Example: Multiple excited state gradients: H2O
**********************************************

"Download EGO_H2O_multi.run"

   #! /bin/sh


   # Basic example of TDDFT calculation with different number of singlets and triplets (LOWEST 10 8) 
   # and multiple gradient calculation (SING_GRADS, TRIP_GRADS)
   # Could be useful for external programs like SHARC.

   $AMSBIN/ams <<eor
   System
     atoms
        O     0.0000000    0.0000000   -0.0668805
        H    -0.7658756    0.0000000    0.5307937
        H     0.7658756    0.0000000    0.5307937
     end
   end

   Task SinglePoint
   Properties
     Gradients True
   End

   Engine ADF
     title H2O TDDFT Multiple Gradients
     excitations
       lowest 10 8
     end
     excitedgo
       sing_grads
          A1 1 2
          A2 1
          B1 1
       end
       trip_grads
          A1 1 2 3
          A2 1
          B1 3
          B2 1
       end
     end
     basis
       type SZ
       core None
       CreateOutput Yes
     end
     numericalquality Good
     print SOMATRIX
     relativity
       level scalar
       formalism ZORA
     end
     sopert
        gscorr True
     end
     symmetry C(2v)
     tda
     xc
       gga BP86
     end
   EndEngine
   eor
