File: cpptraj.ene.dat.save

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cpptraj 5.1.0%2Bdfsg-5
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#Iter.            ENE          RMS
1          9.4726E+02   6.9669E+02
2          9.3875E+02   6.9355E+02
3          9.2858E+02   6.8979E+02
4          9.1646E+02   6.8527E+02
5          9.0201E+02   6.7985E+02
6          8.8483E+02   6.7334E+02
7          8.6443E+02   6.6553E+02
8          8.4026E+02   6.5616E+02
9          8.1171E+02   6.4492E+02
10         7.7810E+02   6.3143E+02
11         7.3871E+02   6.1524E+02
12         6.9279E+02   5.9581E+02
13         6.3964E+02   5.7249E+02
14         5.7865E+02   5.4452E+02
15         5.0949E+02   5.1094E+02
16         4.3232E+02   4.7066E+02
17         3.4807E+02   4.2231E+02
18         2.5901E+02   3.6430E+02
19         1.6948E+02   2.9469E+02
20         8.7008E+01   2.1115E+02
21         2.4003E+01   1.1090E+02
22         1.7225E-01   9.3948E+00
23         3.5547E+01   1.3496E+02
24         7.6925E+00   6.2783E+01
25         1.1083E+00   2.3830E+01
26         1.2523E+01   8.0105E+01
27         1.5451E+00   2.8137E+01
28         2.2858E+00   3.4224E+01
29         1.8074E-02   3.0432E+00
30         2.3059E+00   3.4374E+01
31         4.7892E-01   1.5665E+01
32         8.9840E-02   6.7848E+00
33         7.9280E-01   2.0155E+01
34         8.7220E-02   6.6852E+00
35         1.7535E-01   9.4789E+00
36         3.8079E-03   1.3968E+00
37         1.3450E-01   8.3016E+00
38         2.3261E-02   3.4524E+00
39         1.0931E-02   2.3667E+00
40         4.1587E-02   4.6162E+00
41         2.4689E-03   1.1247E+00
42         1.8333E-02   3.0650E+00
43         1.8367E-03   9.7011E-01
44         4.6508E-03   1.5437E+00
45         1.6053E-04   2.8681E-01
46         2.9119E-03   1.2215E+00
47         4.2625E-04   4.6734E-01
48         3.7378E-04   4.3764E-01
49         8.2034E-04   6.4834E-01
50         2.1661E-05   1.0535E-01
51         5.8230E-04   5.4623E-01
52         9.4836E-05   2.2044E-01
53         5.6740E-05   1.7051E-01
54         1.7404E-04   2.9863E-01
55         8.0088E-06   6.4060E-02
56         9.2259E-05   2.1742E-01
57         1.1476E-05   7.6682E-02
58         1.6593E-05   9.2209E-02
59         1.1763E-07   7.7635E-03
60         1.7087E-05   9.3571E-02
61         3.5924E-06   4.2904E-02
62         6.2510E-07   1.7897E-02
63         5.9173E-06   5.5064E-02
64         6.7398E-07   1.8583E-02
65         1.2387E-06   2.5193E-02
66         2.1314E-08   3.3048E-03
67         1.0289E-06   2.2961E-02
68         1.8851E-07   9.8282E-03
69         6.8659E-08   5.9313E-03
70         3.2881E-07   1.2980E-02
71         2.4241E-08   3.5244E-03
72         1.1942E-07   7.8225E-03
73         9.0134E-09   2.1491E-03
74         4.2363E-08   4.6591E-03
75         3.0738E-09   1.2550E-03
76         1.5629E-08   2.8299E-03
77         1.2101E-09   7.8743E-04
78         5.4005E-09   1.6635E-03
79         3.7445E-10   4.3803E-04
80         2.0806E-09   1.0325E-03
81         1.7244E-10   2.9725E-04
82         6.6807E-10   5.8508E-04
83         4.0421E-11   1.4392E-04
84         1.0649E-07   7.3868E-03
85         2.5595E-08   3.6214E-03
86         1.5702E-09   8.9699E-04
87         3.9962E-08   4.5251E-03
88         6.4224E-09   1.8141E-03
89         4.0423E-09   1.4392E-03
90         1.1856E-08   2.4647E-03
91         5.1312E-10   5.1276E-04
92         6.5328E-09   1.8296E-03
93         8.4604E-10   6.5841E-04
94         1.0890E-09   7.4700E-04
95         3.8286E-12   4.4292E-05