./neb0_image10_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 -25.728742986 1.000000
2 -20.378755661 1.000000
3 -19.790103150 1.000000
4 -19.191280453 1.000000
5 -14.184993451 1.000000
6 -13.207417590 1.000000
7 -12.957465214 1.000000
8 -12.480522620 1.000000
9 -12.416854165 1.000000
10 -12.060841323 1.000000
11 -10.931803404 1.000000
12 -10.812250181 1.000000
13 -9.636314999 1.000000
14 -9.310173451 1.000000
15 -9.222265323 1.000000
16 -8.735253022 1.000000
17 -8.616067676 1.000000
18 -8.442581284 1.000000
19 -8.266946605 1.000000
20 -8.059480644 1.000000
21 -7.834584659 1.000000
22 -7.701833886 1.000000
23 -7.650414695 1.000000
24 -7.478595965 1.000000
25 -7.146726831 1.000000
26 -6.992333280 1.000000
27 -6.949403280 1.000000
28 -6.789552775 1.000000
29 -6.514132499 1.000000
30 -6.035245726 1.000000
31 -5.071763771 1.003068
32 -4.784145143 0.997222
33 -0.751402435 -0.000000
34 -0.468054943 -0.000000
35 -0.135281163 -0.000000
36 0.159755504 -0.000000
37 0.271550295 -0.000000
38 0.409590394 -0.000000
39 0.520103564 -0.000000
40 0.567937116 -0.000000
41 0.694302360 -0.000000
42 0.810323708 0.000000
43 0.918010312 0.000000
44 0.974366964 0.000000
45 1.045035451 0.000000
46 1.143457229 0.000000
47 1.225568402 0.000000
0.0000000E+00 0.5000000E+00 0.0000000E+00 0.2500000E+00
1 -25.728599528 1.000000
2 -20.378729665 1.000000
3 -19.790068816 1.000000
4 -19.191264753 1.000000
5 -14.184913679 1.000000
6 -13.207370776 1.000000
7 -12.957346743 1.000000
8 -12.480514539 1.000000
9 -12.416774428 1.000000
10 -12.060688115 1.000000
11 -10.931723229 1.000000
12 -10.812119659 1.000000
13 -9.636086946 1.000000
14 -9.309983423 1.000000
15 -9.222177308 1.000000
16 -8.735125288 1.000000
17 -8.615993105 1.000000
18 -8.442542684 1.000000
19 -8.266773057 1.000000
20 -8.059481080 1.000000
21 -7.834623148 1.000000
22 -7.701833882 1.000000
23 -7.650268079 1.000000
24 -7.478519844 1.000000
25 -7.146633550 1.000000
26 -6.992343359 1.000000
27 -6.949320313 1.000000
28 -6.789445000 1.000000
29 -6.513999341 1.000000
30 -6.035019407 1.000000
31 -5.071405143 1.003090
32 -4.784037049 0.997097
33 -0.760698540 -0.000000
34 -0.407120331 -0.000000
35 -0.081516662 -0.000000
36 0.159716383 -0.000000
37 0.235283365 -0.000000
38 0.420646509 -0.000000
39 0.484221080 -0.000000
40 0.657678423 -0.000000
41 0.767901575 0.000000
42 0.817769989 0.000000
43 0.830384699 0.000000
44 0.941039474 0.000000
45 0.959965959 0.000000
46 1.051266922 0.000000
47 1.199963060 0.000000
0.0000000E+00 0.0000000E+00 0.5000000E+00 0.2500000E+00
1 -25.728655458 1.000000
2 -20.378728162 1.000000
3 -19.790038041 1.000000
4 -19.191255464 1.000000
5 -14.184819365 1.000000
6 -13.207369384 1.000000
7 -12.957329313 1.000000
8 -12.480534125 1.000000
9 -12.416746637 1.000000
10 -12.060753170 1.000000
11 -10.931725561 1.000000
12 -10.812166242 1.000000
13 -9.636183904 1.000000
14 -9.310069959 1.000000
15 -9.222131944 1.000000
16 -8.735113752 1.000000
17 -8.615887538 1.000000
18 -8.442548965 1.000000
19 -8.266862435 1.000000
20 -8.059481739 1.000000
21 -7.834559409 1.000000
22 -7.701771798 1.000000
23 -7.650327386 1.000000
24 -7.478467004 1.000000
25 -7.146608131 1.000000
26 -6.992429077 1.000000
27 -6.949502539 1.000000
28 -6.789706038 1.000000
29 -6.514118398 1.000000
30 -6.034748022 1.000000
31 -5.071436113 1.003088
32 -4.783662579 0.996664
33 -0.760687664 -0.000000
34 -0.472369897 -0.000000
35 -0.027862192 -0.000000
36 0.170875707 -0.000000
37 0.271554173 -0.000000
38 0.419403508 -0.000000
39 0.489985271 -0.000000
40 0.583430942 -0.000000
41 0.668802362 -0.000000
42 0.755573382 0.000000
43 0.873276120 0.000000
44 1.012303086 0.000000
45 1.087542457 0.000000
46 1.097490953 0.000000
47 1.155763417 0.000000
0.0000000E+00 0.5000000E+00 0.5000000E+00 0.2500000E+00
1 -25.728529046 1.000000
2 -20.378713325 1.000000
3 -19.790053982 1.000000
4 -19.191208171 1.000000
5 -14.184778217 1.000000
6 -13.207305890 1.000000
7 -12.957311160 1.000000
8 -12.480469340 1.000000
9 -12.416712205 1.000000
10 -12.060601997 1.000000
11 -10.931599756 1.000000
12 -10.811975267 1.000000
13 -9.636035017 1.000000
14 -9.310006986 1.000000
15 -9.222086729 1.000000
16 -8.734987599 1.000000
17 -8.615797192 1.000000
18 -8.442518695 1.000000
19 -8.266708572 1.000000
20 -8.059484349 1.000000
21 -7.834592782 1.000000
22 -7.701770336 1.000000
23 -7.650280134 1.000000
24 -7.478448849 1.000000
25 -7.146509660 1.000000
26 -6.992432091 1.000000
27 -6.949400595 1.000000
28 -6.789626218 1.000000
29 -6.513877561 1.000000
30 -6.034764150 1.000000
31 -5.071211723 1.003102
32 -4.783667213 0.996669
33 -0.768483914 -0.000000
34 -0.420443835 -0.000000
35 0.030288174 -0.000000
36 0.170585682 -0.000000
37 0.302156399 -0.000000
38 0.436897867 -0.000000
39 0.450355948 -0.000000
40 0.591184636 -0.000000
41 0.716246129 0.000000
42 0.837006104 0.000000
43 0.847111983 0.000000
44 0.931287529 0.000000
45 0.965532739 0.000000
46 1.004673839 0.000000
47 1.113147846 0.000000