Geometry optimization status

Iteration:   145

Total enthalpy                  : -78146600.342337 kcal/mol
  External pressure term        : 0.000000 kcal/mol

Total energy                    :   -78146600.342337 kcal/mol

Contributions to total energy (kcal/mol):
  Valence energy (diag. terms)  :       62990.988
    Bond                        :       59273.860
    Angle                       :        2003.697
    Torsion                     :        -133.771
    Inversion                   :        1847.203
  Valence energy (cross terms)  :          55.209
    Stretch-Stretch             :         225.518
    Stretch-Bend-Stretch        :        -141.691
    Stretch-Torsion-Stretch     :           0.000
    Separated-Stretch-Stretch   :           0.000
    Torsion-Stretch             :           0.000
    Bend-Bend                   :         -40.933
    Torsion-Bend-Bend           :          12.315
    Bend-Torsion-Bend           :           0.000
  Non-bond energy               :   -78209646.539
    van der Waals               :        8001.439
    Long range correction       :          -1.809
    Electrostatic               :   -78217646.169
 
rms force  :  5.730E+13 kcal/mol/A     
max force  :  4.150E+14 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
