1.ATOM      Fe                    5 CORE STATES
:1S 001: 1S                -513.396392254 Ry
:2S 001: 2S                 -59.323080057 Ry
:2PP001: 2P*                -51.025066663 Ry
:2P 001: 2P                 -50.107662626 Ry
:3S 001: 3S                  -5.989091762 Ry

        2.ATOM      Ge                    7 CORE STATES
       CORE-FORCE in mRy/a.u. = |F|      Fx             Fy             Fz
:FCO002:   2.ATOM         83.637          0.000          0.000        -83.637

:1S 002: 1S                -804.518875977 Ry
:2S 002: 2S                 -99.917688756 Ry
:2PP002: 2P*                -88.775997875 Ry
:2P 002: 2P                 -86.433465616 Ry
:3S 002: 3S                 -11.515582160 Ry
:3PP002: 3P*                 -7.843114095 Ry
:3P 002: 3P                  -7.528866131 Ry

        3.ATOM      Mg                    1 CORE STATES
       CORE-FORCE in mRy/a.u. = |F|      Fx             Fy             Fz
:FCO003:   3.ATOM         44.702          0.000          0.000         44.702

:1S 003: 1S                 -91.802661290 Ry