&GLOBAL
  PROJECT ch2o
  RUN_TYPE geo_opt
  PRINT_LEVEL low
&END GLOBAL
&MOTION
  &GEO_OPT
     MAX_ITER 1
  &END
&END

&FORCE_EVAL
  METHOD Quickstep

  &DFT
    BASIS_SET_FILE_NAME BASIS_SET
    POTENTIAL_FILE_NAME POTENTIAL

    ROKS
    MULTIPLICITY  3
    &LOW_SPIN_ROKS
       ENERGY_SCALING -2.0 2.0
       SPIN_CONFIGURATION 1 1
       SPIN_CONFIGURATION 1 2
    &END

    &MGRID
      CUTOFF 200
    &END MGRID

    &QS
      METHOD GPW
    &END QS

    &SCF
       SCF_GUESS ATOMIC 
       EPS_SCF 1.0E-4
       MAX_SCF 20
       &OT
         MINIMIZER DIIS
         PRECONDITIONER FULL_SINGLE_INVERSE
         STEPSIZE 0.1
         ROTATION
       &END
       &OUTER_SCF
          EPS_SCF 1.0E-4
          MAX_SCF 5
       &END
    &END SCF

    &XC
      &XC_FUNCTIONAL PADE
      &END XC_FUNCTIONAL
    &END XC
  &END DFT

  &SUBSYS
    &CELL
      ABC 6.0 6.0 6.0
    &END CELL

    &COORD
   O         0.9588431900        1.1234806613        1.8643358699
   C         1.0045827842        1.0372747429        0.6713062328
   H         1.0304990091        1.9328340670        0.0202209074
   H         1.0234151411        0.0574091066        0.1554705073
    &END COORD

    &KIND O
      BASIS_SET DZVP-GTH-PBE
      POTENTIAL GTH-PBE-q6
    &END KIND
    &KIND C
      BASIS_SET DZVP-GTH-PBE
      POTENTIAL GTH-PBE-q4
    &END KIND
    &KIND H
      BASIS_SET DZV-GTH-PBE
      POTENTIAL GTH-PBE-q1
    &END KIND
  &END SUBSYS
&END FORCE_EVAL
