Geometry optimization status

Iteration:   155

Total enthalpy                  : -2487.869514 kcal/mol
  External pressure term        : 0.000000 kcal/mol

Total energy                    :       -2487.869514 kcal/mol

Contributions to total energy (kcal/mol):
  Valence energy (diag. terms)  :         142.323
    Bond                        :           5.797
    Angle                       :         100.169
    Torsion                     :          36.358
    Inversion                   :           0.000
  Valence energy (cross terms)  :           0.839
    Stretch-Stretch             :           0.299
    Stretch-Bend-Stretch        :           0.541
    Bend-Bend                   :           0.000
    Torsion-Bend-Bend           :           0.000
  Non-bond energy               :       -2631.032
    van der Waals               :         -41.361
    Long range correction       :          -1.184
    Electrostatic               :       -2588.488
 
rms force  :  8.719E-02 kcal/mol/A     
max force  :  5.242E-01 kcal/mol/A
       
Cell parameters:    a:   9.421005 A    b:   9.421005 A    c:   9.421005 A   
                alpha:  94.200 deg  beta:  94.200 deg gamma:  94.200 deg
