 Etot  =    -4935.368406
 Ekin  =     4932.234516
 Ecoul =     2031.645838
 Eenuc =   -11762.875805
 Exc   =     -136.372955
 1sD      -860.134909
 1su      -860.134909
 2sD      -123.105078
 2su      -123.105078
 2pD      -114.408286
 2pu      -114.408286
 3sD       -22.060898
 3su       -22.060898
 3pD       -18.580798
 3pu       -18.580798
 3dD       -12.132197
 3du       -12.132197
 4sD        -2.889173
 4su        -2.889173
 4pD        -1.815215
 4pu        -1.815215
 4dD        -0.160771
 4du        -0.160771
