HyperChem log start -- Mon Nov 22 02:46:12 2010.
Single Point, SemiEmpirical, molecule = I2.hin.
ExtendedHuckel
Extended-Huckel Calculation:
Singlet State Calculation
Number of Electrons = 14
Starting Extended-Huckel calculation with 8 orbitals
Charge on the System = 0
Total Orbitals = 8
Number of Double Occupied Levels = 7
Unweighted Huckel Constant = 1.7500000
d Orbitals on Si...Cl If Any Not Included

                       Eigenvalues (eV)  and Eigenvectors

Mol. Orbital       1          2          3          4          5          6
Symmetry:        1 SIG      1 SIU      2 SIG      1 PIU      1 PIU      1 PIG 
Eigenvalue    -19.42487  -17.23750  -14.11941  -13.36963  -13.36963  -11.92081

  S  I   1     -0.63204   -0.67996    0.26532    0.00000   -0.00000    0.00000
 Px  I   1     -0.00000    0.00000    0.00000    0.15665    0.66356    0.58219
 Py  I   1     -0.00000   -0.00000    0.00000   -0.66356    0.15665   -0.44940
 Pz  I   1     -0.14926    0.20192   -0.60920    0.00000    0.00000   -0.00000
  S  I   2     -0.63204    0.67996    0.26532   -0.00000   -0.00000   -0.00000
 Px  I   2     -0.00000    0.00000    0.00000    0.15665    0.66356   -0.58219
 Py  I   2     -0.00000   -0.00000    0.00000   -0.66356    0.15665    0.44940
 Pz  I   2      0.14926    0.20192    0.60920    0.00000   -0.00000    0.00000

Mol. Orbital       7          8
Symmetry:        1 PIG      2 SIU 
Eigenvalue    -11.92081   -6.31737

  S  I   1      0.00000    0.34582
 Px  I   1      0.44940   -0.00000
 Py  I   1      0.58219    0.00000
 Pz  I   1     -0.00000    0.84745
  S  I   2      0.00000   -0.34582
 Px  I   2     -0.44940    0.00000
 Py  I   2     -0.58219    0.00000
 Pz  I   2      0.00000    0.84745

Energy=-4675.049060 Symmetry=D*H

 ********************************* RESULTS *********************************

      Sum of One-Electron Energies =   -4675.0490599 (kcal/mol)
      Sum of One-Electron Energies =    -7.450016153 (a.u.)

                   -----   Molecular Point Group:  D*H  -----

                   ----- EIGENVALUES(eV) AND SYMMETRIES -----

Symmetry:      1 SIG        1 SIU        2 SIG        1 PIU        1 PIU 
Eigenvalue:  -19.424872   -17.237498   -14.119415   -13.369629   -13.369629

Symmetry:      1 PIG        1 PIG        2 SIU 
Eigenvalue:  -11.920814   -11.920814    -6.317374

                ----- ATOMIC ORBITAL ELECTRON POPULATIONS -----

AO:            1   S  I     1  Px  I     1  Py  I     1  Pz  I     2   S  I
               1.891916     2.000000     2.000000     1.108084     1.891916

AO:            2  Px  I     2  Py  I     2  Pz  I
               2.000000     2.000000     1.108084

                    ----- NET CHARGES AND COORDINATES -----
Atom  Z     Charge             Coordinates(Angstrom)
                            x           y           z
  1  53     0.000000       0.00000    -0.00000    -1.33500
  2  53     0.000000      -0.00000     0.00000     1.33500
HyperChem log stop -- Mon Nov 22 02:46:29 2010.