 Etot  =     -396.279736
 Ekin  =      395.467438
 Ecoul =      170.244047
 Eenuc =     -938.172650
 Exc   =      -23.818570
 1s        -88.230067
 2s         -8.130689
 2p         -6.183084
 3s         -1.010929
 3p         -0.620857
