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i NZ NE iSLP iLV iCONF E(RYD)
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1 3 2 100 1 1s2 -5.53159E+00
2 3 2 300 1 1s 2s -1.22129E+00
3 3 2 100 2 1s 2s -1.07741E+00
4 3 2 311 1 1s 2p -1.05501E+00
5 3 2 111 1 1s 2p -9.85976E-01
6 3 2 300 2 1s 3s -5.04122E-01
7 3 2 100 3 1s 3s -4.66299E-01
8 3 2 311 2 1s 3p -4.60797E-01
9 3 2 320 1 1s 3d -4.45046E-01
10 3 2 120 1 1s 3d -4.44771E-01
11 3 2 111 2 1s 3p -4.40172E-01
12 3 2 300 3 1s 4s -2.74257E-01
13 3 2 100 4 1s 4s -2.59063E-01
14 3 2 311 3 1s 4p -2.56875E-01
15 3 2 320 2 1s 4d -2.50297E-01
16 3 2 120 2 1s 4d -2.50142E-01
17 3 2 111 3 1s 4p -2.48196E-01
18 3 2 300 4 1s 5s -1.72175E-01
19 3 2 100 5 1s 5s -1.64610E-01
20 3 2 311 4 1s 5p -1.63512E-01
21 3 2 320 3 1s 5d -1.60165E-01
22 3 2 120 3 1s 5d -1.60077E-01
23 3 2 111 4 1s 5p -1.59078E-01
24 3 2 300 5 1s 6s -1.18070E-01
25 3 2 100 6 1s 6s -1.13768E-01
26 3 2 311 5 1s 6p -1.13140E-01
27 3 2 320 4 1s 6d -1.11211E-01
28 3 2 120 4 1s 6d -1.11157E-01
29 3 2 111 5 1s 6p -1.10579E-01
30 3 2 300 6 1s 7s -8.59787E-02
31 3 2 100 7 1s 7s -8.33004E-02
32 3 2 311 6 1s 7p -8.29088E-02
33 3 2 320 5 1s 7d -8.16969E-02
34 3 2 120 5 1s 7d -8.16619E-02
35 3 2 111 6 1s 7p -8.12979E-02
36 3 2 300 7 1s 8s -6.53940E-02
37 3 2 100 8 1s 8s -6.36147E-02
38 3 2 311 7 1s 8p -6.33540E-02
39 3 2 320 6 1s 8d -6.25435E-02
40 3 2 120 6 1s 8d -6.25196E-02
41 3 2 111 7 1s 8p -6.22760E-02
42 3 2 300 8 1s 9s -5.14061E-02
43 3 2 100 9 1s 9s -5.01642E-02
44 3 2 311 8 1s 9p -4.99820E-02
45 3 2 320 7 1s 9d -4.94136E-02
46 3 2 120 7 1s 9d -4.93965E-02
47 3 2 111 8 1s 9p -4.92255E-02
48 3 2 300 9 1s10s -4.14698E-02
49 3 2 100 10 1s10s -4.05690E-02
50 3 2 311 9 1s10p -4.04365E-02
51 3 2 320 8 1s10d -4.00226E-02
52 3 2 120 8 1s10d -4.00101E-02
53 3 2 111 9 1s10p -3.98854E-02
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