MacSPARTAN '08 MECHANICS PROGRAM: x86/Darwin       131


 Frequency Calculation

  Adjusted 3 (out of 9) low frequency modes

  Reason for exit: Successful completion 
  Mechanics CPU Time :          .04
  Mechanics Wall Time:         5.34

MacSPARTAN '08 Quantum Mechanics Program:  (x86/Darwin)     build  131v4

Job type: Geometry optimization.
Method: RHF
Basis set: 3-21G(*)
Number of shells: 7
Number of basis functions: 13
Multiplicity: 1

SCF model:
 A restricted Hartree-Fock SCF calculation will be
 performed using Pulay DIIS + Geometric Direct Minimization


Optimization:
         Step      Energy          Max Grad.      Max Dist. 
            1      -75.585527       0.015642       0.029492   1
            2      -75.585660       0.000218       0.000223   1

  Reason for exit: Successful completion 
  Quantum Calculation CPU Time :          .11
  Quantum Calculation Wall Time:        10.33


MacSPARTAN '08 Semi-Empirical Program:  (x86/Darwin)          build  131       
    Semi-empirical Property Calculation 

  M0001                                                                      

  Guess from Archive
    
  Energy Due to Solvation
   Solvation Energy SM5.4/A        -34.795
  Memory Used:          31.02 Kb
  Reason for exit: Successful completion
  Semi-Empirical Program CPU Time :          .01
  Semi-Empirical Program Wall Time:         4.86


SPARTAN PROPERTIES PACKAGE: MAC/P4             build 131    
   
   

  Reason for exit: Successful completion 
  Properties CPU Time :          .06
  Properties Wall Time:         4.74

molecule M0001 terminated normally



End-   molecule "M0001" Mon Mar 11 16:50:31 2013