## Time[ps]   Etot[eV]   Epot[eV]   Ekin[eV]   <Etot>   <Edelta>   <Temp[K]>
     5.0000     -118.8096569    -120.7780194       1.9683625    -118.8096232    1.7255  305.6184
    10.0000     -118.8090190    -120.6097180       1.8006990    -118.8096485    1.7255  303.9563
    15.0000     -118.8092335    -120.4984570       1.6892235    -118.8096907    1.7255  306.3520
    20.0000     -118.8091616    -120.6662447       1.8570831    -118.8096758    1.7255  307.9720
    25.0000     -118.8091595    -120.5099420       1.7007826    -118.8096024    1.7255  305.4614
    30.0000     -118.8106551    -120.8502253       2.0395702    -118.8097585    1.7255  308.8416
    35.0000     -118.8083019    -120.4941531       1.6858513    -118.8096822    1.7255  308.5354
    40.0000     -118.8097466    -120.6771231       1.8673765    -118.8097407    1.7255  307.7152
    45.0000     -118.8095263    -120.6820346       1.8725082    -118.8096448    1.7255  305.3297
    50.0000     -118.8097591    -120.7067358       1.8969767    -118.8096981    1.7255  306.6995
    55.0000     -122.6924002    -122.6925290       0.0001288    -122.6174094    1.4372    3.3702
    60.0000     -122.6934110    -122.6934110       0.0000000    -122.6933405    1.4315    0.0027
    65.0000     -122.6934110    -122.6934110       0.0000000    -122.6934110    1.4315    0.0000