./iterations/neb1_max2_image01_iter38_EIGENVAL output for 41: 3.3A-->1.3A (Job 121) O-H...N hydrogen bond by TSA-OH, TSA-NH2 (TSS)
Status:
finished
29 29 1 1
0.7448276E+02 0.1500000E-08 0.1200000E-08 0.1200000E-08 0.5000000E-15
1.000000000000000E-004
CAR
No title
64 4 47
0.0000000E+00 0.0000000E+00 0.0000000E+00 0.2500000E+00
1 -25.583866070 1.000000
2 -20.447326461 1.000000
3 -19.893343035 1.000000
4 -19.235190892 1.000000
5 -14.276388427 1.000000
6 -13.207466452 1.000000
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8 -12.490086297 1.000000
9 -12.465961936 1.000000
10 -11.817452839 1.000000
11 -10.988786359 1.000000
12 -10.789551863 1.000000
13 -9.631795583 1.000000
14 -9.384909344 1.000000
15 -9.274844602 1.000000
16 -8.775212007 1.000000
17 -8.650843406 1.000000
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23 -7.669658091 1.000000
24 -7.492639867 1.000000
25 -7.173420411 1.000000
26 -7.008992501 1.000000
27 -6.955259787 1.000000
28 -6.796209424 1.000000
29 -6.629304898 1.000000
30 -6.080554937 1.000000
31 -5.134500261 1.010419
32 -4.911316538 0.989808
33 -0.694389448 -0.000000
34 -0.424161922 -0.000000
35 -0.130631172 -0.000000
36 0.165249218 -0.000000
37 0.281512079 -0.000000
38 0.402635839 -0.000000
39 0.535229014 -0.000000
40 0.575168641 0.000000
41 0.692311017 0.000000
42 0.813913751 0.000000
43 0.912384636 0.000000
44 0.970587444 0.000000
45 1.054442322 0.000000
46 1.147507138 0.000000
47 1.227710076 0.000000
0.0000000E+00 0.5000000E+00 0.0000000E+00 0.2500000E+00
1 -25.583718696 1.000000
2 -20.447299680 1.000000
3 -19.893311972 1.000000
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7 -12.750583304 1.000000
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20 -8.089149680 1.000000
21 -7.854341866 1.000000
22 -7.720359315 1.000000
23 -7.669557209 1.000000
24 -7.492470109 1.000000
25 -7.173330578 1.000000
26 -7.009012282 1.000000
27 -6.955149048 1.000000
28 -6.796110192 1.000000
29 -6.629187427 1.000000
30 -6.080350194 1.000000
31 -5.134133399 1.010477
32 -4.911215006 0.989678
33 -0.702740365 -0.000000
34 -0.358674383 -0.000000
35 -0.083804010 -0.000000
36 0.166763348 -0.000000
37 0.223034486 -0.000000
38 0.444436509 -0.000000
39 0.492578953 -0.000000
40 0.664362193 0.000000
41 0.773528357 0.000000
42 0.809345670 0.000000
43 0.831817350 0.000000
44 0.947842461 0.000000
45 0.959410677 0.000000
46 1.049273312 0.000000
47 1.225316441 0.000000
0.0000000E+00 0.0000000E+00 0.5000000E+00 0.2500000E+00
1 -25.583769608 1.000000
2 -20.447299538 1.000000
3 -19.893278897 1.000000
4 -19.235171134 1.000000
5 -14.276209538 1.000000
6 -13.207432982 1.000000
7 -12.750574387 1.000000
8 -12.490113374 1.000000
9 -12.465844706 1.000000
10 -11.817351232 1.000000
11 -10.988700305 1.000000
12 -10.789471955 1.000000
13 -9.631649912 1.000000
14 -9.384798108 1.000000
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21 -7.854278843 1.000000
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23 -7.669590581 1.000000
24 -7.492493013 1.000000
25 -7.173275850 1.000000
26 -7.009072591 1.000000
27 -6.955335666 1.000000
28 -6.796412609 1.000000
29 -6.629171606 1.000000
30 -6.080072246 1.000000
31 -5.134066655 1.010487
32 -4.910950445 0.989337
33 -0.701226542 -0.000000
34 -0.431384438 -0.000000
35 -0.024132987 -0.000000
36 0.177176403 -0.000000
37 0.275334376 -0.000000
38 0.422313270 -0.000000
39 0.486535744 -0.000000
40 0.591895780 0.000000
41 0.675707812 0.000000
42 0.757494801 0.000000
43 0.878819452 0.000000
44 1.027053186 0.000000
45 1.081336285 0.000000
46 1.101172597 0.000000
47 1.135758237 0.000000
0.0000000E+00 0.5000000E+00 0.5000000E+00 0.2500000E+00
1 -25.583647259 1.000000
2 -20.447283259 1.000000
3 -19.893289099 1.000000
4 -19.235118293 1.000000
5 -14.276169635 1.000000
6 -13.207383670 1.000000
7 -12.750544409 1.000000
8 -12.490021093 1.000000
9 -12.465831849 1.000000
10 -11.817190285 1.000000
11 -10.988586594 1.000000
12 -10.789269867 1.000000
13 -9.631487387 1.000000
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20 -8.089166122 1.000000
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22 -7.720310557 1.000000
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24 -7.492401660 1.000000
25 -7.173209839 1.000000
26 -7.009054660 1.000000
27 -6.955244830 1.000000
28 -6.796312915 1.000000
29 -6.629017825 1.000000
30 -6.080096523 1.000000
31 -5.133869181 1.010518
32 -4.910902982 0.989276
33 -0.708318049 -0.000000
34 -0.377880864 -0.000000
35 0.030637837 -0.000000
36 0.178098130 -0.000000
37 0.283608917 -0.000000
38 0.446638412 -0.000000
39 0.473735040 -0.000000
40 0.594776382 0.000000
41 0.713194224 0.000000
42 0.830680002 0.000000
43 0.849868625 0.000000
44 0.939056096 0.000000
45 0.971048303 0.000000
46 1.034479073 0.000000
47 1.107188474 0.000000