./iterations/neb1_max2_image01_iter47_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 -25.687452386 1.000000
2 -20.429750560 1.000000
3 -19.803911434 1.000000
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5 -14.200646148 1.000000
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24 -7.475811086 1.000000
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27 -6.950290120 1.000000
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29 -6.569055026 1.000000
30 -6.062152816 1.000000
31 -5.087854644 1.004333
32 -4.817294903 0.995954
33 -0.730872478 -0.000000
34 -0.450030909 -0.000000
35 -0.128669338 -0.000000
36 0.161834571 -0.000000
37 0.272835028 -0.000000
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39 0.522011338 -0.000000
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41 0.692550307 0.000000
42 0.808817529 0.000000
43 0.917280093 0.000000
44 0.973985584 0.000000
45 1.049960155 0.000000
46 1.142599223 0.000000
47 1.226425235 0.000000
0.0000000E+00 0.5000000E+00 0.0000000E+00 0.2500000E+00
1 -25.687310520 1.000000
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27 -6.950189315 1.000000
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29 -6.568927381 1.000000
30 -6.061931026 1.000000
31 -5.087492976 1.004362
32 -4.817186394 0.995826
33 -0.740237823 -0.000000
34 -0.386362188 -0.000000
35 -0.078732515 -0.000000
36 0.161713856 -0.000000
37 0.230668685 -0.000000
38 0.429610637 -0.000000
39 0.488125602 -0.000000
40 0.654663516 -0.000000
41 0.771788807 0.000000
42 0.814346954 0.000000
43 0.829545488 0.000000
44 0.944321340 0.000000
45 0.960380145 0.000000
46 1.050101968 0.000000
47 1.212982789 0.000000
0.0000000E+00 0.0000000E+00 0.5000000E+00 0.2500000E+00
1 -25.687366470 1.000000
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3 -19.803846931 1.000000
4 -19.198480320 1.000000
5 -14.200470285 1.000000
6 -13.209306196 1.000000
7 -12.888736578 1.000000
8 -12.488457451 1.000000
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10 -11.997928698 1.000000
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12 -10.788550608 1.000000
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27 -6.950372824 1.000000
28 -6.785353531 1.000000
29 -6.569004912 1.000000
30 -6.061657261 1.000000
31 -5.087520021 1.004360
32 -4.816822003 0.995396
33 -0.739602409 -0.000000
34 -0.454254802 -0.000000
35 -0.022754357 -0.000000
36 0.173460098 -0.000000
37 0.272645032 -0.000000
38 0.420938456 -0.000000
39 0.488144876 -0.000000
40 0.581178890 -0.000000
41 0.669519118 -0.000000
42 0.757021112 0.000000
43 0.875631966 0.000000
44 1.021062277 0.000000
45 1.082769797 0.000000
46 1.099352729 0.000000
47 1.208281423 0.000000
0.0000000E+00 0.5000000E+00 0.5000000E+00 0.2500000E+00
1 -25.687240564 1.000000
2 -20.429708373 1.000000
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4 -19.198432750 1.000000
5 -14.200428804 1.000000
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30 -6.061676135 1.000000
31 -5.087291519 1.004378
32 -4.816818949 0.995392
33 -0.747484102 -0.000000
34 -0.400840118 -0.000000
35 0.033120732 -0.000000
36 0.172980274 -0.000000
37 0.294746995 -0.000000
38 0.446557678 -0.000000
39 0.453880992 -0.000000
40 0.591504002 -0.000000
41 0.710817656 0.000000
42 0.836997841 0.000000
43 0.847733410 0.000000
44 0.934733642 0.000000
45 0.967590431 0.000000
46 1.017184600 0.000000
47 1.111406626 0.000000