./iterations/neb1_max2_image01_iter43_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 -25.940116987 1.000000
2 -20.478077224 1.000000
3 -19.729866607 1.000000
4 -19.138295149 1.000000
5 -14.254058649 1.000000
6 -13.273047096 1.000000
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23 -7.653626866 1.000000
24 -7.475560663 1.000000
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26 -6.991314500 1.000000
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28 -6.754906242 1.000000
29 -6.455809500 1.000000
30 -6.087438815 1.000000
31 -5.043311417 1.002154
32 -4.738908163 0.998157
33 -0.769692071 -0.000000
34 -0.472671467 -0.000000
35 -0.138760272 -0.000000
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38 0.411289327 -0.000000
39 0.506220560 -0.000000
40 0.565699755 -0.000000
41 0.684653252 -0.000000
42 0.810241399 0.000000
43 0.917649713 0.000000
44 0.968490646 0.000000
45 1.048652849 0.000000
46 1.147466612 0.000000
47 1.225967466 0.000000
0.0000000E+00 0.5000000E+00 0.0000000E+00 0.2500000E+00
1 -25.939972488 1.000000
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22 -7.740417702 1.000000
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24 -7.475501730 1.000000
25 -7.126781253 1.000000
26 -6.991349127 1.000000
27 -6.919143585 1.000000
28 -6.754806364 1.000000
29 -6.455692235 1.000000
30 -6.087190934 1.000000
31 -5.042957539 1.002169
32 -4.738778608 0.998010
33 -0.778925596 -0.000000
34 -0.411520804 -0.000000
35 -0.086815837 -0.000000
36 0.172636088 -0.000000
37 0.226478624 -0.000000
38 0.406671262 -0.000000
39 0.485497400 -0.000000
40 0.648382609 -0.000000
41 0.757546289 0.000000
42 0.809905980 0.000000
43 0.826861004 0.000000
44 0.939538973 0.000000
45 0.966293246 0.000000
46 1.048403009 0.000000
47 1.203581462 0.000000
0.0000000E+00 0.0000000E+00 0.5000000E+00 0.2500000E+00
1 -25.940023452 1.000000
2 -20.478048779 1.000000
3 -19.729802279 1.000000
4 -19.138265723 1.000000
5 -14.253870833 1.000000
6 -13.272968643 1.000000
7 -13.107086007 1.000000
8 -12.481733759 1.000000
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11 -10.909982568 1.000000
12 -10.798674629 1.000000
13 -9.699096798 1.000000
14 -9.319981522 1.000000
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23 -7.653549452 1.000000
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25 -7.126760629 1.000000
26 -6.991397478 1.000000
27 -6.919334222 1.000000
28 -6.755075548 1.000000
29 -6.455830652 1.000000
30 -6.086938239 1.000000
31 -5.043001401 1.002167
32 -4.738398550 0.997576
33 -0.778181736 -0.000000
34 -0.476612838 -0.000000
35 -0.033146306 -0.000000
36 0.182469760 -0.000000
37 0.254981666 -0.000000
38 0.411804283 -0.000000
39 0.488421332 -0.000000
40 0.567966160 -0.000000
41 0.667983747 -0.000000
42 0.747508574 -0.000000
43 0.885225253 0.000000
44 1.014052758 0.000000
45 1.081012606 0.000000
46 1.103799167 0.000000
47 1.130868326 0.000000
0.0000000E+00 0.5000000E+00 0.5000000E+00 0.2500000E+00
1 -25.939899341 1.000000
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3 -19.729818726 1.000000
4 -19.138225463 1.000000
5 -14.253833630 1.000000
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10 -12.067360237 1.000000
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29 -6.455567052 1.000000
30 -6.086934015 1.000000
31 -5.042772729 1.002178
32 -4.738409046 0.997588
33 -0.785994614 -0.000000
34 -0.424601018 -0.000000
35 0.023459193 -0.000000
36 0.182460189 -0.000000
37 0.289863224 -0.000000
38 0.423433369 -0.000000
39 0.451022810 -0.000000
40 0.588975956 -0.000000
41 0.704400107 -0.000000
42 0.820003027 0.000000
43 0.848857768 0.000000
44 0.925311450 0.000000
45 0.976787975 0.000000
46 1.006907426 0.000000
47 1.110782970 0.000000