3 *** Parameters derived by integrating MP2/6-31G** local energy surfaces *** 2 2 2 2 2 2 2 2 2 1 2 2 2 2 2 2 2 2 2 3 6 0 ************ G-G 1 4.03053E-03 0.0 2 -4.90330E-03 0.0 3 2.70952E-01 0.0 4 -7.20927E-02 0.0 5 -3.66258E-03 0.0 6 -6.34294E-03 0.0 6 0 ************ G-A 1 1.27465E-02 -1.01763E-01 2 -8.41985E-03 1.18716E-02 3 2.50582E-01 3.30235E-02 4 -1.02631E-01 1.46337E-01 5 6.63161E-03 8.86275E-03 6 -6.81049E-03 8.71641E-03 10 0 ************ G-P 1 -1.14953E+00 1.29720E+00 2 -1.08859E-03 -1.20321E-02 3 4.04229E-01 2.92750E-01 4 -2.41994E-01 5.38295E-02 5 4.31804E-02 -6.56306E-02 6 4.29080E-02 1.38685E-01 7 -6.31286E-02 -2.65338E-02 8 1.46743E-02 -3.26658E-03 9 -1.33460E-02 3.01470E-02 0 -1.11258E-02 -3.15723E-02 6 0 ************ A-G 1 5.14830E-03 9.48478E-02 2 -8.85552E-02 1.20661E-01 3 2.65903E-01 -8.99192E-02 4 -6.16552E-02 -6.07952E-02 5 2.19209E-02 -3.09487E-02 6 -1.58136E-02 -1.74252E-02 6 0 ************ A-A 1 1.05084E+00 -1.83406E-03 2 2.56198E-01 3.75825E-02 3 2.97224E-01 -6.65886E-03 4 -9.30144E-02 2.78499E-02 5 2.69127E-02 -2.79813E-03 6 -5.69348E-03 -5.76679E-03 10 0 ************ A-P 1 1.97348E+00 3.61809E+00 2 3.25172E-01 6.93324E-01 3 7.44811E-01 2.28853E-01 4 -1.11515E-02 4.21766E-01 5 -1.09160E-01 4.09945E-02 6 1.08618E-01 6.71048E-03 7 1.21785E-02 9.37813E-02 8 -2.77282E-02 2.84981E-02 9 2.15879E-02 1.85528E-02 0 -8.56980E-03 3.92482E-02 10 0 ************ P-G 1 2.12359E-02 4.05506E-02 2 -1.19424E-01 2.91087E-01 3 3.81770E-01 -1.11839E-01 4 -9.75339E-02 -7.60089E-02 5 -5.00214E-02 3.42037E-02 6 8.12296E-02 3.98713E-02 7 -1.21613E-02 -4.57682E-02 8 6.95870E-03 2.28245E-02 9 2.02598E-02 -2.00100E-02 0 -1.48685E-02 -1.09627E-02 10 0 ************ P-A 1 1.40539E+00 -7.42879E-01 2 9.21075E-02 -1.17205E-01 3 4.49479E-01 3.82888E-02 4 8.11975E-02 -3.35594E-02 5 -9.88964E-03 -4.63759E-02 6 8.58396E-02 4.22362E-02 7 2.73049E-02 -5.43392E-02 8 -4.18620E-03 -1.04889E-02 9 1.06804E-02 -7.89066E-03 0 -5.01879E-03 -1.20569E-02 10 0 ************ P-P 1 4.23219E+00 1.42318E+00 2 1.24967E+00 -2.32575E-01 3 5.38690E-01 -4.25507E-01 4 4.01096E-01 -6.42186E-01 5 2.52852E-01 -2.32257E-01 6 -3.06406E-02 -2.48617E-01 7 -1.68086E-02 -1.55069E-01 8 -9.68421E-02 -1.80718E-01 9 -2.73541E-02 -1.36915E-01 0 -6.08829E-02 -6.71426E-02