&GLOBAL
  ECHO_INPUT yes
  PRINT_LEVEL MEDIUM
  PROJECT dynamics
  RUN_TYPE md
&END GLOBAL

&MOTION
  &MD
    ENSEMBLE nve
    STEPS 2
    TIMESTEP 1.0  ! fs
  &END MD
&END MOTION

&FORCE_EVAL
  METHOD qs
  &DFT
    BASIS_SET_FILE_NAME BASIS_SET
    POTENTIAL_FILE_NAME POTENTIAL
    &MGRID
      CUTOFF 50
    &END MGRID
    &PRINT
    &END PRINT
    &SCF
      EPS_SCF 1.e-1
      IGNORE_CONVERGENCE_FAILURE
      MAX_SCF 2
    &END SCF
    &XC
      &XC_FUNCTIONAL blyp
      &END XC_FUNCTIONAL
    &END XC
  &END DFT
  &PRINT
    &FORCES LOW
    &END FORCES
  &END PRINT
  &SUBSYS
    &CELL
      ABC [angstrom] 6.0 6.0 6.0
    &END CELL
    &COORD
      UNIT angstrom
      O   0.000000    0.000000   -0.065587
      H   0.000000   -0.757136    0.520545
      H   0.000000    0.757136    0.520545
      He   6.929   6.929   6.929
    &END COORD
    &KIND O
      BASIS_SET DZVP-GTH-BLYP
      MASS 18.0855
      POTENTIAL GTH-BLYP-q6
    &END KIND
    &KIND H
      BASIS_SET DZVP-GTH-BLYP
      MASS 2.
      POTENTIAL GTH-BLYP-q1
    &END KIND
    &KIND He
      BASIS_SET DZVP-GTH-BLYP
      GHOST t
      MASS 7
    &END KIND
    &PRINT
      &ATOMIC_COORDINATES
      &END ATOMIC_COORDINATES
    &END PRINT
  &END SUBSYS
&END FORCE_EVAL
