           RANDOM_SEED =         533289179                0                0
                MDALGO =   2
               SCALING =       0
             HILLS_BIN =         500
               HILLS_H =  0.00100000
               HILLS_W =  0.00100000
       HILLS_MAXSTRIDE =      1
          HILLS_STRIDE =  1.50000000
      HILLS_VARIABLE_W =           F

   original number of atomic DOF:         24
   number of independent constraints:      0
   number of active DOF:                  24

========================================
         MD step No.       1
========================================

  Atomic velocities initialized by STEP_tb

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61782613E+02   -0.62096469E+02    0.31385638E+00    0.00000000E+00
    0.00000000E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    303.511

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00000   0.00000   0.00000   0.00000   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.       2
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786328E+02   -0.62112674E+02    0.32634555E+00    0.19701995E-07
    0.65559770E-06

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    315.588

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00001   0.00001   0.00000   0.00000   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.       3
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786628E+02   -0.62138732E+02    0.35209931E+00    0.36594045E-06
    0.41366448E-05

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    340.493

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00002   0.00002   0.00001   0.00001   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.       4
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787122E+02   -0.62169244E+02    0.38210614E+00    0.22750163E-05
    0.14006990E-04

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    369.511

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00006   0.00004   0.00002   0.00002   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.       5
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787645E+02   -0.62195704E+02    0.40801677E+00    0.81657176E-05
    0.34398758E-04

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    394.567

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00011   0.00007   0.00006   0.00004   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.       6
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787958E+02   -0.62209173E+02    0.42112634E+00    0.20440803E-04
    0.68862585E-04

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    407.245

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00019   0.00009   0.00011   0.00007   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.       7
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787905E+02   -0.62203982E+02    0.41591798E+00    0.39076308E-04
    0.11917660E-03

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    402.208

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00030   0.00012   0.00019   0.00009   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.       8
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787496E+02   -0.62180157E+02    0.39241681E+00    0.60132258E-04
    0.18459262E-03

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    379.482

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00042   0.00013   0.00030   0.00012   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.       9
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786872E+02   -0.62143439E+02    0.35622835E+00    0.77167978E-04
    0.26184153E-03

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    344.486

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00056   0.00014   0.00042   0.00013   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      10
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786220E+02   -0.62103173E+02    0.31652257E+00    0.84886860E-04
    0.34590456E-03

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    306.089

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00070   0.00014   0.00056   0.00014   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      11
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61785725E+02   -0.62069316E+02    0.28307809E+00    0.82173261E-04
    0.43127734E-03

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    273.747

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00083   0.00013   0.00070   0.00014   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      12
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61785489E+02   -0.62049611E+02    0.26353618E+00    0.72259960E-04
    0.51332073E-03

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    254.849

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00095   0.00012   0.00083   0.00013   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      13
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61785563E+02   -0.62047796E+02    0.26158340E+00    0.60382834E-04
    0.58931881E-03

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    252.961

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00106   0.00011   0.00095   0.00012   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      14
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61785913E+02   -0.62062936E+02    0.27631317E+00    0.51068693E-04
    0.65899111E-03

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    267.205

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00117   0.00010   0.00106   0.00011   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      15
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786426E+02   -0.62089977E+02    0.30277989E+00    0.46941238E-04
    0.72436977E-03

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    292.799

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00127   0.00011   0.00117   0.00010   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      16
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786973E+02   -0.62121363E+02    0.33355173E+00    0.49157145E-04
    0.78911779E-03

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    322.557

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00138   0.00011   0.00127   0.00011   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      17
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787406E+02   -0.62149245E+02    0.36092337E+00    0.58220104E-04
    0.85750355E-03

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    349.026

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00150   0.00013   0.00138   0.00011   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      18
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787624E+02   -0.62167659E+02    0.37902804E+00    0.74054862E-04
    0.93333581E-03

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    366.534

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00164   0.00015   0.00150   0.00013   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      19
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787637E+02   -0.62173886E+02    0.38513447E+00    0.95401236E-04
    0.10191500E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    372.439

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00180   0.00016   0.00164   0.00015   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      20
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787510E+02   -0.62168450E+02    0.37970511E+00    0.11947925E-03
    0.11158243E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    367.189

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00197   0.00018   0.00180   0.00016   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      21
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787293E+02   -0.62154199E+02    0.36554016E+00    0.14250871E-03
    0.12226356E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    353.491

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00216   0.00019   0.00197   0.00018   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      22
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786993E+02   -0.62135524E+02    0.34703205E+00    0.16093243E-03
    0.13376453E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    335.593

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00235   0.00020   0.00216   0.00019   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      23
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786615E+02   -0.62118212E+02    0.32996590E+00    0.17289622E-03
    0.14583125E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    319.089

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00255   0.00020   0.00235   0.00020   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      24
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786254E+02   -0.62108909E+02    0.32089246E+00    0.17948040E-03
    0.15823011E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    310.315

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00275   0.00020   0.00255   0.00020   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      25
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786173E+02   -0.62113035E+02    0.32496853E+00    0.18487105E-03
    0.17083810E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    314.257

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00296   0.00021   0.00275   0.00020   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      26
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786518E+02   -0.62131393E+02    0.34284278E+00    0.19509030E-03
    0.18371252E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    331.542

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00318   0.00022   0.00296   0.00021   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      27
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787178E+02   -0.62158135E+02    0.36877020E+00    0.21585436E-03
    0.19709850E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    356.615

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00341   0.00024   0.00318   0.00022   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      28
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787853E+02   -0.62182353E+02    0.39213682E+00    0.25026962E-03
    0.21134971E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    379.211

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00366   0.00026   0.00341   0.00024   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      29
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788219E+02   -0.62192803E+02    0.40201942E+00    0.29664175E-03
    0.22678321E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    388.768

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00393   0.00028   0.00366   0.00026   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      30
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788118E+02   -0.62182855E+02    0.39195527E+00    0.34715853E-03
    0.24353024E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    379.035

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00421   0.00030   0.00393   0.00028   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      31
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787626E+02   -0.62152996E+02    0.36236621E+00    0.38923900E-03
    0.26144768E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    350.422

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00451   0.00030   0.00421   0.00030   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      32
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786934E+02   -0.62110083E+02    0.31993689E+00    0.41031041E-03
    0.28012361E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    309.391

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00482   0.00030   0.00451   0.00030   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      33
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786242E+02   -0.62064526E+02    0.27489071E+00    0.40369078E-03
    0.29896905E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    265.830

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00511   0.00029   0.00482   0.00030   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      34
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61785730E+02   -0.62026929E+02    0.23765345E+00    0.37174174E-03
    0.31735885E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    229.820

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00540   0.00027   0.00511   0.00029   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      35
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61785488E+02   -0.62005297E+02    0.21613734E+00    0.32433836E-03
    0.33477591E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    209.013

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00566   0.00025   0.00540   0.00027   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      36
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61785558E+02   -0.62003458E+02    0.21411613E+00    0.27413321E-03
    0.35092083E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    207.058

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00590   0.00023   0.00566   0.00025   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      37
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61785901E+02   -0.62020505E+02    0.23071383E+00    0.23175414E-03
    0.36576454E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    223.109

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00612   0.00021   0.00590   0.00023   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      38
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786443E+02   -0.62051323E+02    0.26088082E+00    0.20340207E-03
    0.37953629E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    252.281

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00633   0.00021   0.00612   0.00021   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      39
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787066E+02   -0.62087810E+02    0.29662670E+00    0.19106890E-03
    0.39265381E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    286.849

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00654   0.00021   0.00633   0.00021   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      40
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787638E+02   -0.62120712E+02    0.32882385E+00    0.19382333E-03
    0.40561259E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    317.985

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00675   0.00022   0.00654   0.00021   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      41
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788030E+02   -0.62141743E+02    0.34931656E+00    0.20849946E-03
    0.41885943E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    337.802

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00697   0.00023   0.00675   0.00022   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      42
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788131E+02   -0.62145719E+02    0.35303184E+00    0.22950945E-03
    0.43267961E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    341.395

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00721   0.00024   0.00697   0.00023   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      43
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787891E+02   -0.62132181E+02    0.33956890E+00    0.24907308E-03
    0.44712685E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    328.376

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00745   0.00024   0.00721   0.00024   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      44
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787341E+02   -0.62105989E+02    0.31376902E+00    0.25920872E-03
    0.46201800E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    303.426

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00769   0.00024   0.00745   0.00024   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      45
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786628E+02   -0.62076603E+02    0.28494985E+00    0.25526234E-03
    0.47700016E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    275.557

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00792   0.00023   0.00769   0.00024   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      46
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61785976E+02   -0.62055742E+02    0.26461031E+00    0.23875448E-03
    0.49167954E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    255.888

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00815   0.00022   0.00792   0.00023   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      47
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61785679E+02   -0.62053699E+02    0.26274569E+00    0.21717258E-03
    0.50577967E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    254.085

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00837   0.00021   0.00815   0.00022   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      48
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61785914E+02   -0.62075053E+02    0.28374599E+00    0.20062226E-03
    0.51927842E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    274.393

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00858   0.00021   0.00837   0.00021   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      49
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786646E+02   -0.62115904E+02    0.32373468E+00    0.19806217E-03
    0.53246736E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    313.064

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00880   0.00022   0.00858   0.00021   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      50
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787588E+02   -0.62164546E+02    0.37128324E+00    0.21554873E-03
    0.54589798E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    359.045

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00903   0.00024   0.00880   0.00022   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      51
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788332E+02   -0.62205964E+02    0.41177421E+00    0.25576102E-03
    0.56022495E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    398.201

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00928   0.00027   0.00903   0.00024   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      52
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788598E+02   -0.62227951E+02    0.43327627E+00    0.31663519E-03
    0.57600575E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    418.994

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00957   0.00030   0.00928   0.00027   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      53
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788348E+02   -0.62225492E+02    0.43081975E+00    0.38966028E-03
    0.59353680E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    416.619

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.00988   0.00032   0.00957   0.00030   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      54
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787734E+02   -0.62201633E+02    0.40731080E+00    0.46094222E-03
    0.61278448E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    393.885

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01021   0.00034   0.00988   0.00032   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      55
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786991E+02   -0.62165196E+02    0.37135494E+00    0.51621554E-03
    0.63342429E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    359.114

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01056   0.00035   0.01021   0.00034   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      56
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786357E+02   -0.62127100E+02    0.33364606E+00    0.54686706E-03
    0.65495883E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    322.648

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01091   0.00035   0.01056   0.00035   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      57
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61785974E+02   -0.62096889E+02    0.30359387E+00    0.55302831E-03
    0.67686525E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    293.587

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01126   0.00035   0.01091   0.00035   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      58
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61785890E+02   -0.62080471E+02    0.28705145E+00    0.54225517E-03
    0.69872551E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    277.589

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01161   0.00035   0.01126   0.00035   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      59
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786072E+02   -0.62079208E+02    0.28540830E+00    0.52539777E-03
    0.72030786E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    276.000

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01195   0.00034   0.01161   0.00035   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      60
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786462E+02   -0.62090288E+02    0.29589792E+00    0.51240128E-03
    0.74158658E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    286.144

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01229   0.00034   0.01195   0.00034   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      61
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786936E+02   -0.62107830E+02    0.31275732E+00    0.50969110E-03
    0.76270406E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    302.448

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01263   0.00034   0.01229   0.00034   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      62
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787385E+02   -0.62124683E+02    0.32893981E+00    0.51918646E-03
    0.78389131E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    318.097

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01298   0.00035   0.01263   0.00034   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      63
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787707E+02   -0.62134351E+02    0.33805222E+00    0.53831436E-03
    0.80537059E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    326.909

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01333   0.00036   0.01298   0.00035   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      64
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787825E+02   -0.62132672E+02    0.33601331E+00    0.56068669E-03
    0.82726705E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    324.937

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01369   0.00036   0.01333   0.00036   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      65
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787717E+02   -0.62118766E+02    0.32197584E+00    0.57761412E-03
    0.84955211E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    311.363

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01405   0.00036   0.01369   0.00036   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      66
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787463E+02   -0.62095035E+02    0.29827142E+00    0.58056954E-03
    0.87203156E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    288.440

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01441   0.00036   0.01405   0.00036   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      67
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787134E+02   -0.62066249E+02    0.26960678E+00    0.56396170E-03
    0.89437756E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    260.720

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01477   0.00035   0.01441   0.00036   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      68
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786811E+02   -0.62038369E+02    0.24186840E+00    0.52717595E-03
    0.91619357E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    233.896

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01510   0.00033   0.01477   0.00035   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      69
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786563E+02   -0.62017254E+02    0.22084458E+00    0.47487634E-03
    0.93709589E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    213.565

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01542   0.00031   0.01510   0.00033   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      70
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786430E+02   -0.62007436E+02    0.21102216E+00    0.41542710E-03
    0.95679397E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    204.066

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01572   0.00028   0.01542   0.00031   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      71
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786410E+02   -0.62011498E+02    0.21497838E+00    0.35813482E-03
    0.97515286E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    207.892

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01599   0.00027   0.01572   0.00028   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      72
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786581E+02   -0.62029821E+02    0.23300681E+00    0.31100390E-03
    0.99222884E-02

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    225.326

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01625   0.00025   0.01599   0.00027   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      73
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786970E+02   -0.62059498E+02    0.26216667E+00    0.27936955E-03
    0.10082725E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    253.525

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01650   0.00025   0.01625   0.00025   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      74
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787445E+02   -0.62094172E+02    0.29622569E+00    0.26535351E-03
    0.10236877E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    286.461

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01674   0.00025   0.01650   0.00025   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      75
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787810E+02   -0.62126113E+02    0.32764543E+00    0.26822343E-03
    0.10389456E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    316.845

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01700   0.00025   0.01674   0.00025   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      76
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787950E+02   -0.62149252E+02    0.35047252E+00    0.28509686E-03
    0.10544815E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    338.920

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01726   0.00027   0.01700   0.00025   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      77
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787831E+02   -0.62161118E+02    0.36226912E+00    0.31160659E-03
    0.10706128E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    350.328

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01753   0.00028   0.01726   0.00027   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      78
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787537E+02   -0.62163082E+02    0.36432650E+00    0.34278543E-03
    0.10875052E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    352.317

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01781   0.00029   0.01753   0.00028   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      79
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787237E+02   -0.62159018E+02    0.36035473E+00    0.37436250E-03
    0.11051899E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    348.476

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01811   0.00030   0.01781   0.00029   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      80
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787055E+02   -0.62153096E+02    0.35440158E+00    0.40386355E-03
    0.11236134E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    342.720

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01842   0.00031   0.01811   0.00030   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      81
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787007E+02   -0.62147962E+02    0.34909696E+00    0.43073829E-03
    0.11426935E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    337.590

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01873   0.00032   0.01842   0.00031   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      82
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787069E+02   -0.62144178E+02    0.34503001E+00    0.45548781E-03
    0.11623555E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    333.657

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01906   0.00033   0.01873   0.00032   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      83
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787173E+02   -0.62140678E+02    0.34120163E+00    0.47850187E-03
    0.11825408E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    329.955

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01939   0.00034   0.01906   0.00033   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      84
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787255E+02   -0.62135789E+02    0.33600253E+00    0.49923634E-03
    0.12031938E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    324.927

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.01973   0.00034   0.01939   0.00034   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      85
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787290E+02   -0.62128247E+02    0.32819815E+00    0.51605324E-03
    0.12242402E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    317.380

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02008   0.00035   0.01973   0.00034   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      86
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787251E+02   -0.62117735E+02    0.31750130E+00    0.52670464E-03
    0.12455698E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    307.036

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02042   0.00035   0.02008   0.00035   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      87
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787187E+02   -0.62105037E+02    0.30465081E+00    0.52912822E-03
    0.12670331E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    294.609

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02077   0.00034   0.02042   0.00035   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      88
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787101E+02   -0.62091617E+02    0.29110932E+00    0.52223622E-03
    0.12884507E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    281.514

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02111   0.00034   0.02077   0.00034   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      89
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787041E+02   -0.62079171E+02    0.27852675E+00    0.50633056E-03
    0.13096343E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    269.346

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02144   0.00033   0.02111   0.00034   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      90
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787037E+02   -0.62069083E+02    0.26825930E+00    0.48298957E-03
    0.13304091E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    259.417

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02177   0.00032   0.02144   0.00033   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      91
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787071E+02   -0.62062101E+02    0.26106902E+00    0.45458298E-03
    0.13506323E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    252.463

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02208   0.00031   0.02177   0.00032   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      92
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787092E+02   -0.62058476E+02    0.25725873E+00    0.42364941E-03
    0.13702042E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    248.779

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02239   0.00030   0.02208   0.00031   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      93
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787084E+02   -0.62058510E+02    0.25714201E+00    0.39262712E-03
    0.13890728E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    248.666

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02268   0.00029   0.02239   0.00030   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      94
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787014E+02   -0.62062954E+02    0.26150392E+00    0.36392132E-03
    0.14072378E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    252.884

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02296   0.00028   0.02268   0.00029   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      95
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786924E+02   -0.62073504E+02    0.27199198E+00    0.34022721E-03
    0.14247632E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    263.026

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02324   0.00027   0.02296   0.00028   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      96
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786906E+02   -0.62092146E+02    0.29049638E+00    0.32501647E-03
    0.14417989E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    280.921

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02351   0.00027   0.02324   0.00027   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      97
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787106E+02   -0.62119323E+02    0.31730889E+00    0.32241124E-03
    0.14586060E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    306.850

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02378   0.00028   0.02351   0.00027   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      98
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787496E+02   -0.62152148E+02    0.34955994E+00    0.33641705E-03
    0.14755595E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    338.037

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02406   0.00029   0.02378   0.00028   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.      99
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787900E+02   -0.62184811E+02    0.38161039E+00    0.36981002E-03
    0.14931083E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    369.031

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02436   0.00031   0.02406   0.00029   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     100
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788102E+02   -0.62211302E+02    0.40765993E+00    0.42315759E-03
    0.15116983E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    394.222

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02469   0.00033   0.02436   0.00031   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     101
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788010E+02   -0.62228624E+02    0.42480257E+00    0.49455127E-03
    0.15316932E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    410.800

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02504   0.00036   0.02469   0.00033   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     102
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787708E+02   -0.62238185E+02    0.43436278E+00    0.58068043E-03
    0.15533353E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    420.045

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02541   0.00039   0.02504   0.00036   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     103
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787369E+02   -0.62244789E+02    0.44097392E+00    0.67919083E-03
    0.15767629E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    426.438

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02582   0.00042   0.02541   0.00039   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     104
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787088E+02   -0.62254127E+02    0.45022646E+00    0.79128507E-03
    0.16020740E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    435.386

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02626   0.00046   0.02582   0.00042   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     105
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786829E+02   -0.62271124E+02    0.46707805E+00    0.92305562E-03
    0.16294030E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    451.682

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02674   0.00050   0.02626   0.00046   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     106
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786939E+02   -0.62299510E+02    0.49489505E+00    0.10866000E-02
    0.16589898E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    478.582

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02726   0.00054   0.02674   0.00050   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     107
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787140E+02   -0.62338213E+02    0.53286145E+00    0.12997159E-02
    0.16912247E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    515.297

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02783   0.00060   0.02726   0.00054   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     108
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787364E+02   -0.62383701E+02    0.57748900E+00    0.15815088E-02
    0.17266379E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    558.453

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02846   0.00067   0.02783   0.00060   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     109
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787750E+02   -0.62431893E+02    0.62453174E+00    0.19526903E-02
    0.17658519E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    603.945

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02916   0.00074   0.02846   0.00067   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     110
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788130E+02   -0.62476834E+02    0.66817667E+00    0.24315582E-02
    0.18095231E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    646.152

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.02995   0.00083   0.02916   0.00074   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     111
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788367E+02   -0.62513042E+02    0.70306358E+00    0.30290625E-02
    0.18582608E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    679.889

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.03083   0.00092   0.02995   0.00083   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     112
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788346E+02   -0.62537681E+02    0.72646318E+00    0.37461145E-02
    0.19125542E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    702.517

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.03180   0.00102   0.03083   0.00092   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     113
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788139E+02   -0.62551485E+02    0.73904370E+00    0.45751091E-02
    0.19727339E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    714.683

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.03286   0.00112   0.03180   0.00102   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     114
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787947E+02   -0.62557653E+02    0.74381122E+00    0.55048418E-02
    0.20389804E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    719.293

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.03403   0.00122   0.03286   0.00112   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     115
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787909E+02   -0.62559444E+02    0.74389655E+00    0.65252469E-02
    0.21113640E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    719.376

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.03530   0.00131   0.03403   0.00122   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     116
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788009E+02   -0.62557975E+02    0.74043933E+00    0.76280127E-02
    0.21898867E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    716.032

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.03666   0.00141   0.03530   0.00131   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     117
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788147E+02   -0.62551901E+02    0.73220789E+00    0.88013976E-02
    0.22744985E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    708.072

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.03812   0.00151   0.03666   0.00141   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     118
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788144E+02   -0.62539202E+02    0.71738234E+00    0.10024628E-01
    0.23650816E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    693.735

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.03967   0.00160   0.03812   0.00151   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     119
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787963E+02   -0.62519740E+02    0.69589486E+00    0.11268396E-01
    0.24614269E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    672.956

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.04131   0.00168   0.03967   0.00160   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     120
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787660E+02   -0.62496366E+02    0.67057061E+00    0.12503070E-01
    0.25632342E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    648.467

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.04304   0.00176   0.04131   0.00168   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     121
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787326E+02   -0.62474088E+02    0.64635007E+00    0.13710640E-01
    0.26701510E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    625.045

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.04484   0.00184   0.04304   0.00176   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     122
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787093E+02   -0.62458177E+02    0.62837251E+00    0.14892906E-01
    0.27818411E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    607.660

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.04671   0.00191   0.04484   0.00184   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     123
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787041E+02   -0.62452320E+02    0.62022591E+00    0.16072404E-01
    0.28980545E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    599.782

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.04865   0.00198   0.04671   0.00191   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     124
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787181E+02   -0.62457534E+02    0.62287979E+00    0.17286386E-01
    0.30186776E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    602.348

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.05067   0.00205   0.04865   0.00198   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     125
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787473E+02   -0.62471935E+02    0.63444835E+00    0.18576323E-01
    0.31437463E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    613.535

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.05276   0.00213   0.05067   0.00205   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     126
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787877E+02   -0.62491230E+02    0.65064263E+00    0.19976016E-01
    0.32734197E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    629.196

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.05493   0.00221   0.05276   0.00213   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     127
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788254E+02   -0.62509607E+02    0.66577310E+00    0.21500791E-01
    0.34079211E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    643.827

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.05718   0.00229   0.05493   0.00221   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     128
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788547E+02   -0.62521331E+02    0.67416939E+00    0.23140120E-01
    0.35474584E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    651.947

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.05951   0.00237   0.05718   0.00229   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     129
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788655E+02   -0.62522181E+02    0.67174870E+00    0.24856581E-01
    0.36921468E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    649.606

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.06192   0.00246   0.05951   0.00237   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     130
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788539E+02   -0.62510746E+02    0.65719509E+00    0.26592638E-01
    0.38419513E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    635.532

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.06442   0.00253   0.06192   0.00246   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     131
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788243E+02   -0.62488900E+02    0.63240638E+00    0.28284385E-01
    0.39966693E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    611.561

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.06698   0.00260   0.06442   0.00253   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     132
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787831E+02   -0.62461500E+02    0.60223067E+00    0.29879190E-01
    0.41559570E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    582.380

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.06962   0.00267   0.06698   0.00260   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     133
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787305E+02   -0.62435602E+02    0.57375037E+00    0.31353308E-01
    0.43193964E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    554.838

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.07231   0.00272   0.06962   0.00267   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     134
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786749E+02   -0.62419810E+02    0.55546857E+00    0.32726374E-01
    0.44865950E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    537.159

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.07506   0.00278   0.07231   0.00272   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     135
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786327E+02   -0.62423037E+02    0.55606589E+00    0.34071158E-01
    0.46573036E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    537.736

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.07787   0.00284   0.07506   0.00278   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     136
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786236E+02   -0.62452181E+02    0.58211629E+00    0.35513551E-01
    0.48315368E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    562.928

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.08074   0.00290   0.07787   0.00284   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     137
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786580E+02   -0.62509025E+02    0.63513227E+00    0.37217054E-01
    0.50096623E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    614.197

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.08369   0.00299   0.08074   0.00290   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     138
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787296E+02   -0.62588310E+02    0.70973912E+00    0.39350491E-01
    0.51924208E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    686.344

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.08672   0.00309   0.08369   0.00299   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     139
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788136E+02   -0.62678918E+02    0.79492330E+00    0.42049931E-01
    0.53808512E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    768.720

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.08987   0.00321   0.08672   0.00309   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     140
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788767E+02   -0.62767783E+02    0.87786341E+00    0.45391262E-01
    0.55761394E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    848.927

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.09315   0.00335   0.08987   0.00321   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     141
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61789040E+02   -0.62844575E+02    0.94835820E+00    0.49381702E-01
    0.57794421E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    917.098

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.09657   0.00350   0.09315   0.00335   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     142
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788945E+02   -0.62904544E+02    0.10017072E+01    0.53974451E-01
    0.59917462E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    968.688

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.10015   0.00366   0.09657   0.00350   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     143
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788634E+02   -0.62948731E+02    0.10388612E+01    0.59097618E-01
    0.62138026E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1004.617

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.10389   0.00383   0.10015   0.00366   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     144
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788279E+02   -0.62982091E+02    0.10646657E+01    0.64685756E-01
    0.64461393E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1029.571

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.10781   0.00400   0.10389   0.00383   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     145
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787970E+02   -0.63011102E+02    0.10855364E+01    0.70704402E-01
    0.66891266E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1049.754

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.11190   0.00418   0.10781   0.00400   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     146
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787735E+02   -0.63041905E+02    0.11075767E+01    0.77163270E-01
    0.69430661E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1071.068

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.11618   0.00437   0.11190   0.00418   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     147
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787575E+02   -0.63079601E+02    0.11358245E+01    0.84118759E-01
    0.72082757E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1098.385

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.12064   0.00456   0.11618   0.00437   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     148
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787500E+02   -0.63128428E+02    0.11744019E+01    0.91674714E-01
    0.74851600E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1135.690

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.12530   0.00476   0.12064   0.00456   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     149
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787528E+02   -0.63191700E+02    0.12264450E+01    0.99984323E-01
    0.77742678E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1186.018

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.13017   0.00498   0.12530   0.00476   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     150
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61787741E+02   -0.63270870E+02    0.12931188E+01    0.10924713E+00
    0.80763355E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1250.494

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.13526   0.00521   0.13017   0.00498   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     151
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788315E+02   -0.63363779E+02    0.13718526E+01    0.11968858E+00
    0.83923021E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1326.633

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.14060   0.00546   0.13526   0.00521   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     152
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61789254E+02   -0.63462744E+02    0.14547452E+01    0.13151276E+00
    0.87232715E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1406.793

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.14619   0.00573   0.14060   0.00546   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     153
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61790356E+02   -0.63554643E+02    0.15287555E+01    0.14482782E+00
    0.90704026E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1478.364

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.15206   0.00601   0.14619   0.00573   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     154
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61791244E+02   -0.63623987E+02    0.15788269E+01    0.15956815E+00
    0.94347279E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1526.785

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.15822   0.00631   0.15206   0.00601   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     155
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61791489E+02   -0.63658636E+02    0.15935228E+01    0.17545449E+00
    0.98169469E-01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1540.996

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.16467   0.00660   0.15822   0.00631   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     156
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61790783E+02   -0.63656127E+02    0.15711346E+01    0.19203685E+00
    0.10217270E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1519.346

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.17141   0.00688   0.16467   0.00660   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     157
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61789138E+02   -0.63628151E+02    0.15238188E+01    0.20884028E+00
    0.10635396E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1473.590

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.17843   0.00715   0.17141   0.00688   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     158
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786962E+02   -0.63600602E+02    0.14773398E+01    0.22559356E+00
    0.11070686E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1428.643

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.18571   0.00741   0.17843   0.00715   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     159
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786134E+02   -0.63606568E+02    0.14627482E+01    0.24246048E+00
    0.11522515E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1414.532

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.19326   0.00768   0.18571   0.00741   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     160
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61782894E+02   -0.63674520E+02    0.15116266E+01    0.26009228E+00
    0.11990704E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1461.799

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.20108   0.00796   0.19326   0.00768   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     161
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61783744E+02   -0.63827374E+02    0.16390942E+01    0.27977646E+00
    0.12475959E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1585.065

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.20920   0.00829   0.20108   0.00796   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     162
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61785228E+02   -0.64054970E+02    0.18370441E+01    0.30289706E+00
    0.12980067E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1776.490

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.21768   0.00866   0.20920   0.00829   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     163
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786966E+02   -0.64341620E+02    0.20886914E+01    0.33090400E+00
    0.13505803E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   2019.842

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.22656   0.00910   0.21768   0.00866   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     164
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61788498E+02   -0.64663654E+02    0.23695213E+01    0.36506816E+00
    0.14056690E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   2291.416

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.23590   0.00960   0.22656   0.00910   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     165
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61789630E+02   -0.65000396E+02    0.26579688E+01    0.40643027E+00
    0.14636664E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   2570.355

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.24578   0.01016   0.23590   0.00960   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     166
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61790709E+02   -0.65335776E+02    0.29367408E+01    0.45582820E+00
    0.15249773E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   2839.938

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.25626   0.01079   0.24578   0.01016   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     167
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61792021E+02   -0.65653500E+02    0.31886248E+01    0.51385469E+00
    0.15899929E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   3083.519

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.26740   0.01147   0.25626   0.01079   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     168
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61793685E+02   -0.65933479E+02    0.33931962E+01    0.58069079E+00
    0.16590664E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   3281.347

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.27923   0.01219   0.26740   0.01147   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     169
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61795667E+02   -0.66150263E+02    0.35254885E+01    0.65585958E+00
    0.17324844E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   3409.279

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.29179   0.01293   0.27923   0.01219   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     170
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61797987E+02   -0.66272922E+02    0.35559969E+01    0.73789482E+00
    0.18104319E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   3438.782

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.30509   0.01367   0.29179   0.01293   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     171
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61800223E+02   -0.66266633E+02    0.34531198E+01    0.82399451E+00
    0.18929515E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   3339.296

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.31911   0.01436   0.30509   0.01367   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     172
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61801775E+02   -0.66099218E+02    0.31896709E+01    0.90978186E+00
    0.19798998E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   3084.531

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.33377   0.01498   0.31911   0.01436   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     173
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61800910E+02   -0.65753783E+02    0.27563406E+01    0.98944111E+00
    0.20709099E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   2665.484

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.34900   0.01548   0.33377   0.01498   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     174
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61795399E+02   -0.65255036E+02    0.21864865E+01    0.10566122E+01
    0.21653806E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   2114.414

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.36466   0.01584   0.34900   0.01548   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     175
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61784444E+02   -0.64701944E+02    0.15846651E+01    0.11065822E+01
    0.22625247E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1532.430

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.38061   0.01607   0.36466   0.01584   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     176
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61772768E+02   -0.64273576E+02    0.11252261E+01    0.11394306E+01
    0.23615148E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1088.136

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.39676   0.01623   0.38061   0.01607   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     177
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61769229E+02   -0.64157962E+02    0.98046810E+00    0.11620923E+01
    0.24617221E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    948.149

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.41308   0.01640   0.39676   0.01623   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     178
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777663E+02   -0.64423200E+02    0.12027832E+01    0.11864589E+01
    0.25629480E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1163.136

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.42961   0.01666   0.41308   0.01640   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     179
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61791552E+02   -0.64956385E+02    0.16745056E+01    0.12237779E+01
    0.26654929E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1619.309

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.44645   0.01703   0.42961   0.01666   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     180
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61801896E+02   -0.65545384E+02    0.21867989E+01    0.12796894E+01
    0.27699989E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   2114.716

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.46372   0.01751   0.44645   0.01703   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     181
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61805251E+02   -0.66007954E+02    0.25618571E+01    0.13531291E+01
    0.28771670E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   2477.411

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.48151   0.01806   0.46372   0.01751   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     182
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61803022E+02   -0.66254581E+02    0.27145538E+01    0.14382540E+01
    0.29875130E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   2625.075

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.49984   0.01861   0.48151   0.01806   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     183
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61797867E+02   -0.66280479E+02    0.26453110E+01    0.15271767E+01
    0.31012475E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   2558.114

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.51870   0.01912   0.49984   0.01861   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     184
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61791868E+02   -0.66132653E+02    0.24066722E+01    0.16122856E+01
    0.32182743E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   2327.342

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.53804   0.01956   0.51870   0.01912   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     185
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61786326E+02   -0.65880322E+02    0.20723372E+01    0.16878327E+01
    0.33382611E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   2004.027

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.55778   0.01992   0.53804   0.01956   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     186
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61782069E+02   -0.65594430E+02    0.17155427E+01    0.17507441E+01
    0.34607420E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1658.994

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.57784   0.02020   0.55778   0.01992   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     187
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61779509E+02   -0.65334000E+02    0.13952805E+01    0.18006889E+01
    0.35852188E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1349.288

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.59815   0.02042   0.57784   0.02020   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     188
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778552E+02   -0.65138120E+02    0.11489148E+01    0.18395287E+01
    0.37112433E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1111.043

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.61866   0.02059   0.59815   0.02042   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     189
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778238E+02   -0.65026293E+02    0.99379312E+00    0.18704149E+01
    0.38384697E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    961.035

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.63932   0.02074   0.61866   0.02059   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     190
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61779110E+02   -0.65004795E+02    0.93194004E+00    0.18970773E+01
    0.39666794E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    901.221

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.66013   0.02088   0.63932   0.02074   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     191
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61780822E+02   -0.65064280E+02    0.95069734E+00    0.19231825E+01
    0.40957838E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    919.360

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.68109   0.02103   0.66013   0.02088   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     192
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61782841E+02   -0.65182448E+02    0.10253559E+01    0.19516706E+01
    0.42258074E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    991.557

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.70221   0.02121   0.68109   0.02103   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     193
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61784231E+02   -0.65329656E+02    0.11254136E+01    0.19843263E+01
    0.43568525E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1088.317

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.72351   0.02141   0.70221   0.02121   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     194
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61785218E+02   -0.65480615E+02    0.12248182E+01    0.20216722E+01
    0.44890575E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1184.445

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.74503   0.02163   0.72351   0.02141   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     195
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61785898E+02   -0.65615752E+02    0.13042284E+01    0.20633689E+01
    0.46225602E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1261.237

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.76678   0.02186   0.74503   0.02163   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     196
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61785984E+02   -0.65719265E+02    0.13492421E+01    0.21082923E+01
    0.47574706E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1304.767

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.78876   0.02210   0.76678   0.02186   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     197
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61785502E+02   -0.65783571E+02    0.13538815E+01    0.21548023E+01
    0.48938515E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1309.254

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.81098   0.02234   0.78876   0.02210   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     198
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61784582E+02   -0.65810205E+02    0.13213220E+01    0.22011307E+01
    0.50317094E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1277.768

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.83342   0.02256   0.81098   0.02234   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     199
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61783600E+02   -0.65808057E+02    0.12615927E+01    0.22457642E+01
    0.51709995E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1220.007

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.85609   0.02277   0.83342   0.02256   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     200
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61782380E+02   -0.65789465E+02    0.11882262E+01    0.22876950E+01
    0.53116391E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1149.059

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.87896   0.02296   0.85609   0.02277   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     201
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61781260E+02   -0.65771303E+02    0.11181316E+01    0.23265587E+01
    0.54535266E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1081.275

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.90201   0.02314   0.87896   0.02296   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     202
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61780595E+02   -0.65769692E+02    0.10666173E+01    0.23628231E+01
    0.55965647E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1031.459

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.92524   0.02331   0.90201   0.02314   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     203
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61780620E+02   -0.65794577E+02    0.10423343E+01    0.23975554E+01
    0.57406817E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1007.976

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.94864   0.02348   0.92524   0.02331   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     204
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61781130E+02   -0.65846299E+02    0.10445107E+01    0.24320733E+01
    0.58858432E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1010.081

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.97220   0.02365   0.94864   0.02348   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     205
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61781642E+02   -0.65916313E+02    0.10640275E+01    0.24674389E+01
    0.60320511E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1028.954

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   0.99594   0.02383   0.97220   0.02365   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     206
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61782017E+02   -0.65993614E+02    0.10894485E+01    0.25042151E+01
    0.61793315E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1053.537

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.01986   0.02401   0.99594   0.02383   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     207
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61782004E+02   -0.66068567E+02    0.11113439E+01    0.25424473E+01
    0.63277186E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1074.711

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.04396   0.02419   1.01986   0.02401   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     208
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61781634E+02   -0.66136366E+02    0.11251807E+01    0.25818264E+01
    0.64772424E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1088.092

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.06824   0.02438   1.04396   0.02419   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     209
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61781154E+02   -0.66197258E+02    0.11313604E+01    0.26219511E+01
    0.66279217E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1094.068

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.09271   0.02457   1.06824   0.02438   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     210
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61780750E+02   -0.66254078E+02    0.11328332E+01    0.26625190E+01
    0.67797647E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1095.492

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.11738   0.02475   1.09271   0.02457   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     211
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61780569E+02   -0.66309535E+02    0.11323032E+01    0.27033853E+01
    0.69327732E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1094.979

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.14222   0.02494   1.11738   0.02475   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     212
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61780596E+02   -0.66363746E+02    0.11299613E+01    0.27444940E+01
    0.70869461E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1092.715

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.16726   0.02513   1.14222   0.02494   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     213
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61780685E+02   -0.66415355E+02    0.11247329E+01    0.27857091E+01
    0.72422795E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1087.659

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.19248   0.02531   1.16726   0.02513   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     214
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61781005E+02   -0.66461175E+02    0.11134322E+01    0.28268605E+01
    0.73987654E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1076.730

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.21788   0.02549   1.19248   0.02531   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     215
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61781420E+02   -0.66493818E+02    0.10892777E+01    0.28674818E+01
    0.75563872E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1053.372

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.24347   0.02567   1.21788   0.02549   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     216
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61781741E+02   -0.66504632E+02    0.10446781E+01    0.29067021E+01
    0.77151103E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000   1010.243

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.26922   0.02583   1.24347   0.02567   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     217
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61781600E+02   -0.66486478E+02    0.97413605E+00    0.29432552E+01
    0.78748716E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    942.026

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.29512   0.02597   1.26922   0.02583   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     218
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61780839E+02   -0.66438521E+02    0.87845345E+00    0.29756715E+01
    0.80355721E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    849.497

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.32115   0.02609   1.29512   0.02597   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     219
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61779852E+02   -0.66368822E+02    0.76653708E+00    0.30027251E+01
    0.81970781E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    741.270

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.34728   0.02618   1.32115   0.02609   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     220
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778671E+02   -0.66291529E+02    0.65309914E+00    0.30238363E+01
    0.83592335E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    631.571

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.37350   0.02625   1.34728   0.02618   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     221
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777675E+02   -0.66224457E+02    0.55529046E+00    0.30393028E+01
    0.85218803E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    536.987

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.39977   0.02630   1.37350   0.02625   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     222
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777223E+02   -0.66183903E+02    0.48784990E+00    0.30503416E+01
    0.86848824E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    471.769

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.42608   0.02633   1.39977   0.02630   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     223
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777357E+02   -0.66179034E+02    0.45805272E+00    0.30588100E+01
    0.88481454E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    442.954

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.45243   0.02637   1.42608   0.02633   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     224
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777871E+02   -0.66210016E+02    0.46426380E+00    0.30667181E+01
    0.90116270E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    448.960

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.47882   0.02640   1.45243   0.02637   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     225
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61780937E+02   -0.66271918E+02    0.49765643E+00    0.30757918E+01
    0.91753351E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    481.252

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.50524   0.02645   1.47882   0.02640   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     226
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61781479E+02   -0.66349129E+02    0.54656851E+00    0.30871502E+01
    0.93393152E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    528.552

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.53173   0.02651   1.50524   0.02645   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     227
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61781880E+02   -0.66433849E+02    0.60026836E+00    0.31013374E+01
    0.95036348E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    580.482

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.55828   0.02659   1.53173   0.02651   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     228
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61782148E+02   -0.66516629E+02    0.64928685E+00    0.31183574E+01
    0.96683681E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    627.885

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.58491   0.02667   1.55828   0.02659   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     229
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61782306E+02   -0.66589359E+02    0.68593343E+00    0.31377615E+01
    0.98335830E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    663.323

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.61162   0.02676   1.58491   0.02667   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     230
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61782330E+02   -0.66645311E+02    0.70431401E+00    0.31587347E+01
    0.99993302E+00

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    681.098

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.63842   0.02685   1.61162   0.02676   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     231
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61782193E+02   -0.66679600E+02    0.70065456E+00    0.31801880E+01
    0.10165635E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    677.559

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.66532   0.02694   1.63842   0.02685   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     232
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61781865E+02   -0.66689873E+02    0.67387710E+00    0.32008810E+01
    0.10332492E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    651.664

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.69229   0.02701   1.66532   0.02694   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     233
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61781376E+02   -0.66676994E+02    0.62605115E+00    0.32195809E+01
    0.10499862E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    605.415

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.71934   0.02708   1.69229   0.02701   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     234
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61780735E+02   -0.66645220E+02    0.56247402E+00    0.32352429E+01
    0.10667681E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    543.933

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.74645   0.02713   1.71934   0.02708   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     235
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61780006E+02   -0.66602037E+02    0.49125966E+00    0.32471856E+01
    0.10835857E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    475.066

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.77359   0.02716   1.74645   0.02713   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     236
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61779288E+02   -0.66557329E+02    0.42237888E+00    0.32552322E+01
    0.11004293E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    408.456

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.80077   0.02718   1.77359   0.02716   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     237
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778715E+02   -0.66521897E+02    0.36611284E+00    0.32597806E+01
    0.11172892E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    354.045

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.82795   0.02719   1.80077   0.02718   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     238
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778415E+02   -0.66505373E+02    0.33103037E+00    0.32617707E+01
    0.11341576E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    320.119

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.85515   0.02719   1.82795   0.02719   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     239
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778458E+02   -0.66513952E+02    0.32193414E+00    0.32625306E+01
    0.11510295E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    311.322

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.88234   0.02720   1.85515   0.02719   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     240
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778810E+02   -0.66548751E+02    0.33851581E+00    0.32635212E+01
    0.11679037E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    327.357

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.90955   0.02721   1.88234   0.02720   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     241
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61779388E+02   -0.66605564E+02    0.37535287E+00    0.32660404E+01
    0.11847824E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    362.980

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.93677   0.02723   1.90955   0.02721   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     242
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61780027E+02   -0.66675960E+02    0.42329033E+00    0.32709724E+01
    0.12016707E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    409.338

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.96401   0.02726   1.93677   0.02723   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     243
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61780593E+02   -0.66749384E+02    0.47157670E+00    0.32786397E+01
    0.12185753E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    456.032

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   1.99130   0.02730   1.96401   0.02726   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     244
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61780997E+02   -0.66815306E+02    0.51002756E+00    0.32887780E+01
    0.12355029E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    493.216

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.01862   0.02735   1.99130   0.02730   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     245
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61781199E+02   -0.66864913E+02    0.53064043E+00    0.33006144E+01
    0.12524588E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    513.149

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.04600   0.02740   2.01862   0.02735   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     246
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61781154E+02   -0.66892152E+02    0.52853973E+00    0.33130132E+01
    0.12694458E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    511.118

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.07343   0.02745   2.04600   0.02740   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     247
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61780950E+02   -0.66894396E+02    0.50232496E+00    0.33246582E+01
    0.12864636E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    485.767

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.10090   0.02749   2.07343   0.02745   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     248
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61780526E+02   -0.66872375E+02    0.45409684E+00    0.33342433E+01
    0.13035087E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    439.129

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.12841   0.02752   2.10090   0.02749   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     249
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61779885E+02   -0.66830729E+02    0.38960147E+00    0.33406674E+01
    0.13205742E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    376.759

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.15593   0.02753   2.12841   0.02752   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     250
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61779080E+02   -0.66778206E+02    0.31822713E+00    0.33432469E+01
    0.13376513E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    307.738

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.18346   0.02752   2.15593   0.02753   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     251
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778265E+02   -0.66726995E+02    0.25209079E+00    0.33419095E+01
    0.13547299E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    243.781

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.21097   0.02750   2.18346   0.02752   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     252
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777658E+02   -0.66690492E+02    0.20373461E+00    0.33372992E+01
    0.13718009E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    197.019

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.23846   0.02748   2.21097   0.02750   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     253
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777469E+02   -0.66679782E+02    0.18274498E+00    0.33307102E+01
    0.13888577E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    176.721

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.26592   0.02745   2.23846   0.02748   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     254
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777776E+02   -0.66700059E+02    0.19256508E+00    0.33238205E+01
    0.14058971E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    186.218

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.29336   0.02743   2.26592   0.02745   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     255
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778472E+02   -0.66748749E+02    0.22907147E+00    0.33182850E+01
    0.14229207E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    221.521

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.32078   0.02741   2.29336   0.02743   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     256
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61779304E+02   -0.66816373E+02    0.28180814E+00    0.33153273E+01
    0.14399333E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    272.519

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.34820   0.02741   2.32078   0.02741   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     257
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61780025E+02   -0.66889742E+02    0.33729981E+00    0.33154740E+01
    0.14569424E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    326.181

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.37562   0.02743   2.34820   0.02741   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     258
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61780483E+02   -0.66955715E+02    0.38277539E+00    0.33185008E+01
    0.14739555E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    370.158

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.40305   0.02745   2.37562   0.02743   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     259
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61780641E+02   -0.67004031E+02    0.40885084E+00    0.33235602E+01
    0.14909790E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    395.374

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.43051   0.02747   2.40305   0.02745   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     260
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61780337E+02   -0.67028771E+02    0.41100548E+00    0.33294118E+01
    0.15080165E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    397.458

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.45800   0.02749   2.43051   0.02747   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     261
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61779807E+02   -0.67030264E+02    0.39067843E+00    0.33347102E+01
    0.15250682E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    377.801

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.48550   0.02751   2.45800   0.02749   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     262
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61779238E+02   -0.67013089E+02    0.35336674E+00    0.33383528E+01
    0.15421314E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    341.719

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.51301   0.02751   2.48550   0.02751   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     263
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778670E+02   -0.66983517E+02    0.30606037E+00    0.33395852E+01
    0.15592008E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    295.972

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.54052   0.02751   2.51301   0.02751   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     264
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778171E+02   -0.66948863E+02    0.25635657E+00    0.33380656E+01
    0.15762699E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    247.906

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.56802   0.02749   2.54052   0.02751   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     265
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777812E+02   -0.66916275E+02    0.21126119E+00    0.33338702E+01
    0.15933316E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    204.297

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.59550   0.02746   2.56802   0.02749   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     266
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777641E+02   -0.66891442E+02    0.17599658E+00    0.33274248E+01
    0.16103797E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    170.195

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.62294   0.02743   2.59550   0.02746   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     267
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777648E+02   -0.66877663E+02    0.15322892E+00    0.33193776E+01
    0.16274093E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    148.178

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.65035   0.02739   2.62294   0.02743   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     268
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777797E+02   -0.66875591E+02    0.14293207E+00    0.33104452E+01
    0.16444171E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    138.221

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.67773   0.02736   2.65035   0.02739   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     269
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778027E+02   -0.66883552E+02    0.14285212E+00    0.33012714E+01
    0.16614017E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    138.143

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.70507   0.02732   2.67773   0.02736   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     270
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778329E+02   -0.66898162E+02    0.14914546E+00    0.32923250E+01
    0.16783629E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    144.229

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.73237   0.02728   2.70507   0.02732   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     271
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778522E+02   -0.66914671E+02    0.15701740E+00    0.32838295E+01
    0.16953018E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    151.842

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.75963   0.02725   2.73237   0.02728   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     272
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778541E+02   -0.66929471E+02    0.16297636E+00    0.32757337E+01
    0.17122192E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    157.604

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.78687   0.02722   2.75963   0.02725   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     273
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778541E+02   -0.66941131E+02    0.16558632E+00    0.32678879E+01
    0.17291161E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    160.128

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.81407   0.02718   2.78687   0.02722   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     274
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778463E+02   -0.66948757E+02    0.16421823E+00    0.32600836E+01
    0.17459927E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    158.805

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.84123   0.02715   2.81407   0.02718   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     275
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778356E+02   -0.66952432E+02    0.15912418E+00    0.32521035E+01
    0.17628490E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    153.879

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.86837   0.02712   2.84123   0.02715   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     276
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778232E+02   -0.66952946E+02    0.15126319E+00    0.32437666E+01
    0.17796841E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    146.277

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.89547   0.02708   2.86837   0.02712   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     277
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778109E+02   -0.66951573E+02    0.14200714E+00    0.32349596E+01
    0.17964969E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    137.326

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.92253   0.02704   2.89547   0.02708   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     278
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778002E+02   -0.66949790E+02    0.13285249E+00    0.32256497E+01
    0.18132863E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    128.473

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.94955   0.02700   2.92253   0.02704   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     279
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777913E+02   -0.66949041E+02    0.12519233E+00    0.32158847E+01
    0.18300508E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    121.066

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   2.97652   0.02696   2.94955   0.02700   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     280
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777852E+02   -0.66950579E+02    0.12015649E+00    0.32057811E+01
    0.18467895E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    116.196

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.00346   0.02691   2.97652   0.02696   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     281
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777821E+02   -0.66955323E+02    0.11849395E+00    0.31955066E+01
    0.18635016E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    114.588

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.03035   0.02687   3.00346   0.02691   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     282
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777828E+02   -0.66963764E+02    0.12049304E+00    0.31852560E+01
    0.18801869E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    116.521

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.05720   0.02683   3.03035   0.02687   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     283
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777863E+02   -0.66975873E+02    0.12593896E+00    0.31752253E+01
    0.18968456E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    121.788

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.08401   0.02679   3.05720   0.02683   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     284
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777931E+02   -0.66991104E+02    0.13411079E+00    0.31655839E+01
    0.19134786E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    129.690

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.11078   0.02675   3.08401   0.02679   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     285
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778012E+02   -0.67008377E+02    0.14382931E+00    0.31564487E+01
    0.19300869E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    139.088

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.13751   0.02671   3.11078   0.02675   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     286
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778099E+02   -0.67026212E+02    0.15357861E+00    0.31478624E+01
    0.19466719E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    148.516

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.16420   0.02668   3.13751   0.02671   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     287
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778173E+02   -0.67042882E+02    0.16169288E+00    0.31397806E+01
    0.19632350E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    156.363

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.19086   0.02665   3.16420   0.02668   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     288
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778229E+02   -0.67056667E+02    0.16658973E+00    0.31320701E+01
    0.19797773E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    161.098

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.21749   0.02661   3.19086   0.02665   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     289
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778242E+02   -0.67066094E+02    0.16703212E+00    0.31245210E+01
    0.19962994E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    161.526

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.24409   0.02658   3.21749   0.02661   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     290
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778211E+02   -0.67070248E+02    0.16236429E+00    0.31168716E+01
    0.20128015E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    157.012

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.27065   0.02655   3.24409   0.02658   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     291
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778131E+02   -0.67068932E+02    0.15267317E+00    0.31088455E+01
    0.20292828E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    147.641

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.29718   0.02651   3.27065   0.02655   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     292
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61778017E+02   -0.67062771E+02    0.13881902E+00    0.31001932E+01
    0.20457420E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    134.243

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.32367   0.02647   3.29718   0.02651   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     293
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777885E+02   -0.67053102E+02    0.12230863E+00    0.30907314E+01
    0.20621772E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    118.277

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.35012   0.02642   3.32367   0.02647   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     294
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777757E+02   -0.67041744E+02    0.10502976E+00    0.30803712E+01
    0.20785861E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000    101.568

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.37652   0.02638   3.35012   0.02642   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     295
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777664E+02   -0.67030674E+02    0.88915231E-01    0.30691288E+01
    0.20949662E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     85.984

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.40287   0.02632   3.37652   0.02638   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     296
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777596E+02   -0.67021617E+02    0.75587530E-01    0.30571179E+01
    0.21113153E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     73.096

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.42917   0.02627   3.40287   0.02632   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     297
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777563E+02   -0.67015816E+02    0.66097478E-01    0.30445236E+01
    0.21276316E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     63.919

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.45541   0.02621   3.42917   0.02627   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     298
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777568E+02   -0.67013869E+02    0.60819532E-01    0.30315672E+01
    0.21439136E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     58.815

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.48159   0.02616   3.45541   0.02621   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     299
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777610E+02   -0.67015736E+02    0.59494818E-01    0.30184704E+01
    0.21601607E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     57.534

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.50772   0.02610   3.48159   0.02616   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     300
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777665E+02   -0.67020865E+02    0.61402097E-01    0.30054250E+01
    0.21763727E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     59.378

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.53380   0.02605   3.50772   0.02610   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     301
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777723E+02   -0.67028400E+02    0.65551663E-01    0.29925751E+01
    0.21925498E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     63.391

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.55981   0.02599   3.53380   0.02605   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     302
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777774E+02   -0.67037344E+02    0.70869015E-01    0.29800081E+01
    0.22086926E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     68.533

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.58578   0.02594   3.55981   0.02599   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     303
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777809E+02   -0.67046708E+02    0.76341087E-01    0.29677555E+01
    0.22248018E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     73.825

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.61169   0.02588   3.58578   0.02594   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     304
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777831E+02   -0.67055628E+02    0.81119546E-01    0.29557995E+01
    0.22408781E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     78.446

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.63755   0.02583   3.61169   0.02588   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     305
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777831E+02   -0.67063429E+02    0.84591902E-01    0.29440844E+01
    0.22569224E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     81.804

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.66335   0.02578   3.63755   0.02583   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     306
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777813E+02   -0.67069696E+02    0.86417760E-01    0.29325301E+01
    0.22729349E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     83.569

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.68911   0.02573   3.66335   0.02578   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     307
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777779E+02   -0.67074284E+02    0.86541838E-01    0.29210470E+01
    0.22889161E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     83.689

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.71482   0.02568   3.68911   0.02573   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     308
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777739E+02   -0.67077319E+02    0.85163752E-01    0.29095502E+01
    0.23048658E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     82.357

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.74047   0.02563   3.71482   0.02568   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     309
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777693E+02   -0.67079110E+02    0.82661117E-01    0.28979717E+01
    0.23207840E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     79.936

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.76608   0.02558   3.74047   0.02563   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     310
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777651E+02   -0.67080082E+02    0.79495262E-01    0.28862659E+01
    0.23366702E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     76.875

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.79163   0.02553   3.76608   0.02558   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     311
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777617E+02   -0.67080663E+02    0.76110361E-01    0.28744119E+01
    0.23525240E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     73.602

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.81713   0.02547   3.79163   0.02553   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     312
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777592E+02   -0.67081197E+02    0.72850712E-01    0.28624097E+01
    0.23683449E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     70.449

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.84258   0.02542   3.81713   0.02547   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     313
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777578E+02   -0.67081895E+02    0.69911078E-01    0.28502733E+01
    0.23841326E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     67.607

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.86797   0.02536   3.84258   0.02542   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     314
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777576E+02   -0.67082811E+02    0.67326183E-01    0.28380224E+01
    0.23998865E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     65.107

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.89330   0.02531   3.86797   0.02536   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     315
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777575E+02   -0.67083859E+02    0.65003645E-01    0.28256744E+01
    0.24156063E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     62.861

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.91858   0.02525   3.89330   0.02531   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     316
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777572E+02   -0.67084876E+02    0.62772756E-01    0.28132396E+01
    0.24312916E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     60.704

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.94381   0.02520   3.91858   0.02525   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     317
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777570E+02   -0.67085678E+02    0.60447632E-01    0.28007185E+01
    0.24469423E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     58.455

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.96898   0.02514   3.94381   0.02520   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     318
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777566E+02   -0.67086113E+02    0.57886693E-01    0.27881031E+01
    0.24625578E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     55.979

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   3.99409   0.02508   3.96898   0.02514   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     319
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777558E+02   -0.67086110E+02    0.55034350E-01    0.27753799E+01
    0.24781379E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     53.220

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.01914   0.02502   3.99409   0.02508   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     320
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777542E+02   -0.67085693E+02    0.51933492E-01    0.27625355E+01
    0.24936822E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     50.222

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.04413   0.02497   4.01914   0.02502   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     321
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777523E+02   -0.67084998E+02    0.48723199E-01    0.27495612E+01
    0.25091902E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     47.117

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.06907   0.02491   4.04413   0.02497   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     322
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777503E+02   -0.67084244E+02    0.45622288E-01    0.27364576E+01
    0.25246614E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     44.118

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.09395   0.02485   4.06907   0.02491   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     323
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777490E+02   -0.67083705E+02    0.42881829E-01    0.27232373E+01
    0.25400955E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     41.468

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.11876   0.02478   4.09395   0.02485   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     324
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777474E+02   -0.67083623E+02    0.40731626E-01    0.27099255E+01
    0.25554921E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     39.389

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.14351   0.02472   4.11876   0.02478   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     325
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777466E+02   -0.67084206E+02    0.39332477E-01    0.26965572E+01
    0.25708508E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     38.036

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.16821   0.02466   4.14351   0.02472   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     326
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777471E+02   -0.67085555E+02    0.38740140E-01    0.26831724E+01
    0.25861714E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     37.463

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.19284   0.02460   4.16821   0.02466   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     327
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777481E+02   -0.67087630E+02    0.38883814E-01    0.26698107E+01
    0.26014539E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     37.602

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.21741   0.02454   4.19284   0.02460   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     328
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777495E+02   -0.67090271E+02    0.39573015E-01    0.26565047E+01
    0.26166983E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     38.269

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.24192   0.02448   4.21741   0.02454   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     329
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777512E+02   -0.67093219E+02    0.40528445E-01    0.26432746E+01
    0.26319047E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     39.193

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.26636   0.02442   4.24192   0.02448   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     330
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777528E+02   -0.67096162E+02    0.41434707E-01    0.26301256E+01
    0.26470732E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     40.069

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.29075   0.02436   4.26636   0.02442   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     331
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777539E+02   -0.67098790E+02    0.41999781E-01    0.26170472E+01
    0.26622039E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     40.615

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.31508   0.02430   4.29075   0.02436   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     332
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777543E+02   -0.67100858E+02    0.42002451E-01    0.26040164E+01
    0.26772970E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     40.618

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.33934   0.02423   4.31508   0.02430   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     333
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777535E+02   -0.67102218E+02    0.41327971E-01    0.25910021E+01
    0.26923523E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     39.966

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.36355   0.02417   4.33934   0.02423   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     334
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777519E+02   -0.67102844E+02    0.39984094E-01    0.25779706E+01
    0.27073699E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     38.666

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.38769   0.02411   4.36355   0.02417   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     335
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777500E+02   -0.67102844E+02    0.38101970E-01    0.25648922E+01
    0.27223494E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     36.846

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.41177   0.02405   4.38769   0.02411   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     336
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777478E+02   -0.67102431E+02    0.35916226E-01    0.25517464E+01
    0.27372908E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     34.732

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.43579   0.02399   4.41177   0.02405   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     337
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777458E+02   -0.67101905E+02    0.33727940E-01    0.25385263E+01
    0.27521935E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     32.616

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.45975   0.02393   4.43579   0.02399   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     338
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777440E+02   -0.67101596E+02    0.31858470E-01    0.25252404E+01
    0.27670575E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     30.808

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.48364   0.02386   4.45975   0.02393   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     339
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777428E+02   -0.67101815E+02    0.30591968E-01    0.25119121E+01
    0.27818823E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     29.584

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.50747   0.02380   4.48364   0.02386   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     340
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777421E+02   -0.67102782E+02    0.30117059E-01    0.24985762E+01
    0.27966678E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     29.124

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.53124   0.02374   4.50747   0.02380   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     341
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777426E+02   -0.67104599E+02    0.30485390E-01    0.24852732E+01
    0.28114140E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     29.481

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.55494   0.02367   4.53124   0.02374   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     342
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777438E+02   -0.67107196E+02    0.31594758E-01    0.24720421E+01
    0.28261209E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     30.553

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.57858   0.02361   4.55494   0.02367   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     343
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777457E+02   -0.67110352E+02    0.33193774E-01    0.24589128E+01
    0.28407886E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     32.100

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.60216   0.02355   4.57858   0.02361   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     344
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777480E+02   -0.67113722E+02    0.34924756E-01    0.24459001E+01
    0.28554174E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     33.774

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.62567   0.02348   4.60216   0.02355   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     345
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777498E+02   -0.67116891E+02    0.36385015E-01    0.24330002E+01
    0.28700075E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     35.186

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.64913   0.02342   4.62567   0.02348   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     346
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777509E+02   -0.67119451E+02    0.37192734E-01    0.24201904E+01
    0.28845591E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     35.967

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.67252   0.02336   4.64913   0.02342   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     347
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777509E+02   -0.67121071E+02    0.37057440E-01    0.24074318E+01
    0.28990723E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     35.836

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.69585   0.02330   4.67252   0.02336   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     348
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777498E+02   -0.67121549E+02    0.35829073E-01    0.23946755E+01
    0.29135471E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     34.648

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.71912   0.02324   4.69585   0.02330   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     349
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777466E+02   -0.67120840E+02    0.33520780E-01    0.23818699E+01
    0.29279833E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     32.416

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.74232   0.02317   4.71912   0.02324   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     350
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777429E+02   -0.67119082E+02    0.30304098E-01    0.23689682E+01
    0.29423806E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     29.305

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.76546   0.02311   4.74232   0.02317   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     351
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777416E+02   -0.67116568E+02    0.26477473E-01    0.23559355E+01
    0.29567386E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     25.605

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.78854   0.02304   4.76546   0.02311   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     352
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777385E+02   -0.67113616E+02    0.22421011E-01    0.23427533E+01
    0.29710567E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     21.682

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.81155   0.02298   4.78854   0.02304   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     353
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777357E+02   -0.67110653E+02    0.18539465E-01    0.23294222E+01
    0.29853344E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     17.928

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.83450   0.02291   4.81155   0.02298   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     354
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777340E+02   -0.67108080E+02    0.15208542E-01    0.23159606E+01
    0.29995710E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     14.707

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.85737   0.02285   4.83450   0.02291   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     355
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777330E+02   -0.67106225E+02    0.12726390E-01    0.23024031E+01
    0.30137662E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     12.307

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.88019   0.02278   4.85737   0.02285   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     356
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777328E+02   -0.67105327E+02    0.11285218E-01    0.22887946E+01
    0.30279196E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     10.913

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.90293   0.02271   4.88019   0.02278   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     357
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777332E+02   -0.67105506E+02    0.10956150E-01    0.22751861E+01
    0.30420309E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     10.595

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.92560   0.02264   4.90293   0.02271   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     358
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777349E+02   -0.67106764E+02    0.11686777E-01    0.22616281E+01
    0.30561002E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     11.302

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.94821   0.02257   4.92560   0.02264   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     359
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777366E+02   -0.67108974E+02    0.13314676E-01    0.22481655E+01
    0.30701275E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     12.876

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.97075   0.02251   4.94821   0.02257   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     360
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777384E+02   -0.67111916E+02    0.15586447E-01    0.22348331E+01
    0.30841131E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     15.073

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   4.99323   0.02244   4.97075   0.02251   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     361
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777401E+02   -0.67115298E+02    0.18187345E-01    0.22216525E+01
    0.30980573E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     17.588

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.01564   0.02238   4.99323   0.02244   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     362
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777415E+02   -0.67118778E+02    0.20772829E-01    0.22086297E+01
    0.31119605E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     20.088

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.03798   0.02231   5.01564   0.02238   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     363
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777436E+02   -0.67122026E+02    0.23011784E-01    0.21957553E+01
    0.31258229E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     22.253

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.06026   0.02224   5.03798   0.02231   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     364
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777445E+02   -0.67124722E+02    0.24625692E-01    0.21830062E+01
    0.31396449E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     23.814

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.08247   0.02218   5.06026   0.02224   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     365
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777447E+02   -0.67126641E+02    0.25418156E-01    0.21703488E+01
    0.31534268E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     24.580

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.10462   0.02212   5.08247   0.02218   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     366
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777441E+02   -0.67127661E+02    0.25308580E-01    0.21577433E+01
    0.31671687E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     24.474

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.12670   0.02205   5.10462   0.02212   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     367
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777428E+02   -0.67127791E+02    0.24342766E-01    0.21451499E+01
    0.31808705E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     23.540

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.14872   0.02199   5.12670   0.02205   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     368
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777410E+02   -0.67127165E+02    0.22688432E-01    0.21325338E+01
    0.31945321E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     21.941

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.17067   0.02192   5.14872   0.02199   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     369
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777390E+02   -0.67126026E+02    0.20612512E-01    0.21198706E+01
    0.32081532E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     19.933

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.19256   0.02186   5.17067   0.02192   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     370
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777369E+02   -0.67124685E+02    0.18432484E-01    0.21071493E+01
    0.32217337E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     17.825

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.21438   0.02179   5.19256   0.02186   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     371
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777346E+02   -0.67123451E+02    0.16458166E-01    0.20943734E+01
    0.32352731E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     15.916

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.23614   0.02172   5.21438   0.02179   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     372
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777344E+02   -0.67122608E+02    0.14933994E-01    0.20815586E+01
    0.32487712E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     14.442

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.25783   0.02165   5.23614   0.02172   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     373
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777342E+02   -0.67122293E+02    0.13993945E-01    0.20687291E+01
    0.32622278E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     13.533

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.27945   0.02159   5.25783   0.02165   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     374
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777348E+02   -0.67122543E+02    0.13641037E-01    0.20559117E+01
    0.32756428E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     13.191

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.30100   0.02152   5.27945   0.02159   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     375
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777356E+02   -0.67123258E+02    0.13755207E-01    0.20431304E+01
    0.32890161E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     13.302

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.32249   0.02145   5.30100   0.02152   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     376
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777369E+02   -0.67124245E+02    0.14127742E-01    0.20304012E+01
    0.33023477E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     13.662

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.34391   0.02139   5.32249   0.02145   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     377
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777378E+02   -0.67125259E+02    0.14514194E-01    0.20177298E+01
    0.33156377E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     14.036

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.36526   0.02132   5.34391   0.02139   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     378
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777383E+02   -0.67126072E+02    0.14691265E-01    0.20051117E+01
    0.33288860E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     14.207

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.38655   0.02125   5.36526   0.02132   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     379
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777383E+02   -0.67126516E+02    0.14506456E-01    0.19925337E+01
    0.33420929E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     14.028

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.40777   0.02119   5.38655   0.02125   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     380
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777375E+02   -0.67126521E+02    0.13908508E-01    0.19799785E+01
    0.33552581E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     13.450

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.42892   0.02112   5.40777   0.02119   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     381
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777371E+02   -0.67126130E+02    0.12947983E-01    0.19674292E+01
    0.33683817E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     12.521

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.45000   0.02105   5.42892   0.02112   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     382
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777355E+02   -0.67125448E+02    0.11755681E-01    0.19548731E+01
    0.33814635E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     11.368

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.47102   0.02098   5.45000   0.02105   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     383
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777340E+02   -0.67124661E+02    0.10513572E-01    0.19423045E+01
    0.33945034E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     10.167

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.49197   0.02091   5.47102   0.02098   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     384
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777326E+02   -0.67123967E+02    0.94137342E-02    0.19297259E+01
    0.34075010E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      9.103

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.51285   0.02085   5.49197   0.02091   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     385
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777322E+02   -0.67123546E+02    0.86193365E-02    0.19171475E+01
    0.34204564E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      8.335

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.53366   0.02078   5.51285   0.02085   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     386
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777318E+02   -0.67123510E+02    0.82369978E-02    0.19045851E+01
    0.34333694E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      7.965

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.55440   0.02071   5.53366   0.02078   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     387
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777321E+02   -0.67123920E+02    0.83023048E-02    0.18920574E+01
    0.34462400E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      8.029

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.57508   0.02064   5.55440   0.02071   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     388
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777325E+02   -0.67124753E+02    0.87776083E-02    0.18795827E+01
    0.34590681E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      8.488

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.59569   0.02057   5.57508   0.02064   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     389
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777332E+02   -0.67125924E+02    0.95620430E-02    0.18671761E+01
    0.34718538E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      9.247

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.61623   0.02050   5.59569   0.02057   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     390
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777341E+02   -0.67127298E+02    0.10512502E-01    0.18548473E+01
    0.34845972E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     10.166

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.63670   0.02044   5.61623   0.02050   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     391
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777350E+02   -0.67128716E+02    0.11467985E-01    0.18425994E+01
    0.34972985E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     11.090

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.65710   0.02037   5.63670   0.02044   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     392
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777357E+02   -0.67130018E+02    0.12273870E-01    0.18304291E+01
    0.35099577E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     11.869

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.67744   0.02030   5.65710   0.02037   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     393
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777362E+02   -0.67131067E+02    0.12803352E-01    0.18183269E+01
    0.35225751E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     12.381

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.69770   0.02023   5.67744   0.02030   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     394
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777363E+02   -0.67131768E+02    0.12975636E-01    0.18062794E+01
    0.35351507E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     12.548

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.71791   0.02017   5.69770   0.02023   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     395
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777359E+02   -0.67132080E+02    0.12765435E-01    0.17942711E+01
    0.35476844E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     12.345

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.73804   0.02010   5.71791   0.02017   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     396
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777350E+02   -0.67132017E+02    0.12203174E-01    0.17822868E+01
    0.35601764E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     11.801

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.75810   0.02003   5.73804   0.02010   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     397
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777340E+02   -0.67131649E+02    0.11368524E-01    0.17703139E+01
    0.35726264E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     10.994

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.77810   0.01996   5.75810   0.02003   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     398
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777334E+02   -0.67131093E+02    0.10380512E-01    0.17583439E+01
    0.35850344E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000     10.038

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.79803   0.01990   5.77810   0.01996   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     399
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777325E+02   -0.67130475E+02    0.93757715E-02    0.17463738E+01
    0.35974002E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      9.067

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.81790   0.01983   5.79803   0.01990   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     400
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777320E+02   -0.67129935E+02    0.84848031E-02    0.17344061E+01
    0.36097237E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      8.205

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.83769   0.01976   5.81790   0.01983   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     401
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777318E+02   -0.67129583E+02    0.78126676E-02    0.17224479E+01
    0.36220048E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      7.555

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.85741   0.01969   5.83769   0.01976   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     402
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777319E+02   -0.67129492E+02    0.74191805E-02    0.17105098E+01
    0.36342434E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      7.175

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.87707   0.01962   5.85741   0.01969   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     403
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777323E+02   -0.67129677E+02    0.73110299E-02    0.16986035E+01
    0.36464394E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      7.070

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.89666   0.01955   5.87707   0.01962   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     404
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777330E+02   -0.67130103E+02    0.74412771E-02    0.16867397E+01
    0.36585928E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      7.196

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.91618   0.01949   5.89666   0.01955   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     405
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777337E+02   -0.67130684E+02    0.77173633E-02    0.16749262E+01
    0.36707036E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      7.463

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.93563   0.01942   5.91618   0.01949   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     406
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777345E+02   -0.67131303E+02    0.80195230E-02    0.16631663E+01
    0.36827719E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      7.755

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.95501   0.01935   5.93563   0.01942   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     407
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777352E+02   -0.67131833E+02    0.82240039E-02    0.16514585E+01
    0.36947977E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      7.953

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.97433   0.01928   5.95501   0.01935   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     408
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777356E+02   -0.67132162E+02    0.82280474E-02    0.16397966E+01
    0.37067810E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      7.957

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   5.99357   0.01921   5.97433   0.01928   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     409
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777355E+02   -0.67132219E+02    0.79699279E-02    0.16281714E+01
    0.37187219E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      7.707

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.01275   0.01914   5.99357   0.01921   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     410
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777354E+02   -0.67131987E+02    0.74411592E-02    0.16165723E+01
    0.37306203E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      7.196

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.03186   0.01907   6.01275   0.01914   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     411
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777348E+02   -0.67131506E+02    0.66917759E-02    0.16049897E+01
    0.37424760E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      6.471

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.05090   0.01901   6.03186   0.01907   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     412
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777338E+02   -0.67130865E+02    0.58208922E-02    0.15934171E+01
    0.37542891E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      5.629

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.06987   0.01894   6.05090   0.01901   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     413
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777330E+02   -0.67130200E+02    0.49572166E-02    0.15818525E+01
    0.37660594E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      4.794

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.08877   0.01887   6.06987   0.01894   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     414
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777324E+02   -0.67129647E+02    0.42373165E-02    0.15702992E+01
    0.37777868E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      4.098

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.10760   0.01880   6.08877   0.01887   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     415
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777319E+02   -0.67129339E+02    0.37833247E-02    0.15587654E+01
    0.37894711E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      3.659

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.12636   0.01873   6.10760   0.01880   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     416
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777320E+02   -0.67129373E+02    0.36776514E-02    0.15472631E+01
    0.38011123E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      3.556

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.14506   0.01866   6.12636   0.01873   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     417
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777323E+02   -0.67129786E+02    0.39456891E-02    0.15358065E+01
    0.38127105E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      3.816

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.16368   0.01859   6.14506   0.01866   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     418
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777330E+02   -0.67130559E+02    0.45534975E-02    0.15244092E+01
    0.38242655E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      4.403

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.18223   0.01852   6.16368   0.01859   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     419
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777339E+02   -0.67131612E+02    0.54138388E-02    0.15130822E+01
    0.38357776E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      5.235

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.20072   0.01845   6.18223   0.01852   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     420
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777346E+02   -0.67132825E+02    0.63998205E-02    0.15018325E+01
    0.38472468E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      6.189

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.21914   0.01838   6.20072   0.01845   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     421
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777352E+02   -0.67134053E+02    0.73658580E-02    0.14906617E+01
    0.38586733E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      7.123

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.23748   0.01831   6.21914   0.01838   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     422
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777358E+02   -0.67135154E+02    0.81725070E-02    0.14795659E+01
    0.38700573E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      7.903

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.25576   0.01825   6.23748   0.01831   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     423
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777360E+02   -0.67136003E+02    0.87074087E-02    0.14685366E+01
    0.38813987E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      8.420

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.27397   0.01818   6.25576   0.01825   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     424
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777359E+02   -0.67136520E+02    0.89013289E-02    0.14575621E+01
    0.38926977E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      8.608

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.29212   0.01811   6.27397   0.01818   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     425
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777358E+02   -0.67136678E+02    0.87371363E-02    0.14466292E+01
    0.39039544E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      8.449

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.31019   0.01804   6.29212   0.01811   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     426
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777352E+02   -0.67136494E+02    0.82480502E-02    0.14357253E+01
    0.39151686E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      7.976

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.32820   0.01797   6.31019   0.01804   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     427
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777345E+02   -0.67136034E+02    0.75082610E-02    0.14248399E+01
    0.39263404E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      7.261

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.34613   0.01790   6.32820   0.01797   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     428
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777340E+02   -0.67135394E+02    0.66187910E-02    0.14139660E+01
    0.39374696E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      6.401

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.36400   0.01783   6.34613   0.01790   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     429
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777335E+02   -0.67134682E+02    0.56907080E-02    0.14031005E+01
    0.39485561E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      5.503

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.38180   0.01776   6.36400   0.01783   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     430
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777331E+02   -0.67134001E+02    0.48255542E-02    0.13922445E+01
    0.39595998E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      4.666

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.39953   0.01770   6.38180   0.01776   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     431
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777327E+02   -0.67133429E+02    0.40987926E-02    0.13814021E+01
    0.39706006E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      3.964

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.41719   0.01763   6.39953   0.01770   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     432
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777327E+02   -0.67133019E+02    0.35539504E-02    0.13705794E+01
    0.39815583E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      3.437

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.43478   0.01756   6.41719   0.01763   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     433
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777327E+02   -0.67132784E+02    0.32011043E-02    0.13597836E+01
    0.39924728E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      3.096

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.45231   0.01749   6.43478   0.01756   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     434
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777326E+02   -0.67132711E+02    0.30196556E-02    0.13490213E+01
    0.40033442E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.920

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.46976   0.01742   6.45231   0.01749   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     435
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777326E+02   -0.67132764E+02    0.29678287E-02    0.13382979E+01
    0.40141724E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.870

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.48714   0.01735   6.46976   0.01742   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     436
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777324E+02   -0.67132893E+02    0.29943404E-02    0.13276173E+01
    0.40249574E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.896

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.50445   0.01728   6.48714   0.01735   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     437
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777325E+02   -0.67133057E+02    0.30512210E-02    0.13169812E+01
    0.40356992E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.951

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.52170   0.01721   6.50445   0.01728   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     438
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777321E+02   -0.67133212E+02    0.31036060E-02    0.13063898E+01
    0.40463978E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      3.001

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.53887   0.01714   6.52170   0.01721   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     439
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777330E+02   -0.67133362E+02    0.31360012E-02    0.12958427E+01
    0.40570532E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      3.033

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.55597   0.01707   6.53887   0.01714   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     440
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777320E+02   -0.67133474E+02    0.31500312E-02    0.12853391E+01
    0.40676654E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      3.046

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.57301   0.01700   6.55597   0.01707   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     441
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777346E+02   -0.67133624E+02    0.31655922E-02    0.12748784E+01
    0.40782344E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      3.061

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.58997   0.01693   6.57301   0.01700   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     442
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777344E+02   -0.67133778E+02    0.32127414E-02    0.12644614E+01
    0.40887602E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      3.107

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.60687   0.01686   6.58997   0.01693   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     443
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777353E+02   -0.67134005E+02    0.33197342E-02    0.12540895E+01
    0.40992429E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      3.210

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.62369   0.01679   6.60687   0.01686   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     444
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777353E+02   -0.67134308E+02    0.35070683E-02    0.12437653E+01
    0.41096824E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      3.391

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.64045   0.01672   6.62369   0.01679   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     445
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777355E+02   -0.67134703E+02    0.37783081E-02    0.12334913E+01
    0.41200788E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      3.654

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.65714   0.01665   6.64045   0.01672   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     446
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777359E+02   -0.67135182E+02    0.41200504E-02    0.12232703E+01
    0.41304321E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      3.984

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.67375   0.01658   6.65714   0.01665   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     447
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777363E+02   -0.67135710E+02    0.45001652E-02    0.12131040E+01
    0.41407423E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      4.352

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.69030   0.01651   6.67375   0.01658   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     448
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777367E+02   -0.67136242E+02    0.48722341E-02    0.12029929E+01
    0.41510095E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      4.712

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.70678   0.01644   6.69030   0.01651   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     449
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777371E+02   -0.67136723E+02    0.51819314E-02    0.11929357E+01
    0.41612338E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      5.011

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.72319   0.01638   6.70678   0.01644   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     450
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777375E+02   -0.67137095E+02    0.53757167E-02    0.11829292E+01
    0.41714152E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      5.199

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.73953   0.01631   6.72319   0.01638   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     451
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777377E+02   -0.67137310E+02    0.54106719E-02    0.11729688E+01
    0.41815537E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      5.232

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.75580   0.01624   6.73953   0.01631   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     452
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777378E+02   -0.67137339E+02    0.52628337E-02    0.11630487E+01
    0.41916494E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      5.089

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.77200   0.01617   6.75580   0.01624   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     453
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777377E+02   -0.67137175E+02    0.49328385E-02    0.11531629E+01
    0.42017021E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      4.770

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.78814   0.01610   6.77200   0.01617   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     454
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777375E+02   -0.67136839E+02    0.44462841E-02    0.11433060E+01
    0.42117120E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      4.300

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.80420   0.01603   6.78814   0.01610   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     455
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777372E+02   -0.67136375E+02    0.38507640E-02    0.11334737E+01
    0.42216788E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      3.724

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.82020   0.01596   6.80420   0.01603   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     456
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777367E+02   -0.67135843E+02    0.32096105E-02    0.11236636E+01
    0.42316025E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      3.104

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.83612   0.01589   6.82020   0.01596   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     457
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777364E+02   -0.67135314E+02    0.25918580E-02    0.11138758E+01
    0.42414831E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.506

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.85198   0.01582   6.83612   0.01589   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     458
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777361E+02   -0.67134856E+02    0.20630566E-02    0.11041123E+01
    0.42513204E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      1.995

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.86776   0.01575   6.85198   0.01582   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     459
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777360E+02   -0.67134526E+02    0.16750447E-02    0.10943770E+01
    0.42611144E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      1.620

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.88348   0.01568   6.86776   0.01575   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     460
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777360E+02   -0.67134358E+02    0.14580437E-02    0.10846753E+01
    0.42708649E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      1.410

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.89912   0.01561   6.88348   0.01568   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     461
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777361E+02   -0.67134363E+02    0.14172092E-02    0.10750128E+01
    0.42805721E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      1.370

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.91470   0.01554   6.89912   0.01561   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     462
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777362E+02   -0.67134526E+02    0.15332171E-02    0.10653948E+01
    0.42902358E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      1.483

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.93020   0.01547   6.91470   0.01554   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     463
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777363E+02   -0.67134813E+02    0.17677161E-02    0.10558258E+01
    0.42998561E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      1.709

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.94564   0.01540   6.93020   0.01547   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     464
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777360E+02   -0.67135173E+02    0.20715535E-02    0.10463084E+01
    0.43094330E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.003

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.96100   0.01533   6.94564   0.01540   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     465
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777368E+02   -0.67135569E+02    0.23908420E-02    0.10368441E+01
    0.43189666E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.312

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.97630   0.01526   6.96100   0.01533   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     466
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777374E+02   -0.67135940E+02    0.26771672E-02    0.10274322E+01
    0.43284569E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.589

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   6.99152   0.01519   6.97630   0.01526   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     467
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777374E+02   -0.67136245E+02    0.28957542E-02    0.10180710E+01
    0.43379040E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.800

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.00668   0.01512   6.99152   0.01519   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     468
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777374E+02   -0.67136468E+02    0.30278135E-02    0.10087580E+01
    0.43473078E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.928

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.02177   0.01505   7.00668   0.01512   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     469
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777374E+02   -0.67136605E+02    0.30721453E-02    0.99949043E+00
    0.43566684E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.971

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.03679   0.01498   7.02177   0.01505   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     470
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777372E+02   -0.67136666E+02    0.30421743E-02    0.99026571E+00
    0.43659859E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.942

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.05173   0.01491   7.03679   0.01498   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     471
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777370E+02   -0.67136674E+02    0.29619314E-02    0.98108195E+00
    0.43752601E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.864

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.06661   0.01484   7.05173   0.01491   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     472
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777368E+02   -0.67136656E+02    0.28590264E-02    0.97193809E+00
    0.43844911E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.765

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.08142   0.01477   7.06661   0.01484   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     473
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777367E+02   -0.67136640E+02    0.27597223E-02    0.96283391E+00
    0.43936789E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.669

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.09616   0.01470   7.08142   0.01477   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     474
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777367E+02   -0.67136645E+02    0.26846809E-02    0.95376991E+00
    0.44028235E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.596

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.11083   0.01463   7.09616   0.01470   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     475
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777368E+02   -0.67136685E+02    0.26450190E-02    0.94474706E+00
    0.44119248E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.558

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.12543   0.01456   7.11083   0.01463   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     476
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777368E+02   -0.67136759E+02    0.26412886E-02    0.93576647E+00
    0.44209828E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.554

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.13995   0.01449   7.12543   0.01456   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     477
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777371E+02   -0.67136861E+02    0.26639573E-02    0.92682911E+00
    0.44299976E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.576

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.15441   0.01442   7.13995   0.01449   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     478
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777371E+02   -0.67136971E+02    0.26954318E-02    0.91793553E+00
    0.44389691E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.607

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.16880   0.01436   7.15441   0.01442   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     479
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777372E+02   -0.67137069E+02    0.27138389E-02    0.90908565E+00
    0.44478974E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.624

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.18312   0.01429   7.16880   0.01436   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     480
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777372E+02   -0.67137131E+02    0.26983057E-02    0.90027878E+00
    0.44567824E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.609

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.19738   0.01422   7.18312   0.01429   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     481
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777372E+02   -0.67137143E+02    0.26337675E-02    0.89151369E+00
    0.44656242E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.547

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.21156   0.01415   7.19738   0.01422   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     482
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777370E+02   -0.67137094E+02    0.25126052E-02    0.88278886E+00
    0.44744227E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.430

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.22567   0.01408   7.21156   0.01415   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     483
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777372E+02   -0.67136989E+02    0.23367796E-02    0.87410271E+00
    0.44831780E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.260

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.23971   0.01401   7.22567   0.01408   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     484
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777371E+02   -0.67136833E+02    0.21180891E-02    0.86545389E+00
    0.44918899E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.048

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.25368   0.01394   7.23971   0.01401   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     485
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777371E+02   -0.67136647E+02    0.18762284E-02    0.85684152E+00
    0.45005585E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      1.814

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.26758   0.01387   7.25368   0.01394   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     486
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777371E+02   -0.67136457E+02    0.16364265E-02    0.84826540E+00
    0.45091838E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      1.582

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.28141   0.01380   7.26758   0.01387   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     487
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777374E+02   -0.67136290E+02    0.14242568E-02    0.83972605E+00
    0.45177657E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      1.377

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.29517   0.01373   7.28141   0.01380   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     488
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777381E+02   -0.67136172E+02    0.12619090E-02    0.83122465E+00
    0.45263041E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      1.220

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.30887   0.01366   7.29517   0.01373   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     489
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777407E+02   -0.67136133E+02    0.11641741E-02    0.82276290E+00
    0.45347990E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      1.126

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.32249   0.01359   7.30887   0.01366   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     490
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777414E+02   -0.67136146E+02    0.11386941E-02    0.81434272E+00
    0.45432506E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      1.101

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.33604   0.01352   7.32249   0.01359   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     491
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777386E+02   -0.67136202E+02    0.11912338E-02    0.80596617E+00
    0.45516586E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      1.152

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.34952   0.01345   7.33604   0.01352   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     492
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777399E+02   -0.67136366E+02    0.13084838E-02    0.79763539E+00
    0.45600232E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      1.265

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.36293   0.01338   7.34952   0.01345   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     493
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777402E+02   -0.67136561E+02    0.14634607E-02    0.78935163E+00
    0.45683443E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      1.415

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.37627   0.01331   7.36293   0.01338   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     494
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777405E+02   -0.67136776E+02    0.16334769E-02    0.78111555E+00
    0.45766220E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      1.580

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.38955   0.01324   7.37627   0.01331   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     495
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777409E+02   -0.67136987E+02    0.17945591E-02    0.77292715E+00
    0.45848563E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      1.735

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.40275   0.01317   7.38955   0.01324   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     496
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777410E+02   -0.67137170E+02    0.19266747E-02    0.76478584E+00
    0.45930473E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      1.863

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.41588   0.01310   7.40275   0.01317   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     497
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777408E+02   -0.67137311E+02    0.20178847E-02    0.75669059E+00
    0.46011948E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      1.951

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.42894   0.01303   7.41588   0.01310   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     498
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777418E+02   -0.67137423E+02    0.20652695E-02    0.74864021E+00
    0.46092991E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      1.997

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.44193   0.01296   7.42894   0.01303   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     499
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777417E+02   -0.67137481E+02    0.20714100E-02    0.74063355E+00
    0.46173600E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      2.003

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.45485   0.01289   7.44193   0.01296   2.00000

           RANDOM_SEED =         533289179               48                0

========================================
         MD step No.     500
========================================

  >Energies
                    E_tot             E_pot             E_kin               EPS                ES
   e_b>   -0.61777415E+02   -0.67137508E+02    0.20456816E-02    0.73266962E+00
    0.46253775E+01

  >Metadynamics

  >Temperature
               T_sim     T_inst
   tmprt>    300.000      1.978

  >Thermostat:
           s(n+1) sdot(n+1)      s(n)   sdot(n)        Qs
   s_b>   7.46771   0.01282   7.45485   0.01289   2.00000

           RANDOM_SEED =         533289179               48                0

