PREPOT has been called for the OH2 potential energy surface POL

    Parameters for the collinear part of the potential:
    Title card for potential:    O+H2 AB 9-12-79  
    D1INF,R1EINF,B1INF,D2INF,R2EINF,B2INF,A1INF,A2INF (kcal/mol):
      97.23777    0.75933    2.01627   98.81423
       0.98712    2.30153    0.00000    0.00000
    R1S,R2S,VSP,ALPH1,ALPH2 (ang/kcal):
            2.21208    2.21531   87.65999    1.00000    1.00000
    Warning: Pivot point is fixed at VSP
    Step for numerical derivative =    0.0000000100
    NPHI, NV =    11     3

    I, PHI(I), (BSP(I,J),CSP(I,J);J=1,NV):
        1    0.00000      97.23777     0.97238E+02
                           1.45598     0.14560E+01
                           2.01627     0.20163E+01
        2   10.00000      95.97664    -0.75584E-01
                           1.47475     0.11016E-02
                           1.95501    -0.72002E-02
        3   20.00000      92.92151    -0.50529E-03
                           1.52991     0.77500E-05
                           1.87987     0.10742E-04
        4   30.00000      90.47624     0.12378E-02
                           1.60562    -0.10105E-04
                           1.61942    -0.78327E-04
        5   37.32999      90.36362    -0.75323E-03
                           1.63381    -0.11820E-04
                           1.48434     0.15574E-03
        6   40.00000      91.32085     0.22499E-02
                           1.63125     0.34308E-05
                           1.46752    -0.85292E-04
        7   50.00000      94.58319    -0.10432E-01
                           1.53349    -0.43690E-04
                           1.68902     0.31409E-03
        8   60.00000      97.28180     0.86242E-02
                           1.39581     0.80966E-04
                           1.93500    -0.45853E-03
        9   70.00000      98.09436    -0.99579E-03
                           1.29882    -0.11972E-04
                           2.14175     0.16569E-03
       10   80.00000      98.54700     0.11264E-02
                           1.24282    -0.18712E-04
                           2.26159    -0.42691E-04
       11   90.00000      98.81423    -0.66153E-03
                           1.22496     0.65063E-05
                           2.30153     0.21110E-04

    K,CSP(K,J);J=1,NV
       12          0.16810E-03    -0.10454E-04     0.12942E-04
       13         -0.58918E-04     0.81005E-05    -0.15473E-04

    Parameters for the bending potential:
         Equilibrium bond distances (Angstroms):
                  1.8323923565E+00     1.4011189374E+00     1.8323923565E+00
         Dissociation energy (kcal/mol):             1.6981416218E-01
         Morse Beta parameter (Angstroms**-1):       1.1003813621E+00
         RBB (Angstroms):                            1.4011189374E+00
         Pauling parameter (Angstroms):              4.9132893251E-01
         Gamma (unitless):                           4.1310000000E-01


  No Reference                                                               
                                                                             
                                                                             
                                                                             
                                                                             


   MAX. AND ACTUAL NO. OF EXCITED SURFACES:   0       0
   MAX. AND ACTUAL ORDER OF DERIVATIVES:      1       1

  The potential routine in POTLIB assumes a
  default labeling of the atoms.  The user has
  made the following selection of atomic labels:

               DEFAULT                         USER-SELECTED

  Atom  1 is       O                                   O 
  Atom  2 is       H                                   H 
  Atom  3 is       H                                   H 


  Atom  1  O  is a member of Reactant #1
  Atom  2  H  is a member of Reactant #2
  Atom  3  H  is a member of Reactant #2

  The Potential Energy is Zero for the following
  geometric arrangement:  The reactants are at
  their equilibrium geometries, widely separated.


  Reactant #1
  O 

  Reactant #2
  H H 

  The default units are:
     BOHR FOR DISTANCE
     HARTREE FOR ENERGY


  The user has chosen units :
     BOHR                 FOR DISTANCE
     HARTREE              FOR ENERGY


  To reset the zero-of-energy, assign a
  non-zero value to the variable ANUZERO.
  The value of ANUZERO will be SUBTRACTED from
  the energy calculated by this routine.

  GS Energy         0.04628571761786

  Derivative          0.04446397746    -0.05978058954     0.00000000000
  Derivative          0.04243546656     0.04362155794     0.00000000000
  Derivative         -0.08689944402     0.01615903160     0.00000000000