# Scan of Total Energy

# X-Axis: Scan Step Number

# Y-Axis: Total Energy (Hartree)
# X Y
1,0000000000 -100,4269306600
2,0000000000 -100,4434585630
3,0000000000 -100,4504812340
4,0000000000 -100,4508712540
5,0000000000 -100,4466668070
6,0000000000 -100,4393176140
7,0000000000 -100,4298586630
8,0000000000 -100,4190367030
9,0000000000 -100,4073938960
10,0000000000 -100,3953240060
11,0000000000 -100,3831137440
12,0000000000 -100,3709670580
13,0000000000 -100,3590290980
14,0000000000 -100,3473989660
15,0000000000 -100,3361431910
16,0000000000 -100,3253057650
17,0000000000 -100,3149117440
18,0000000000 -100,3049751410
19,0000000000 -100,2955030230
20,0000000000 -100,2864935540
21,0000000000 -100,2779393960
22,0000000000 -100,2698322150
23,0000000000 -100,2621604900
24,0000000000 -100,2549077750
25,0000000000 -100,2480566120
26,0000000000 -100,2415912190
27,0000000000 -100,2354952260
28,0000000000 -100,2297498610
29,0000000000 -100,2243361840
30,0000000000 -100,2192375750
31,0000000000 -100,2144391680
32,0000000000 -100,2099256670
33,0000000000 -100,2056806730
34,0000000000 -100,2016879980
35,0000000000 -100,1979330580
36,0000000000 -100,1944033270
37,0000000000 -100,1910878930
38,0000000000 -100,1879765170
39,0000000000 -100,1850586560
40,0000000000 -100,1823227970
41,0000000000 -100,1797565010
42,0000000000 -100,1773471720
43,0000000000 -100,1750830070
44,0000000000 -100,1729536190
45,0000000000 -100,1709502820
46,0000000000 -100,1690657740
47,0000000000 -100,1672938380
48,0000000000 -100,1656285220
49,0000000000 -100,1640637830
50,0000000000 -100,1625934280
51,0000000000 -100,1612113070
52,0000000000 -100,1599115580
53,0000000000 -100,1586887550
54,0000000000 -100,1575379000
55,0000000000 -100,1564543440
56,0000000000 -100,1554337440
57,0000000000 -100,1544720220
58,0000000000 -100,1535653330
59,0000000000 -100,1527100150
60,0000000000 -100,1519025810
61,0000000000 -100,1511397780
62,0000000000 -100,1504186860
63,0000000000 -100,1497367170