H2 distance
MOLECULE
25
1
1      0.486124925158419 0.0               0.0
END
1 1
0 0  4  1.00 1.0
       18.7311370  0.01273
       2.82539370  0.09086
      0.640121700  0.37128
      0.161277800  0.64895
99 0
END
PRINTOUT
ATOMICWF
EIGENVAL
1
EIGENVEC
1
END
END
TOLDEE
7
FMIXING 
30
END