HyperChem log start -- Mon Nov 22 17:03:36 2010.
Single Point, SemiEmpirical, molecule = BeH2.hin.
ExtendedHuckel
Extended-Huckel Calculation:
Singlet State Calculation
Number of Electrons = 4
Starting Extended-Huckel calculation with 6 orbitals
Charge on the System = 0
Total Orbitals = 6
Number of Double Occupied Levels = 2
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      1 PIU      1 PIU      2 SIG      2 SIU 
Eigenvalue    -15.86530  -13.95260   -6.00000   -6.00000    6.62969   25.48194

  S Be   2     -0.38628   -0.00000    0.00000   -0.00000    1.30795   -0.00000
 Px Be   2     -0.00000    0.00000   -0.57430   -0.81865    0.00000    0.00000
 Py Be   2     -0.00000   -0.00000    0.81865   -0.57430    0.00000   -0.00000
 Pz Be   2      0.00000   -0.25622   -0.00000   -0.00000    0.00000    1.71702
  S  H   1     -0.48118    0.56478   -0.00000    0.00000   -0.81021    1.12372
  S  H   3     -0.48118   -0.56478    0.00000    0.00000   -0.81021   -1.12372

Energy=-1375.261154 Symmetry=D*H

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

      Sum of One-Electron Energies =   -1375.2611538 (kcal/mol)
      Sum of One-Electron Energies =    -2.191574394 (a.u.)

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

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

Symmetry:      1 SIG        1 SIU        1 PIU        1 PIU        2 SIG 
Eigenvalue:  -15.865297   -13.952602    -6.000000    -6.000000     6.629693

Symmetry:      2 SIU 
Eigenvalue:   25.481938

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

AO:            2   S Be     2  Px Be     2  Py Be     2  Pz Be     1   S  H
               0.664253     0.000000     0.000000     0.457864     1.438941

AO:            3   S  H
               1.438941

                    ----- NET CHARGES AND COORDINATES -----
Atom  Z     Charge             Coordinates(Angstrom)
                            x           y           z
  2   4     0.877883       0.00000     0.00000     0.00000
  1   1    -0.438941      -0.00000     0.00000    -1.22000
  3   1    -0.438941       0.00000    -0.00000     1.22000
HyperChem log stop -- Mon Nov 22 17:03:42 2010.