).gjf (generated)

012132813.b3lyp_6-31g(d).firefly.inp (generated)

012132813.b3lyp_6-31g(d).smash.inp (generated)

012132813.b3lyp_6-31g(d).nwchem.inp (generated) 012132813.b3lyp_6-31g(d).log.xz 012132813.td-b3lyp_6-31g+(d).inp 012132813.td-b3lyp_6-31g+(d).log.xz

012132813.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132813.td-b3lyp_6-31+g(d).gjf (generated)

012132813.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132813.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132813.mol 012132813.PUBCHEM 012132813.mol (via Jmol)
012132815.b3lyp_6-31g(d).inp

012132815.b3lyp_6-31g(d).qchem.inp (generated)

012132815.b3lyp_6-31g(d).gjf (generated)

012132815.b3lyp_6-31g(d).firefly.inp (generated)

012132815.b3lyp_6-31g(d).smash.inp (generated)

012132815.b3lyp_6-31g(d).nwchem.inp (generated) 012132815.b3lyp_6-31g(d).log.xz 012132815.td-b3lyp_6-31g+(d).inp 012132815.td-b3lyp_6-31g+(d).log.xz

012132815.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132815.td-b3lyp_6-31+g(d).gjf (generated)

012132815.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132815.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132815.mol 012132815.PUBCHEM 012132815.mol (via Jmol)
012132840.b3lyp_6-31g(d).inp

012132840.b3lyp_6-31g(d).qchem.inp (generated)

012132840.b3lyp_6-31g(d).gjf (generated)

012132840.b3lyp_6-31g(d).firefly.inp (generated)

012132840.b3lyp_6-31g(d).smash.inp (generated)

012132840.b3lyp_6-31g(d).nwchem.inp (generated) 012132840.b3lyp_6-31g(d).log.xz 012132840.td-b3lyp_6-31g+(d).inp 012132840.td-b3lyp_6-31g+(d).log.xz

012132840.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132840.td-b3lyp_6-31+g(d).gjf (generated)

012132840.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132840.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132840.mol 012132840.PUBCHEM 012132840.mol (via Jmol)
012132860.b3lyp_6-31g(d).inp

012132860.b3lyp_6-31g(d).qchem.inp (generated)

012132860.b3lyp_6-31g(d).gjf (generated)

012132860.b3lyp_6-31g(d).firefly.inp (generated)

012132860.b3lyp_6-31g(d).smash.inp (generated)

012132860.b3lyp_6-31g(d).nwchem.inp (generated) 012132860.b3lyp_6-31g(d).log.xz 012132860.td-b3lyp_6-31g+(d).inp 012132860.td-b3lyp_6-31g+(d).log.xz

012132860.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132860.td-b3lyp_6-31+g(d).gjf (generated)

012132860.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132860.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132860.mol 012132860.PUBCHEM 012132860.mol (via Jmol)
012132861.b3lyp_6-31g(d).inp

012132861.b3lyp_6-31g(d).qchem.inp (generated)

012132861.b3lyp_6-31g(d).gjf (generated)

012132861.b3lyp_6-31g(d).firefly.inp (generated)

012132861.b3lyp_6-31g(d).smash.inp (generated)

012132861.b3lyp_6-31g(d).nwchem.inp (generated) 012132861.b3lyp_6-31g(d).log.xz 012132861.td-b3lyp_6-31g+(d).inp 012132861.td-b3lyp_6-31g+(d).log.xz

012132861.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132861.td-b3lyp_6-31+g(d).gjf (generated)

012132861.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132861.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132861.mol 012132861.PUBCHEM 012132861.mol (via Jmol)
012132862.b3lyp_6-31g(d).inp

012132862.b3lyp_6-31g(d).qchem.inp (generated)

012132862.b3lyp_6-31g(d).gjf (generated)

012132862.b3lyp_6-31g(d).firefly.inp (generated)

012132862.b3lyp_6-31g(d).smash.inp (generated)

012132862.b3lyp_6-31g(d).nwchem.inp (generated) 012132862.b3lyp_6-31g(d).log.xz 012132862.td-b3lyp_6-31g+(d).inp 012132862.td-b3lyp_6-31g+(d).log.xz

012132862.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132862.td-b3lyp_6-31+g(d).gjf (generated)

012132862.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132862.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132862.mol 012132862.PUBCHEM 012132862.mol (via Jmol)
012132863.b3lyp_6-31g(d).inp

012132863.b3lyp_6-31g(d).qchem.inp (generated)

012132863.b3lyp_6-31g(d).gjf (generated)

012132863.b3lyp_6-31g(d).firefly.inp (generated)

012132863.b3lyp_6-31g(d).smash.inp (generated)

012132863.b3lyp_6-31g(d).nwchem.inp (generated) 012132863.b3lyp_6-31g(d).log.xz 012132863.mol 012132863.PUBCHEM 012132863.mol (via Jmol)
012132904.b3lyp_6-31g(d).inp

012132904.b3lyp_6-31g(d).qchem.inp (generated)

012132904.b3lyp_6-31g(d).gjf (generated)

012132904.b3lyp_6-31g(d).firefly.inp (generated)

012132904.b3lyp_6-31g(d).smash.inp (generated)

012132904.b3lyp_6-31g(d).nwchem.inp (generated) 012132904.b3lyp_6-31g(d).log.xz 012132904.td-b3lyp_6-31g+(d).inp 012132904.td-b3lyp_6-31g+(d).log.xz

012132904.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132904.td-b3lyp_6-31+g(d).gjf (generated)

012132904.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132904.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132904.mol 012132904.PUBCHEM 012132904.mol (via Jmol)
012132905.b3lyp_6-31g(d).inp

012132905.b3lyp_6-31g(d).qchem.inp (generated)

012132905.b3lyp_6-31g(d).gjf (generated)

012132905.b3lyp_6-31g(d).firefly.inp (generated)

012132905.b3lyp_6-31g(d).smash.inp (generated)

012132905.b3lyp_6-31g(d).nwchem.inp (generated) 012132905.b3lyp_6-31g(d).log.xz 012132905.td-b3lyp_6-31g+(d).inp 012132905.td-b3lyp_6-31g+(d).log.xz

012132905.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132905.td-b3lyp_6-31+g(d).gjf (generated)

012132905.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132905.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132905.mol 012132905.PUBCHEM 012132905.mol (via Jmol)
012132910.b3lyp_6-31g(d).inp

012132910.b3lyp_6-31g(d).qchem.inp (generated)

012132910.b3lyp_6-31g(d).gjf (generated)

012132910.b3lyp_6-31g(d).firefly.inp (generated)

012132910.b3lyp_6-31g(d).smash.inp (generated)

012132910.b3lyp_6-31g(d).nwchem.inp (generated) 012132910.b3lyp_6-31g(d).log.xz 012132910.td-b3lyp_6-31g+(d).inp 012132910.td-b3lyp_6-31g+(d).log.xz

012132910.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132910.td-b3lyp_6-31+g(d).gjf (generated)

012132910.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132910.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132910.mol 012132910.PUBCHEM 012132910.mol (via Jmol)
012132914.b3lyp_6-31g(d).inp

012132914.b3lyp_6-31g(d).qchem.inp (generated)

012132914.b3lyp_6-31g(d).gjf (generated)

012132914.b3lyp_6-31g(d).firefly.inp (generated)

012132914.b3lyp_6-31g(d).smash.inp (generated)

012132914.b3lyp_6-31g(d).nwchem.inp (generated) 012132914.b3lyp_6-31g(d).log.xz 012132914.td-b3lyp_6-31g+(d).inp 012132914.td-b3lyp_6-31g+(d).log.xz

012132914.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132914.td-b3lyp_6-31+g(d).gjf (generated)

012132914.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132914.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132914.mol 012132914.PUBCHEM 012132914.mol (via Jmol)
012132915.b3lyp_6-31g(d).inp

012132915.b3lyp_6-31g(d).qchem.inp (generated)

012132915.b3lyp_6-31g(d).gjf (generated)

012132915.b3lyp_6-31g(d).firefly.inp (generated)

012132915.b3lyp_6-31g(d).smash.inp (generated)

012132915.b3lyp_6-31g(d).nwchem.inp (generated) 012132915.b3lyp_6-31g(d).log.xz 012132915.td-b3lyp_6-31g+(d).inp 012132915.td-b3lyp_6-31g+(d).log.xz

012132915.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132915.td-b3lyp_6-31+g(d).gjf (generated)

012132915.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132915.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132915.mol 012132915.PUBCHEM 012132915.mol (via Jmol)
012132916.b3lyp_6-31g(d).inp

012132916.b3lyp_6-31g(d).qchem.inp (generated)

012132916.b3lyp_6-31g(d).gjf (generated)

012132916.b3lyp_6-31g(d).firefly.inp (generated)

012132916.b3lyp_6-31g(d).smash.inp (generated)

012132916.b3lyp_6-31g(d).nwchem.inp (generated) 012132916.b3lyp_6-31g(d).log.xz 012132916.td-b3lyp_6-31g+(d).inp 012132916.td-b3lyp_6-31g+(d).log.xz

012132916.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132916.td-b3lyp_6-31+g(d).gjf (generated)

012132916.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132916.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132916.mol 012132916.PUBCHEM 012132916.mol (via Jmol)
012132917.b3lyp_6-31g(d).inp

012132917.b3lyp_6-31g(d).qchem.inp (generated)

012132917.b3lyp_6-31g(d).gjf (generated)

012132917.b3lyp_6-31g(d).firefly.inp (generated)

012132917.b3lyp_6-31g(d).smash.inp (generated)

012132917.b3lyp_6-31g(d).nwchem.inp (generated) 012132917.b3lyp_6-31g(d).log.xz 012132917.td-b3lyp_6-31g+(d).inp 012132917.td-b3lyp_6-31g+(d).log.xz

012132917.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132917.td-b3lyp_6-31+g(d).gjf (generated)

012132917.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132917.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132917.mol 012132917.PUBCHEM 012132917.mol (via Jmol)
012132974.b3lyp_6-31g(d).inp

012132974.b3lyp_6-31g(d).qchem.inp (generated)

012132974.b3lyp_6-31g(d).gjf (generated)

012132974.b3lyp_6-31g(d).firefly.inp (generated)

012132974.b3lyp_6-31g(d).smash.inp (generated)

012132974.b3lyp_6-31g(d).nwchem.inp (generated) 012132974.b3lyp_6-31g(d).log.xz 012132974.td-b3lyp_6-31g+(d).inp 012132974.td-b3lyp_6-31g+(d).log.xz

012132974.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132974.td-b3lyp_6-31+g(d).gjf (generated)

012132974.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132974.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132974.mol 012132974.PUBCHEM 012132974.mol (via Jmol)
012132991.b3lyp_6-31g(d).inp

012132991.b3lyp_6-31g(d).qchem.inp (generated)

012132991.b3lyp_6-31g(d).gjf (generated)

012132991.b3lyp_6-31g(d).firefly.inp (generated)

012132991.b3lyp_6-31g(d).smash.inp (generated)

012132991.b3lyp_6-31g(d).nwchem.inp (generated) 012132991.b3lyp_6-31g(d).log.xz 012132991.td-b3lyp_6-31g+(d).inp 012132991.td-b3lyp_6-31g+(d).log.xz

012132991.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132991.td-b3lyp_6-31+g(d).gjf (generated)

012132991.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132991.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132991.mol 012132991.PUBCHEM 012132991.mol (via Jmol)
012132993.b3lyp_6-31g(d).inp

012132993.b3lyp_6-31g(d).qchem.inp (generated)

012132993.b3lyp_6-31g(d).gjf (generated)

012132993.b3lyp_6-31g(d).firefly.inp (generated)

012132993.b3lyp_6-31g(d).smash.inp (generated)

012132993.b3lyp_6-31g(d).nwchem.inp (generated) 012132993.b3lyp_6-31g(d).log.xz 012132993.td-b3lyp_6-31g+(d).inp 012132993.td-b3lyp_6-31g+(d).log.xz

012132993.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132993.td-b3lyp_6-31+g(d).gjf (generated)

012132993.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132993.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132993.mol 012132993.PUBCHEM 012132993.mol (via Jmol)
012132998.b3lyp_6-31g(d).inp

012132998.b3lyp_6-31g(d).qchem.inp (generated)

012132998.b3lyp_6-31g(d).gjf (generated)

012132998.b3lyp_6-31g(d).firefly.inp (generated)

012132998.b3lyp_6-31g(d).smash.inp (generated)

012132998.b3lyp_6-31g(d).nwchem.inp (generated) 012132998.b3lyp_6-31g(d).log.xz 012132998.td-b3lyp_6-31g+(d).inp 012132998.td-b3lyp_6-31g+(d).log.xz

012132998.td-b3lyp_6-31+g(d).qchem.inp (generated)

012132998.td-b3lyp_6-31+g(d).gjf (generated)

012132998.td-b3lyp_6-31+g(d).firefly.inp (generated)

012132998.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012132998.mol 012132998.PUBCHEM 012132998.mol (via Jmol)
012133027.b3lyp_6-31g(d).inp

012133027.b3lyp_6-31g(d).qchem.inp (generated)

012133027.b3lyp_6-31g(d).gjf (generated)

012133027.b3lyp_6-31g(d).firefly.inp (generated)

012133027.b3lyp_6-31g(d).smash.inp (generated)

012133027.b3lyp_6-31g(d).nwchem.inp (generated) 012133027.b3lyp_6-31g(d).log.xz 012133027.td-b3lyp_6-31g+(d).inp 012133027.td-b3lyp_6-31g+(d).log.xz

012133027.td-b3lyp_6-31+g(d).qchem.inp (generated)

012133027.td-b3lyp_6-31+g(d).gjf (generated)

012133027.td-b3lyp_6-31+g(d).firefly.inp (generated)

012133027.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012133027.mol 012133027.PUBCHEM 012133027.mol (via Jmol)
012133053.b3lyp_6-31g(d).inp

012133053.b3lyp_6-31g(d).qchem.inp (generated)

012133053.b3lyp_6-31g(d).gjf (generated)

012133053.b3lyp_6-31g(d).firefly.inp (generated)

012133053.b3lyp_6-31g(d).smash.inp (generated)

012133053.b3lyp_6-31g(d).nwchem.inp (generated) 012133053.b3lyp_6-31g(d).log.xz 012133053.td-b3lyp_6-31g+(d).inp 012133053.td-b3lyp_6-31g+(d).log.xz

012133053.td-b3lyp_6-31+g(d).qchem.inp (generated)

012133053.td-b3lyp_6-31+g(d).gjf (generated)

012133053.td-b3lyp_6-31+g(d).firefly.inp (generated)

012133053.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012133053.mol 012133053.PUBCHEM 012133053.mol (via Jmol)
012133056.b3lyp_6-31g(d).inp

012133056.b3lyp_6-31g(d).qchem.inp (generated)

012133056.b3lyp_6-31g(d).gjf (generated)

012133056.b3lyp_6-31g(d).firefly.inp (generated)

012133056.b3lyp_6-31g(d).smash.inp (generated)

012133056.b3lyp_6-31g(d).nwchem.inp (generated) 012133056.b3lyp_6-31g(d).log.xz 012133056.td-b3lyp_6-31g+(d).inp 012133056.td-b3lyp_6-31g+(d).log.xz

012133056.td-b3lyp_6-31+g(d).qchem.inp (generated)

012133056.td-b3lyp_6-31+g(d).gjf (generated)

012133056.td-b3lyp_6-31+g(d).firefly.inp (generated)

012133056.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012133056.mol 012133056.PUBCHEM 012133056.mol (via Jmol)
012133061.b3lyp_6-31g(d).inp

012133061.b3lyp_6-31g(d).qchem.inp (generated)

012133061.b3lyp_6-31g(d).gjf (generated)

012133061.b3lyp_6-31g(d).firefly.inp (generated)

012133061.b3lyp_6-31g(d).smash.inp (generated)

012133061.b3lyp_6-31g(d).nwchem.inp (generated) 012133061.b3lyp_6-31g(d).log.xz 012133061.td-b3lyp_6-31g+(d).inp 012133061.td-b3lyp_6-31g+(d).log.xz

012133061.td-b3lyp_6-31+g(d).qchem.inp (generated)

012133061.td-b3lyp_6-31+g(d).gjf (generated)

012133061.td-b3lyp_6-31+g(d).firefly.inp (generated)

012133061.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012133061.mol 012133061.PUBCHEM 012133061.mol (via Jmol)
012133065.b3lyp_6-31g(d).inp

012133065.b3lyp_6-31g(d).qchem.inp (generated)

012133065.b3lyp_6-31g(d).gjf (generated)

012133065.b3lyp_6-31g(d).firefly.inp (generated)

012133065.b3lyp_6-31g(d).smash.inp (generated)

012133065.b3lyp_6-31g(d).nwchem.inp (generated) 012133065.b3lyp_6-31g(d).log.xz 012133065.td-b3lyp_6-31g+(d).inp 012133065.td-b3lyp_6-31g+(d).log.xz

012133065.td-b3lyp_6-31+g(d).qchem.inp (generated)

012133065.td-b3lyp_6-31+g(d).gjf (generated)

012133065.td-b3lyp_6-31+g(d).firefly.inp (generated)

012133065.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012133065.mol 012133065.PUBCHEM 012133065.mol (via Jmol)
012133066.b3lyp_6-31g(d).inp

012133066.b3lyp_6-31g(d).qchem.inp (generated)

012133066.b3lyp_6-31g(d).gjf (generated)

012133066.b3lyp_6-31g(d).firefly.inp (generated)

012133066.b3lyp_6-31g(d).smash.inp (generated)

012133066.b3lyp_6-31g(d).nwchem.inp (generated) 012133066.b3lyp_6-31g(d).log.xz 012133066.td-b3lyp_6-31g+(d).inp 012133066.td-b3lyp_6-31g+(d).log.xz

012133066.td-b3lyp_6-31+g(d).qchem.inp (generated)

012133066.td-b3lyp_6-31+g(d).gjf (generated)

012133066.td-b3lyp_6-31+g(d).firefly.inp (generated)

012133066.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012133066.mol 012133066.PUBCHEM 012133066.mol (via Jmol)
012133067.b3lyp_6-31g(d).inp

012133067.b3lyp_6-31g(d).qchem.inp (generated)

012133067.b3lyp_6-31g(d).gjf (generated)

012133067.b3lyp_6-31g(d).firefly.inp (generated)

012133067.b3lyp_6-31g(d).smash.inp (generated)

012133067.b3lyp_6-31g(d).nwchem.inp (generated) 012133067.b3lyp_6-31g(d).log.xz 012133067.td-b3lyp_6-31g+(d).inp 012133067.td-b3lyp_6-31g+(d).log.xz

012133067.td-b3lyp_6-31+g(d).qchem.inp (generated)

012133067.td-b3lyp_6-31+g(d).gjf (generated)

012133067.td-b3lyp_6-31+g(d).firefly.inp (generated)

012133067.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012133067.mol 012133067.PUBCHEM 012133067.mol (via Jmol)
012133070.b3lyp_6-31g(d).inp

012133070.b3lyp_6-31g(d).qchem.inp (generated)

012133070.b3lyp_6-31g(d).gjf (generated)

012133070.b3lyp_6-31g(d).firefly.inp (generated)

012133070.b3lyp_6-31g(d).smash.inp (generated)

012133070.b3lyp_6-31g(d).nwchem.inp (generated) 012133070.b3lyp_6-31g(d).log.xz 012133070.td-b3lyp_6-31g+(d).inp 012133070.td-b3lyp_6-31g+(d).log.xz

012133070.td-b3lyp_6-31+g(d).qchem.inp (generated)

012133070.td-b3lyp_6-31+g(d).gjf (generated)

012133070.td-b3lyp_6-31+g(d).firefly.inp (generated)

012133070.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012133070.mol 012133070.PUBCHEM 012133070.mol (via Jmol)
012133074.b3lyp_6-31g(d).inp

012133074.b3lyp_6-31g(d).qchem.inp (generated)

012133074.b3lyp_6-31g(d).gjf (generated)

012133074.b3lyp_6-31g(d).firefly.inp (generated)

012133074.b3lyp_6-31g(d).smash.inp (generated)

012133074.b3lyp_6-31g(d).nwchem.inp (generated) 012133074.b3lyp_6-31g(d).log.xz 012133074.td-b3lyp_6-31g+(d).inp 012133074.td-b3lyp_6-31g+(d).log.xz

012133074.td-b3lyp_6-31+g(d).qchem.inp (generated)

012133074.td-b3lyp_6-31+g(d).gjf (generated)

012133074.td-b3lyp_6-31+g(d).firefly.inp (generated)

012133074.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012133074.mol 012133074.PUBCHEM 012133074.mol (via Jmol)
012133075.b3lyp_6-31g(d).inp

012133075.b3lyp_6-31g(d).qchem.inp (generated)

012133075.b3lyp_6-31g(d).gjf (generated)

012133075.b3lyp_6-31g(d).firefly.inp (generated)

012133075.b3lyp_6-31g(d).smash.inp (generated)

012133075.b3lyp_6-31g(d).nwchem.inp (generated) 012133075.b3lyp_6-31g(d).log.xz 012133075.td-b3lyp_6-31g+(d).inp 012133075.td-b3lyp_6-31g+(d).log.xz

012133075.td-b3lyp_6-31+g(d).qchem.inp (generated)

012133075.td-b3lyp_6-31+g(d).gjf (generated)

012133075.td-b3lyp_6-31+g(d).firefly.inp (generated)

012133075.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012133075.mol 012133075.PUBCHEM 012133075.mol (via Jmol)
012133078.b3lyp_6-31g(d).inp

012133078.b3lyp_6-31g(d).qchem.inp (generated)

012133078.b3lyp_6-31g(d).gjf (generated)

012133078.b3lyp_6-31g(d).firefly.inp (generated)

012133078.b3lyp_6-31g(d).smash.inp (generated)

012133078.b3lyp_6-31g(d).nwchem.inp (generated) 012133078.b3lyp_6-31g(d).log.xz 012133078.mol 012133078.PUBCHEM 012133078.mol (via Jmol)
012133079.b3lyp_6-31g(d).inp

012133079.b3lyp_6-31g(d).qchem.inp (generated)

012133079.b3lyp_6-31g(d).gjf (generated)

012133079.b3lyp_6-31g(d).firefly.inp (generated)

012133079.b3lyp_6-31g(d).smash.inp (generated)

012133079.b3lyp_6-31g(d).nwchem.inp (generated) 012133079.b3lyp_6-31g(d).log.xz 012133079.td-b3lyp_6-31g+(d).inp 012133079.td-b3lyp_6-31g+(d).log.xz

012133079.td-b3lyp_6-31+g(d).qchem.inp (generated)

012133079.td-b3lyp_6-31+g(d).gjf (generated)

012133079.td-b3lyp_6-31+g(d).firefly.inp (generated)

012133079.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012133079.mol 012133079.PUBCHEM 012133079.mol (via Jmol)
012133090.b3lyp_6-31g(d).inp

012133090.b3lyp_6-31g(d).qchem.inp (generated)

012133090.b3lyp_6-31g(d).gjf (generated)

012133090.b3lyp_6-31g(d).firefly.inp (generated)

012133090.b3lyp_6-31g(d).smash.inp (generated)

012133090.b3lyp_6-31g(d).nwchem.inp (generated) 012133090.b3lyp_6-31g(d).log.xz 012133090.mol 012133090.PUBCHEM 012133090.mol (via Jmol)
012133134.b3lyp_6-31g(d).inp

012133134.b3lyp_6-31g(d).qchem.inp (generated)

012133134.b3lyp_6-31g(d).gjf (generated)

012133134.b3lyp_6-31g(d).firefly.inp (generated)

012133134.b3lyp_6-31g(d).smash.inp (generated)

012133134.b3lyp_6-31g(d).nwchem.inp (generated) 012133134.b3lyp_6-31g(d).log.xz 012133134.mol 012133134.PUBCHEM 012133134.mol (via Jmol)
012133156.b3lyp_6-31g(d).inp

012133156.b3lyp_6-31g(d).qchem.inp (generated)

012133156.b3lyp_6-31g(d).gjf (generated)

012133156.b3lyp_6-31g(d).firefly.inp (generated)

012133156.b3lyp_6-31g(d).smash.inp (generated)

012133156.b3lyp_6-31g(d).nwchem.inp (generated) 012133156.b3lyp_6-31g(d).log.xz 012133156.mol 012133156.PUBCHEM 012133156.mol (via Jmol)
012133195.b3lyp_6-31g(d).inp

012133195.b3lyp_6-31g(d).qchem.inp (generated)

012133195.b3lyp_6-31g(d).gjf (generated)

012133195.b3lyp_6-31g(d).firefly.inp (generated)

012133195.b3lyp_6-31g(d).smash.inp (generated)

012133195.b3lyp_6-31g(d).nwchem.inp (generated) 012133195.b3lyp_6-31g(d).log.xz 012133195.mol 012133195.PUBCHEM 012133195.mol (via Jmol)
012133198.b3lyp_6-31g(d).inp

012133198.b3lyp_6-31g(d).qchem.inp (generated)

012133198.b3lyp_6-31g(d).gjf (generated)

012133198.b3lyp_6-31g(d).firefly.inp (generated)

012133198.b3lyp_6-31g(d).smash.inp (generated)

012133198.b3lyp_6-31g(d).nwchem.inp (generated) 012133198.b3lyp_6-31g(d).log.xz 012133198.mol 012133198.PUBCHEM 012133198.mol (via Jmol)
012133359.b3lyp_6-31g(d).inp

012133359.b3lyp_6-31g(d).qchem.inp (generated)

012133359.b3lyp_6-31g(d).gjf (generated)

012133359.b3lyp_6-31g(d).firefly.inp (generated)

012133359.b3lyp_6-31g(d).smash.inp (generated)

012133359.b3lyp_6-31g(d).nwchem.inp (generated) 012133359.b3lyp_6-31g(d).log.xz 012133359.td-b3lyp_6-31g+(d).inp 012133359.td-b3lyp_6-31g+(d).log.xz

012133359.td-b3lyp_6-31+g(d).qchem.inp (generated)

012133359.td-b3lyp_6-31+g(d).gjf (generated)

012133359.td-b3lyp_6-31+g(d).firefly.inp (generated)

012133359.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012133359.mol 012133359.PUBCHEM 012133359.mol (via Jmol)
012133374.b3lyp_6-31g(d).inp

012133374.b3lyp_6-31g(d).qchem.inp (generated)

012133374.b3lyp_6-31g(d).gjf (generated)

012133374.b3lyp_6-31g(d).firefly.inp (generated)

012133374.b3lyp_6-31g(d).smash.inp (generated)

012133374.b3lyp_6-31g(d).nwchem.inp (generated) 012133374.b3lyp_6-31g(d).log.xz 012133374.td-b3lyp_6-31g+(d).inp 012133374.td-b3lyp_6-31g+(d).log.xz

012133374.td-b3lyp_6-31+g(d).qchem.inp (generated)

012133374.td-b3lyp_6-31+g(d).gjf (generated)

012133374.td-b3lyp_6-31+g(d).firefly.inp (generated)

012133374.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012133374.mol 012133374.PUBCHEM 012133374.mol (via Jmol)
012133376.b3lyp_6-31g(d).inp

012133376.b3lyp_6-31g(d).qchem.inp (generated)

012133376.b3lyp_6-31g(d).gjf (generated)

012133376.b3lyp_6-31g(d).firefly.inp (generated)

012133376.b3lyp_6-31g(d).smash.inp (generated)

012133376.b3lyp_6-31g(d).nwchem.inp (generated) 012133376.b3lyp_6-31g(d).log.xz 012133376.td-b3lyp_6-31g+(d).inp 012133376.td-b3lyp_6-31g+(d).log.xz

012133376.td-b3lyp_6-31+g(d).qchem.inp (generated)

012133376.td-b3lyp_6-31+g(d).gjf (generated)

012133376.td-b3lyp_6-31+g(d).firefly.inp (generated)

012133376.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012133376.mol 012133376.PUBCHEM 012133376.mol (via Jmol)
012133413.b3lyp_6-31g(d).inp

012133413.b3lyp_6-31g(d).qchem.inp (generated)

012133413.b3lyp_6-31g(d).gjf (generated)

012133413.b3lyp_6-31g(d).firefly.inp (generated)

012133413.b3lyp_6-31g(d).smash.inp (generated)

012133413.b3lyp_6-31g(d).nwchem.inp (generated) 012133413.b3lyp_6-31g(d).log.xz 012133413.td-b3lyp_6-31g+(d).inp 012133413.td-b3lyp_6-31g+(d).log.xz

012133413.td-b3lyp_6-31+g(d).qchem.inp (generated)

012133413.td-b3lyp_6-31+g(d).gjf (generated)

012133413.td-b3lyp_6-31+g(d).firefly.inp (generated)

012133413.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012133413.mol 012133413.PUBCHEM 012133413.mol (via Jmol)
012133503.b3lyp_6-31g(d).inp

012133503.b3lyp_6-31g(d).qchem.inp (generated)

012133503.b3lyp_6-31g(d).gjf (generated)

012133503.b3lyp_6-31g(d).firefly.inp (generated)

012133503.b3lyp_6-31g(d).smash.inp (generated)

012133503.b3lyp_6-31g(d).nwchem.inp (generated) 012133503.b3lyp_6-31g(d).log.xz 012133503.td-b3lyp_6-31g+(d).inp 012133503.td-b3lyp_6-31g+(d).log.xz

012133503.td-b3lyp_6-31+g(d).qchem.inp (generated)

012133503.td-b3lyp_6-31+g(d).gjf (generated)

012133503.td-b3lyp_6-31+g(d).firefly.inp (generated)

012133503.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012133503.mol 012133503.PUBCHEM 012133503.mol (via Jmol)
012133518.b3lyp_6-31g(d).inp

012133518.b3lyp_6-31g(d).qchem.inp (generated)

012133518.b3lyp_6-31g(d).gjf (generated)

012133518.b3lyp_6-31g(d).firefly.inp (generated)

012133518.b3lyp_6-31g(d).smash.inp (generated)

012133518.b3lyp_6-31g(d).nwchem.inp (generated) 012133518.b3lyp_6-31g(d).log.xz 012133518.td-b3lyp_6-31g+(d).inp 012133518.td-b3lyp_6-31g+(d).log.xz

012133518.td-b3lyp_6-31+g(d).qchem.inp (generated)

012133518.td-b3lyp_6-31+g(d).gjf (generated)

012133518.td-b3lyp_6-31+g(d).firefly.inp (generated)

012133518.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012133518.mol 012133518.PUBCHEM 012133518.mol (via Jmol)
012133609.b3lyp_6-31g(d).inp

012133609.b3lyp_6-31g(d).qchem.inp (generated)

012133609.b3lyp_6-31g(d).gjf (generated)

012133609.b3lyp_6-31g(d).firefly.inp (generated)

012133609.b3lyp_6-31g(d).smash.inp (generated)

012133609.b3lyp_6-31g(d).nwchem.inp (generated) 012133609.b3lyp_6-31g(d).log.xz 012133609.td-b3lyp_6-31g+(d).inp 012133609.td-b3lyp_6-31g+(d).log.xz

012133609.td-b3lyp_6-31+g(d).qchem.inp (generated)

012133609.td-b3lyp_6-31+g(d).gjf (generated)

012133609.td-b3lyp_6-31+g(d).firefly.inp (generated)

012133609.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012133609.mol 012133609.PUBCHEM 012133609.mol (via Jmol)
012133620.b3lyp_6-31g(d).inp

012133620.b3lyp_6-31g(d).qchem.inp (generated)

012133620.b3lyp_6-31g(d).gjf (generated)

012133620.b3lyp_6-31g(d).firefly.inp (generated)

012133620.b3lyp_6-31g(d).smash.inp (generated)

012133620.b3lyp_6-31g(d).nwchem.inp (generated) 012133620.b3lyp_6-31g(d).log.xz 012133620.td-b3lyp_6-31g+(d).inp 012133620.td-b3lyp_6-31g+(d).log.xz

012133620.td-b3lyp_6-31+g(d).qchem.inp (generated)

012133620.td-b3lyp_6-31+g(d).gjf (generated)

012133620.td-b3lyp_6-31+g(d).firefly.inp (generated)

012133620.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012133620.mol 012133620.PUBCHEM 012133620.mol (via Jmol)
012133634.b3lyp_6-31g(d).inp

012133634.b3lyp_6-31g(d).qchem.inp (generated)

012133634.b3lyp_6-31g(d).gjf (generated)

012133634.b3lyp_6-31g(d).firefly.inp (generated)

012133634.b3lyp_6-31g(d).smash.inp (generated)

012133634.b3lyp_6-31g(d).nwchem.inp (generated) 012133634.b3lyp_6-31g(d).log.xz 012133634.td-b3lyp_6-31g+(d).inp 012133634.td-b3lyp_6-31g+(d).log.xz

012133634.td-b3lyp_6-31+g(d).qchem.inp (generated)

012133634.td-b3lyp_6-31+g(d).gjf (generated)

012133634.td-b3lyp_6-31+g(d).firefly.inp (generated)

012133634.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012133634.mol 012133634.PUBCHEM 012133634.mol (via Jmol)
012133638.b3lyp_6-31g(d).inp

012133638.b3lyp_6-31g(d).qchem.inp (generated)

012133638.b3lyp_6-31g(d).gjf (generated)

012133638.b3lyp_6-31g(d).firefly.inp (generated)

012133638.b3lyp_6-31g(d).smash.inp (generated)

012133638.b3lyp_6-31g(d).nwchem.inp (generated) 012133638.b3lyp_6-31g(d).log.xz 012133638.td-b3lyp_6-31g+(d).inp 012133638.td-b3lyp_6-31g+(d).log.xz

012133638.td-b3lyp_6-31+g(d).qchem.inp (generated)

012133638.td-b3lyp_6-31+g(d).gjf (generated)

012133638.td-b3lyp_6-31+g(d).firefly.inp (generated)

012133638.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012133638.mol 012133638.PUBCHEM 012133638.mol (via Jmol)
012133682.b3lyp_6-31g(d).inp

012133682.b3lyp_6-31g(d).qchem.inp (generated)

012133682.b3lyp_6-31g(d).gjf (generated)

012133682.b3lyp_6-31g(d).firefly.inp (generated)

012133682.b3lyp_6-31g(d).smash.inp (generated)

012133682.b3lyp_6-31g(d).nwchem.inp (generated) 012133682.b3lyp_6-31g(d).log.xz 012133682.td-b3lyp_6-31g+(d).inp 012133682.td-b3lyp_6-31g+(d).log.xz

012133682.td-b3lyp_6-31+g(d).qchem.inp (generated)

012133682.td-b3lyp_6-31+g(d).gjf (generated)

012133682.td-b3lyp_6-31+g(d).firefly.inp (generated)

012133682.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012133682.mol 012133682.PUBCHEM 012133682.mol (via Jmol)
012133686.b3lyp_6-31g(d).inp

012133686.b3lyp_6-31g(d).qchem.inp (generated)

012133686.b3lyp_6-31g(d).gjf (generated)

012133686.b3lyp_6-31g(d).firefly.inp (generated)

012133686.b3lyp_6-31g(d).smash.inp (generated)

012133686.b3lyp_6-31g(d).nwchem.inp (generated) 012133686.b3lyp_6-31g(d).log.xz 012133686.td-b3lyp_6-31g+(d).inp 012133686.td-b3lyp_6-31g+(d).log.xz

012133686.td-b3lyp_6-31+g(d).qchem.inp (generated)

012133686.td-b3lyp_6-31+g(d).gjf (generated)

012133686.td-b3lyp_6-31+g(d).firefly.inp (generated)

012133686.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012133686.mol 012133686.PUBCHEM 012133686.mol (via Jmol)
012133792.b3lyp_6-31g(d).inp

012133792.b3lyp_6-31g(d).qchem.inp (generated)

012133792.b3lyp_6-31g(d).gjf (generated)

012133792.b3lyp_6-31g(d).firefly.inp (generated)

012133792.b3lyp_6-31g(d).smash.inp (generated)

012133792.b3lyp_6-31g(d).nwchem.inp (generated) 012133792.b3lyp_6-31g(d).log.xz 012133792.td-b3lyp_6-31g+(d).inp 012133792.td-b3lyp_6-31g+(d).log.xz

012133792.td-b3lyp_6-31+g(d).qchem.inp (generated)

012133792.td-b3lyp_6-31+g(d).gjf (generated)

012133792.td-b3lyp_6-31+g(d).firefly.inp (generated)

012133792.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012133792.mol 012133792.PUBCHEM 012133792.mol (via Jmol)
012133904.b3lyp_6-31g(d).inp

012133904.b3lyp_6-31g(d).qchem.inp (generated)

012133904.b3lyp_6-31g(d).gjf (generated)

012133904.b3lyp_6-31g(d).firefly.inp (generated)

012133904.b3lyp_6-31g(d).smash.inp (generated)

012133904.b3lyp_6-31g(d).nwchem.inp (generated) 012133904.b3lyp_6-31g(d).log.xz 012133904.mol 012133904.PUBCHEM 012133904.mol (via Jmol)
012133952.b3lyp_6-31g(d).inp

012133952.b3lyp_6-31g(d).qchem.inp (generated)

012133952.b3lyp_6-31g(d).gjf (generated)

012133952.b3lyp_6-31g(d).firefly.inp (generated)

012133952.b3lyp_6-31g(d).smash.inp (generated)

012133952.b3lyp_6-31g(d).nwchem.inp (generated) 012133952.b3lyp_6-31g(d).log.xz 012133952.td-b3lyp_6-31g+(d).inp 012133952.td-b3lyp_6-31g+(d).log.xz

012133952.td-b3lyp_6-31+g(d).qchem.inp (generated)

012133952.td-b3lyp_6-31+g(d).gjf (generated)

012133952.td-b3lyp_6-31+g(d).firefly.inp (generated)

012133952.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012133952.mol 012133952.PUBCHEM 012133952.mol (via Jmol)
012134011.b3lyp_6-31g(d).inp

012134011.b3lyp_6-31g(d).qchem.inp (generated)

012134011.b3lyp_6-31g(d).gjf (generated)

012134011.b3lyp_6-31g(d).firefly.inp (generated)

012134011.b3lyp_6-31g(d).smash.inp (generated)

012134011.b3lyp_6-31g(d).nwchem.inp (generated) 012134011.b3lyp_6-31g(d).log.xz 012134011.td-b3lyp_6-31g+(d).inp 012134011.td-b3lyp_6-31g+(d).log.xz

012134011.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134011.td-b3lyp_6-31+g(d).gjf (generated)

012134011.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134011.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134011.mol 012134011.PUBCHEM 012134011.mol (via Jmol)
012134013.b3lyp_6-31g(d).inp

012134013.b3lyp_6-31g(d).qchem.inp (generated)

012134013.b3lyp_6-31g(d).gjf (generated)

012134013.b3lyp_6-31g(d).firefly.inp (generated)

012134013.b3lyp_6-31g(d).smash.inp (generated)

012134013.b3lyp_6-31g(d).nwchem.inp (generated) 012134013.b3lyp_6-31g(d).log.xz 012134013.td-b3lyp_6-31g+(d).inp 012134013.td-b3lyp_6-31g+(d).log.xz

012134013.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134013.td-b3lyp_6-31+g(d).gjf (generated)

012134013.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134013.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134013.mol 012134013.PUBCHEM 012134013.mol (via Jmol)
012134038.b3lyp_6-31g(d).inp

012134038.b3lyp_6-31g(d).qchem.inp (generated)

012134038.b3lyp_6-31g(d).gjf (generated)

012134038.b3lyp_6-31g(d).firefly.inp (generated)

012134038.b3lyp_6-31g(d).smash.inp (generated)

012134038.b3lyp_6-31g(d).nwchem.inp (generated) 012134038.b3lyp_6-31g(d).log.xz 012134038.td-b3lyp_6-31g+(d).inp 012134038.td-b3lyp_6-31g+(d).log.xz

012134038.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134038.td-b3lyp_6-31+g(d).gjf (generated)

012134038.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134038.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134038.mol 012134038.PUBCHEM 012134038.mol (via Jmol)
012134061.b3lyp_6-31g(d).inp

012134061.b3lyp_6-31g(d).qchem.inp (generated)

012134061.b3lyp_6-31g(d).gjf (generated)

012134061.b3lyp_6-31g(d).firefly.inp (generated)

012134061.b3lyp_6-31g(d).smash.inp (generated)

012134061.b3lyp_6-31g(d).nwchem.inp (generated) 012134061.b3lyp_6-31g(d).log.xz 012134061.td-b3lyp_6-31g+(d).inp 012134061.td-b3lyp_6-31g+(d).log.xz

012134061.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134061.td-b3lyp_6-31+g(d).gjf (generated)

012134061.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134061.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134061.mol 012134061.PUBCHEM 012134061.mol (via Jmol)
012134106.b3lyp_6-31g(d).inp

012134106.b3lyp_6-31g(d).qchem.inp (generated)

012134106.b3lyp_6-31g(d).gjf (generated)

012134106.b3lyp_6-31g(d).firefly.inp (generated)

012134106.b3lyp_6-31g(d).smash.inp (generated)

012134106.b3lyp_6-31g(d).nwchem.inp (generated) 012134106.b3lyp_6-31g(d).log.xz 012134106.td-b3lyp_6-31g+(d).inp 012134106.td-b3lyp_6-31g+(d).log.xz

012134106.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134106.td-b3lyp_6-31+g(d).gjf (generated)

012134106.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134106.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134106.mol 012134106.PUBCHEM 012134106.mol (via Jmol)
012134107.b3lyp_6-31g(d).inp

012134107.b3lyp_6-31g(d).qchem.inp (generated)

012134107.b3lyp_6-31g(d).gjf (generated)

012134107.b3lyp_6-31g(d).firefly.inp (generated)

012134107.b3lyp_6-31g(d).smash.inp (generated)

012134107.b3lyp_6-31g(d).nwchem.inp (generated) 012134107.b3lyp_6-31g(d).log.xz 012134107.td-b3lyp_6-31g+(d).inp 012134107.td-b3lyp_6-31g+(d).log.xz

012134107.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134107.td-b3lyp_6-31+g(d).gjf (generated)

012134107.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134107.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134107.mol 012134107.PUBCHEM 012134107.mol (via Jmol)
012134110.b3lyp_6-31g(d).inp

012134110.b3lyp_6-31g(d).qchem.inp (generated)

012134110.b3lyp_6-31g(d).gjf (generated)

012134110.b3lyp_6-31g(d).firefly.inp (generated)

012134110.b3lyp_6-31g(d).smash.inp (generated)

012134110.b3lyp_6-31g(d).nwchem.inp (generated) 012134110.b3lyp_6-31g(d).log.xz 012134110.td-b3lyp_6-31g+(d).inp 012134110.td-b3lyp_6-31g+(d).log.xz

012134110.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134110.td-b3lyp_6-31+g(d).gjf (generated)

012134110.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134110.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134110.mol 012134110.PUBCHEM 012134110.mol (via Jmol)
012134301.b3lyp_6-31g(d).inp

012134301.b3lyp_6-31g(d).qchem.inp (generated)

012134301.b3lyp_6-31g(d).gjf (generated)

012134301.b3lyp_6-31g(d).firefly.inp (generated)

012134301.b3lyp_6-31g(d).smash.inp (generated)

012134301.b3lyp_6-31g(d).nwchem.inp (generated) 012134301.b3lyp_6-31g(d).log.xz 012134301.td-b3lyp_6-31g+(d).inp 012134301.td-b3lyp_6-31g+(d).log.xz

012134301.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134301.td-b3lyp_6-31+g(d).gjf (generated)

012134301.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134301.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134301.mol 012134301.PUBCHEM 012134301.mol (via Jmol)
012134303.b3lyp_6-31g(d).inp

012134303.b3lyp_6-31g(d).qchem.inp (generated)

012134303.b3lyp_6-31g(d).gjf (generated)

012134303.b3lyp_6-31g(d).firefly.inp (generated)

012134303.b3lyp_6-31g(d).smash.inp (generated)

012134303.b3lyp_6-31g(d).nwchem.inp (generated) 012134303.b3lyp_6-31g(d).log.xz 012134303.td-b3lyp_6-31g+(d).inp 012134303.td-b3lyp_6-31g+(d).log.xz

012134303.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134303.td-b3lyp_6-31+g(d).gjf (generated)

012134303.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134303.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134303.mol 012134303.PUBCHEM 012134303.mol (via Jmol)
012134304.b3lyp_6-31g(d).inp

012134304.b3lyp_6-31g(d).qchem.inp (generated)

012134304.b3lyp_6-31g(d).gjf (generated)

012134304.b3lyp_6-31g(d).firefly.inp (generated)

012134304.b3lyp_6-31g(d).smash.inp (generated)

012134304.b3lyp_6-31g(d).nwchem.inp (generated) 012134304.b3lyp_6-31g(d).log.xz 012134304.td-b3lyp_6-31g+(d).inp 012134304.td-b3lyp_6-31g+(d).log.xz

012134304.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134304.td-b3lyp_6-31+g(d).gjf (generated)

012134304.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134304.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134304.mol 012134304.PUBCHEM 012134304.mol (via Jmol)
012134306.b3lyp_6-31g(d).inp

012134306.b3lyp_6-31g(d).qchem.inp (generated)

012134306.b3lyp_6-31g(d).gjf (generated)

012134306.b3lyp_6-31g(d).firefly.inp (generated)

012134306.b3lyp_6-31g(d).smash.inp (generated)

012134306.b3lyp_6-31g(d).nwchem.inp (generated) 012134306.b3lyp_6-31g(d).log.xz 012134306.td-b3lyp_6-31g+(d).inp 012134306.td-b3lyp_6-31g+(d).log.xz

012134306.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134306.td-b3lyp_6-31+g(d).gjf (generated)

012134306.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134306.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134306.mol 012134306.PUBCHEM 012134306.mol (via Jmol)
012134307.b3lyp_6-31g(d).inp

012134307.b3lyp_6-31g(d).qchem.inp (generated)

012134307.b3lyp_6-31g(d).gjf (generated)

012134307.b3lyp_6-31g(d).firefly.inp (generated)

012134307.b3lyp_6-31g(d).smash.inp (generated)

012134307.b3lyp_6-31g(d).nwchem.inp (generated) 012134307.b3lyp_6-31g(d).log.xz 012134307.mol 012134307.PUBCHEM 012134307.mol (via Jmol)
012134310.b3lyp_6-31g(d).inp

012134310.b3lyp_6-31g(d).qchem.inp (generated)

012134310.b3lyp_6-31g(d).gjf (generated)

012134310.b3lyp_6-31g(d).firefly.inp (generated)

012134310.b3lyp_6-31g(d).smash.inp (generated)

012134310.b3lyp_6-31g(d).nwchem.inp (generated) 012134310.b3lyp_6-31g(d).log.xz 012134310.td-b3lyp_6-31g+(d).inp 012134310.td-b3lyp_6-31g+(d).log.xz

012134310.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134310.td-b3lyp_6-31+g(d).gjf (generated)

012134310.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134310.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134310.mol 012134310.PUBCHEM 012134310.mol (via Jmol)
012134312.b3lyp_6-31g(d).inp

012134312.b3lyp_6-31g(d).qchem.inp (generated)

012134312.b3lyp_6-31g(d).gjf (generated)

012134312.b3lyp_6-31g(d).firefly.inp (generated)

012134312.b3lyp_6-31g(d).smash.inp (generated)

012134312.b3lyp_6-31g(d).nwchem.inp (generated) 012134312.b3lyp_6-31g(d).log.xz 012134312.td-b3lyp_6-31g+(d).inp 012134312.td-b3lyp_6-31g+(d).log.xz

012134312.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134312.td-b3lyp_6-31+g(d).gjf (generated)

012134312.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134312.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134312.mol 012134312.PUBCHEM 012134312.mol (via Jmol)
012134314.b3lyp_6-31g(d).inp

012134314.b3lyp_6-31g(d).qchem.inp (generated)

012134314.b3lyp_6-31g(d).gjf (generated)

012134314.b3lyp_6-31g(d).firefly.inp (generated)

012134314.b3lyp_6-31g(d).smash.inp (generated)

012134314.b3lyp_6-31g(d).nwchem.inp (generated) 012134314.b3lyp_6-31g(d).log.xz 012134314.td-b3lyp_6-31g+(d).inp 012134314.td-b3lyp_6-31g+(d).log.xz

012134314.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134314.td-b3lyp_6-31+g(d).gjf (generated)

012134314.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134314.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134314.mol 012134314.PUBCHEM 012134314.mol (via Jmol)
012134318.b3lyp_6-31g(d).inp

012134318.b3lyp_6-31g(d).qchem.inp (generated)

012134318.b3lyp_6-31g(d).gjf (generated)

012134318.b3lyp_6-31g(d).firefly.inp (generated)

012134318.b3lyp_6-31g(d).smash.inp (generated)

012134318.b3lyp_6-31g(d).nwchem.inp (generated) 012134318.b3lyp_6-31g(d).log.xz 012134318.td-b3lyp_6-31g+(d).inp 012134318.td-b3lyp_6-31g+(d).log.xz

012134318.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134318.td-b3lyp_6-31+g(d).gjf (generated)

012134318.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134318.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134318.mol 012134318.PUBCHEM 012134318.mol (via Jmol)
012134352.b3lyp_6-31g(d).inp

012134352.b3lyp_6-31g(d).qchem.inp (generated)

012134352.b3lyp_6-31g(d).gjf (generated)

012134352.b3lyp_6-31g(d).firefly.inp (generated)

012134352.b3lyp_6-31g(d).smash.inp (generated)

012134352.b3lyp_6-31g(d).nwchem.inp (generated) 012134352.b3lyp_6-31g(d).log.xz 012134352.td-b3lyp_6-31g+(d).inp 012134352.td-b3lyp_6-31g+(d).log.xz

012134352.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134352.td-b3lyp_6-31+g(d).gjf (generated)

012134352.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134352.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134352.mol 012134352.PUBCHEM 012134352.mol (via Jmol)
012134370.b3lyp_6-31g(d).inp

012134370.b3lyp_6-31g(d).qchem.inp (generated)

012134370.b3lyp_6-31g(d).gjf (generated)

012134370.b3lyp_6-31g(d).firefly.inp (generated)

012134370.b3lyp_6-31g(d).smash.inp (generated)

012134370.b3lyp_6-31g(d).nwchem.inp (generated) 012134370.b3lyp_6-31g(d).log.xz 012134370.td-b3lyp_6-31g+(d).inp 012134370.td-b3lyp_6-31g+(d).log.xz

012134370.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134370.td-b3lyp_6-31+g(d).gjf (generated)

012134370.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134370.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134370.mol 012134370.PUBCHEM 012134370.mol (via Jmol)
012134381.b3lyp_6-31g(d).inp

012134381.b3lyp_6-31g(d).qchem.inp (generated)

012134381.b3lyp_6-31g(d).gjf (generated)

012134381.b3lyp_6-31g(d).firefly.inp (generated)

012134381.b3lyp_6-31g(d).smash.inp (generated)

012134381.b3lyp_6-31g(d).nwchem.inp (generated) 012134381.b3lyp_6-31g(d).log.xz 012134381.td-b3lyp_6-31g+(d).inp 012134381.td-b3lyp_6-31g+(d).log.xz

012134381.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134381.td-b3lyp_6-31+g(d).gjf (generated)

012134381.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134381.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134381.mol 012134381.PUBCHEM 012134381.mol (via Jmol)
012134406.b3lyp_6-31g(d).inp

012134406.b3lyp_6-31g(d).qchem.inp (generated)

012134406.b3lyp_6-31g(d).gjf (generated)

012134406.b3lyp_6-31g(d).firefly.inp (generated)

012134406.b3lyp_6-31g(d).smash.inp (generated)

012134406.b3lyp_6-31g(d).nwchem.inp (generated) 012134406.b3lyp_6-31g(d).log.xz 012134406.td-b3lyp_6-31g+(d).inp 012134406.td-b3lyp_6-31g+(d).log.xz

012134406.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134406.td-b3lyp_6-31+g(d).gjf (generated)

012134406.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134406.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134406.mol 012134406.PUBCHEM 012134406.mol (via Jmol)
012134442.b3lyp_6-31g(d).inp

012134442.b3lyp_6-31g(d).qchem.inp (generated)

012134442.b3lyp_6-31g(d).gjf (generated)

012134442.b3lyp_6-31g(d).firefly.inp (generated)

012134442.b3lyp_6-31g(d).smash.inp (generated)

012134442.b3lyp_6-31g(d).nwchem.inp (generated) 012134442.b3lyp_6-31g(d).log.xz 012134442.td-b3lyp_6-31g+(d).inp 012134442.td-b3lyp_6-31g+(d).log.xz

012134442.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134442.td-b3lyp_6-31+g(d).gjf (generated)

012134442.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134442.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134442.mol 012134442.PUBCHEM 012134442.mol (via Jmol)
012134516.b3lyp_6-31g(d).inp

012134516.b3lyp_6-31g(d).qchem.inp (generated)

012134516.b3lyp_6-31g(d).gjf (generated)

012134516.b3lyp_6-31g(d).firefly.inp (generated)

012134516.b3lyp_6-31g(d).smash.inp (generated)

012134516.b3lyp_6-31g(d).nwchem.inp (generated) 012134516.b3lyp_6-31g(d).log.xz 012134516.mol 012134516.PUBCHEM 012134516.mol (via Jmol)
012134565.b3lyp_6-31g(d).inp

012134565.b3lyp_6-31g(d).qchem.inp (generated)

012134565.b3lyp_6-31g(d).gjf (generated)

012134565.b3lyp_6-31g(d).firefly.inp (generated)

012134565.b3lyp_6-31g(d).smash.inp (generated)

012134565.b3lyp_6-31g(d).nwchem.inp (generated) 012134565.b3lyp_6-31g(d).log.xz 012134565.td-b3lyp_6-31g+(d).inp 012134565.td-b3lyp_6-31g+(d).log.xz

012134565.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134565.td-b3lyp_6-31+g(d).gjf (generated)

012134565.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134565.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134565.mol 012134565.PUBCHEM 012134565.mol (via Jmol)
012134568.b3lyp_6-31g(d).inp

012134568.b3lyp_6-31g(d).qchem.inp (generated)

012134568.b3lyp_6-31g(d).gjf (generated)

012134568.b3lyp_6-31g(d).firefly.inp (generated)

012134568.b3lyp_6-31g(d).smash.inp (generated)

012134568.b3lyp_6-31g(d).nwchem.inp (generated) 012134568.b3lyp_6-31g(d).log.xz 012134568.mol 012134568.PUBCHEM 012134568.mol (via Jmol)
012134569.b3lyp_6-31g(d).inp

012134569.b3lyp_6-31g(d).qchem.inp (generated)

012134569.b3lyp_6-31g(d).gjf (generated)

012134569.b3lyp_6-31g(d).firefly.inp (generated)

012134569.b3lyp_6-31g(d).smash.inp (generated)

012134569.b3lyp_6-31g(d).nwchem.inp (generated) 012134569.b3lyp_6-31g(d).log.xz 012134569.mol 012134569.PUBCHEM 012134569.mol (via Jmol)
012134601.b3lyp_6-31g(d).inp

012134601.b3lyp_6-31g(d).qchem.inp (generated)

012134601.b3lyp_6-31g(d).gjf (generated)

012134601.b3lyp_6-31g(d).firefly.inp (generated)

012134601.b3lyp_6-31g(d).smash.inp (generated)

012134601.b3lyp_6-31g(d).nwchem.inp (generated) 012134601.b3lyp_6-31g(d).log.xz 012134601.td-b3lyp_6-31g+(d).inp 012134601.td-b3lyp_6-31g+(d).log.xz

012134601.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134601.td-b3lyp_6-31+g(d).gjf (generated)

012134601.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134601.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134601.mol 012134601.PUBCHEM 012134601.mol (via Jmol)
012134602.b3lyp_6-31g(d).inp

012134602.b3lyp_6-31g(d).qchem.inp (generated)

012134602.b3lyp_6-31g(d).gjf (generated)

012134602.b3lyp_6-31g(d).firefly.inp (generated)

012134602.b3lyp_6-31g(d).smash.inp (generated)

012134602.b3lyp_6-31g(d).nwchem.inp (generated) 012134602.b3lyp_6-31g(d).log.xz 012134602.td-b3lyp_6-31g+(d).inp 012134602.td-b3lyp_6-31g+(d).log.xz

012134602.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134602.td-b3lyp_6-31+g(d).gjf (generated)

012134602.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134602.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134602.mol 012134602.PUBCHEM 012134602.mol (via Jmol)
012134604.b3lyp_6-31g(d).inp

012134604.b3lyp_6-31g(d).qchem.inp (generated)

012134604.b3lyp_6-31g(d).gjf (generated)

012134604.b3lyp_6-31g(d).firefly.inp (generated)

012134604.b3lyp_6-31g(d).smash.inp (generated)

012134604.b3lyp_6-31g(d).nwchem.inp (generated) 012134604.b3lyp_6-31g(d).log.xz 012134604.mol 012134604.PUBCHEM 012134604.mol (via Jmol)
012134633.b3lyp_6-31g(d).inp

012134633.b3lyp_6-31g(d).qchem.inp (generated)

012134633.b3lyp_6-31g(d).gjf (generated)

012134633.b3lyp_6-31g(d).firefly.inp (generated)

012134633.b3lyp_6-31g(d).smash.inp (generated)

012134633.b3lyp_6-31g(d).nwchem.inp (generated) 012134633.b3lyp_6-31g(d).log.xz 012134633.td-b3lyp_6-31g+(d).inp 012134633.td-b3lyp_6-31g+(d).log.xz

012134633.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134633.td-b3lyp_6-31+g(d).gjf (generated)

012134633.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134633.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134633.mol 012134633.PUBCHEM 012134633.mol (via Jmol)
012134675.b3lyp_6-31g(d).inp

012134675.b3lyp_6-31g(d).qchem.inp (generated)

012134675.b3lyp_6-31g(d).gjf (generated)

012134675.b3lyp_6-31g(d).firefly.inp (generated)

012134675.b3lyp_6-31g(d).smash.inp (generated)

012134675.b3lyp_6-31g(d).nwchem.inp (generated) 012134675.b3lyp_6-31g(d).log.xz 012134675.td-b3lyp_6-31g+(d).inp 012134675.td-b3lyp_6-31g+(d).log.xz

012134675.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134675.td-b3lyp_6-31+g(d).gjf (generated)

012134675.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134675.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134675.mol 012134675.PUBCHEM 012134675.mol (via Jmol)
012134700.b3lyp_6-31g(d).inp

012134700.b3lyp_6-31g(d).qchem.inp (generated)

012134700.b3lyp_6-31g(d).gjf (generated)

012134700.b3lyp_6-31g(d).firefly.inp (generated)

012134700.b3lyp_6-31g(d).smash.inp (generated)

012134700.b3lyp_6-31g(d).nwchem.inp (generated) 012134700.b3lyp_6-31g(d).log.xz 012134700.td-b3lyp_6-31g+(d).inp 012134700.td-b3lyp_6-31g+(d).log.xz

012134700.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134700.td-b3lyp_6-31+g(d).gjf (generated)

012134700.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134700.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134700.mol 012134700.PUBCHEM 012134700.mol (via Jmol)
012134718.b3lyp_6-31g(d).inp

012134718.b3lyp_6-31g(d).qchem.inp (generated)

012134718.b3lyp_6-31g(d).gjf (generated)

012134718.b3lyp_6-31g(d).firefly.inp (generated)

012134718.b3lyp_6-31g(d).smash.inp (generated)

012134718.b3lyp_6-31g(d).nwchem.inp (generated) 012134718.b3lyp_6-31g(d).log.xz 012134718.td-b3lyp_6-31g+(d).inp 012134718.td-b3lyp_6-31g+(d).log.xz

012134718.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134718.td-b3lyp_6-31+g(d).gjf (generated)

012134718.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134718.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134718.mol 012134718.PUBCHEM 012134718.mol (via Jmol)
012134719.b3lyp_6-31g(d).inp

012134719.b3lyp_6-31g(d).qchem.inp (generated)

012134719.b3lyp_6-31g(d).gjf (generated)

012134719.b3lyp_6-31g(d).firefly.inp (generated)

012134719.b3lyp_6-31g(d).smash.inp (generated)

012134719.b3lyp_6-31g(d).nwchem.inp (generated) 012134719.b3lyp_6-31g(d).log.xz 012134719.td-b3lyp_6-31g+(d).inp 012134719.td-b3lyp_6-31g+(d).log.xz

012134719.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134719.td-b3lyp_6-31+g(d).gjf (generated)

012134719.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134719.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134719.mol 012134719.PUBCHEM 012134719.mol (via Jmol)
012134720.b3lyp_6-31g(d).inp

012134720.b3lyp_6-31g(d).qchem.inp (generated)

012134720.b3lyp_6-31g(d).gjf (generated)

012134720.b3lyp_6-31g(d).firefly.inp (generated)

012134720.b3lyp_6-31g(d).smash.inp (generated)

012134720.b3lyp_6-31g(d).nwchem.inp (generated) 012134720.b3lyp_6-31g(d).log.xz 012134720.td-b3lyp_6-31g+(d).inp 012134720.td-b3lyp_6-31g+(d).log.xz

012134720.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134720.td-b3lyp_6-31+g(d).gjf (generated)

012134720.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134720.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134720.mol 012134720.PUBCHEM 012134720.mol (via Jmol)
012134749.b3lyp_6-31g(d).inp

012134749.b3lyp_6-31g(d).qchem.inp (generated)

012134749.b3lyp_6-31g(d).gjf (generated)

012134749.b3lyp_6-31g(d).firefly.inp (generated)

012134749.b3lyp_6-31g(d).smash.inp (generated)

012134749.b3lyp_6-31g(d).nwchem.inp (generated) 012134749.b3lyp_6-31g(d).log.xz 012134749.td-b3lyp_6-31g+(d).inp 012134749.td-b3lyp_6-31g+(d).log.xz

012134749.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134749.td-b3lyp_6-31+g(d).gjf (generated)

012134749.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134749.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134749.mol 012134749.PUBCHEM 012134749.mol (via Jmol)
012134859.b3lyp_6-31g(d).inp

012134859.b3lyp_6-31g(d).qchem.inp (generated)

012134859.b3lyp_6-31g(d).gjf (generated)

012134859.b3lyp_6-31g(d).firefly.inp (generated)

012134859.b3lyp_6-31g(d).smash.inp (generated)

012134859.b3lyp_6-31g(d).nwchem.inp (generated) 012134859.b3lyp_6-31g(d).log.xz 012134859.td-b3lyp_6-31g+(d).inp 012134859.td-b3lyp_6-31g+(d).log.xz

012134859.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134859.td-b3lyp_6-31+g(d).gjf (generated)

012134859.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134859.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134859.mol 012134859.PUBCHEM 012134859.mol (via Jmol)
012134866.b3lyp_6-31g(d).inp

012134866.b3lyp_6-31g(d).qchem.inp (generated)

012134866.b3lyp_6-31g(d).gjf (generated)

012134866.b3lyp_6-31g(d).firefly.inp (generated)

012134866.b3lyp_6-31g(d).smash.inp (generated)

012134866.b3lyp_6-31g(d).nwchem.inp (generated) 012134866.b3lyp_6-31g(d).log.xz 012134866.td-b3lyp_6-31g+(d).inp 012134866.td-b3lyp_6-31g+(d).log.xz

012134866.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134866.td-b3lyp_6-31+g(d).gjf (generated)

012134866.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134866.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134866.mol 012134866.PUBCHEM 012134866.mol (via Jmol)
012134884.b3lyp_6-31g(d).inp

012134884.b3lyp_6-31g(d).qchem.inp (generated)

012134884.b3lyp_6-31g(d).gjf (generated)

012134884.b3lyp_6-31g(d).firefly.inp (generated)

012134884.b3lyp_6-31g(d).smash.inp (generated)

012134884.b3lyp_6-31g(d).nwchem.inp (generated) 012134884.b3lyp_6-31g(d).log.xz 012134884.mol 012134884.PUBCHEM 012134884.mol (via Jmol)
012134885.b3lyp_6-31g(d).inp

012134885.b3lyp_6-31g(d).qchem.inp (generated)

012134885.b3lyp_6-31g(d).gjf (generated)

012134885.b3lyp_6-31g(d).firefly.inp (generated)

012134885.b3lyp_6-31g(d).smash.inp (generated)

012134885.b3lyp_6-31g(d).nwchem.inp (generated) 012134885.b3lyp_6-31g(d).log.xz 012134885.td-b3lyp_6-31g+(d).inp 012134885.td-b3lyp_6-31g+(d).log.xz

012134885.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134885.td-b3lyp_6-31+g(d).gjf (generated)

012134885.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134885.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134885.mol 012134885.PUBCHEM 012134885.mol (via Jmol)
012134928.b3lyp_6-31g(d).inp

012134928.b3lyp_6-31g(d).qchem.inp (generated)

012134928.b3lyp_6-31g(d).gjf (generated)

012134928.b3lyp_6-31g(d).firefly.inp (generated)

012134928.b3lyp_6-31g(d).smash.inp (generated)

012134928.b3lyp_6-31g(d).nwchem.inp (generated) 012134928.b3lyp_6-31g(d).log.xz 012134928.td-b3lyp_6-31g+(d).inp 012134928.td-b3lyp_6-31g+(d).log.xz

012134928.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134928.td-b3lyp_6-31+g(d).gjf (generated)

012134928.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134928.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134928.mol 012134928.PUBCHEM 012134928.mol (via Jmol)
012134939.b3lyp_6-31g(d).inp

012134939.b3lyp_6-31g(d).qchem.inp (generated)

012134939.b3lyp_6-31g(d).gjf (generated)

012134939.b3lyp_6-31g(d).firefly.inp (generated)

012134939.b3lyp_6-31g(d).smash.inp (generated)

012134939.b3lyp_6-31g(d).nwchem.inp (generated) 012134939.b3lyp_6-31g(d).log.xz 012134939.td-b3lyp_6-31g+(d).inp 012134939.td-b3lyp_6-31g+(d).log.xz

012134939.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134939.td-b3lyp_6-31+g(d).gjf (generated)

012134939.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134939.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134939.mol 012134939.PUBCHEM 012134939.mol (via Jmol)
012134971.b3lyp_6-31g(d).inp

012134971.b3lyp_6-31g(d).qchem.inp (generated)

012134971.b3lyp_6-31g(d).gjf (generated)

012134971.b3lyp_6-31g(d).firefly.inp (generated)

012134971.b3lyp_6-31g(d).smash.inp (generated)

012134971.b3lyp_6-31g(d).nwchem.inp (generated) 012134971.b3lyp_6-31g(d).log.xz 012134971.td-b3lyp_6-31g+(d).inp 012134971.td-b3lyp_6-31g+(d).log.xz

012134971.td-b3lyp_6-31+g(d).qchem.inp (generated)

012134971.td-b3lyp_6-31+g(d).gjf (generated)

012134971.td-b3lyp_6-31+g(d).firefly.inp (generated)

012134971.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012134971.mol 012134971.PUBCHEM 012134971.mol (via Jmol)
012135019.b3lyp_6-31g(d).inp

012135019.b3lyp_6-31g(d).qchem.inp (generated)

012135019.b3lyp_6-31g(d).gjf (generated)

012135019.b3lyp_6-31g(d).firefly.inp (generated)

012135019.b3lyp_6-31g(d).smash.inp (generated)

012135019.b3lyp_6-31g(d).nwchem.inp (generated) 012135019.b3lyp_6-31g(d).log.xz 012135019.td-b3lyp_6-31g+(d).inp 012135019.td-b3lyp_6-31g+(d).log.xz

012135019.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135019.td-b3lyp_6-31+g(d).gjf (generated)

012135019.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135019.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135019.mol 012135019.PUBCHEM 012135019.mol (via Jmol)
012135023.b3lyp_6-31g(d).inp

012135023.b3lyp_6-31g(d).qchem.inp (generated)

012135023.b3lyp_6-31g(d).gjf (generated)

012135023.b3lyp_6-31g(d).firefly.inp (generated)

012135023.b3lyp_6-31g(d).smash.inp (generated)

012135023.b3lyp_6-31g(d).nwchem.inp (generated) 012135023.b3lyp_6-31g(d).log.xz 012135023.td-b3lyp_6-31g+(d).inp 012135023.td-b3lyp_6-31g+(d).log.xz

012135023.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135023.td-b3lyp_6-31+g(d).gjf (generated)

012135023.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135023.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135023.mol 012135023.PUBCHEM 012135023.mol (via Jmol)
012135024.b3lyp_6-31g(d).inp

012135024.b3lyp_6-31g(d).qchem.inp (generated)

012135024.b3lyp_6-31g(d).gjf (generated)

012135024.b3lyp_6-31g(d).firefly.inp (generated)

012135024.b3lyp_6-31g(d).smash.inp (generated)

012135024.b3lyp_6-31g(d).nwchem.inp (generated) 012135024.b3lyp_6-31g(d).log.xz 012135024.td-b3lyp_6-31g+(d).inp 012135024.td-b3lyp_6-31g+(d).log.xz

012135024.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135024.td-b3lyp_6-31+g(d).gjf (generated)

012135024.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135024.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135024.mol 012135024.PUBCHEM 012135024.mol (via Jmol)
012135029.b3lyp_6-31g(d).inp

012135029.b3lyp_6-31g(d).qchem.inp (generated)

012135029.b3lyp_6-31g(d).gjf (generated)

012135029.b3lyp_6-31g(d).firefly.inp (generated)

012135029.b3lyp_6-31g(d).smash.inp (generated)

012135029.b3lyp_6-31g(d).nwchem.inp (generated) 012135029.b3lyp_6-31g(d).log.xz 012135029.td-b3lyp_6-31g+(d).inp 012135029.td-b3lyp_6-31g+(d).log.xz

012135029.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135029.td-b3lyp_6-31+g(d).gjf (generated)

012135029.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135029.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135029.mol 012135029.PUBCHEM 012135029.mol (via Jmol)
012135175.b3lyp_6-31g(d).inp

012135175.b3lyp_6-31g(d).qchem.inp (generated)

012135175.b3lyp_6-31g(d).gjf (generated)

012135175.b3lyp_6-31g(d).firefly.inp (generated)

012135175.b3lyp_6-31g(d).smash.inp (generated)

012135175.b3lyp_6-31g(d).nwchem.inp (generated) 012135175.b3lyp_6-31g(d).log.xz 012135175.mol 012135175.PUBCHEM 012135175.mol (via Jmol)
012135176.b3lyp_6-31g(d).inp

012135176.b3lyp_6-31g(d).qchem.inp (generated)

012135176.b3lyp_6-31g(d).gjf (generated)

012135176.b3lyp_6-31g(d).firefly.inp (generated)

012135176.b3lyp_6-31g(d).smash.inp (generated)

012135176.b3lyp_6-31g(d).nwchem.inp (generated) 012135176.b3lyp_6-31g(d).log.xz 012135176.td-b3lyp_6-31g+(d).inp 012135176.td-b3lyp_6-31g+(d).log.xz

012135176.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135176.td-b3lyp_6-31+g(d).gjf (generated)

012135176.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135176.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135176.mol 012135176.PUBCHEM 012135176.mol (via Jmol)
012135177.b3lyp_6-31g(d).inp

012135177.b3lyp_6-31g(d).qchem.inp (generated)

012135177.b3lyp_6-31g(d).gjf (generated)

012135177.b3lyp_6-31g(d).firefly.inp (generated)

012135177.b3lyp_6-31g(d).smash.inp (generated)

012135177.b3lyp_6-31g(d).nwchem.inp (generated) 012135177.b3lyp_6-31g(d).log.xz 012135177.mol 012135177.PUBCHEM 012135177.mol (via Jmol)
012135279.b3lyp_6-31g(d).inp

012135279.b3lyp_6-31g(d).qchem.inp (generated)

012135279.b3lyp_6-31g(d).gjf (generated)

012135279.b3lyp_6-31g(d).firefly.inp (generated)

012135279.b3lyp_6-31g(d).smash.inp (generated)

012135279.b3lyp_6-31g(d).nwchem.inp (generated) 012135279.b3lyp_6-31g(d).log.xz 012135279.td-b3lyp_6-31g+(d).inp 012135279.td-b3lyp_6-31g+(d).log.xz

012135279.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135279.td-b3lyp_6-31+g(d).gjf (generated)

012135279.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135279.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135279.mol 012135279.PUBCHEM 012135279.mol (via Jmol)
012135282.b3lyp_6-31g(d).inp

012135282.b3lyp_6-31g(d).qchem.inp (generated)

012135282.b3lyp_6-31g(d).gjf (generated)

012135282.b3lyp_6-31g(d).firefly.inp (generated)

012135282.b3lyp_6-31g(d).smash.inp (generated)

012135282.b3lyp_6-31g(d).nwchem.inp (generated) 012135282.b3lyp_6-31g(d).log.xz 012135282.td-b3lyp_6-31g+(d).inp 012135282.td-b3lyp_6-31g+(d).log.xz

012135282.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135282.td-b3lyp_6-31+g(d).gjf (generated)

012135282.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135282.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135282.mol 012135282.PUBCHEM 012135282.mol (via Jmol)
012135283.b3lyp_6-31g(d).inp

012135283.b3lyp_6-31g(d).qchem.inp (generated)

012135283.b3lyp_6-31g(d).gjf (generated)

012135283.b3lyp_6-31g(d).firefly.inp (generated)

012135283.b3lyp_6-31g(d).smash.inp (generated)

012135283.b3lyp_6-31g(d).nwchem.inp (generated) 012135283.b3lyp_6-31g(d).log.xz 012135283.td-b3lyp_6-31g+(d).inp 012135283.td-b3lyp_6-31g+(d).log.xz

012135283.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135283.td-b3lyp_6-31+g(d).gjf (generated)

012135283.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135283.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135283.mol 012135283.PUBCHEM 012135283.mol (via Jmol)
012135285.b3lyp_6-31g(d).inp

012135285.b3lyp_6-31g(d).qchem.inp (generated)

012135285.b3lyp_6-31g(d).gjf (generated)

012135285.b3lyp_6-31g(d).firefly.inp (generated)

012135285.b3lyp_6-31g(d).smash.inp (generated)

012135285.b3lyp_6-31g(d).nwchem.inp (generated) 012135285.b3lyp_6-31g(d).log.xz 012135285.td-b3lyp_6-31g+(d).inp 012135285.td-b3lyp_6-31g+(d).log.xz

012135285.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135285.td-b3lyp_6-31+g(d).gjf (generated)

012135285.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135285.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135285.mol 012135285.PUBCHEM 012135285.mol (via Jmol)
012135327.b3lyp_6-31g(d).inp

012135327.b3lyp_6-31g(d).qchem.inp (generated)

012135327.b3lyp_6-31g(d).gjf (generated)

012135327.b3lyp_6-31g(d).firefly.inp (generated)

012135327.b3lyp_6-31g(d).smash.inp (generated)

012135327.b3lyp_6-31g(d).nwchem.inp (generated) 012135327.b3lyp_6-31g(d).log.xz 012135327.td-b3lyp_6-31g+(d).inp 012135327.td-b3lyp_6-31g+(d).log.xz

012135327.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135327.td-b3lyp_6-31+g(d).gjf (generated)

012135327.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135327.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135327.mol 012135327.PUBCHEM 012135327.mol (via Jmol)
012135328.b3lyp_6-31g(d).inp

012135328.b3lyp_6-31g(d).qchem.inp (generated)

012135328.b3lyp_6-31g(d).gjf (generated)

012135328.b3lyp_6-31g(d).firefly.inp (generated)

012135328.b3lyp_6-31g(d).smash.inp (generated)

012135328.b3lyp_6-31g(d).nwchem.inp (generated) 012135328.b3lyp_6-31g(d).log.xz 012135328.td-b3lyp_6-31g+(d).inp 012135328.td-b3lyp_6-31g+(d).log.xz

012135328.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135328.td-b3lyp_6-31+g(d).gjf (generated)

012135328.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135328.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135328.mol 012135328.PUBCHEM 012135328.mol (via Jmol)
012135351.b3lyp_6-31g(d).inp

012135351.b3lyp_6-31g(d).qchem.inp (generated)

012135351.b3lyp_6-31g(d).gjf (generated)

012135351.b3lyp_6-31g(d).firefly.inp (generated)

012135351.b3lyp_6-31g(d).smash.inp (generated)

012135351.b3lyp_6-31g(d).nwchem.inp (generated) 012135351.b3lyp_6-31g(d).log.xz 012135351.td-b3lyp_6-31g+(d).inp 012135351.td-b3lyp_6-31g+(d).log.xz

012135351.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135351.td-b3lyp_6-31+g(d).gjf (generated)

012135351.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135351.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135351.mol 012135351.PUBCHEM 012135351.mol (via Jmol)
012135375.b3lyp_6-31g(d).inp

012135375.b3lyp_6-31g(d).qchem.inp (generated)

012135375.b3lyp_6-31g(d).gjf (generated)

012135375.b3lyp_6-31g(d).firefly.inp (generated)

012135375.b3lyp_6-31g(d).smash.inp (generated)

012135375.b3lyp_6-31g(d).nwchem.inp (generated) 012135375.b3lyp_6-31g(d).log.xz 012135375.td-b3lyp_6-31g+(d).inp 012135375.td-b3lyp_6-31g+(d).log.xz

012135375.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135375.td-b3lyp_6-31+g(d).gjf (generated)

012135375.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135375.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135375.mol 012135375.PUBCHEM 012135375.mol (via Jmol)
012135384.b3lyp_6-31g(d).inp

012135384.b3lyp_6-31g(d).qchem.inp (generated)

012135384.b3lyp_6-31g(d).gjf (generated)

012135384.b3lyp_6-31g(d).firefly.inp (generated)

012135384.b3lyp_6-31g(d).smash.inp (generated)

012135384.b3lyp_6-31g(d).nwchem.inp (generated) 012135384.b3lyp_6-31g(d).log.xz 012135384.td-b3lyp_6-31g+(d).inp 012135384.td-b3lyp_6-31g+(d).log.xz

012135384.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135384.td-b3lyp_6-31+g(d).gjf (generated)

012135384.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135384.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135384.mol 012135384.PUBCHEM 012135384.mol (via Jmol)
012135385.b3lyp_6-31g(d).inp

012135385.b3lyp_6-31g(d).qchem.inp (generated)

012135385.b3lyp_6-31g(d).gjf (generated)

012135385.b3lyp_6-31g(d).firefly.inp (generated)

012135385.b3lyp_6-31g(d).smash.inp (generated)

012135385.b3lyp_6-31g(d).nwchem.inp (generated) 012135385.b3lyp_6-31g(d).log.xz 012135385.td-b3lyp_6-31g+(d).inp 012135385.td-b3lyp_6-31g+(d).log.xz

012135385.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135385.td-b3lyp_6-31+g(d).gjf (generated)

012135385.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135385.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135385.mol 012135385.PUBCHEM 012135385.mol (via Jmol)
012135388.b3lyp_6-31g(d).inp

012135388.b3lyp_6-31g(d).qchem.inp (generated)

012135388.b3lyp_6-31g(d).gjf (generated)

012135388.b3lyp_6-31g(d).firefly.inp (generated)

012135388.b3lyp_6-31g(d).smash.inp (generated)

012135388.b3lyp_6-31g(d).nwchem.inp (generated) 012135388.b3lyp_6-31g(d).log.xz 012135388.td-b3lyp_6-31g+(d).inp 012135388.td-b3lyp_6-31g+(d).log.xz

012135388.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135388.td-b3lyp_6-31+g(d).gjf (generated)

012135388.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135388.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135388.mol 012135388.PUBCHEM 012135388.mol (via Jmol)
012135399.b3lyp_6-31g(d).inp

012135399.b3lyp_6-31g(d).qchem.inp (generated)

012135399.b3lyp_6-31g(d).gjf (generated)

012135399.b3lyp_6-31g(d).firefly.inp (generated)

012135399.b3lyp_6-31g(d).smash.inp (generated)

012135399.b3lyp_6-31g(d).nwchem.inp (generated) 012135399.b3lyp_6-31g(d).log.xz 012135399.td-b3lyp_6-31g+(d).inp 012135399.td-b3lyp_6-31g+(d).log.xz

012135399.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135399.td-b3lyp_6-31+g(d).gjf (generated)

012135399.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135399.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135399.mol 012135399.PUBCHEM 012135399.mol (via Jmol)
012135420.b3lyp_6-31g(d).inp

012135420.b3lyp_6-31g(d).qchem.inp (generated)

012135420.b3lyp_6-31g(d).gjf (generated)

012135420.b3lyp_6-31g(d).firefly.inp (generated)

012135420.b3lyp_6-31g(d).smash.inp (generated)

012135420.b3lyp_6-31g(d).nwchem.inp (generated) 012135420.b3lyp_6-31g(d).log.xz 012135420.td-b3lyp_6-31g+(d).inp 012135420.td-b3lyp_6-31g+(d).log.xz

012135420.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135420.td-b3lyp_6-31+g(d).gjf (generated)

012135420.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135420.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135420.mol 012135420.PUBCHEM 012135420.mol (via Jmol)
012135519.b3lyp_6-31g(d).inp

012135519.b3lyp_6-31g(d).qchem.inp (generated)

012135519.b3lyp_6-31g(d).gjf (generated)

012135519.b3lyp_6-31g(d).firefly.inp (generated)

012135519.b3lyp_6-31g(d).smash.inp (generated)

012135519.b3lyp_6-31g(d).nwchem.inp (generated) 012135519.b3lyp_6-31g(d).log.xz 012135519.td-b3lyp_6-31g+(d).inp 012135519.td-b3lyp_6-31g+(d).log.xz

012135519.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135519.td-b3lyp_6-31+g(d).gjf (generated)

012135519.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135519.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135519.mol 012135519.PUBCHEM 012135519.mol (via Jmol)
012135555.b3lyp_6-31g(d).inp

012135555.b3lyp_6-31g(d).qchem.inp (generated)

012135555.b3lyp_6-31g(d).gjf (generated)

012135555.b3lyp_6-31g(d).firefly.inp (generated)

012135555.b3lyp_6-31g(d).smash.inp (generated)

012135555.b3lyp_6-31g(d).nwchem.inp (generated) 012135555.b3lyp_6-31g(d).log.xz 012135555.td-b3lyp_6-31g+(d).inp 012135555.td-b3lyp_6-31g+(d).log.xz

012135555.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135555.td-b3lyp_6-31+g(d).gjf (generated)

012135555.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135555.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135555.mol 012135555.PUBCHEM 012135555.mol (via Jmol)
012135559.b3lyp_6-31g(d).inp

012135559.b3lyp_6-31g(d).qchem.inp (generated)

012135559.b3lyp_6-31g(d).gjf (generated)

012135559.b3lyp_6-31g(d).firefly.inp (generated)

012135559.b3lyp_6-31g(d).smash.inp (generated)

012135559.b3lyp_6-31g(d).nwchem.inp (generated) 012135559.b3lyp_6-31g(d).log.xz 012135559.mol 012135559.PUBCHEM 012135559.mol (via Jmol)
012135560.b3lyp_6-31g(d).inp

012135560.b3lyp_6-31g(d).qchem.inp (generated)

012135560.b3lyp_6-31g(d).gjf (generated)

012135560.b3lyp_6-31g(d).firefly.inp (generated)

012135560.b3lyp_6-31g(d).smash.inp (generated)

012135560.b3lyp_6-31g(d).nwchem.inp (generated) 012135560.b3lyp_6-31g(d).log.xz 012135560.mol 012135560.PUBCHEM 012135560.mol (via Jmol)
012135562.b3lyp_6-31g(d).inp

012135562.b3lyp_6-31g(d).qchem.inp (generated)

012135562.b3lyp_6-31g(d).gjf (generated)

012135562.b3lyp_6-31g(d).firefly.inp (generated)

012135562.b3lyp_6-31g(d).smash.inp (generated)

012135562.b3lyp_6-31g(d).nwchem.inp (generated) 012135562.b3lyp_6-31g(d).log.xz 012135562.mol 012135562.PUBCHEM 012135562.mol (via Jmol)
012135563.b3lyp_6-31g(d).inp

012135563.b3lyp_6-31g(d).qchem.inp (generated)

012135563.b3lyp_6-31g(d).gjf (generated)

012135563.b3lyp_6-31g(d).firefly.inp (generated)

012135563.b3lyp_6-31g(d).smash.inp (generated)

012135563.b3lyp_6-31g(d).nwchem.inp (generated) 012135563.b3lyp_6-31g(d).log.xz 012135563.td-b3lyp_6-31g+(d).inp 012135563.td-b3lyp_6-31g+(d).log.xz

012135563.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135563.td-b3lyp_6-31+g(d).gjf (generated)

012135563.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135563.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135563.mol 012135563.PUBCHEM 012135563.mol (via Jmol)
012135565.b3lyp_6-31g(d).inp

012135565.b3lyp_6-31g(d).qchem.inp (generated)

012135565.b3lyp_6-31g(d).gjf (generated)

012135565.b3lyp_6-31g(d).firefly.inp (generated)

012135565.b3lyp_6-31g(d).smash.inp (generated)

012135565.b3lyp_6-31g(d).nwchem.inp (generated) 012135565.b3lyp_6-31g(d).log.xz 012135565.td-b3lyp_6-31g+(d).inp 012135565.td-b3lyp_6-31g+(d).log.xz

012135565.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135565.td-b3lyp_6-31+g(d).gjf (generated)

012135565.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135565.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135565.mol 012135565.PUBCHEM 012135565.mol (via Jmol)
012135566.b3lyp_6-31g(d).inp

012135566.b3lyp_6-31g(d).qchem.inp (generated)

012135566.b3lyp_6-31g(d).gjf (generated)

012135566.b3lyp_6-31g(d).firefly.inp (generated)

012135566.b3lyp_6-31g(d).smash.inp (generated)

012135566.b3lyp_6-31g(d).nwchem.inp (generated) 012135566.b3lyp_6-31g(d).log.xz 012135566.td-b3lyp_6-31g+(d).inp 012135566.td-b3lyp_6-31g+(d).log.xz

012135566.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135566.td-b3lyp_6-31+g(d).gjf (generated)

012135566.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135566.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135566.mol 012135566.PUBCHEM 012135566.mol (via Jmol)
012135569.b3lyp_6-31g(d).inp

012135569.b3lyp_6-31g(d).qchem.inp (generated)

012135569.b3lyp_6-31g(d).gjf (generated)

012135569.b3lyp_6-31g(d).firefly.inp (generated)

012135569.b3lyp_6-31g(d).smash.inp (generated)

012135569.b3lyp_6-31g(d).nwchem.inp (generated) 012135569.b3lyp_6-31g(d).log.xz 012135569.td-b3lyp_6-31g+(d).inp 012135569.td-b3lyp_6-31g+(d).log.xz

012135569.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135569.td-b3lyp_6-31+g(d).gjf (generated)

012135569.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135569.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135569.mol 012135569.PUBCHEM 012135569.mol (via Jmol)
012135575.b3lyp_6-31g(d).inp

012135575.b3lyp_6-31g(d).qchem.inp (generated)

012135575.b3lyp_6-31g(d).gjf (generated)

012135575.b3lyp_6-31g(d).firefly.inp (generated)

012135575.b3lyp_6-31g(d).smash.inp (generated)

012135575.b3lyp_6-31g(d).nwchem.inp (generated) 012135575.b3lyp_6-31g(d).log.xz 012135575.mol 012135575.PUBCHEM 012135575.mol (via Jmol)
012135576.b3lyp_6-31g(d).inp

012135576.b3lyp_6-31g(d).qchem.inp (generated)

012135576.b3lyp_6-31g(d).gjf (generated)

012135576.b3lyp_6-31g(d).firefly.inp (generated)

012135576.b3lyp_6-31g(d).smash.inp (generated)

012135576.b3lyp_6-31g(d).nwchem.inp (generated) 012135576.b3lyp_6-31g(d).log.xz 012135576.mol 012135576.PUBCHEM 012135576.mol (via Jmol)
012135581.b3lyp_6-31g(d).inp

012135581.b3lyp_6-31g(d).qchem.inp (generated)

012135581.b3lyp_6-31g(d).gjf (generated)

012135581.b3lyp_6-31g(d).firefly.inp (generated)

012135581.b3lyp_6-31g(d).smash.inp (generated)

012135581.b3lyp_6-31g(d).nwchem.inp (generated) 012135581.b3lyp_6-31g(d).log.xz 012135581.td-b3lyp_6-31g+(d).inp 012135581.td-b3lyp_6-31g+(d).log.xz

012135581.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135581.td-b3lyp_6-31+g(d).gjf (generated)

012135581.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135581.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135581.mol 012135581.PUBCHEM 012135581.mol (via Jmol)
012135609.b3lyp_6-31g(d).inp

012135609.b3lyp_6-31g(d).qchem.inp (generated)

012135609.b3lyp_6-31g(d).gjf (generated)

012135609.b3lyp_6-31g(d).firefly.inp (generated)

012135609.b3lyp_6-31g(d).smash.inp (generated)

012135609.b3lyp_6-31g(d).nwchem.inp (generated) 012135609.b3lyp_6-31g(d).log.xz 012135609.td-b3lyp_6-31g+(d).inp 012135609.td-b3lyp_6-31g+(d).log.xz

012135609.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135609.td-b3lyp_6-31+g(d).gjf (generated)

012135609.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135609.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135609.mol 012135609.PUBCHEM 012135609.mol (via Jmol)
012135673.b3lyp_6-31g(d).inp

012135673.b3lyp_6-31g(d).qchem.inp (generated)

012135673.b3lyp_6-31g(d).gjf (generated)

012135673.b3lyp_6-31g(d).firefly.inp (generated)

012135673.b3lyp_6-31g(d).smash.inp (generated)

012135673.b3lyp_6-31g(d).nwchem.inp (generated) 012135673.b3lyp_6-31g(d).log.xz 012135673.td-b3lyp_6-31g+(d).inp 012135673.td-b3lyp_6-31g+(d).log.xz

012135673.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135673.td-b3lyp_6-31+g(d).gjf (generated)

012135673.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135673.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135673.mol 012135673.PUBCHEM 012135673.mol (via Jmol)
012135682.b3lyp_6-31g(d).inp

012135682.b3lyp_6-31g(d).qchem.inp (generated)

012135682.b3lyp_6-31g(d).gjf (generated)

012135682.b3lyp_6-31g(d).firefly.inp (generated)

012135682.b3lyp_6-31g(d).smash.inp (generated)

012135682.b3lyp_6-31g(d).nwchem.inp (generated) 012135682.b3lyp_6-31g(d).log.xz 012135682.td-b3lyp_6-31g+(d).inp 012135682.td-b3lyp_6-31g+(d).log.xz

012135682.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135682.td-b3lyp_6-31+g(d).gjf (generated)

012135682.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135682.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135682.mol 012135682.PUBCHEM 012135682.mol (via Jmol)
012135685.b3lyp_6-31g(d).inp

012135685.b3lyp_6-31g(d).qchem.inp (generated)

012135685.b3lyp_6-31g(d).gjf (generated)

012135685.b3lyp_6-31g(d).firefly.inp (generated)

012135685.b3lyp_6-31g(d).smash.inp (generated)

012135685.b3lyp_6-31g(d).nwchem.inp (generated) 012135685.b3lyp_6-31g(d).log.xz 012135685.td-b3lyp_6-31g+(d).inp 012135685.td-b3lyp_6-31g+(d).log.xz

012135685.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135685.td-b3lyp_6-31+g(d).gjf (generated)

012135685.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135685.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135685.mol 012135685.PUBCHEM 012135685.mol (via Jmol)
012135698.b3lyp_6-31g(d).inp

012135698.b3lyp_6-31g(d).qchem.inp (generated)

012135698.b3lyp_6-31g(d).gjf (generated)

012135698.b3lyp_6-31g(d).firefly.inp (generated)

012135698.b3lyp_6-31g(d).smash.inp (generated)

012135698.b3lyp_6-31g(d).nwchem.inp (generated) 012135698.b3lyp_6-31g(d).log.xz 012135698.td-b3lyp_6-31g+(d).inp 012135698.td-b3lyp_6-31g+(d).log.xz

012135698.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135698.td-b3lyp_6-31+g(d).gjf (generated)

012135698.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135698.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135698.mol 012135698.PUBCHEM 012135698.mol (via Jmol)
012135701.b3lyp_6-31g(d).inp

012135701.b3lyp_6-31g(d).qchem.inp (generated)

012135701.b3lyp_6-31g(d).gjf (generated)

012135701.b3lyp_6-31g(d).firefly.inp (generated)

012135701.b3lyp_6-31g(d).smash.inp (generated)

012135701.b3lyp_6-31g(d).nwchem.inp (generated) 012135701.b3lyp_6-31g(d).log.xz 012135701.td-b3lyp_6-31g+(d).inp 012135701.td-b3lyp_6-31g+(d).log.xz

012135701.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135701.td-b3lyp_6-31+g(d).gjf (generated)

012135701.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135701.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135701.mol 012135701.PUBCHEM 012135701.mol (via Jmol)
012135702.b3lyp_6-31g(d).inp

012135702.b3lyp_6-31g(d).qchem.inp (generated)

012135702.b3lyp_6-31g(d).gjf (generated)

012135702.b3lyp_6-31g(d).firefly.inp (generated)

012135702.b3lyp_6-31g(d).smash.inp (generated)

012135702.b3lyp_6-31g(d).nwchem.inp (generated) 012135702.b3lyp_6-31g(d).log.xz 012135702.td-b3lyp_6-31g+(d).inp 012135702.td-b3lyp_6-31g+(d).log.xz

012135702.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135702.td-b3lyp_6-31+g(d).gjf (generated)

012135702.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135702.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135702.mol 012135702.PUBCHEM 012135702.mol (via Jmol)
012135710.b3lyp_6-31g(d).inp

012135710.b3lyp_6-31g(d).qchem.inp (generated)

012135710.b3lyp_6-31g(d).gjf (generated)

012135710.b3lyp_6-31g(d).firefly.inp (generated)

012135710.b3lyp_6-31g(d).smash.inp (generated)

012135710.b3lyp_6-31g(d).nwchem.inp (generated) 012135710.b3lyp_6-31g(d).log.xz 012135710.td-b3lyp_6-31g+(d).inp 012135710.td-b3lyp_6-31g+(d).log.xz

012135710.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135710.td-b3lyp_6-31+g(d).gjf (generated)

012135710.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135710.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135710.mol 012135710.PUBCHEM 012135710.mol (via Jmol)
012135716.b3lyp_6-31g(d).inp

012135716.b3lyp_6-31g(d).qchem.inp (generated)

012135716.b3lyp_6-31g(d).gjf (generated)

012135716.b3lyp_6-31g(d).firefly.inp (generated)

012135716.b3lyp_6-31g(d).smash.inp (generated)

012135716.b3lyp_6-31g(d).nwchem.inp (generated) 012135716.b3lyp_6-31g(d).log.xz 012135716.td-b3lyp_6-31g+(d).inp 012135716.td-b3lyp_6-31g+(d).log.xz

012135716.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135716.td-b3lyp_6-31+g(d).gjf (generated)

012135716.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135716.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135716.mol 012135716.PUBCHEM 012135716.mol (via Jmol)
012135726.b3lyp_6-31g(d).inp

012135726.b3lyp_6-31g(d).qchem.inp (generated)

012135726.b3lyp_6-31g(d).gjf (generated)

012135726.b3lyp_6-31g(d).firefly.inp (generated)

012135726.b3lyp_6-31g(d).smash.inp (generated)

012135726.b3lyp_6-31g(d).nwchem.inp (generated) 012135726.b3lyp_6-31g(d).log.xz 012135726.td-b3lyp_6-31g+(d).inp 012135726.td-b3lyp_6-31g+(d).log.xz

012135726.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135726.td-b3lyp_6-31+g(d).gjf (generated)

012135726.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135726.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135726.mol 012135726.PUBCHEM 012135726.mol (via Jmol)
012135736.b3lyp_6-31g(d).inp

012135736.b3lyp_6-31g(d).qchem.inp (generated)

012135736.b3lyp_6-31g(d).gjf (generated)

012135736.b3lyp_6-31g(d).firefly.inp (generated)

012135736.b3lyp_6-31g(d).smash.inp (generated)

012135736.b3lyp_6-31g(d).nwchem.inp (generated) 012135736.b3lyp_6-31g(d).log.xz 012135736.td-b3lyp_6-31g+(d).inp 012135736.td-b3lyp_6-31g+(d).log.xz

012135736.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135736.td-b3lyp_6-31+g(d).gjf (generated)

012135736.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135736.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135736.mol 012135736.PUBCHEM 012135736.mol (via Jmol)
012135738.b3lyp_6-31g(d).inp

012135738.b3lyp_6-31g(d).qchem.inp (generated)

012135738.b3lyp_6-31g(d).gjf (generated)

012135738.b3lyp_6-31g(d).firefly.inp (generated)

012135738.b3lyp_6-31g(d).smash.inp (generated)

012135738.b3lyp_6-31g(d).nwchem.inp (generated) 012135738.b3lyp_6-31g(d).log.xz 012135738.td-b3lyp_6-31g+(d).inp 012135738.td-b3lyp_6-31g+(d).log.xz

012135738.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135738.td-b3lyp_6-31+g(d).gjf (generated)

012135738.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135738.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135738.mol 012135738.PUBCHEM 012135738.mol (via Jmol)
012135783.b3lyp_6-31g(d).inp

012135783.b3lyp_6-31g(d).qchem.inp (generated)

012135783.b3lyp_6-31g(d).gjf (generated)

012135783.b3lyp_6-31g(d).firefly.inp (generated)

012135783.b3lyp_6-31g(d).smash.inp (generated)

012135783.b3lyp_6-31g(d).nwchem.inp (generated) 012135783.b3lyp_6-31g(d).log.xz 012135783.td-b3lyp_6-31g+(d).inp 012135783.td-b3lyp_6-31g+(d).log.xz

012135783.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135783.td-b3lyp_6-31+g(d).gjf (generated)

012135783.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135783.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135783.mol 012135783.PUBCHEM 012135783.mol (via Jmol)
012135939.b3lyp_6-31g(d).inp

012135939.b3lyp_6-31g(d).qchem.inp (generated)

012135939.b3lyp_6-31g(d).gjf (generated)

012135939.b3lyp_6-31g(d).firefly.inp (generated)

012135939.b3lyp_6-31g(d).smash.inp (generated)

012135939.b3lyp_6-31g(d).nwchem.inp (generated) 012135939.b3lyp_6-31g(d).log.xz 012135939.td-b3lyp_6-31g+(d).inp 012135939.td-b3lyp_6-31g+(d).log.xz

012135939.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135939.td-b3lyp_6-31+g(d).gjf (generated)

012135939.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135939.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135939.mol 012135939.PUBCHEM 012135939.mol (via Jmol)
012135969.b3lyp_6-31g(d).inp

012135969.b3lyp_6-31g(d).qchem.inp (generated)

012135969.b3lyp_6-31g(d).gjf (generated)

012135969.b3lyp_6-31g(d).firefly.inp (generated)

012135969.b3lyp_6-31g(d).smash.inp (generated)

012135969.b3lyp_6-31g(d).nwchem.inp (generated) 012135969.b3lyp_6-31g(d).log.xz 012135969.td-b3lyp_6-31g+(d).inp 012135969.td-b3lyp_6-31g+(d).log.xz

012135969.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135969.td-b3lyp_6-31+g(d).gjf (generated)

012135969.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135969.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135969.mol 012135969.PUBCHEM 012135969.mol (via Jmol)
012135972.b3lyp_6-31g(d).inp

012135972.b3lyp_6-31g(d).qchem.inp (generated)

012135972.b3lyp_6-31g(d).gjf (generated)

012135972.b3lyp_6-31g(d).firefly.inp (generated)

012135972.b3lyp_6-31g(d).smash.inp (generated)

012135972.b3lyp_6-31g(d).nwchem.inp (generated) 012135972.b3lyp_6-31g(d).log.xz 012135972.td-b3lyp_6-31g+(d).inp 012135972.td-b3lyp_6-31g+(d).log.xz

012135972.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135972.td-b3lyp_6-31+g(d).gjf (generated)

012135972.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135972.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135972.mol 012135972.PUBCHEM 012135972.mol (via Jmol)
012135980.b3lyp_6-31g(d).inp

012135980.b3lyp_6-31g(d).qchem.inp (generated)

012135980.b3lyp_6-31g(d).gjf (generated)

012135980.b3lyp_6-31g(d).firefly.inp (generated)

012135980.b3lyp_6-31g(d).smash.inp (generated)

012135980.b3lyp_6-31g(d).nwchem.inp (generated) 012135980.b3lyp_6-31g(d).log.xz 012135980.td-b3lyp_6-31g+(d).inp 012135980.td-b3lyp_6-31g+(d).log.xz

012135980.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135980.td-b3lyp_6-31+g(d).gjf (generated)

012135980.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135980.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135980.mol 012135980.PUBCHEM 012135980.mol (via Jmol)
012135989.b3lyp_6-31g(d).inp

012135989.b3lyp_6-31g(d).qchem.inp (generated)

012135989.b3lyp_6-31g(d).gjf (generated)

012135989.b3lyp_6-31g(d).firefly.inp (generated)

012135989.b3lyp_6-31g(d).smash.inp (generated)

012135989.b3lyp_6-31g(d).nwchem.inp (generated) 012135989.b3lyp_6-31g(d).log.xz 012135989.td-b3lyp_6-31g+(d).inp 012135989.td-b3lyp_6-31g+(d).log.xz

012135989.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135989.td-b3lyp_6-31+g(d).gjf (generated)

012135989.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135989.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135989.mol 012135989.PUBCHEM 012135989.mol (via Jmol)
012135990.b3lyp_6-31g(d).inp

012135990.b3lyp_6-31g(d).qchem.inp (generated)

012135990.b3lyp_6-31g(d).gjf (generated)

012135990.b3lyp_6-31g(d).firefly.inp (generated)

012135990.b3lyp_6-31g(d).smash.inp (generated)

012135990.b3lyp_6-31g(d).nwchem.inp (generated) 012135990.b3lyp_6-31g(d).log.xz 012135990.td-b3lyp_6-31g+(d).inp 012135990.td-b3lyp_6-31g+(d).log.xz

012135990.td-b3lyp_6-31+g(d).qchem.inp (generated)

012135990.td-b3lyp_6-31+g(d).gjf (generated)

012135990.td-b3lyp_6-31+g(d).firefly.inp (generated)

012135990.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012135990.mol 012135990.PUBCHEM 012135990.mol (via Jmol)
012136051.b3lyp_6-31g(d).inp

012136051.b3lyp_6-31g(d).qchem.inp (generated)

012136051.b3lyp_6-31g(d).gjf (generated)

012136051.b3lyp_6-31g(d).firefly.inp (generated)

012136051.b3lyp_6-31g(d).smash.inp (generated)

012136051.b3lyp_6-31g(d).nwchem.inp (generated) 012136051.b3lyp_6-31g(d).log.xz 012136051.td-b3lyp_6-31g+(d).inp 012136051.td-b3lyp_6-31g+(d).log.xz

012136051.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136051.td-b3lyp_6-31+g(d).gjf (generated)

012136051.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136051.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136051.mol 012136051.PUBCHEM 012136051.mol (via Jmol)
012136078.b3lyp_6-31g(d).inp

012136078.b3lyp_6-31g(d).qchem.inp (generated)

012136078.b3lyp_6-31g(d).gjf (generated)

012136078.b3lyp_6-31g(d).firefly.inp (generated)

012136078.b3lyp_6-31g(d).smash.inp (generated)

012136078.b3lyp_6-31g(d).nwchem.inp (generated) 012136078.b3lyp_6-31g(d).log.xz 012136078.td-b3lyp_6-31g+(d).inp 012136078.td-b3lyp_6-31g+(d).log.xz

012136078.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136078.td-b3lyp_6-31+g(d).gjf (generated)

012136078.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136078.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136078.mol 012136078.PUBCHEM 012136078.mol (via Jmol)
012136095.b3lyp_6-31g(d).inp

012136095.b3lyp_6-31g(d).qchem.inp (generated)

012136095.b3lyp_6-31g(d).gjf (generated)

012136095.b3lyp_6-31g(d).firefly.inp (generated)

012136095.b3lyp_6-31g(d).smash.inp (generated)

012136095.b3lyp_6-31g(d).nwchem.inp (generated) 012136095.b3lyp_6-31g(d).log.xz 012136095.td-b3lyp_6-31g+(d).inp 012136095.td-b3lyp_6-31g+(d).log.xz

012136095.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136095.td-b3lyp_6-31+g(d).gjf (generated)

012136095.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136095.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136095.mol 012136095.PUBCHEM 012136095.mol (via Jmol)
012136123.b3lyp_6-31g(d).inp

012136123.b3lyp_6-31g(d).qchem.inp (generated)

012136123.b3lyp_6-31g(d).gjf (generated)

012136123.b3lyp_6-31g(d).firefly.inp (generated)

012136123.b3lyp_6-31g(d).smash.inp (generated)

012136123.b3lyp_6-31g(d).nwchem.inp (generated) 012136123.b3lyp_6-31g(d).log.xz 012136123.mol 012136123.PUBCHEM 012136123.mol (via Jmol)
012136126.b3lyp_6-31g(d).inp

012136126.b3lyp_6-31g(d).qchem.inp (generated)

012136126.b3lyp_6-31g(d).gjf (generated)

012136126.b3lyp_6-31g(d).firefly.inp (generated)

012136126.b3lyp_6-31g(d).smash.inp (generated)

012136126.b3lyp_6-31g(d).nwchem.inp (generated) 012136126.b3lyp_6-31g(d).log.xz 012136126.td-b3lyp_6-31g+(d).inp 012136126.td-b3lyp_6-31g+(d).log.xz

012136126.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136126.td-b3lyp_6-31+g(d).gjf (generated)

012136126.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136126.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136126.mol 012136126.PUBCHEM 012136126.mol (via Jmol)
012136207.b3lyp_6-31g(d).inp

012136207.b3lyp_6-31g(d).qchem.inp (generated)

012136207.b3lyp_6-31g(d).gjf (generated)

012136207.b3lyp_6-31g(d).firefly.inp (generated)

012136207.b3lyp_6-31g(d).smash.inp (generated)

012136207.b3lyp_6-31g(d).nwchem.inp (generated) 012136207.b3lyp_6-31g(d).log.xz 012136207.td-b3lyp_6-31g+(d).inp 012136207.td-b3lyp_6-31g+(d).log.xz

012136207.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136207.td-b3lyp_6-31+g(d).gjf (generated)

012136207.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136207.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136207.mol 012136207.PUBCHEM 012136207.mol (via Jmol)
012136311.b3lyp_6-31g(d).inp

012136311.b3lyp_6-31g(d).qchem.inp (generated)

012136311.b3lyp_6-31g(d).gjf (generated)

012136311.b3lyp_6-31g(d).firefly.inp (generated)

012136311.b3lyp_6-31g(d).smash.inp (generated)

012136311.b3lyp_6-31g(d).nwchem.inp (generated) 012136311.b3lyp_6-31g(d).log.xz 012136311.td-b3lyp_6-31g+(d).inp 012136311.td-b3lyp_6-31g+(d).log.xz

012136311.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136311.td-b3lyp_6-31+g(d).gjf (generated)

012136311.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136311.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136311.mol 012136311.PUBCHEM 012136311.mol (via Jmol)
012136363.b3lyp_6-31g(d).inp

012136363.b3lyp_6-31g(d).qchem.inp (generated)

012136363.b3lyp_6-31g(d).gjf (generated)

012136363.b3lyp_6-31g(d).firefly.inp (generated)

012136363.b3lyp_6-31g(d).smash.inp (generated)

012136363.b3lyp_6-31g(d).nwchem.inp (generated) 012136363.b3lyp_6-31g(d).log.xz 012136363.td-b3lyp_6-31g+(d).inp 012136363.td-b3lyp_6-31g+(d).log.xz

012136363.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136363.td-b3lyp_6-31+g(d).gjf (generated)

012136363.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136363.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136363.mol 012136363.PUBCHEM 012136363.mol (via Jmol)
012136393.b3lyp_6-31g(d).inp

012136393.b3lyp_6-31g(d).qchem.inp (generated)

012136393.b3lyp_6-31g(d).gjf (generated)

012136393.b3lyp_6-31g(d).firefly.inp (generated)

012136393.b3lyp_6-31g(d).smash.inp (generated)

012136393.b3lyp_6-31g(d).nwchem.inp (generated) 012136393.b3lyp_6-31g(d).log.xz 012136393.td-b3lyp_6-31g+(d).inp 012136393.td-b3lyp_6-31g+(d).log.xz

012136393.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136393.td-b3lyp_6-31+g(d).gjf (generated)

012136393.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136393.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136393.mol 012136393.PUBCHEM 012136393.mol (via Jmol)
012136434.b3lyp_6-31g(d).inp

012136434.b3lyp_6-31g(d).qchem.inp (generated)

012136434.b3lyp_6-31g(d).gjf (generated)

012136434.b3lyp_6-31g(d).firefly.inp (generated)

012136434.b3lyp_6-31g(d).smash.inp (generated)

012136434.b3lyp_6-31g(d).nwchem.inp (generated) 012136434.b3lyp_6-31g(d).log.xz 012136434.td-b3lyp_6-31g+(d).inp 012136434.td-b3lyp_6-31g+(d).log.xz

012136434.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136434.td-b3lyp_6-31+g(d).gjf (generated)

012136434.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136434.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136434.mol 012136434.PUBCHEM 012136434.mol (via Jmol)
012136623.b3lyp_6-31g(d).inp

012136623.b3lyp_6-31g(d).qchem.inp (generated)

012136623.b3lyp_6-31g(d).gjf (generated)

012136623.b3lyp_6-31g(d).firefly.inp (generated)

012136623.b3lyp_6-31g(d).smash.inp (generated)

012136623.b3lyp_6-31g(d).nwchem.inp (generated) 012136623.b3lyp_6-31g(d).log.xz 012136623.td-b3lyp_6-31g+(d).inp 012136623.td-b3lyp_6-31g+(d).log.xz

012136623.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136623.td-b3lyp_6-31+g(d).gjf (generated)

012136623.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136623.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136623.mol 012136623.PUBCHEM 012136623.mol (via Jmol)
012136626.b3lyp_6-31g(d).inp

012136626.b3lyp_6-31g(d).qchem.inp (generated)

012136626.b3lyp_6-31g(d).gjf (generated)

012136626.b3lyp_6-31g(d).firefly.inp (generated)

012136626.b3lyp_6-31g(d).smash.inp (generated)

012136626.b3lyp_6-31g(d).nwchem.inp (generated) 012136626.b3lyp_6-31g(d).log.xz 012136626.td-b3lyp_6-31g+(d).inp 012136626.td-b3lyp_6-31g+(d).log.xz

012136626.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136626.td-b3lyp_6-31+g(d).gjf (generated)

012136626.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136626.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136626.mol 012136626.PUBCHEM 012136626.mol (via Jmol)
012136627.b3lyp_6-31g(d).inp

012136627.b3lyp_6-31g(d).qchem.inp (generated)

012136627.b3lyp_6-31g(d).gjf (generated)

012136627.b3lyp_6-31g(d).firefly.inp (generated)

012136627.b3lyp_6-31g(d).smash.inp (generated)

012136627.b3lyp_6-31g(d).nwchem.inp (generated) 012136627.b3lyp_6-31g(d).log.xz 012136627.td-b3lyp_6-31g+(d).inp 012136627.td-b3lyp_6-31g+(d).log.xz

012136627.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136627.td-b3lyp_6-31+g(d).gjf (generated)

012136627.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136627.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136627.mol 012136627.PUBCHEM 012136627.mol (via Jmol)
012136628.b3lyp_6-31g(d).inp

012136628.b3lyp_6-31g(d).qchem.inp (generated)

012136628.b3lyp_6-31g(d).gjf (generated)

012136628.b3lyp_6-31g(d).firefly.inp (generated)

012136628.b3lyp_6-31g(d).smash.inp (generated)

012136628.b3lyp_6-31g(d).nwchem.inp (generated) 012136628.b3lyp_6-31g(d).log.xz 012136628.td-b3lyp_6-31g+(d).inp 012136628.td-b3lyp_6-31g+(d).log.xz

012136628.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136628.td-b3lyp_6-31+g(d).gjf (generated)

012136628.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136628.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136628.mol 012136628.PUBCHEM 012136628.mol (via Jmol)
012136631.b3lyp_6-31g(d).inp

012136631.b3lyp_6-31g(d).qchem.inp (generated)

012136631.b3lyp_6-31g(d).gjf (generated)

012136631.b3lyp_6-31g(d).firefly.inp (generated)

012136631.b3lyp_6-31g(d).smash.inp (generated)

012136631.b3lyp_6-31g(d).nwchem.inp (generated) 012136631.b3lyp_6-31g(d).log.xz 012136631.td-b3lyp_6-31g+(d).inp 012136631.td-b3lyp_6-31g+(d).log.xz

012136631.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136631.td-b3lyp_6-31+g(d).gjf (generated)

012136631.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136631.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136631.mol 012136631.PUBCHEM 012136631.mol (via Jmol)
012136632.b3lyp_6-31g(d).inp

012136632.b3lyp_6-31g(d).qchem.inp (generated)

012136632.b3lyp_6-31g(d).gjf (generated)

012136632.b3lyp_6-31g(d).firefly.inp (generated)

012136632.b3lyp_6-31g(d).smash.inp (generated)

012136632.b3lyp_6-31g(d).nwchem.inp (generated) 012136632.b3lyp_6-31g(d).log.xz 012136632.td-b3lyp_6-31g+(d).inp 012136632.td-b3lyp_6-31g+(d).log.xz

012136632.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136632.td-b3lyp_6-31+g(d).gjf (generated)

012136632.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136632.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136632.mol 012136632.PUBCHEM 012136632.mol (via Jmol)
012136634.b3lyp_6-31g(d).inp

012136634.b3lyp_6-31g(d).qchem.inp (generated)

012136634.b3lyp_6-31g(d).gjf (generated)

012136634.b3lyp_6-31g(d).firefly.inp (generated)

012136634.b3lyp_6-31g(d).smash.inp (generated)

012136634.b3lyp_6-31g(d).nwchem.inp (generated) 012136634.b3lyp_6-31g(d).log.xz 012136634.td-b3lyp_6-31g+(d).inp 012136634.td-b3lyp_6-31g+(d).log.xz

012136634.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136634.td-b3lyp_6-31+g(d).gjf (generated)

012136634.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136634.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136634.mol 012136634.PUBCHEM 012136634.mol (via Jmol)
012136635.b3lyp_6-31g(d).inp

012136635.b3lyp_6-31g(d).qchem.inp (generated)

012136635.b3lyp_6-31g(d).gjf (generated)

012136635.b3lyp_6-31g(d).firefly.inp (generated)

012136635.b3lyp_6-31g(d).smash.inp (generated)

012136635.b3lyp_6-31g(d).nwchem.inp (generated) 012136635.b3lyp_6-31g(d).log.xz 012136635.td-b3lyp_6-31g+(d).inp 012136635.td-b3lyp_6-31g+(d).log.xz

012136635.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136635.td-b3lyp_6-31+g(d).gjf (generated)

012136635.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136635.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136635.mol 012136635.PUBCHEM 012136635.mol (via Jmol)
012136636.b3lyp_6-31g(d).inp

012136636.b3lyp_6-31g(d).qchem.inp (generated)

012136636.b3lyp_6-31g(d).gjf (generated)

012136636.b3lyp_6-31g(d).firefly.inp (generated)

012136636.b3lyp_6-31g(d).smash.inp (generated)

012136636.b3lyp_6-31g(d).nwchem.inp (generated) 012136636.b3lyp_6-31g(d).log.xz 012136636.td-b3lyp_6-31g+(d).inp 012136636.td-b3lyp_6-31g+(d).log.xz

012136636.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136636.td-b3lyp_6-31+g(d).gjf (generated)

012136636.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136636.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136636.mol 012136636.PUBCHEM 012136636.mol (via Jmol)
012136637.b3lyp_6-31g(d).inp

012136637.b3lyp_6-31g(d).qchem.inp (generated)

012136637.b3lyp_6-31g(d).gjf (generated)

012136637.b3lyp_6-31g(d).firefly.inp (generated)

012136637.b3lyp_6-31g(d).smash.inp (generated)

012136637.b3lyp_6-31g(d).nwchem.inp (generated) 012136637.b3lyp_6-31g(d).log.xz 012136637.td-b3lyp_6-31g+(d).inp 012136637.td-b3lyp_6-31g+(d).log.xz

012136637.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136637.td-b3lyp_6-31+g(d).gjf (generated)

012136637.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136637.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136637.mol 012136637.PUBCHEM 012136637.mol (via Jmol)
012136639.b3lyp_6-31g(d).inp

012136639.b3lyp_6-31g(d).qchem.inp (generated)

012136639.b3lyp_6-31g(d).gjf (generated)

012136639.b3lyp_6-31g(d).firefly.inp (generated)

012136639.b3lyp_6-31g(d).smash.inp (generated)

012136639.b3lyp_6-31g(d).nwchem.inp (generated) 012136639.b3lyp_6-31g(d).log.xz 012136639.td-b3lyp_6-31g+(d).inp 012136639.td-b3lyp_6-31g+(d).log.xz

012136639.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136639.td-b3lyp_6-31+g(d).gjf (generated)

012136639.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136639.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136639.mol 012136639.PUBCHEM 012136639.mol (via Jmol)
012136640.b3lyp_6-31g(d).inp

012136640.b3lyp_6-31g(d).qchem.inp (generated)

012136640.b3lyp_6-31g(d).gjf (generated)

012136640.b3lyp_6-31g(d).firefly.inp (generated)

012136640.b3lyp_6-31g(d).smash.inp (generated)

012136640.b3lyp_6-31g(d).nwchem.inp (generated) 012136640.b3lyp_6-31g(d).log.xz 012136640.td-b3lyp_6-31g+(d).inp 012136640.td-b3lyp_6-31g+(d).log.xz

012136640.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136640.td-b3lyp_6-31+g(d).gjf (generated)

012136640.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136640.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136640.mol 012136640.PUBCHEM 012136640.mol (via Jmol)
012136641.b3lyp_6-31g(d).inp

012136641.b3lyp_6-31g(d).qchem.inp (generated)

012136641.b3lyp_6-31g(d).gjf (generated)

012136641.b3lyp_6-31g(d).firefly.inp (generated)

012136641.b3lyp_6-31g(d).smash.inp (generated)

012136641.b3lyp_6-31g(d).nwchem.inp (generated) 012136641.b3lyp_6-31g(d).log.xz 012136641.td-b3lyp_6-31g+(d).inp 012136641.td-b3lyp_6-31g+(d).log.xz

012136641.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136641.td-b3lyp_6-31+g(d).gjf (generated)

012136641.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136641.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136641.mol 012136641.PUBCHEM 012136641.mol (via Jmol)
012136642.b3lyp_6-31g(d).inp

012136642.b3lyp_6-31g(d).qchem.inp (generated)

012136642.b3lyp_6-31g(d).gjf (generated)

012136642.b3lyp_6-31g(d).firefly.inp (generated)

012136642.b3lyp_6-31g(d).smash.inp (generated)

012136642.b3lyp_6-31g(d).nwchem.inp (generated) 012136642.b3lyp_6-31g(d).log.xz 012136642.td-b3lyp_6-31g+(d).inp 012136642.td-b3lyp_6-31g+(d).log.xz

012136642.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136642.td-b3lyp_6-31+g(d).gjf (generated)

012136642.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136642.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136642.mol 012136642.PUBCHEM 012136642.mol (via Jmol)
012136643.b3lyp_6-31g(d).inp

012136643.b3lyp_6-31g(d).qchem.inp (generated)

012136643.b3lyp_6-31g(d).gjf (generated)

012136643.b3lyp_6-31g(d).firefly.inp (generated)

012136643.b3lyp_6-31g(d).smash.inp (generated)

012136643.b3lyp_6-31g(d).nwchem.inp (generated) 012136643.b3lyp_6-31g(d).log.xz 012136643.td-b3lyp_6-31g+(d).inp 012136643.td-b3lyp_6-31g+(d).log.xz

012136643.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136643.td-b3lyp_6-31+g(d).gjf (generated)

012136643.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136643.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136643.mol 012136643.PUBCHEM 012136643.mol (via Jmol)
012136646.b3lyp_6-31g(d).inp

012136646.b3lyp_6-31g(d).qchem.inp (generated)

012136646.b3lyp_6-31g(d).gjf (generated)

012136646.b3lyp_6-31g(d).firefly.inp (generated)

012136646.b3lyp_6-31g(d).smash.inp (generated)

012136646.b3lyp_6-31g(d).nwchem.inp (generated) 012136646.b3lyp_6-31g(d).log.xz 012136646.mol 012136646.PUBCHEM 012136646.mol (via Jmol)
012136661.b3lyp_6-31g(d).inp

012136661.b3lyp_6-31g(d).qchem.inp (generated)

012136661.b3lyp_6-31g(d).gjf (generated)

012136661.b3lyp_6-31g(d).firefly.inp (generated)

012136661.b3lyp_6-31g(d).smash.inp (generated)

012136661.b3lyp_6-31g(d).nwchem.inp (generated) 012136661.b3lyp_6-31g(d).log.xz 012136661.td-b3lyp_6-31g+(d).inp 012136661.td-b3lyp_6-31g+(d).log.xz

012136661.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136661.td-b3lyp_6-31+g(d).gjf (generated)

012136661.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136661.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136661.mol 012136661.PUBCHEM 012136661.mol (via Jmol)
012136769.b3lyp_6-31g(d).inp

012136769.b3lyp_6-31g(d).qchem.inp (generated)

012136769.b3lyp_6-31g(d).gjf (generated)

012136769.b3lyp_6-31g(d).firefly.inp (generated)

012136769.b3lyp_6-31g(d).smash.inp (generated)

012136769.b3lyp_6-31g(d).nwchem.inp (generated) 012136769.b3lyp_6-31g(d).log.xz 012136769.td-b3lyp_6-31g+(d).inp 012136769.td-b3lyp_6-31g+(d).log.xz

012136769.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136769.td-b3lyp_6-31+g(d).gjf (generated)

012136769.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136769.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136769.mol 012136769.PUBCHEM 012136769.mol (via Jmol)
012136775.b3lyp_6-31g(d).inp

012136775.b3lyp_6-31g(d).qchem.inp (generated)

012136775.b3lyp_6-31g(d).gjf (generated)

012136775.b3lyp_6-31g(d).firefly.inp (generated)

012136775.b3lyp_6-31g(d).smash.inp (generated)

012136775.b3lyp_6-31g(d).nwchem.inp (generated) 012136775.b3lyp_6-31g(d).log.xz 012136775.td-b3lyp_6-31g+(d).inp 012136775.td-b3lyp_6-31g+(d).log.xz

012136775.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136775.td-b3lyp_6-31+g(d).gjf (generated)

012136775.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136775.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136775.mol 012136775.PUBCHEM 012136775.mol (via Jmol)
012136808.b3lyp_6-31g(d).inp

012136808.b3lyp_6-31g(d).qchem.inp (generated)

012136808.b3lyp_6-31g(d).gjf (generated)

012136808.b3lyp_6-31g(d).firefly.inp (generated)

012136808.b3lyp_6-31g(d).smash.inp (generated)

012136808.b3lyp_6-31g(d).nwchem.inp (generated) 012136808.b3lyp_6-31g(d).log.xz 012136808.td-b3lyp_6-31g+(d).inp 012136808.td-b3lyp_6-31g+(d).log.xz

012136808.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136808.td-b3lyp_6-31+g(d).gjf (generated)

012136808.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136808.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136808.mol 012136808.PUBCHEM 012136808.mol (via Jmol)
012136844.b3lyp_6-31g(d).inp

012136844.b3lyp_6-31g(d).qchem.inp (generated)

012136844.b3lyp_6-31g(d).gjf (generated)

012136844.b3lyp_6-31g(d).firefly.inp (generated)

012136844.b3lyp_6-31g(d).smash.inp (generated)

012136844.b3lyp_6-31g(d).nwchem.inp (generated) 012136844.b3lyp_6-31g(d).log.xz 012136844.td-b3lyp_6-31g+(d).inp 012136844.td-b3lyp_6-31g+(d).log.xz

012136844.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136844.td-b3lyp_6-31+g(d).gjf (generated)

012136844.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136844.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136844.mol 012136844.PUBCHEM 012136844.mol (via Jmol)
012136851.b3lyp_6-31g(d).inp

012136851.b3lyp_6-31g(d).qchem.inp (generated)

012136851.b3lyp_6-31g(d).gjf (generated)

012136851.b3lyp_6-31g(d).firefly.inp (generated)

012136851.b3lyp_6-31g(d).smash.inp (generated)

012136851.b3lyp_6-31g(d).nwchem.inp (generated) 012136851.b3lyp_6-31g(d).log.xz 012136851.td-b3lyp_6-31g+(d).inp 012136851.td-b3lyp_6-31g+(d).log.xz

012136851.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136851.td-b3lyp_6-31+g(d).gjf (generated)

012136851.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136851.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136851.mol 012136851.PUBCHEM 012136851.mol (via Jmol)
012136852.b3lyp_6-31g(d).inp

012136852.b3lyp_6-31g(d).qchem.inp (generated)

012136852.b3lyp_6-31g(d).gjf (generated)

012136852.b3lyp_6-31g(d).firefly.inp (generated)

012136852.b3lyp_6-31g(d).smash.inp (generated)

012136852.b3lyp_6-31g(d).nwchem.inp (generated) 012136852.b3lyp_6-31g(d).log.xz 012136852.td-b3lyp_6-31g+(d).inp 012136852.td-b3lyp_6-31g+(d).log.xz

012136852.td-b3lyp_6-31+g(d).qchem.inp (generated)

012136852.td-b3lyp_6-31+g(d).gjf (generated)

012136852.td-b3lyp_6-31+g(d).firefly.inp (generated)

012136852.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012136852.mol 012136852.PUBCHEM 012136852.mol (via Jmol)
012136990.b3lyp_6-31g(d).inp

012136990.b3lyp_6-31g(d).qchem.inp (generated)

012136990.b3lyp_6-31g(d).gjf (generated)

012136990.b3lyp_6-31g(d).firefly.inp (generated)

012136990.b3lyp_6-31g(d).smash.inp (generated)

012136990.b3lyp_6-31g(d).nwchem.inp (generated) 012136990.b3lyp_6-31g(d).log.xz 012136990.mol 012136990.PUBCHEM 012136990.mol (via Jmol)
012136996.b3lyp_6-31g(d).inp

012136996.b3lyp_6-31g(d).qchem.inp (generated)

012136996.b3lyp_6-31g(d).gjf (generated)

012136996.b3lyp_6-31g(d).firefly.inp (generated)

012136996.b3lyp_6-31g(d).smash.inp (generated)

012136996.b3lyp_6-31g(d).nwchem.inp (generated) 012136996.b3lyp_6-31g(d).log.xz 012136996.mol 012136996.PUBCHEM 012136996.mol (via Jmol)
012137088.b3lyp_6-31g(d).inp

012137088.b3lyp_6-31g(d).qchem.inp (generated)

012137088.b3lyp_6-31g(d).gjf (generated)

012137088.b3lyp_6-31g(d).firefly.inp (generated)

012137088.b3lyp_6-31g(d).smash.inp (generated)

012137088.b3lyp_6-31g(d).nwchem.inp (generated) 012137088.b3lyp_6-31g(d).log.xz 012137088.td-b3lyp_6-31g+(d).inp 012137088.td-b3lyp_6-31g+(d).log.xz

012137088.td-b3lyp_6-31+g(d).qchem.inp (generated)

012137088.td-b3lyp_6-31+g(d).gjf (generated)

012137088.td-b3lyp_6-31+g(d).firefly.inp (generated)

012137088.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012137088.mol 012137088.PUBCHEM 012137088.mol (via Jmol)
012137093.b3lyp_6-31g(d).inp

012137093.b3lyp_6-31g(d).qchem.inp (generated)

012137093.b3lyp_6-31g(d).gjf (generated)

012137093.b3lyp_6-31g(d).firefly.inp (generated)

012137093.b3lyp_6-31g(d).smash.inp (generated)

012137093.b3lyp_6-31g(d).nwchem.inp (generated) 012137093.b3lyp_6-31g(d).log.xz 012137093.td-b3lyp_6-31g+(d).inp 012137093.td-b3lyp_6-31g+(d).log.xz

012137093.td-b3lyp_6-31+g(d).qchem.inp (generated)

012137093.td-b3lyp_6-31+g(d).gjf (generated)

012137093.td-b3lyp_6-31+g(d).firefly.inp (generated)

012137093.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012137093.mol 012137093.PUBCHEM 012137093.mol (via Jmol)
012137096.b3lyp_6-31g(d).inp

012137096.b3lyp_6-31g(d).qchem.inp (generated)

012137096.b3lyp_6-31g(d).gjf (generated)

012137096.b3lyp_6-31g(d).firefly.inp (generated)

012137096.b3lyp_6-31g(d).smash.inp (generated)

012137096.b3lyp_6-31g(d).nwchem.inp (generated) 012137096.b3lyp_6-31g(d).log.xz 012137096.td-b3lyp_6-31g+(d).inp 012137096.td-b3lyp_6-31g+(d).log.xz

012137096.td-b3lyp_6-31+g(d).qchem.inp (generated)

012137096.td-b3lyp_6-31+g(d).gjf (generated)

012137096.td-b3lyp_6-31+g(d).firefly.inp (generated)

012137096.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012137096.mol 012137096.PUBCHEM 012137096.mol (via Jmol)
012137098.b3lyp_6-31g(d).inp

012137098.b3lyp_6-31g(d).qchem.inp (generated)

012137098.b3lyp_6-31g(d).gjf (generated)

012137098.b3lyp_6-31g(d).firefly.inp (generated)

012137098.b3lyp_6-31g(d).smash.inp (generated)

012137098.b3lyp_6-31g(d).nwchem.inp (generated) 012137098.b3lyp_6-31g(d).log.xz 012137098.td-b3lyp_6-31g+(d).inp 012137098.td-b3lyp_6-31g+(d).log.xz

012137098.td-b3lyp_6-31+g(d).qchem.inp (generated)

012137098.td-b3lyp_6-31+g(d).gjf (generated)

012137098.td-b3lyp_6-31+g(d).firefly.inp (generated)

012137098.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012137098.mol 012137098.PUBCHEM 012137098.mol (via Jmol)
012137118.b3lyp_6-31g(d).inp

012137118.b3lyp_6-31g(d).qchem.inp (generated)

012137118.b3lyp_6-31g(d).gjf (generated)

012137118.b3lyp_6-31g(d).firefly.inp (generated)

012137118.b3lyp_6-31g(d).smash.inp (generated)

012137118.b3lyp_6-31g(d).nwchem.inp (generated) 012137118.b3lyp_6-31g(d).log.xz 012137118.td-b3lyp_6-31g+(d).inp 012137118.td-b3lyp_6-31g+(d).log.xz

012137118.td-b3lyp_6-31+g(d).qchem.inp (generated)

012137118.td-b3lyp_6-31+g(d).gjf (generated)

012137118.td-b3lyp_6-31+g(d).firefly.inp (generated)

012137118.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012137118.mol 012137118.PUBCHEM 012137118.mol (via Jmol)
012137128.b3lyp_6-31g(d).inp

012137128.b3lyp_6-31g(d).qchem.inp (generated)

012137128.b3lyp_6-31g(d).gjf (generated)

012137128.b3lyp_6-31g(d).firefly.inp (generated)

012137128.b3lyp_6-31g(d).smash.inp (generated)

012137128.b3lyp_6-31g(d).nwchem.inp (generated) 012137128.b3lyp_6-31g(d).log.xz 012137128.td-b3lyp_6-31g+(d).inp 012137128.td-b3lyp_6-31g+(d).log.xz

012137128.td-b3lyp_6-31+g(d).qchem.inp (generated)

012137128.td-b3lyp_6-31+g(d).gjf (generated)

012137128.td-b3lyp_6-31+g(d).firefly.inp (generated)

012137128.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012137128.mol 012137128.PUBCHEM 012137128.mol (via Jmol)
012137236.b3lyp_6-31g(d).inp

012137236.b3lyp_6-31g(d).qchem.inp (generated)

012137236.b3lyp_6-31g(d).gjf (generated)

012137236.b3lyp_6-31g(d).firefly.inp (generated)

012137236.b3lyp_6-31g(d).smash.inp (generated)

012137236.b3lyp_6-31g(d).nwchem.inp (generated) 012137236.b3lyp_6-31g(d).log.xz 012137236.td-b3lyp_6-31g+(d).inp 012137236.td-b3lyp_6-31g+(d).log.xz

012137236.td-b3lyp_6-31+g(d).qchem.inp (generated)

012137236.td-b3lyp_6-31+g(d).gjf (generated)

012137236.td-b3lyp_6-31+g(d).firefly.inp (generated)

012137236.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012137236.mol 012137236.PUBCHEM 012137236.mol (via Jmol)
012137383.b3lyp_6-31g(d).inp

012137383.b3lyp_6-31g(d).qchem.inp (generated)

012137383.b3lyp_6-31g(d).gjf (generated)

012137383.b3lyp_6-31g(d).firefly.inp (generated)

012137383.b3lyp_6-31g(d).smash.inp (generated)

012137383.b3lyp_6-31g(d).nwchem.inp (generated) 012137383.b3lyp_6-31g(d).log.xz 012137383.td-b3lyp_6-31g+(d).inp 012137383.td-b3lyp_6-31g+(d).log.xz

012137383.td-b3lyp_6-31+g(d).qchem.inp (generated)

012137383.td-b3lyp_6-31+g(d).gjf (generated)

012137383.td-b3lyp_6-31+g(d).firefly.inp (generated)

012137383.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012137383.mol 012137383.PUBCHEM 012137383.mol (via Jmol)
012137384.b3lyp_6-31g(d).inp

012137384.b3lyp_6-31g(d).qchem.inp (generated)

012137384.b3lyp_6-31g(d).gjf (generated)

012137384.b3lyp_6-31g(d).firefly.inp (generated)

012137384.b3lyp_6-31g(d).smash.inp (generated)

012137384.b3lyp_6-31g(d).nwchem.inp (generated) 012137384.b3lyp_6-31g(d).log.xz 012137384.td-b3lyp_6-31g+(d).inp 012137384.td-b3lyp_6-31g+(d).log.xz

012137384.td-b3lyp_6-31+g(d).qchem.inp (generated)

012137384.td-b3lyp_6-31+g(d).gjf (generated)

012137384.td-b3lyp_6-31+g(d).firefly.inp (generated)

012137384.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012137384.mol 012137384.PUBCHEM 012137384.mol (via Jmol)
012137485.b3lyp_6-31g(d).inp

012137485.b3lyp_6-31g(d).qchem.inp (generated)

012137485.b3lyp_6-31g(d).gjf (generated)

012137485.b3lyp_6-31g(d).firefly.inp (generated)

012137485.b3lyp_6-31g(d).smash.inp (generated)

012137485.b3lyp_6-31g(d).nwchem.inp (generated) 012137485.b3lyp_6-31g(d).log.xz 012137485.td-b3lyp_6-31g+(d).inp 012137485.td-b3lyp_6-31g+(d).log.xz

012137485.td-b3lyp_6-31+g(d).qchem.inp (generated)

012137485.td-b3lyp_6-31+g(d).gjf (generated)

012137485.td-b3lyp_6-31+g(d).firefly.inp (generated)

012137485.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012137485.mol 012137485.PUBCHEM 012137485.mol (via Jmol)
012137486.b3lyp_6-31g(d).inp

012137486.b3lyp_6-31g(d).qchem.inp (generated)

012137486.b3lyp_6-31g(d).gjf (generated)

012137486.b3lyp_6-31g(d).firefly.inp (generated)

012137486.b3lyp_6-31g(d).smash.inp (generated)

012137486.b3lyp_6-31g(d).nwchem.inp (generated) 012137486.b3lyp_6-31g(d).log.xz 012137486.td-b3lyp_6-31g+(d).inp 012137486.td-b3lyp_6-31g+(d).log.xz

012137486.td-b3lyp_6-31+g(d).qchem.inp (generated)

012137486.td-b3lyp_6-31+g(d).gjf (generated)

012137486.td-b3lyp_6-31+g(d).firefly.inp (generated)

012137486.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012137486.mol 012137486.PUBCHEM 012137486.mol (via Jmol)
012137487.b3lyp_6-31g(d).inp

012137487.b3lyp_6-31g(d).qchem.inp (generated)

012137487.b3lyp_6-31g(d).gjf (generated)

012137487.b3lyp_6-31g(d).firefly.inp (generated)

012137487.b3lyp_6-31g(d).smash.inp (generated)

012137487.b3lyp_6-31g(d).nwchem.inp (generated) 012137487.b3lyp_6-31g(d).log.xz 012137487.td-b3lyp_6-31g+(d).inp 012137487.td-b3lyp_6-31g+(d).log.xz

012137487.td-b3lyp_6-31+g(d).qchem.inp (generated)

012137487.td-b3lyp_6-31+g(d).gjf (generated)

012137487.td-b3lyp_6-31+g(d).firefly.inp (generated)

012137487.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012137487.mol 012137487.PUBCHEM 012137487.mol (via Jmol)
012137489.b3lyp_6-31g(d).inp

012137489.b3lyp_6-31g(d).qchem.inp (generated)

012137489.b3lyp_6-31g(d).gjf (generated)

012137489.b3lyp_6-31g(d).firefly.inp (generated)

012137489.b3lyp_6-31g(d).smash.inp (generated)

012137489.b3lyp_6-31g(d).nwchem.inp (generated) 012137489.b3lyp_6-31g(d).log.xz 012137489.td-b3lyp_6-31g+(d).inp 012137489.td-b3lyp_6-31g+(d).log.xz

012137489.td-b3lyp_6-31+g(d).qchem.inp (generated)

012137489.td-b3lyp_6-31+g(d).gjf (generated)

012137489.td-b3lyp_6-31+g(d).firefly.inp (generated)

012137489.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012137489.mol 012137489.PUBCHEM 012137489.mol (via Jmol)
012137570.b3lyp_6-31g(d).inp

012137570.b3lyp_6-31g(d).qchem.inp (generated)

012137570.b3lyp_6-31g(d).gjf (generated)

012137570.b3lyp_6-31g(d).firefly.inp (generated)

012137570.b3lyp_6-31g(d).smash.inp (generated)

012137570.b3lyp_6-31g(d).nwchem.inp (generated) 012137570.b3lyp_6-31g(d).log.xz 012137570.mol 012137570.PUBCHEM 012137570.mol (via Jmol)
012137574.b3lyp_6-31g(d).inp

012137574.b3lyp_6-31g(d).qchem.inp (generated)

012137574.b3lyp_6-31g(d).gjf (generated)

012137574.b3lyp_6-31g(d).firefly.inp (generated)

012137574.b3lyp_6-31g(d).smash.inp (generated)

012137574.b3lyp_6-31g(d).nwchem.inp (generated) 012137574.b3lyp_6-31g(d).log.xz 012137574.td-b3lyp_6-31g+(d).inp 012137574.td-b3lyp_6-31g+(d).log.xz

012137574.td-b3lyp_6-31+g(d).qchem.inp (generated)

012137574.td-b3lyp_6-31+g(d).gjf (generated)

012137574.td-b3lyp_6-31+g(d).firefly.inp (generated)

012137574.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012137574.mol 012137574.PUBCHEM 012137574.mol (via Jmol)
012137593.b3lyp_6-31g(d).inp

012137593.b3lyp_6-31g(d).qchem.inp (generated)

012137593.b3lyp_6-31g(d).gjf (generated)

012137593.b3lyp_6-31g(d).firefly.inp (generated)

012137593.b3lyp_6-31g(d).smash.inp (generated)

012137593.b3lyp_6-31g(d).nwchem.inp (generated) 012137593.b3lyp_6-31g(d).log.xz 012137593.td-b3lyp_6-31g+(d).inp 012137593.td-b3lyp_6-31g+(d).log.xz

012137593.td-b3lyp_6-31+g(d).qchem.inp (generated)

012137593.td-b3lyp_6-31+g(d).gjf (generated)

012137593.td-b3lyp_6-31+g(d).firefly.inp (generated)

012137593.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012137593.mol 012137593.PUBCHEM 012137593.mol (via Jmol)
012137597.b3lyp_6-31g(d).inp

012137597.b3lyp_6-31g(d).qchem.inp (generated)

012137597.b3lyp_6-31g(d).gjf (generated)

012137