# geometry from run  - Butadiene C2h                                                                  
&atoms nctype 2 natom 10
&atom_types  1 C  2 H 
geometry
-1.157935 -0.733652  0.000000 1
 1.157935  0.733652  0.000000 1
-3.466419  0.298187  0.000000 1
 3.466419 -0.298187  0.000000 1
-3.706633  2.326423  0.000000 2
 3.706633 -2.326423  0.000000 2
-0.963193 -2.772181  0.000000 2
 0.963193  2.772181  0.000000 2
-5.146950 -0.855551  0.000000 2
 5.146950  0.855551  0.000000 2
end
znuc
4.000000 1.000000 
end