MDALGO =   3
        LANGEVIN_GAMMA =    50.000   50.000   50.000
      LANGEVIN_GAMMA_L =    10.000
               SCALING =       0
                 CNEXP =     9.000   14.000
                 PMASS =  1000.00000
   LATTICE_CONSTRAINTS =   T T T (X,Y,Z) = 9 degree(s) of freedom
           RANDOM_SEED =         525468405                0                0

   original number of atomic DOF:        663
   number of independent constraints:      0
   number of active DOF:                 663

  Atomic velocities initialized by STEP_tb

  Lattice velocities initialized by STEP_tb