&FORCE_EVAL
  METHOD Quickstep
  &DFT
    &QS
      METHOD MNDO
      &SE
        ANALYTICAL_GRADIENTS T
        SCP T
      &END
    &END QS
    &SCF
      &OUTER_SCF
        TYPE SCP
        EPS_SCF 1.0E-6
        MAX_SCF 30
      &END OUTER_SCF
      SCF_GUESS ATOMIC
      EPS_SCF 1.0E-6
      MAX_SCF 500
      &OT T
        MINIMIZER SD
        SCP_NDDO T    
        PRECONDITIONER FULL_ALL
        LINESEARCH 3PNT
      &END OT
      &PRINT
       &DETAILED_ENERGY
         &EACH 
            QS_SCF 1
         &END EACH 
       &END DETAILED_ENERGY
      &END PRINT
    &END SCF
  &END DFT
  &SUBSYS
    &CELL
      ABC 20.0 20.0 20.0
      PERIODIC NONE
    &END CELL
    &COORD
O -1.41388  -1.84021   0.000000
H -0.41911  -1.84021   0.000000
H -1.67014  -0.87900   0.000000
O  0.92195   1.19994   0.000000
H  1.29058   1.67975  -0.789668
H  1.29061   1.67973   0.789667
    &END COORD
  &END SUBSYS
&END FORCE_EVAL
&MOTION
  &MD
     ENSEMBLE NVT
     STEPS 5
     TIMESTEP 0.5
     TEMPERATURE 300.0
     &THERMOSTAT
       REGION MASSIVE
       TYPE NOSE
       &NOSE  
         TIMECON [wavenumber_t] 3000
       &END NOSE  
     &END THERMOSTAT
  &END MD
&END MOTION
&GLOBAL
  PROJECT dimer4
  RUN_TYPE ENERGY
&END GLOBAL
