&GLOBAL
  PROJECT 2h2o
  RUN_TYPE MD
&END GLOBAL

&MOTION
  &MD
    ENSEMBLE NVE
    STEPS 5
    TEMPERATURE 300
    TIMESTEP 0.5
  &END MD
  &PRINT
    &TRAJECTORY OFF
    &END TRAJECTORY
    &VELOCITIES OFF
    &END VELOCITIES
  &END PRINT
&END MOTION

&FORCE_EVAL
  METHOD Quickstep
  &DFT
    &QS
      METHOD PM3
      &SE
        COORDINATION_CUTOFF 1.e-4
        D3_SCALING 1.0 1.2 1.4
        DISPERSION T
        DISPERSION_PARAMETER_FILE dftd3.dat
        DISPERSION_RADIUS 15.
      &END SE
    &END QS
    &SCF
      SCF_GUESS MOPAC
    &END SCF
  &END DFT
  &PRINT
    &FORCES
    &END FORCES
  &END PRINT
  &SUBSYS
    &CELL
      ABC 20.0 20.0 20.0
    &END CELL
    &COORD
      O     0.000000     0.000000     0.000000    H2O1
      H     0.000000     0.000000     1.000000    H2O1
      H     0.942809     0.000000    -0.333333    H2O1
      O    -1.617979    -0.948062    -2.341650    H2O2
      H    -2.529195    -1.296822    -2.122437    H2O2
      H    -1.534288    -0.833088    -3.331486    H2O2
    &END COORD
  &END SUBSYS
&END FORCE_EVAL
