Index of

Last updated : Thu Aug 17 01:52:36 JST 2017
Total : 88 (71) in this page
030450116.b3lyp_6-31g(d).inp

030450116.b3lyp_6-31g(d).qchem.inp (generated)

030450116.b3lyp_6-31g(d).gjf (generated)

030450116.b3lyp_6-31g(d).firefly.inp (generated)

030450116.b3lyp_6-31g(d).smash.inp (generated)

030450116.b3lyp_6-31g(d).nwchem.inp (generated) 030450116.b3lyp_6-31g(d).log.xz 030450116.td-b3lyp_6-31g+(d).inp 030450116.td-b3lyp_6-31g+(d).log.xz

030450116.td-b3lyp_6-31+g(d).qchem.inp (generated)

030450116.td-b3lyp_6-31+g(d).gjf (generated)

030450116.td-b3lyp_6-31+g(d).firefly.inp (generated)

030450116.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030450116.mol 030450116.PUBCHEM 030450116.mol (via Jmol)
030450117.b3lyp_6-31g(d).inp

030450117.b3lyp_6-31g(d).qchem.inp (generated)

030450117.b3lyp_6-31g(d).gjf (generated)

030450117.b3lyp_6-31g(d).firefly.inp (generated)

030450117.b3lyp_6-31g(d).smash.inp (generated)

030450117.b3lyp_6-31g(d).nwchem.inp (generated) 030450117.b3lyp_6-31g(d).log.xz 030450117.td-b3lyp_6-31g+(d).inp 030450117.td-b3lyp_6-31g+(d).log.xz

030450117.td-b3lyp_6-31+g(d).qchem.inp (generated)

030450117.td-b3lyp_6-31+g(d).gjf (generated)

030450117.td-b3lyp_6-31+g(d).firefly.inp (generated)

030450117.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030450117.mol 030450117.PUBCHEM 030450117.mol (via Jmol)
030450347.b3lyp_6-31g(d).inp

030450347.b3lyp_6-31g(d).qchem.inp (generated)

030450347.b3lyp_6-31g(d).gjf (generated)

030450347.b3lyp_6-31g(d).firefly.inp (generated)

030450347.b3lyp_6-31g(d).smash.inp (generated)

030450347.b3lyp_6-31g(d).nwchem.inp (generated) 030450347.b3lyp_6-31g(d).log.xz 030450347.td-b3lyp_6-31g+(d).inp 030450347.td-b3lyp_6-31g+(d).log.xz

030450347.td-b3lyp_6-31+g(d).qchem.inp (generated)

030450347.td-b3lyp_6-31+g(d).gjf (generated)

030450347.td-b3lyp_6-31+g(d).firefly.inp (generated)

030450347.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030450347.mol 030450347.PUBCHEM 030450347.mol (via Jmol)
030450502.b3lyp_6-31g(d).inp

030450502.b3lyp_6-31g(d).qchem.inp (generated)

030450502.b3lyp_6-31g(d).gjf (generated)

030450502.b3lyp_6-31g(d).firefly.inp (generated)

030450502.b3lyp_6-31g(d).smash.inp (generated)

030450502.b3lyp_6-31g(d).nwchem.inp (generated) 030450502.b3lyp_6-31g(d).log.xz 030450502.td-b3lyp_6-31g+(d).inp 030450502.td-b3lyp_6-31g+(d).log.xz

030450502.td-b3lyp_6-31+g(d).qchem.inp (generated)

030450502.td-b3lyp_6-31+g(d).gjf (generated)

030450502.td-b3lyp_6-31+g(d).firefly.inp (generated)

030450502.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030450502.mol 030450502.PUBCHEM 030450502.mol (via Jmol)
030451892.b3lyp_6-31g(d).inp

030451892.b3lyp_6-31g(d).qchem.inp (generated)

030451892.b3lyp_6-31g(d).gjf (generated)

030451892.b3lyp_6-31g(d).firefly.inp (generated)

030451892.b3lyp_6-31g(d).smash.inp (generated)

030451892.b3lyp_6-31g(d).nwchem.inp (generated) 030451892.b3lyp_6-31g(d).log.xz 030451892.td-b3lyp_6-31g+(d).inp 030451892.td-b3lyp_6-31g+(d).log.xz

030451892.td-b3lyp_6-31+g(d).qchem.inp (generated)

030451892.td-b3lyp_6-31+g(d).gjf (generated)

030451892.td-b3lyp_6-31+g(d).firefly.inp (generated)

030451892.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030451892.mol 030451892.PUBCHEM 030451892.mol (via Jmol)
030451898.b3lyp_6-31g(d).inp

030451898.b3lyp_6-31g(d).qchem.inp (generated)

030451898.b3lyp_6-31g(d).gjf (generated)

030451898.b3lyp_6-31g(d).firefly.inp (generated)

030451898.b3lyp_6-31g(d).smash.inp (generated)

030451898.b3lyp_6-31g(d).nwchem.inp (generated) 030451898.b3lyp_6-31g(d).log.xz 030451898.td-b3lyp_6-31g+(d).inp 030451898.td-b3lyp_6-31g+(d).log.xz

030451898.td-b3lyp_6-31+g(d).qchem.inp (generated)

030451898.td-b3lyp_6-31+g(d).gjf (generated)

030451898.td-b3lyp_6-31+g(d).firefly.inp (generated)

030451898.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030451898.mol 030451898.PUBCHEM 030451898.mol (via Jmol)
030451902.b3lyp_6-31g(d).inp

030451902.b3lyp_6-31g(d).qchem.inp (generated)

030451902.b3lyp_6-31g(d).gjf (generated)

030451902.b3lyp_6-31g(d).firefly.inp (generated)

030451902.b3lyp_6-31g(d).smash.inp (generated)

030451902.b3lyp_6-31g(d).nwchem.inp (generated) 030451902.b3lyp_6-31g(d).log.xz 030451902.td-b3lyp_6-31g+(d).inp 030451902.td-b3lyp_6-31g+(d).log.xz

030451902.td-b3lyp_6-31+g(d).qchem.inp (generated)

030451902.td-b3lyp_6-31+g(d).gjf (generated)

030451902.td-b3lyp_6-31+g(d).firefly.inp (generated)

030451902.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030451902.mol 030451902.PUBCHEM 030451902.mol (via Jmol)
030452271.b3lyp_6-31g(d).inp

030452271.b3lyp_6-31g(d).qchem.inp (generated)

030452271.b3lyp_6-31g(d).gjf (generated)

030452271.b3lyp_6-31g(d).firefly.inp (generated)

030452271.b3lyp_6-31g(d).smash.inp (generated)

030452271.b3lyp_6-31g(d).nwchem.inp (generated) 030452271.b3lyp_6-31g(d).log.xz 030452271.td-b3lyp_6-31g+(d).inp 030452271.td-b3lyp_6-31g+(d).log.xz

030452271.td-b3lyp_6-31+g(d).qchem.inp (generated)

030452271.td-b3lyp_6-31+g(d).gjf (generated)

030452271.td-b3lyp_6-31+g(d).firefly.inp (generated)

030452271.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030452271.mol 030452271.PUBCHEM 030452271.mol (via Jmol)
030452294.b3lyp_6-31g(d).inp

030452294.b3lyp_6-31g(d).qchem.inp (generated)

030452294.b3lyp_6-31g(d).gjf (generated)

030452294.b3lyp_6-31g(d).firefly.inp (generated)

030452294.b3lyp_6-31g(d).smash.inp (generated)

030452294.b3lyp_6-31g(d).nwchem.inp (generated) 030452294.b3lyp_6-31g(d).log.xz 030452294.mol 030452294.PUBCHEM 030452294.mol (via Jmol)
030452573.b3lyp_6-31g(d).inp

030452573.b3lyp_6-31g(d).qchem.inp (generated)

030452573.b3lyp_6-31g(d).gjf (generated)

030452573.b3lyp_6-31g(d).firefly.inp (generated)

030452573.b3lyp_6-31g(d).smash.inp (generated)

030452573.b3lyp_6-31g(d).nwchem.inp (generated) 030452573.b3lyp_6-31g(d).log.xz 030452573.td-b3lyp_6-31g+(d).inp 030452573.td-b3lyp_6-31g+(d).log.xz

030452573.td-b3lyp_6-31+g(d).qchem.inp (generated)

030452573.td-b3lyp_6-31+g(d).gjf (generated)

030452573.td-b3lyp_6-31+g(d).firefly.inp (generated)

030452573.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030452573.mol 030452573.PUBCHEM 030452573.mol (via Jmol)
030452954.b3lyp_6-31g(d).inp

030452954.b3lyp_6-31g(d).qchem.inp (generated)

030452954.b3lyp_6-31g(d).gjf (generated)

030452954.b3lyp_6-31g(d).firefly.inp (generated)

030452954.b3lyp_6-31g(d).smash.inp (generated)

030452954.b3lyp_6-31g(d).nwchem.inp (generated) 030452954.b3lyp_6-31g(d).log.xz 030452954.td-b3lyp_6-31g+(d).inp 030452954.td-b3lyp_6-31g+(d).log.xz

030452954.td-b3lyp_6-31+g(d).qchem.inp (generated)

030452954.td-b3lyp_6-31+g(d).gjf (generated)

030452954.td-b3lyp_6-31+g(d).firefly.inp (generated)

030452954.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030452954.mol 030452954.PUBCHEM 030452954.mol (via Jmol)
030453325.b3lyp_6-31g(d).inp

030453325.b3lyp_6-31g(d).qchem.inp (generated)

030453325.b3lyp_6-31g(d).gjf (generated)

030453325.b3lyp_6-31g(d).firefly.inp (generated)

030453325.b3lyp_6-31g(d).smash.inp (generated)

030453325.b3lyp_6-31g(d).nwchem.inp (generated) 030453325.b3lyp_6-31g(d).log.xz 030453325.mol 030453325.PUBCHEM 030453325.mol (via Jmol)
030462801.b3lyp_6-31g(d).inp

030462801.b3lyp_6-31g(d).qchem.inp (generated)

030462801.b3lyp_6-31g(d).gjf (generated)

030462801.b3lyp_6-31g(d).firefly.inp (generated)

030462801.b3lyp_6-31g(d).smash.inp (generated)

030462801.b3lyp_6-31g(d).nwchem.inp (generated) 030462801.b3lyp_6-31g(d).log.xz 030462801.td-b3lyp_6-31g+(d).inp 030462801.td-b3lyp_6-31g+(d).log.xz

030462801.td-b3lyp_6-31+g(d).qchem.inp (generated)

030462801.td-b3lyp_6-31+g(d).gjf (generated)

030462801.td-b3lyp_6-31+g(d).firefly.inp (generated)

030462801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030462801.mol 030462801.PUBCHEM 030462801.mol (via Jmol)
030462806.b3lyp_6-31g(d).inp

030462806.b3lyp_6-31g(d).qchem.inp (generated)

030462806.b3lyp_6-31g(d).gjf (generated)

030462806.b3lyp_6-31g(d).firefly.inp (generated)

030462806.b3lyp_6-31g(d).smash.inp (generated)

030462806.b3lyp_6-31g(d).nwchem.inp (generated) 030462806.b3lyp_6-31g(d).log.xz 030462806.td-b3lyp_6-31g+(d).inp 030462806.td-b3lyp_6-31g+(d).log.xz

030462806.td-b3lyp_6-31+g(d).qchem.inp (generated)

030462806.td-b3lyp_6-31+g(d).gjf (generated)

030462806.td-b3lyp_6-31+g(d).firefly.inp (generated)

030462806.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030462806.mol 030462806.PUBCHEM 030462806.mol (via Jmol)
030462905.b3lyp_6-31g(d).inp

030462905.b3lyp_6-31g(d).qchem.inp (generated)

030462905.b3lyp_6-31g(d).gjf (generated)

030462905.b3lyp_6-31g(d).firefly.inp (generated)

030462905.b3lyp_6-31g(d).smash.inp (generated)

030462905.b3lyp_6-31g(d).nwchem.inp (generated) 030462905.b3lyp_6-31g(d).log.xz 030462905.td-b3lyp_6-31g+(d).inp 030462905.td-b3lyp_6-31g+(d).log.xz

030462905.td-b3lyp_6-31+g(d).qchem.inp (generated)

030462905.td-b3lyp_6-31+g(d).gjf (generated)

030462905.td-b3lyp_6-31+g(d).firefly.inp (generated)

030462905.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030462905.mol 030462905.PUBCHEM 030462905.mol (via Jmol)
030462909.b3lyp_6-31g(d).inp

030462909.b3lyp_6-31g(d).qchem.inp (generated)

030462909.b3lyp_6-31g(d).gjf (generated)

030462909.b3lyp_6-31g(d).firefly.inp (generated)

030462909.b3lyp_6-31g(d).smash.inp (generated)

030462909.b3lyp_6-31g(d).nwchem.inp (generated) 030462909.b3lyp_6-31g(d).log.xz 030462909.td-b3lyp_6-31g+(d).inp 030462909.td-b3lyp_6-31g+(d).log.xz

030462909.td-b3lyp_6-31+g(d).qchem.inp (generated)

030462909.td-b3lyp_6-31+g(d).gjf (generated)

030462909.td-b3lyp_6-31+g(d).firefly.inp (generated)

030462909.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030462909.mol 030462909.PUBCHEM 030462909.mol (via Jmol)
030463000.b3lyp_6-31g(d).inp

030463000.b3lyp_6-31g(d).qchem.inp (generated)

030463000.b3lyp_6-31g(d).gjf (generated)

030463000.b3lyp_6-31g(d).firefly.inp (generated)

030463000.b3lyp_6-31g(d).smash.inp (generated)

030463000.b3lyp_6-31g(d).nwchem.inp (generated) 030463000.b3lyp_6-31g(d).log.xz 030463000.mol 030463000.PUBCHEM 030463000.mol (via Jmol)
030463005.b3lyp_6-31g(d).inp

030463005.b3lyp_6-31g(d).qchem.inp (generated)

030463005.b3lyp_6-31g(d).gjf (generated)

030463005.b3lyp_6-31g(d).firefly.inp (generated)

030463005.b3lyp_6-31g(d).smash.inp (generated)

030463005.b3lyp_6-31g(d).nwchem.inp (generated) 030463005.b3lyp_6-31g(d).log.xz 030463005.td-b3lyp_6-31g+(d).inp 030463005.td-b3lyp_6-31g+(d).log.xz

030463005.td-b3lyp_6-31+g(d).qchem.inp (generated)

030463005.td-b3lyp_6-31+g(d).gjf (generated)

030463005.td-b3lyp_6-31+g(d).firefly.inp (generated)

030463005.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030463005.mol 030463005.PUBCHEM 030463005.mol (via Jmol)
030463285.b3lyp_6-31g(d).inp

030463285.b3lyp_6-31g(d).qchem.inp (generated)

030463285.b3lyp_6-31g(d).gjf (generated)

030463285.b3lyp_6-31g(d).firefly.inp (generated)

030463285.b3lyp_6-31g(d).smash.inp (generated)

030463285.b3lyp_6-31g(d).nwchem.inp (generated) 030463285.b3lyp_6-31g(d).log.xz 030463285.td-b3lyp_6-31g+(d).inp 030463285.td-b3lyp_6-31g+(d).log.xz

030463285.td-b3lyp_6-31+g(d).qchem.inp (generated)

030463285.td-b3lyp_6-31+g(d).gjf (generated)

030463285.td-b3lyp_6-31+g(d).firefly.inp (generated)

030463285.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030463285.mol 030463285.PUBCHEM 030463285.mol (via Jmol)
030464213.b3lyp_6-31g(d).inp

030464213.b3lyp_6-31g(d).qchem.inp (generated)

030464213.b3lyp_6-31g(d).gjf (generated)

030464213.b3lyp_6-31g(d).firefly.inp (generated)

030464213.b3lyp_6-31g(d).smash.inp (generated)

030464213.b3lyp_6-31g(d).nwchem.inp (generated) 030464213.b3lyp_6-31g(d).log.xz 030464213.td-b3lyp_6-31g+(d).inp 030464213.td-b3lyp_6-31g+(d).log.xz

030464213.td-b3lyp_6-31+g(d).qchem.inp (generated)

030464213.td-b3lyp_6-31+g(d).gjf (generated)

030464213.td-b3lyp_6-31+g(d).firefly.inp (generated)

030464213.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030464213.mol 030464213.PUBCHEM 030464213.mol (via Jmol)
030464215.b3lyp_6-31g(d).inp

030464215.b3lyp_6-31g(d).qchem.inp (generated)

030464215.b3lyp_6-31g(d).gjf (generated)

030464215.b3lyp_6-31g(d).firefly.inp (generated)

030464215.b3lyp_6-31g(d).smash.inp (generated)

030464215.b3lyp_6-31g(d).nwchem.inp (generated) 030464215.b3lyp_6-31g(d).log.xz 030464215.td-b3lyp_6-31g+(d).inp 030464215.td-b3lyp_6-31g+(d).log.xz

030464215.td-b3lyp_6-31+g(d).qchem.inp (generated)

030464215.td-b3lyp_6-31+g(d).gjf (generated)

030464215.td-b3lyp_6-31+g(d).firefly.inp (generated)

030464215.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030464215.mol 030464215.PUBCHEM 030464215.mol (via Jmol)
030464217.b3lyp_6-31g(d).inp

030464217.b3lyp_6-31g(d).qchem.inp (generated)

030464217.b3lyp_6-31g(d).gjf (generated)

030464217.b3lyp_6-31g(d).firefly.inp (generated)

030464217.b3lyp_6-31g(d).smash.inp (generated)

030464217.b3lyp_6-31g(d).nwchem.inp (generated) 030464217.b3lyp_6-31g(d).log.xz 030464217.td-b3lyp_6-31g+(d).inp 030464217.td-b3lyp_6-31g+(d).log.xz

030464217.td-b3lyp_6-31+g(d).qchem.inp (generated)

030464217.td-b3lyp_6-31+g(d).gjf (generated)

030464217.td-b3lyp_6-31+g(d).firefly.inp (generated)

030464217.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030464217.mol 030464217.PUBCHEM 030464217.mol (via Jmol)
030464220.b3lyp_6-31g(d).inp

030464220.b3lyp_6-31g(d).qchem.inp (generated)

030464220.b3lyp_6-31g(d).gjf (generated)

030464220.b3lyp_6-31g(d).firefly.inp (generated)

030464220.b3lyp_6-31g(d).smash.inp (generated)

030464220.b3lyp_6-31g(d).nwchem.inp (generated) 030464220.b3lyp_6-31g(d).log.xz 030464220.td-b3lyp_6-31g+(d).inp 030464220.td-b3lyp_6-31g+(d).log.xz

030464220.td-b3lyp_6-31+g(d).qchem.inp (generated)

030464220.td-b3lyp_6-31+g(d).gjf (generated)

030464220.td-b3lyp_6-31+g(d).firefly.inp (generated)

030464220.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030464220.mol 030464220.PUBCHEM 030464220.mol (via Jmol)
030464222.b3lyp_6-31g(d).inp

030464222.b3lyp_6-31g(d).qchem.inp (generated)

030464222.b3lyp_6-31g(d).gjf (generated)

030464222.b3lyp_6-31g(d).firefly.inp (generated)

030464222.b3lyp_6-31g(d).smash.inp (generated)

030464222.b3lyp_6-31g(d).nwchem.inp (generated) 030464222.b3lyp_6-31g(d).log.xz 030464222.td-b3lyp_6-31g+(d).inp 030464222.td-b3lyp_6-31g+(d).log.xz

030464222.td-b3lyp_6-31+g(d).qchem.inp (generated)

030464222.td-b3lyp_6-31+g(d).gjf (generated)

030464222.td-b3lyp_6-31+g(d).firefly.inp (generated)

030464222.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030464222.mol 030464222.PUBCHEM 030464222.mol (via Jmol)
030464227.b3lyp_6-31g(d).inp

030464227.b3lyp_6-31g(d).qchem.inp (generated)

030464227.b3lyp_6-31g(d).gjf (generated)

030464227.b3lyp_6-31g(d).firefly.inp (generated)

030464227.b3lyp_6-31g(d).smash.inp (generated)

030464227.b3lyp_6-31g(d).nwchem.inp (generated) 030464227.b3lyp_6-31g(d).log.xz 030464227.td-b3lyp_6-31g+(d).inp 030464227.td-b3lyp_6-31g+(d).log.xz

030464227.td-b3lyp_6-31+g(d).qchem.inp (generated)

030464227.td-b3lyp_6-31+g(d).gjf (generated)

030464227.td-b3lyp_6-31+g(d).firefly.inp (generated)

030464227.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030464227.mol 030464227.PUBCHEM 030464227.mol (via Jmol)
030464229.b3lyp_6-31g(d).inp

030464229.b3lyp_6-31g(d).qchem.inp (generated)

030464229.b3lyp_6-31g(d).gjf (generated)

030464229.b3lyp_6-31g(d).firefly.inp (generated)

030464229.b3lyp_6-31g(d).smash.inp (generated)

030464229.b3lyp_6-31g(d).nwchem.inp (generated) 030464229.b3lyp_6-31g(d).log.xz 030464229.td-b3lyp_6-31g+(d).inp 030464229.td-b3lyp_6-31g+(d).log.xz

030464229.td-b3lyp_6-31+g(d).qchem.inp (generated)

030464229.td-b3lyp_6-31+g(d).gjf (generated)

030464229.td-b3lyp_6-31+g(d).firefly.inp (generated)

030464229.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030464229.mol 030464229.PUBCHEM 030464229.mol (via Jmol)
030464232.b3lyp_6-31g(d).inp

030464232.b3lyp_6-31g(d).qchem.inp (generated)

030464232.b3lyp_6-31g(d).gjf (generated)

030464232.b3lyp_6-31g(d).firefly.inp (generated)

030464232.b3lyp_6-31g(d).smash.inp (generated)

030464232.b3lyp_6-31g(d).nwchem.inp (generated) 030464232.b3lyp_6-31g(d).log.xz 030464232.td-b3lyp_6-31g+(d).inp 030464232.td-b3lyp_6-31g+(d).log.xz

030464232.td-b3lyp_6-31+g(d).qchem.inp (generated)

030464232.td-b3lyp_6-31+g(d).gjf (generated)

030464232.td-b3lyp_6-31+g(d).firefly.inp (generated)

030464232.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030464232.mol 030464232.PUBCHEM 030464232.mol (via Jmol)
030464234.b3lyp_6-31g(d).inp

030464234.b3lyp_6-31g(d).qchem.inp (generated)

030464234.b3lyp_6-31g(d).gjf (generated)

030464234.b3lyp_6-31g(d).firefly.inp (generated)

030464234.b3lyp_6-31g(d).smash.inp (generated)

030464234.b3lyp_6-31g(d).nwchem.inp (generated) 030464234.b3lyp_6-31g(d).log.xz 030464234.td-b3lyp_6-31g+(d).inp 030464234.td-b3lyp_6-31g+(d).log.xz

030464234.td-b3lyp_6-31+g(d).qchem.inp (generated)

030464234.td-b3lyp_6-31+g(d).gjf (generated)

030464234.td-b3lyp_6-31+g(d).firefly.inp (generated)

030464234.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030464234.mol 030464234.PUBCHEM 030464234.mol (via Jmol)
030464236.b3lyp_6-31g(d).inp

030464236.b3lyp_6-31g(d).qchem.inp (generated)

030464236.b3lyp_6-31g(d).gjf (generated)

030464236.b3lyp_6-31g(d).firefly.inp (generated)

030464236.b3lyp_6-31g(d).smash.inp (generated)

030464236.b3lyp_6-31g(d).nwchem.inp (generated) 030464236.b3lyp_6-31g(d).log.xz 030464236.mol 030464236.PUBCHEM 030464236.mol (via Jmol)
030464238.b3lyp_6-31g(d).inp

030464238.b3lyp_6-31g(d).qchem.inp (generated)

030464238.b3lyp_6-31g(d).gjf (generated)

030464238.b3lyp_6-31g(d).firefly.inp (generated)

030464238.b3lyp_6-31g(d).smash.inp (generated)

030464238.b3lyp_6-31g(d).nwchem.inp (generated) 030464238.b3lyp_6-31g(d).log.xz 030464238.td-b3lyp_6-31g+(d).inp 030464238.td-b3lyp_6-31g+(d).log.xz

030464238.td-b3lyp_6-31+g(d).qchem.inp (generated)

030464238.td-b3lyp_6-31+g(d).gjf (generated)

030464238.td-b3lyp_6-31+g(d).firefly.inp (generated)

030464238.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030464238.mol 030464238.PUBCHEM 030464238.mol (via Jmol)
030464241.b3lyp_6-31g(d).inp

030464241.b3lyp_6-31g(d).qchem.inp (generated)

030464241.b3lyp_6-31g(d).gjf (generated)

030464241.b3lyp_6-31g(d).firefly.inp (generated)

030464241.b3lyp_6-31g(d).smash.inp (generated)

030464241.b3lyp_6-31g(d).nwchem.inp (generated) 030464241.b3lyp_6-31g(d).log.xz 030464241.td-b3lyp_6-31g+(d).inp 030464241.td-b3lyp_6-31g+(d).log.xz

030464241.td-b3lyp_6-31+g(d).qchem.inp (generated)

030464241.td-b3lyp_6-31+g(d).gjf (generated)

030464241.td-b3lyp_6-31+g(d).firefly.inp (generated)

030464241.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030464241.mol 030464241.PUBCHEM 030464241.mol (via Jmol)
030464243.b3lyp_6-31g(d).inp

030464243.b3lyp_6-31g(d).qchem.inp (generated)

030464243.b3lyp_6-31g(d).gjf (generated)

030464243.b3lyp_6-31g(d).firefly.inp (generated)

030464243.b3lyp_6-31g(d).smash.inp (generated)

030464243.b3lyp_6-31g(d).nwchem.inp (generated) 030464243.b3lyp_6-31g(d).log.xz 030464243.td-b3lyp_6-31g+(d).inp 030464243.td-b3lyp_6-31g+(d).log.xz

030464243.td-b3lyp_6-31+g(d).qchem.inp (generated)

030464243.td-b3lyp_6-31+g(d).gjf (generated)

030464243.td-b3lyp_6-31+g(d).firefly.inp (generated)

030464243.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030464243.mol 030464243.PUBCHEM 030464243.mol (via Jmol)
030464245.b3lyp_6-31g(d).inp

030464245.b3lyp_6-31g(d).qchem.inp (generated)

030464245.b3lyp_6-31g(d).gjf (generated)

030464245.b3lyp_6-31g(d).firefly.inp (generated)

030464245.b3lyp_6-31g(d).smash.inp (generated)

030464245.b3lyp_6-31g(d).nwchem.inp (generated) 030464245.b3lyp_6-31g(d).log.xz 030464245.td-b3lyp_6-31g+(d).inp 030464245.td-b3lyp_6-31g+(d).log.xz

030464245.td-b3lyp_6-31+g(d).qchem.inp (generated)

030464245.td-b3lyp_6-31+g(d).gjf (generated)

030464245.td-b3lyp_6-31+g(d).firefly.inp (generated)

030464245.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030464245.mol 030464245.PUBCHEM 030464245.mol (via Jmol)
030464247.b3lyp_6-31g(d).inp

030464247.b3lyp_6-31g(d).qchem.inp (generated)

030464247.b3lyp_6-31g(d).gjf (generated)

030464247.b3lyp_6-31g(d).firefly.inp (generated)

030464247.b3lyp_6-31g(d).smash.inp (generated)

030464247.b3lyp_6-31g(d).nwchem.inp (generated) 030464247.b3lyp_6-31g(d).log.xz 030464247.td-b3lyp_6-31g+(d).inp 030464247.td-b3lyp_6-31g+(d).log.xz

030464247.td-b3lyp_6-31+g(d).qchem.inp (generated)

030464247.td-b3lyp_6-31+g(d).gjf (generated)

030464247.td-b3lyp_6-31+g(d).firefly.inp (generated)

030464247.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030464247.mol 030464247.PUBCHEM 030464247.mol (via Jmol)
030464267.b3lyp_6-31g(d).inp

030464267.b3lyp_6-31g(d).qchem.inp (generated)

030464267.b3lyp_6-31g(d).gjf (generated)

030464267.b3lyp_6-31g(d).firefly.inp (generated)

030464267.b3lyp_6-31g(d).smash.inp (generated)

030464267.b3lyp_6-31g(d).nwchem.inp (generated) 030464267.b3lyp_6-31g(d).log.xz 030464267.td-b3lyp_6-31g+(d).inp 030464267.td-b3lyp_6-31g+(d).log.xz

030464267.td-b3lyp_6-31+g(d).qchem.inp (generated)

030464267.td-b3lyp_6-31+g(d).gjf (generated)

030464267.td-b3lyp_6-31+g(d).firefly.inp (generated)

030464267.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030464267.mol 030464267.PUBCHEM 030464267.mol (via Jmol)
030464279.b3lyp_6-31g(d).inp

030464279.b3lyp_6-31g(d).qchem.inp (generated)

030464279.b3lyp_6-31g(d).gjf (generated)

030464279.b3lyp_6-31g(d).firefly.inp (generated)

030464279.b3lyp_6-31g(d).smash.inp (generated)

030464279.b3lyp_6-31g(d).nwchem.inp (generated) 030464279.b3lyp_6-31g(d).log.xz 030464279.td-b3lyp_6-31g+(d).inp 030464279.td-b3lyp_6-31g+(d).log.xz

030464279.td-b3lyp_6-31+g(d).qchem.inp (generated)

030464279.td-b3lyp_6-31+g(d).gjf (generated)

030464279.td-b3lyp_6-31+g(d).firefly.inp (generated)

030464279.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030464279.mol 030464279.PUBCHEM 030464279.mol (via Jmol)
030464280.b3lyp_6-31g(d).inp

030464280.b3lyp_6-31g(d).qchem.inp (generated)

030464280.b3lyp_6-31g(d).gjf (generated)

030464280.b3lyp_6-31g(d).firefly.inp (generated)

030464280.b3lyp_6-31g(d).smash.inp (generated)

030464280.b3lyp_6-31g(d).nwchem.inp (generated) 030464280.b3lyp_6-31g(d).log.xz 030464280.td-b3lyp_6-31g+(d).inp 030464280.td-b3lyp_6-31g+(d).log.xz

030464280.td-b3lyp_6-31+g(d).qchem.inp (generated)

030464280.td-b3lyp_6-31+g(d).gjf (generated)

030464280.td-b3lyp_6-31+g(d).firefly.inp (generated)

030464280.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030464280.mol 030464280.PUBCHEM 030464280.mol (via Jmol)
030464282.b3lyp_6-31g(d).inp

030464282.b3lyp_6-31g(d).qchem.inp (generated)

030464282.b3lyp_6-31g(d).gjf (generated)

030464282.b3lyp_6-31g(d).firefly.inp (generated)

030464282.b3lyp_6-31g(d).smash.inp (generated)

030464282.b3lyp_6-31g(d).nwchem.inp (generated) 030464282.b3lyp_6-31g(d).log.xz 030464282.td-b3lyp_6-31g+(d).inp 030464282.td-b3lyp_6-31g+(d).log.xz

030464282.td-b3lyp_6-31+g(d).qchem.inp (generated)

030464282.td-b3lyp_6-31+g(d).gjf (generated)

030464282.td-b3lyp_6-31+g(d).firefly.inp (generated)

030464282.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030464282.mol 030464282.PUBCHEM 030464282.mol (via Jmol)
030464284.b3lyp_6-31g(d).inp

030464284.b3lyp_6-31g(d).qchem.inp (generated)

030464284.b3lyp_6-31g(d).gjf (generated)

030464284.b3lyp_6-31g(d).firefly.inp (generated)

030464284.b3lyp_6-31g(d).smash.inp (generated)

030464284.b3lyp_6-31g(d).nwchem.inp (generated) 030464284.b3lyp_6-31g(d).log.xz 030464284.td-b3lyp_6-31g+(d).inp 030464284.td-b3lyp_6-31g+(d).log.xz

030464284.td-b3lyp_6-31+g(d).qchem.inp (generated)

030464284.td-b3lyp_6-31+g(d).gjf (generated)

030464284.td-b3lyp_6-31+g(d).firefly.inp (generated)

030464284.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030464284.mol 030464284.PUBCHEM 030464284.mol (via Jmol)
030464306.b3lyp_6-31g(d).inp

030464306.b3lyp_6-31g(d).qchem.inp (generated)

030464306.b3lyp_6-31g(d).gjf (generated)

030464306.b3lyp_6-31g(d).firefly.inp (generated)

030464306.b3lyp_6-31g(d).smash.inp (generated)

030464306.b3lyp_6-31g(d).nwchem.inp (generated) 030464306.b3lyp_6-31g(d).log.xz 030464306.mol 030464306.PUBCHEM 030464306.mol (via Jmol)
030464308.b3lyp_6-31g(d).inp

030464308.b3lyp_6-31g(d).qchem.inp (generated)

030464308.b3lyp_6-31g(d).gjf (generated)

030464308.b3lyp_6-31g(d).firefly.inp (generated)

030464308.b3lyp_6-31g(d).smash.inp (generated)

030464308.b3lyp_6-31g(d).nwchem.inp (generated) 030464308.b3lyp_6-31g(d).log.xz 030464308.mol 030464308.PUBCHEM 030464308.mol (via Jmol)
030464310.b3lyp_6-31g(d).inp

030464310.b3lyp_6-31g(d).qchem.inp (generated)

030464310.b3lyp_6-31g(d).gjf (generated)

030464310.b3lyp_6-31g(d).firefly.inp (generated)

030464310.b3lyp_6-31g(d).smash.inp (generated)

030464310.b3lyp_6-31g(d).nwchem.inp (generated) 030464310.b3lyp_6-31g(d).log.xz 030464310.mol 030464310.PUBCHEM 030464310.mol (via Jmol)
030464312.b3lyp_6-31g(d).inp

030464312.b3lyp_6-31g(d).qchem.inp (generated)

030464312.b3lyp_6-31g(d).gjf (generated)

030464312.b3lyp_6-31g(d).firefly.inp (generated)

030464312.b3lyp_6-31g(d).smash.inp (generated)

030464312.b3lyp_6-31g(d).nwchem.inp (generated) 030464312.b3lyp_6-31g(d).log.xz 030464312.td-b3lyp_6-31g+(d).inp 030464312.td-b3lyp_6-31g+(d).log.xz

030464312.td-b3lyp_6-31+g(d).qchem.inp (generated)

030464312.td-b3lyp_6-31+g(d).gjf (generated)

030464312.td-b3lyp_6-31+g(d).firefly.inp (generated)

030464312.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030464312.mol 030464312.PUBCHEM 030464312.mol (via Jmol)
030464314.b3lyp_6-31g(d).inp

030464314.b3lyp_6-31g(d).qchem.inp (generated)

030464314.b3lyp_6-31g(d).gjf (generated)

030464314.b3lyp_6-31g(d).firefly.inp (generated)

030464314.b3lyp_6-31g(d).smash.inp (generated)

030464314.b3lyp_6-31g(d).nwchem.inp (generated) 030464314.b3lyp_6-31g(d).log.xz 030464314.td-b3lyp_6-31g+(d).inp 030464314.td-b3lyp_6-31g+(d).log.xz

030464314.td-b3lyp_6-31+g(d).qchem.inp (generated)

030464314.td-b3lyp_6-31+g(d).gjf (generated)

030464314.td-b3lyp_6-31+g(d).firefly.inp (generated)

030464314.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030464314.mol 030464314.PUBCHEM 030464314.mol (via Jmol)
030464315.b3lyp_6-31g(d).inp

030464315.b3lyp_6-31g(d).qchem.inp (generated)

030464315.b3lyp_6-31g(d).gjf (generated)

030464315.b3lyp_6-31g(d).firefly.inp (generated)

030464315.b3lyp_6-31g(d).smash.inp (generated)

030464315.b3lyp_6-31g(d).nwchem.inp (generated) 030464315.b3lyp_6-31g(d).log.xz 030464315.td-b3lyp_6-31g+(d).inp 030464315.td-b3lyp_6-31g+(d).log.xz

030464315.td-b3lyp_6-31+g(d).qchem.inp (generated)

030464315.td-b3lyp_6-31+g(d).gjf (generated)

030464315.td-b3lyp_6-31+g(d).firefly.inp (generated)

030464315.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030464315.mol 030464315.PUBCHEM 030464315.mol (via Jmol)
030464335.b3lyp_6-31g(d).inp

030464335.b3lyp_6-31g(d).qchem.inp (generated)

030464335.b3lyp_6-31g(d).gjf (generated)

030464335.b3lyp_6-31g(d).firefly.inp (generated)

030464335.b3lyp_6-31g(d).smash.inp (generated)

030464335.b3lyp_6-31g(d).nwchem.inp (generated) 030464335.b3lyp_6-31g(d).log.xz 030464335.td-b3lyp_6-31g+(d).inp 030464335.td-b3lyp_6-31g+(d).log.xz

030464335.td-b3lyp_6-31+g(d).qchem.inp (generated)

030464335.td-b3lyp_6-31+g(d).gjf (generated)

030464335.td-b3lyp_6-31+g(d).firefly.inp (generated)

030464335.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030464335.mol 030464335.PUBCHEM 030464335.mol (via Jmol)
030464906.b3lyp_6-31g(d).inp

030464906.b3lyp_6-31g(d).qchem.inp (generated)

030464906.b3lyp_6-31g(d).gjf (generated)

030464906.b3lyp_6-31g(d).firefly.inp (generated)

030464906.b3lyp_6-31g(d).smash.inp (generated)

030464906.b3lyp_6-31g(d).nwchem.inp (generated) 030464906.b3lyp_6-31g(d).log.xz 030464906.td-b3lyp_6-31g+(d).inp 030464906.td-b3lyp_6-31g+(d).log.xz

030464906.td-b3lyp_6-31+g(d).qchem.inp (generated)

030464906.td-b3lyp_6-31+g(d).gjf (generated)

030464906.td-b3lyp_6-31+g(d).firefly.inp (generated)

030464906.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030464906.mol 030464906.PUBCHEM 030464906.mol (via Jmol)
030465103.b3lyp_6-31g(d).inp

030465103.b3lyp_6-31g(d).qchem.inp (generated)

030465103.b3lyp_6-31g(d).gjf (generated)

030465103.b3lyp_6-31g(d).firefly.inp (generated)

030465103.b3lyp_6-31g(d).smash.inp (generated)

030465103.b3lyp_6-31g(d).nwchem.inp (generated) 030465103.b3lyp_6-31g(d).log.xz 030465103.mol 030465103.PUBCHEM 030465103.mol (via Jmol)
030465279.b3lyp_6-31g(d).inp

030465279.b3lyp_6-31g(d).qchem.inp (generated)

030465279.b3lyp_6-31g(d).gjf (generated)

030465279.b3lyp_6-31g(d).firefly.inp (generated)

030465279.b3lyp_6-31g(d).smash.inp (generated)

030465279.b3lyp_6-31g(d).nwchem.inp (generated) 030465279.b3lyp_6-31g(d).log.xz 030465279.mol 030465279.PUBCHEM 030465279.mol (via Jmol)
030465384.b3lyp_6-31g(d).inp

030465384.b3lyp_6-31g(d).qchem.inp (generated)

030465384.b3lyp_6-31g(d).gjf (generated)

030465384.b3lyp_6-31g(d).firefly.inp (generated)

030465384.b3lyp_6-31g(d).smash.inp (generated)

030465384.b3lyp_6-31g(d).nwchem.inp (generated) 030465384.b3lyp_6-31g(d).log.xz 030465384.td-b3lyp_6-31g+(d).inp 030465384.td-b3lyp_6-31g+(d).log.xz

030465384.td-b3lyp_6-31+g(d).qchem.inp (generated)

030465384.td-b3lyp_6-31+g(d).gjf (generated)

030465384.td-b3lyp_6-31+g(d).firefly.inp (generated)

030465384.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030465384.mol 030465384.PUBCHEM 030465384.mol (via Jmol)
030465390.b3lyp_6-31g(d).inp

030465390.b3lyp_6-31g(d).qchem.inp (generated)

030465390.b3lyp_6-31g(d).gjf (generated)

030465390.b3lyp_6-31g(d).firefly.inp (generated)

030465390.b3lyp_6-31g(d).smash.inp (generated)

030465390.b3lyp_6-31g(d).nwchem.inp (generated) 030465390.b3lyp_6-31g(d).log.xz 030465390.td-b3lyp_6-31g+(d).inp 030465390.td-b3lyp_6-31g+(d).log.xz

030465390.td-b3lyp_6-31+g(d).qchem.inp (generated)

030465390.td-b3lyp_6-31+g(d).gjf (generated)

030465390.td-b3lyp_6-31+g(d).firefly.inp (generated)

030465390.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030465390.mol 030465390.PUBCHEM 030465390.mol (via Jmol)
030469207.b3lyp_6-31g(d).inp

030469207.b3lyp_6-31g(d).qchem.inp (generated)

030469207.b3lyp_6-31g(d).gjf (generated)

030469207.b3lyp_6-31g(d).firefly.inp (generated)

030469207.b3lyp_6-31g(d).smash.inp (generated)

030469207.b3lyp_6-31g(d).nwchem.inp (generated) 030469207.b3lyp_6-31g(d).log.xz 030469207.td-b3lyp_6-31g+(d).inp 030469207.td-b3lyp_6-31g+(d).log.xz

030469207.td-b3lyp_6-31+g(d).qchem.inp (generated)

030469207.td-b3lyp_6-31+g(d).gjf (generated)

030469207.td-b3lyp_6-31+g(d).firefly.inp (generated)

030469207.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030469207.mol 030469207.PUBCHEM 030469207.mol (via Jmol)
030469241.b3lyp_6-31g(d).inp

030469241.b3lyp_6-31g(d).qchem.inp (generated)

030469241.b3lyp_6-31g(d).gjf (generated)

030469241.b3lyp_6-31g(d).firefly.inp (generated)

030469241.b3lyp_6-31g(d).smash.inp (generated)

030469241.b3lyp_6-31g(d).nwchem.inp (generated) 030469241.b3lyp_6-31g(d).log.xz 030469241.mol 030469241.PUBCHEM 030469241.mol (via Jmol)
030469660.b3lyp_6-31g(d).inp

030469660.b3lyp_6-31g(d).qchem.inp (generated)

030469660.b3lyp_6-31g(d).gjf (generated)

030469660.b3lyp_6-31g(d).firefly.inp (generated)

030469660.b3lyp_6-31g(d).smash.inp (generated)

030469660.b3lyp_6-31g(d).nwchem.inp (generated) 030469660.b3lyp_6-31g(d).log.xz 030469660.td-b3lyp_6-31g+(d).inp 030469660.td-b3lyp_6-31g+(d).log.xz

030469660.td-b3lyp_6-31+g(d).qchem.inp (generated)

030469660.td-b3lyp_6-31+g(d).gjf (generated)

030469660.td-b3lyp_6-31+g(d).firefly.inp (generated)

030469660.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030469660.mol 030469660.PUBCHEM 030469660.mol (via Jmol)
030469663.b3lyp_6-31g(d).inp

030469663.b3lyp_6-31g(d).qchem.inp (generated)

030469663.b3lyp_6-31g(d).gjf (generated)

030469663.b3lyp_6-31g(d).firefly.inp (generated)

030469663.b3lyp_6-31g(d).smash.inp (generated)

030469663.b3lyp_6-31g(d).nwchem.inp (generated) 030469663.b3lyp_6-31g(d).log.xz 030469663.td-b3lyp_6-31g+(d).inp 030469663.td-b3lyp_6-31g+(d).log.xz

030469663.td-b3lyp_6-31+g(d).qchem.inp (generated)

030469663.td-b3lyp_6-31+g(d).gjf (generated)

030469663.td-b3lyp_6-31+g(d).firefly.inp (generated)

030469663.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030469663.mol 030469663.PUBCHEM 030469663.mol (via Jmol)
030469670.b3lyp_6-31g(d).inp

030469670.b3lyp_6-31g(d).qchem.inp (generated)

030469670.b3lyp_6-31g(d).gjf (generated)

030469670.b3lyp_6-31g(d).firefly.inp (generated)

030469670.b3lyp_6-31g(d).smash.inp (generated)

030469670.b3lyp_6-31g(d).nwchem.inp (generated) 030469670.b3lyp_6-31g(d).log.xz 030469670.td-b3lyp_6-31g+(d).inp 030469670.td-b3lyp_6-31g+(d).log.xz

030469670.td-b3lyp_6-31+g(d).qchem.inp (generated)

030469670.td-b3lyp_6-31+g(d).gjf (generated)

030469670.td-b3lyp_6-31+g(d).firefly.inp (generated)

030469670.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030469670.mol 030469670.PUBCHEM 030469670.mol (via Jmol)
030469674.b3lyp_6-31g(d).inp

030469674.b3lyp_6-31g(d).qchem.inp (generated)

030469674.b3lyp_6-31g(d).gjf (generated)

030469674.b3lyp_6-31g(d).firefly.inp (generated)

030469674.b3lyp_6-31g(d).smash.inp (generated)

030469674.b3lyp_6-31g(d).nwchem.inp (generated) 030469674.b3lyp_6-31g(d).log.xz 030469674.td-b3lyp_6-31g+(d).inp 030469674.td-b3lyp_6-31g+(d).log.xz

030469674.td-b3lyp_6-31+g(d).qchem.inp (generated)

030469674.td-b3lyp_6-31+g(d).gjf (generated)

030469674.td-b3lyp_6-31+g(d).firefly.inp (generated)

030469674.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030469674.mol 030469674.PUBCHEM 030469674.mol (via Jmol)
030469675.b3lyp_6-31g(d).inp

030469675.b3lyp_6-31g(d).qchem.inp (generated)

030469675.b3lyp_6-31g(d).gjf (generated)

030469675.b3lyp_6-31g(d).firefly.inp (generated)

030469675.b3lyp_6-31g(d).smash.inp (generated)

030469675.b3lyp_6-31g(d).nwchem.inp (generated) 030469675.b3lyp_6-31g(d).log.xz 030469675.td-b3lyp_6-31g+(d).inp 030469675.td-b3lyp_6-31g+(d).log.xz

030469675.td-b3lyp_6-31+g(d).qchem.inp (generated)

030469675.td-b3lyp_6-31+g(d).gjf (generated)

030469675.td-b3lyp_6-31+g(d).firefly.inp (generated)

030469675.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030469675.mol 030469675.PUBCHEM 030469675.mol (via Jmol)
030469678.b3lyp_6-31g(d).inp

030469678.b3lyp_6-31g(d).qchem.inp (generated)

030469678.b3lyp_6-31g(d).gjf (generated)

030469678.b3lyp_6-31g(d).firefly.inp (generated)

030469678.b3lyp_6-31g(d).smash.inp (generated)

030469678.b3lyp_6-31g(d).nwchem.inp (generated) 030469678.b3lyp_6-31g(d).log.xz 030469678.td-b3lyp_6-31g+(d).inp 030469678.td-b3lyp_6-31g+(d).log.xz

030469678.td-b3lyp_6-31+g(d).qchem.inp (generated)

030469678.td-b3lyp_6-31+g(d).gjf (generated)

030469678.td-b3lyp_6-31+g(d).firefly.inp (generated)

030469678.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030469678.mol 030469678.PUBCHEM 030469678.mol (via Jmol)
030469696.b3lyp_6-31g(d).inp

030469696.b3lyp_6-31g(d).qchem.inp (generated)

030469696.b3lyp_6-31g(d).gjf (generated)

030469696.b3lyp_6-31g(d).firefly.inp (generated)

030469696.b3lyp_6-31g(d).smash.inp (generated)

030469696.b3lyp_6-31g(d).nwchem.inp (generated) 030469696.b3lyp_6-31g(d).log.xz 030469696.td-b3lyp_6-31g+(d).inp 030469696.td-b3lyp_6-31g+(d).log.xz

030469696.td-b3lyp_6-31+g(d).qchem.inp (generated)

030469696.td-b3lyp_6-31+g(d).gjf (generated)

030469696.td-b3lyp_6-31+g(d).firefly.inp (generated)

030469696.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030469696.mol 030469696.PUBCHEM 030469696.mol (via Jmol)
030469697.b3lyp_6-31g(d).inp

030469697.b3lyp_6-31g(d).qchem.inp (generated)

030469697.b3lyp_6-31g(d).gjf (generated)

030469697.b3lyp_6-31g(d).firefly.inp (generated)

030469697.b3lyp_6-31g(d).smash.inp (generated)

030469697.b3lyp_6-31g(d).nwchem.inp (generated) 030469697.b3lyp_6-31g(d).log.xz 030469697.td-b3lyp_6-31g+(d).inp 030469697.td-b3lyp_6-31g+(d).log.xz

030469697.td-b3lyp_6-31+g(d).qchem.inp (generated)

030469697.td-b3lyp_6-31+g(d).gjf (generated)

030469697.td-b3lyp_6-31+g(d).firefly.inp (generated)

030469697.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030469697.mol 030469697.PUBCHEM 030469697.mol (via Jmol)
030469766.b3lyp_6-31g(d).inp

030469766.b3lyp_6-31g(d).qchem.inp (generated)

030469766.b3lyp_6-31g(d).gjf (generated)

030469766.b3lyp_6-31g(d).firefly.inp (generated)

030469766.b3lyp_6-31g(d).smash.inp (generated)

030469766.b3lyp_6-31g(d).nwchem.inp (generated) 030469766.b3lyp_6-31g(d).log.xz 030469766.mol 030469766.PUBCHEM 030469766.mol (via Jmol)
030469800.b3lyp_6-31g(d).inp

030469800.b3lyp_6-31g(d).qchem.inp (generated)

030469800.b3lyp_6-31g(d).gjf (generated)

030469800.b3lyp_6-31g(d).firefly.inp (generated)

030469800.b3lyp_6-31g(d).smash.inp (generated)

030469800.b3lyp_6-31g(d).nwchem.inp (generated) 030469800.b3lyp_6-31g(d).log.xz 030469800.td-b3lyp_6-31g+(d).inp 030469800.td-b3lyp_6-31g+(d).log.xz

030469800.td-b3lyp_6-31+g(d).qchem.inp (generated)

030469800.td-b3lyp_6-31+g(d).gjf (generated)

030469800.td-b3lyp_6-31+g(d).firefly.inp (generated)

030469800.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030469800.mol 030469800.PUBCHEM 030469800.mol (via Jmol)
030469804.b3lyp_6-31g(d).inp

030469804.b3lyp_6-31g(d).qchem.inp (generated)

030469804.b3lyp_6-31g(d).gjf (generated)

030469804.b3lyp_6-31g(d).firefly.inp (generated)

030469804.b3lyp_6-31g(d).smash.inp (generated)

030469804.b3lyp_6-31g(d).nwchem.inp (generated) 030469804.b3lyp_6-31g(d).log.xz 030469804.mol 030469804.PUBCHEM 030469804.mol (via Jmol)
030469807.b3lyp_6-31g(d).inp

030469807.b3lyp_6-31g(d).qchem.inp (generated)

030469807.b3lyp_6-31g(d).gjf (generated)

030469807.b3lyp_6-31g(d).firefly.inp (generated)

030469807.b3lyp_6-31g(d).smash.inp (generated)

030469807.b3lyp_6-31g(d).nwchem.inp (generated) 030469807.b3lyp_6-31g(d).log.xz 030469807.td-b3lyp_6-31g+(d).inp 030469807.td-b3lyp_6-31g+(d).log.xz

030469807.td-b3lyp_6-31+g(d).qchem.inp (generated)

030469807.td-b3lyp_6-31+g(d).gjf (generated)

030469807.td-b3lyp_6-31+g(d).firefly.inp (generated)

030469807.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030469807.mol 030469807.PUBCHEM 030469807.mol (via Jmol)
030469812.b3lyp_6-31g(d).inp

030469812.b3lyp_6-31g(d).qchem.inp (generated)

030469812.b3lyp_6-31g(d).gjf (generated)

030469812.b3lyp_6-31g(d).firefly.inp (generated)

030469812.b3lyp_6-31g(d).smash.inp (generated)

030469812.b3lyp_6-31g(d).nwchem.inp (generated) 030469812.b3lyp_6-31g(d).log.xz 030469812.mol 030469812.PUBCHEM 030469812.mol (via Jmol)
030469905.b3lyp_6-31g(d).inp

030469905.b3lyp_6-31g(d).qchem.inp (generated)

030469905.b3lyp_6-31g(d).gjf (generated)

030469905.b3lyp_6-31g(d).firefly.inp (generated)

030469905.b3lyp_6-31g(d).smash.inp (generated)

030469905.b3lyp_6-31g(d).nwchem.inp (generated) 030469905.b3lyp_6-31g(d).log.xz 030469905.td-b3lyp_6-31g+(d).inp 030469905.td-b3lyp_6-31g+(d).log.xz

030469905.td-b3lyp_6-31+g(d).qchem.inp (generated)

030469905.td-b3lyp_6-31+g(d).gjf (generated)

030469905.td-b3lyp_6-31+g(d).firefly.inp (generated)

030469905.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030469905.mol 030469905.PUBCHEM 030469905.mol (via Jmol)
030469910.b3lyp_6-31g(d).inp

030469910.b3lyp_6-31g(d).qchem.inp (generated)

030469910.b3lyp_6-31g(d).gjf (generated)

030469910.b3lyp_6-31g(d).firefly.inp (generated)

030469910.b3lyp_6-31g(d).smash.inp (generated)

030469910.b3lyp_6-31g(d).nwchem.inp (generated) 030469910.b3lyp_6-31g(d).log.xz 030469910.td-b3lyp_6-31g+(d).inp 030469910.td-b3lyp_6-31g+(d).log.xz

030469910.td-b3lyp_6-31+g(d).qchem.inp (generated)

030469910.td-b3lyp_6-31+g(d).gjf (generated)

030469910.td-b3lyp_6-31+g(d).firefly.inp (generated)

030469910.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030469910.mol 030469910.PUBCHEM 030469910.mol (via Jmol)
030469997.b3lyp_6-31g(d).inp

030469997.b3lyp_6-31g(d).qchem.inp (generated)

030469997.b3lyp_6-31g(d).gjf (generated)

030469997.b3lyp_6-31g(d).firefly.inp (generated)

030469997.b3lyp_6-31g(d).smash.inp (generated)

030469997.b3lyp_6-31g(d).nwchem.inp (generated) 030469997.b3lyp_6-31g(d).log.xz 030469997.td-b3lyp_6-31g+(d).inp 030469997.td-b3lyp_6-31g+(d).log.xz

030469997.td-b3lyp_6-31+g(d).qchem.inp (generated)

030469997.td-b3lyp_6-31+g(d).gjf (generated)

030469997.td-b3lyp_6-31+g(d).firefly.inp (generated)

030469997.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030469997.mol 030469997.PUBCHEM 030469997.mol (via Jmol)
030470034.b3lyp_6-31g(d).inp

030470034.b3lyp_6-31g(d).qchem.inp (generated)

030470034.b3lyp_6-31g(d).gjf (generated)

030470034.b3lyp_6-31g(d).firefly.inp (generated)

030470034.b3lyp_6-31g(d).smash.inp (generated)

030470034.b3lyp_6-31g(d).nwchem.inp (generated) 030470034.b3lyp_6-31g(d).log.xz 030470034.td-b3lyp_6-31g+(d).inp 030470034.td-b3lyp_6-31g+(d).log.xz

030470034.td-b3lyp_6-31+g(d).qchem.inp (generated)

030470034.td-b3lyp_6-31+g(d).gjf (generated)

030470034.td-b3lyp_6-31+g(d).firefly.inp (generated)

030470034.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030470034.mol 030470034.PUBCHEM 030470034.mol (via Jmol)
030470037.b3lyp_6-31g(d).inp

030470037.b3lyp_6-31g(d).qchem.inp (generated)

030470037.b3lyp_6-31g(d).gjf (generated)

030470037.b3lyp_6-31g(d).firefly.inp (generated)

030470037.b3lyp_6-31g(d).smash.inp (generated)

030470037.b3lyp_6-31g(d).nwchem.inp (generated) 030470037.b3lyp_6-31g(d).log.xz 030470037.mol 030470037.PUBCHEM 030470037.mol (via Jmol)
030470090.b3lyp_6-31g(d).inp

030470090.b3lyp_6-31g(d).qchem.inp (generated)

030470090.b3lyp_6-31g(d).gjf (generated)

030470090.b3lyp_6-31g(d).firefly.inp (generated)

030470090.b3lyp_6-31g(d).smash.inp (generated)

030470090.b3lyp_6-31g(d).nwchem.inp (generated) 030470090.b3lyp_6-31g(d).log.xz 030470090.td-b3lyp_6-31g+(d).inp 030470090.td-b3lyp_6-31g+(d).log.xz

030470090.td-b3lyp_6-31+g(d).qchem.inp (generated)

030470090.td-b3lyp_6-31+g(d).gjf (generated)

030470090.td-b3lyp_6-31+g(d).firefly.inp (generated)

030470090.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030470090.mol 030470090.PUBCHEM 030470090.mol (via Jmol)
030470093.b3lyp_6-31g(d).inp

030470093.b3lyp_6-31g(d).qchem.inp (generated)

030470093.b3lyp_6-31g(d).gjf (generated)

030470093.b3lyp_6-31g(d).firefly.inp (generated)

030470093.b3lyp_6-31g(d).smash.inp (generated)

030470093.b3lyp_6-31g(d).nwchem.inp (generated) 030470093.b3lyp_6-31g(d).log.xz 030470093.td-b3lyp_6-31g+(d).inp 030470093.td-b3lyp_6-31g+(d).log.xz

030470093.td-b3lyp_6-31+g(d).qchem.inp (generated)

030470093.td-b3lyp_6-31+g(d).gjf (generated)

030470093.td-b3lyp_6-31+g(d).firefly.inp (generated)

030470093.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030470093.mol 030470093.PUBCHEM 030470093.mol (via Jmol)
030470095.b3lyp_6-31g(d).inp

030470095.b3lyp_6-31g(d).qchem.inp (generated)

030470095.b3lyp_6-31g(d).gjf (generated)

030470095.b3lyp_6-31g(d).firefly.inp (generated)

030470095.b3lyp_6-31g(d).smash.inp (generated)

030470095.b3lyp_6-31g(d).nwchem.inp (generated) 030470095.b3lyp_6-31g(d).log.xz 030470095.mol 030470095.PUBCHEM 030470095.mol (via Jmol)
030470362.b3lyp_6-31g(d).inp

030470362.b3lyp_6-31g(d).qchem.inp (generated)

030470362.b3lyp_6-31g(d).gjf (generated)

030470362.b3lyp_6-31g(d).firefly.inp (generated)

030470362.b3lyp_6-31g(d).smash.inp (generated)

030470362.b3lyp_6-31g(d).nwchem.inp (generated) 030470362.b3lyp_6-31g(d).log.xz 030470362.td-b3lyp_6-31g+(d).inp 030470362.td-b3lyp_6-31g+(d).log.xz

030470362.td-b3lyp_6-31+g(d).qchem.inp (generated)

030470362.td-b3lyp_6-31+g(d).gjf (generated)

030470362.td-b3lyp_6-31+g(d).firefly.inp (generated)

030470362.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030470362.mol 030470362.PUBCHEM 030470362.mol (via Jmol)
030470560.b3lyp_6-31g(d).inp

030470560.b3lyp_6-31g(d).qchem.inp (generated)

030470560.b3lyp_6-31g(d).gjf (generated)

030470560.b3lyp_6-31g(d).firefly.inp (generated)

030470560.b3lyp_6-31g(d).smash.inp (generated)

030470560.b3lyp_6-31g(d).nwchem.inp (generated) 030470560.b3lyp_6-31g(d).log.xz 030470560.td-b3lyp_6-31g+(d).inp 030470560.td-b3lyp_6-31g+(d).log.xz

030470560.td-b3lyp_6-31+g(d).qchem.inp (generated)

030470560.td-b3lyp_6-31+g(d).gjf (generated)

030470560.td-b3lyp_6-31+g(d).firefly.inp (generated)

030470560.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030470560.mol 030470560.PUBCHEM 030470560.mol (via Jmol)
030470562.b3lyp_6-31g(d).inp

030470562.b3lyp_6-31g(d).qchem.inp (generated)

030470562.b3lyp_6-31g(d).gjf (generated)

030470562.b3lyp_6-31g(d).firefly.inp (generated)

030470562.b3lyp_6-31g(d).smash.inp (generated)

030470562.b3lyp_6-31g(d).nwchem.inp (generated) 030470562.b3lyp_6-31g(d).log.xz 030470562.td-b3lyp_6-31g+(d).inp 030470562.td-b3lyp_6-31g+(d).log.xz

030470562.td-b3lyp_6-31+g(d).qchem.inp (generated)

030470562.td-b3lyp_6-31+g(d).gjf (generated)

030470562.td-b3lyp_6-31+g(d).firefly.inp (generated)

030470562.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030470562.mol 030470562.PUBCHEM 030470562.mol (via Jmol)
030470564.b3lyp_6-31g(d).inp

030470564.b3lyp_6-31g(d).qchem.inp (generated)

030470564.b3lyp_6-31g(d).gjf (generated)

030470564.b3lyp_6-31g(d).firefly.inp (generated)

030470564.b3lyp_6-31g(d).smash.inp (generated)

030470564.b3lyp_6-31g(d).nwchem.inp (generated) 030470564.b3lyp_6-31g(d).log.xz 030470564.td-b3lyp_6-31g+(d).inp 030470564.td-b3lyp_6-31g+(d).log.xz

030470564.td-b3lyp_6-31+g(d).qchem.inp (generated)

030470564.td-b3lyp_6-31+g(d).gjf (generated)

030470564.td-b3lyp_6-31+g(d).firefly.inp (generated)

030470564.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030470564.mol 030470564.PUBCHEM 030470564.mol (via Jmol)
030470578.b3lyp_6-31g(d).inp

030470578.b3lyp_6-31g(d).qchem.inp (generated)

030470578.b3lyp_6-31g(d).gjf (generated)

030470578.b3lyp_6-31g(d).firefly.inp (generated)

030470578.b3lyp_6-31g(d).smash.inp (generated)

030470578.b3lyp_6-31g(d).nwchem.inp (generated) 030470578.b3lyp_6-31g(d).log.xz 030470578.td-b3lyp_6-31g+(d).inp 030470578.td-b3lyp_6-31g+(d).log.xz

030470578.td-b3lyp_6-31+g(d).qchem.inp (generated)

030470578.td-b3lyp_6-31+g(d).gjf (generated)

030470578.td-b3lyp_6-31+g(d).firefly.inp (generated)

030470578.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030470578.mol 030470578.PUBCHEM 030470578.mol (via Jmol)
030470580.b3lyp_6-31g(d).inp

030470580.b3lyp_6-31g(d).qchem.inp (generated)

030470580.b3lyp_6-31g(d).gjf (generated)

030470580.b3lyp_6-31g(d).firefly.inp (generated)

030470580.b3lyp_6-31g(d).smash.inp (generated)

030470580.b3lyp_6-31g(d).nwchem.inp (generated) 030470580.b3lyp_6-31g(d).log.xz 030470580.mol 030470580.PUBCHEM 030470580.mol (via Jmol)
030470582.b3lyp_6-31g(d).inp

030470582.b3lyp_6-31g(d).qchem.inp (generated)

030470582.b3lyp_6-31g(d).gjf (generated)

030470582.b3lyp_6-31g(d).firefly.inp (generated)

030470582.b3lyp_6-31g(d).smash.inp (generated)

030470582.b3lyp_6-31g(d).nwchem.inp (generated) 030470582.b3lyp_6-31g(d).log.xz 030470582.td-b3lyp_6-31g+(d).inp 030470582.td-b3lyp_6-31g+(d).log.xz

030470582.td-b3lyp_6-31+g(d).qchem.inp (generated)

030470582.td-b3lyp_6-31+g(d).gjf (generated)

030470582.td-b3lyp_6-31+g(d).firefly.inp (generated)

030470582.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030470582.mol 030470582.PUBCHEM 030470582.mol (via Jmol)
030470586.b3lyp_6-31g(d).inp

030470586.b3lyp_6-31g(d).qchem.inp (generated)

030470586.b3lyp_6-31g(d).gjf (generated)

030470586.b3lyp_6-31g(d).firefly.inp (generated)

030470586.b3lyp_6-31g(d).smash.inp (generated)

030470586.b3lyp_6-31g(d).nwchem.inp (generated) 030470586.b3lyp_6-31g(d).log.xz 030470586.td-b3lyp_6-31g+(d).inp 030470586.td-b3lyp_6-31g+(d).log.xz

030470586.td-b3lyp_6-31+g(d).qchem.inp (generated)

030470586.td-b3lyp_6-31+g(d).gjf (generated)

030470586.td-b3lyp_6-31+g(d).firefly.inp (generated)

030470586.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030470586.mol 030470586.PUBCHEM 030470586.mol (via Jmol)
030470626.b3lyp_6-31g(d).inp

030470626.b3lyp_6-31g(d).qchem.inp (generated)

030470626.b3lyp_6-31g(d).gjf (generated)

030470626.b3lyp_6-31g(d).firefly.inp (generated)

030470626.b3lyp_6-31g(d).smash.inp (generated)

030470626.b3lyp_6-31g(d).nwchem.inp (generated) 030470626.b3lyp_6-31g(d).log.xz 030470626.td-b3lyp_6-31g+(d).inp 030470626.td-b3lyp_6-31g+(d).log.xz

030470626.td-b3lyp_6-31+g(d).qchem.inp (generated)

030470626.td-b3lyp_6-31+g(d).gjf (generated)

030470626.td-b3lyp_6-31+g(d).firefly.inp (generated)

030470626.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030470626.mol 030470626.PUBCHEM 030470626.mol (via Jmol)
030470939.b3lyp_6-31g(d).inp

030470939.b3lyp_6-31g(d).qchem.inp (generated)

030470939.b3lyp_6-31g(d).gjf (generated)

030470939.b3lyp_6-31g(d).firefly.inp (generated)

030470939.b3lyp_6-31g(d).smash.inp (generated)

030470939.b3lyp_6-31g(d).nwchem.inp (generated) 030470939.b3lyp_6-31g(d).log.xz 030470939.td-b3lyp_6-31g+(d).inp 030470939.td-b3lyp_6-31g+(d).log.xz

030470939.td-b3lyp_6-31+g(d).qchem.inp (generated)

030470939.td-b3lyp_6-31+g(d).gjf (generated)

030470939.td-b3lyp_6-31+g(d).firefly.inp (generated)

030470939.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030470939.mol 030470939.PUBCHEM 030470939.mol (via Jmol)
030472316.b3lyp_6-31g(d).inp

030472316.b3lyp_6-31g(d).qchem.inp (generated)

030472316.b3lyp_6-31g(d).gjf (generated)

030472316.b3lyp_6-31g(d).firefly.inp (generated)

030472316.b3lyp_6-31g(d).smash.inp (generated)

030472316.b3lyp_6-31g(d).nwchem.inp (generated) 030472316.b3lyp_6-31g(d).log.xz 030472316.td-b3lyp_6-31g+(d).inp 030472316.td-b3lyp_6-31g+(d).log.xz

030472316.td-b3lyp_6-31+g(d).qchem.inp (generated)

030472316.td-b3lyp_6-31+g(d).gjf (generated)

030472316.td-b3lyp_6-31+g(d).firefly.inp (generated)

030472316.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030472316.mol 030472316.PUBCHEM 030472316.mol (via Jmol)
030472318.b3lyp_6-31g(d).inp

030472318.b3lyp_6-31g(d).qchem.inp (generated)

030472318.b3lyp_6-31g(d).gjf (generated)

030472318.b3lyp_6-31g(d).firefly.inp (generated)

030472318.b3lyp_6-31g(d).smash.inp (generated)

030472318.b3lyp_6-31g(d).nwchem.inp (generated) 030472318.b3lyp_6-31g(d).log.xz 030472318.td-b3lyp_6-31g+(d).inp 030472318.td-b3lyp_6-31g+(d).log.xz

030472318.td-b3lyp_6-31+g(d).qchem.inp (generated)

030472318.td-b3lyp_6-31+g(d).gjf (generated)

030472318.td-b3lyp_6-31+g(d).firefly.inp (generated)

030472318.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030472318.mol 030472318.PUBCHEM 030472318.mol (via Jmol)
030472909.b3lyp_6-31g(d).inp

030472909.b3lyp_6-31g(d).qchem.inp (generated)

030472909.b3lyp_6-31g(d).gjf (generated)

030472909.b3lyp_6-31g(d).firefly.inp (generated)

030472909.b3lyp_6-31g(d).smash.inp (generated)

030472909.b3lyp_6-31g(d).nwchem.inp (generated) 030472909.b3lyp_6-31g(d).log.xz 030472909.mol 030472909.PUBCHEM 030472909.mol (via Jmol)
030473107.b3lyp_6-31g(d).inp

030473107.b3lyp_6-31g(d).qchem.inp (generated)

030473107.b3lyp_6-31g(d).gjf (generated)

030473107.b3lyp_6-31g(d).firefly.inp (generated)

030473107.b3lyp_6-31g(d).smash.inp (generated)

030473107.b3lyp_6-31g(d).nwchem.inp (generated) 030473107.b3lyp_6-31g(d).log.xz 030473107.td-b3lyp_6-31g+(d).inp 030473107.td-b3lyp_6-31g+(d).log.xz

030473107.td-b3lyp_6-31+g(d).qchem.inp (generated)

030473107.td-b3lyp_6-31+g(d).gjf (generated)

030473107.td-b3lyp_6-31+g(d).firefly.inp (generated)

030473107.td-b3lyp_6-31+g(d).nwchem.inp (generated) 030473107.mol 030473107.PUBCHEM 030473107.mol (via Jmol)


maho@riken.jp/maho.nakata@gmail.com