#MOPAC REFERENCE
#
#          FINAL HEAT OF FORMATION =       2113.49370 KCAL =       8842.85762 KJ
#
#
#          TOTAL ENERGY            =      -421.707886676 EV
#          ELECTRONIC ENERGY       =       -998.74877 EV  POINT GROUP:     C*v
#          CORE-CORE REPULSION     =        577.04088 EV
#
&FORCE_EVAL
  METHOD Quickstep
  &DFT
    &QS
      METHOD MNDOD
      &SE
       ANALYTICAL_GRADIENTS F
       STO_NG 6
      &END
    &END QS
    &SCF
      SCF_GUESS MOPAC
    &END SCF
    &PRINT
      &MO
        EIGENVECTORS
        EIGENVALUES
      &END
      &AO_MATRICES
          DENSITY
          CORE_HAMILTONIAN
          OVERLAP
          KOHN_SHAM_MATRIX
      &END
    &END
  &END DFT
  &SUBSYS
    &CELL
      ABC 20.0 20.0 20.0
      PERIODIC NONE
    &END CELL
    &COORD
       Br                   .00000000     .00000000     .00000000
       Cl                   .00000000     .00000000    1.00000000
    &END COORD
    &PRINT
      &KINDS
        BASIS_SET
      &END
    &END
  &END SUBSYS
&END FORCE_EVAL
&GLOBAL
  PROJECT brcl
  RUN_TYPE ENERGY_FORCE
&END GLOBAL
