## Time[ps]   Etot[eV]   Epot[eV]   Ekin[eV]   <Etot>   <Edelta>   <Temp[K]>
     5.0000     -110.8874404    -112.6682949       1.7808545    -110.8874812    1.7281  304.1306
    10.0000     -110.8872186    -112.4241647       1.5369461    -110.8874936    1.7281  306.1348
    15.0000     -110.8882029    -112.6969639       1.8087610    -110.8875157    1.7281  308.9278
    20.0000     -110.8875387    -112.6639668       1.7764280    -110.8875274    1.7281  308.2327
    25.0000     -110.8881736    -112.6823295       1.7941558    -110.8876015    1.7280  308.0241
    30.0000     -110.8882867    -112.8873622       1.9990755    -110.8876194    1.7280  309.8191
    35.0000     -110.8871023    -112.7232680       1.8361657    -110.8875130    1.7281  304.7408
    40.0000     -110.8873892    -112.6688391       1.7814499    -110.8875436    1.7281  309.2947
    45.0000     -110.8870734    -112.4108569       1.5237834    -110.8876040    1.7280  307.8126
    50.0000     -110.8869495    -112.6753200       1.7883705    -110.8875080    1.7281  307.0861
    55.0000     -114.5795922    -114.5795944       0.0000023    -114.5096675    1.4418    3.5831
    60.0000     -114.5796065    -114.5796065       0.0000000    -114.5796052    1.4362    0.0000
    65.0000     -114.5796065    -114.5796065       0.0000000    -114.5796065    1.4362    0.0000