## Time[ps]   Etot[eV]   Epot[eV]   Ekin[eV]   <Etot>   <Edelta>   <Temp[K]>
     5.0000      -81.5235033     -83.2352500       1.7117468     -81.5236202    1.7891  407.1467
    10.0000      -81.5245645     -83.6418367       2.1172721     -81.5235667    1.7891  403.9032
    15.0000      -81.5236505     -83.2355276       1.7118770     -81.5235310    1.7891  400.2281
    20.0000      -81.5231664     -83.2772627       1.7540963     -81.5235076    1.7891  392.5972
    25.0000      -81.5232261     -83.2822563       1.7590301     -81.5235106    1.7891  390.2232
    30.0000      -81.5235377     -83.3427001       1.8191624     -81.5235024    1.7891  395.2352
    35.0000      -81.5235292     -83.1424800       1.6189508     -81.5235674    1.7891  399.7386
    40.0000      -81.5235476     -83.4913757       1.9678281     -81.5236093    1.7891  404.8589
    45.0000      -81.5235392     -83.3452010       1.8216618     -81.5236082    1.7891  402.6742
    50.0000      -81.5232987     -83.0918387       1.5685400     -81.5235792    1.7891  405.9008
    55.0000      -85.1651796     -85.1651870       0.0000074     -85.0904784    1.4492    5.2563
    60.0000      -85.1655378     -85.1655393       0.0000015     -85.1654185    1.4421    0.0019
    65.0000      -85.1655898     -85.1655899       0.0000001     -85.1655693    1.4420    0.0003
    70.0000      -85.1656002     -85.1656002       0.0000001     -85.1655962    1.4420    0.0001
    75.0000      -85.1656025     -85.1656026       0.0000000     -85.1656017    1.4420    0.0000
    80.0000      -85.1656030     -85.1656030       0.0000000     -85.1656028    1.4420    0.0000