 Etot  =   -15283.448822
 Ekin  =    15277.849307
 Ecoul =     6141.634533
 Eenuc =   -36404.087502
 Exc   =     -298.845160
 1s      -2341.042887
 2s       -384.856157
 2p       -369.013973
 3s        -87.867792
 3p        -80.502102
 3d        -66.724787
 4s        -17.570797
 4p        -14.495102
 4d         -8.879693
 4f         -1.550835
 5s         -2.396018
 5p         -1.504457
 5d         -0.220603
 6s         -0.181413
