Content for NMR-STAR saveframe, "spectral_peak_list_9"
save_spectral_peak_list_9
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode spectral_peak_list_9
_Spectral_peak_list.Entry_ID 34575
_Spectral_peak_list.ID 9
_Spectral_peak_list.Name .
_Spectral_peak_list.Sample_ID 2
_Spectral_peak_list.Sample_label $sample_2
_Spectral_peak_list.Sample_condition_list_ID 1
_Spectral_peak_list.Sample_condition_list_label $sample_conditions_1
_Spectral_peak_list.Chem_shift_reference_ID 1
_Spectral_peak_list.Chem_shift_reference_label $chem_shift_reference_1
_Spectral_peak_list.Experiment_ID 7
_Spectral_peak_list.Experiment_name '3D 1H-15N NOESY'
_Spectral_peak_list.Experiment_class .
_Spectral_peak_list.Experiment_type .
_Spectral_peak_list.Number_of_spectral_dimensions 3
_Spectral_peak_list.Chemical_shift_list .
_Spectral_peak_list.Assigned_chem_shift_list_ID 1
_Spectral_peak_list.Assigned_chem_shift_list_label $assigned_chemical_shifts_1
_Spectral_peak_list.Details .
_Spectral_peak_list.Text_data_format text
_Spectral_peak_list.Text_data
;
# Number of dimensions 3
#FORMAT xeasy3D
#INAME 1 HC
#INAME 2 C
#INAME 3 H
#SPECTRUM C13NOESY HC C H
1 2.475 30.796 0.829 9 T 7.825e+09 0.00e+00 a 0 0 0 0 0
2 4.330 56.048 0.832 9 T 3.532e+10 0.00e+00 a 0 0 0 0 0
3 2.793 37.777 0.830 9 T 4.622e+10 0.00e+00 a 0 0 0 0 0
4 4.414 55.446 0.831 9 T 9.707e+09 0.00e+00 a 0 0 0 0 0
5 1.607 42.470 2.182 9 T 1.057e+10 0.00e+00 a 0 0 0 0 0
6 1.606 42.273 0.929 9 T 1.583e+10 0.00e+00 a 0 0 0 0 0
7 1.594 42.323 0.826 9 T 2.348e+10 0.00e+00 a 0 0 0 0 0
8 1.594 42.234 7.086 9 T 1.490e+10 0.00e+00 a 0 0 0 0 0
9 1.658 42.265 0.923 9 T 8.514e+09 0.00e+00 a 0 0 0 0 0
10 0.821 24.676 0.935 9 T 5.104e+10 0.00e+00 a 0 0 0 0 0
11 0.814 24.995 1.364 9 T 6.030e+09 0.00e+00 a 0 0 0 0 0
12 0.821 24.790 1.552 9 T 8.929e+09 0.00e+00 a 0 0 0 0 0
13 0.821 24.720 1.808 9 T 1.113e+10 0.00e+00 a 0 0 0 0 0
14 0.819 24.709 1.670 9 T 2.153e+10 0.00e+00 a 0 0 0 0 0
15 0.821 24.852 2.227 9 T 1.115e+10 0.00e+00 a 0 0 0 0 0
16 0.821 24.738 2.033 9 T 7.779e+09 0.00e+00 a 0 0 0 0 0
17 0.822 24.687 4.283 9 T 1.454e+10 0.00e+00 a 0 0 0 0 0
18 0.823 24.610 4.214 9 T 1.228e+10 0.00e+00 a 0 0 0 0 0
19 0.822 24.735 4.024 9 T 1.613e+10 0.00e+00 a 0 0 0 0 0
20 0.823 24.699 3.915 9 T 6.972e+09 0.00e+00 a 0 0 0 0 0
21 0.822 24.669 6.802 9 T 7.804e+09 0.00e+00 a 0 0 0 0 0
22 0.823 24.715 7.030 9 T 1.174e+10 0.00e+00 a 0 0 0 0 0
23 0.747 24.954 4.265 9 T 3.164e+10 0.00e+00 a 0 0 0 0 0
24 0.750 24.914 4.204 9 T 3.041e+10 0.00e+00 a 0 0 0 0 0
25 0.746 24.924 6.814 9 T 8.902e+09 0.00e+00 a 0 0 0 0 0
26 0.738 24.937 7.035 9 T 1.561e+10 0.00e+00 a 0 0 0 0 0
27 0.745 24.961 4.024 9 T 2.206e+10 0.00e+00 a 0 0 0 0 0
28 0.744 24.898 2.189 9 T 1.211e+10 0.00e+00 a 0 0 0 0 0
29 0.744 24.825 2.012 9 T 1.714e+10 0.00e+00 a 0 0 0 0 0
30 0.747 24.888 1.818 9 T 2.685e+10 0.00e+00 a 0 0 0 0 0
31 0.743 24.961 1.661 9 T 2.264e+10 0.00e+00 a 0 0 0 0 0
32 0.744 24.825 1.556 9 T 1.408e+10 0.00e+00 a 0 0 0 0 0
33 0.748 24.915 1.393 9 T 1.132e+10 0.00e+00 a 0 0 0 0 0
34 0.748 24.892 0.929 9 T 6.140e+10 0.00e+00 a 0 0 0 0 0
35 0.746 24.922 0.828 9 T 1.478e+11 0.00e+00 a 0 0 0 0 0
36 0.745 24.813 1.044 9 T 7.173e+09 0.00e+00 a 0 0 0 0 0
37 1.468 27.112 0.925 9 T 1.798e+10 0.00e+00 a 0 0 0 0 0
38 1.465 27.099 0.828 9 T 2.953e+10 0.00e+00 a 0 0 0 0 0
39 3.851 63.940 0.935 9 T 6.509e+09 0.00e+00 a 0 0 0 0 0
40 3.845 64.106 0.827 9 T 9.258e+09 0.00e+00 a 0 0 0 0 0
41 1.202 21.452 0.924 9 T 2.234e+10 0.00e+00 a 0 0 0 0 0
42 1.203 21.437 0.825 9 T 9.092e+10 0.00e+00 a 0 0 0 0 0
43 1.196 21.433 1.619 9 T 7.011e+09 0.00e+00 a 0 0 0 0 0
44 1.205 21.466 1.821 9 T 1.951e+10 0.00e+00 a 0 0 0 0 0
45 1.204 21.449 2.845 9 T 1.499e+10 0.00e+00 a 0 0 0 0 0
47 1.203 21.426 2.607 9 T 1.517e+10 0.00e+00 a 0 0 0 0 0
48 1.200 21.409 4.027 9 T 7.769e+09 0.00e+00 a 0 0 0 0 0
49 1.201 21.415 4.269 9 T 2.447e+10 0.00e+00 a 0 0 0 0 0
50 1.192 21.560 4.212 9 T 1.877e+10 0.00e+00 a 0 0 0 0 0
51 1.774 42.149 0.820 9 T 8.239e+09 0.00e+00 a 0 0 0 0 0
52 1.788 42.216 7.442 9 T 1.093e+10 0.00e+00 a 0 0 0 0 0
53 1.785 42.254 7.096 9 T 1.053e+10 0.00e+00 a 0 0 0 0 0
54 0.644 25.513 0.935 9 T 1.992e+10 0.00e+00 a 0 0 0 0 0
55 0.645 25.510 0.825 9 T 3.436e+10 0.00e+00 a 0 0 0 0 0
56 0.644 25.730 2.178 9 T 1.591e+10 0.00e+00 a 0 0 0 0 0
57 0.637 25.473 2.086 9 T 5.618e+09 0.00e+00 a 0 0 0 0 0
58 0.641 25.757 1.979 9 T 6.768e+09 0.00e+00 a 0 0 0 0 0
59 0.639 25.558 4.262 9 T 9.988e+09 0.00e+00 a 0 0 0 0 0
60 0.643 25.553 4.023 9 T 7.787e+09 0.00e+00 a 0 0 0 0 0
61 0.656 25.367 3.925 9 T 9.041e+09 0.00e+00 a 0 0 0 0 0
62 0.642 25.572 7.037 9 T 1.963e+10 0.00e+00 a 0 0 0 0 0
63 0.642 25.560 6.807 9 T 4.526e+10 0.00e+00 a 0 0 0 0 0
64 0.838 22.719 7.440 9 T 2.363e+10 0.00e+00 a 0 0 0 0 0
65 0.843 22.499 7.033 9 T 2.219e+10 0.00e+00 a 0 0 0 0 0
66 0.845 22.366 6.812 9 T 5.367e+10 0.00e+00 a 0 0 0 0 0
67 0.836 22.513 4.813 9 T 9.118e+09 0.00e+00 a 0 0 0 0 0
68 0.838 22.657 4.467 9 T 7.325e+09 0.00e+00 a 0 0 0 0 0
69 0.838 22.641 4.360 9 T 2.379e+10 0.00e+00 a 0 0 0 0 0
70 0.838 22.702 4.262 9 T 1.605e+10 0.00e+00 a 0 0 0 0 0
71 0.836 22.624 4.084 9 T 2.002e+10 0.00e+00 a 0 0 0 0 0
72 0.837 22.711 4.003 9 T 2.321e+10 0.00e+00 a 0 0 0 0 0
73 0.835 22.636 3.916 9 T 2.149e+10 0.00e+00 a 0 0 0 0 0
74 0.838 22.489 3.770 9 T 1.337e+10 0.00e+00 a 0 0 0 0 0
75 0.835 22.630 2.719 9 T 1.021e+10 0.00e+00 a 0 0 0 0 0
76 0.841 22.419 2.454 9 T 1.396e+10 0.00e+00 a 0 0 0 0 0
77 0.843 22.430 2.177 9 T 2.495e+10 0.00e+00 a 0 0 0 0 0
78 0.840 22.514 1.988 9 T 1.667e+10 0.00e+00 a 0 0 0 0 0
79 0.837 22.636 1.671 9 T 1.399e+10 0.00e+00 a 0 0 0 0 0
80 0.832 22.568 1.570 9 T 1.593e+10 0.00e+00 a 0 0 0 0 0
81 0.840 22.580 1.300 9 T 1.278e+10 0.00e+00 a 0 0 0 0 0
82 0.839 22.594 0.968 9 T 8.448e+09 0.00e+00 a 0 0 0 0 0
83 0.838 22.601 0.651 9 T 6.707e+10 0.00e+00 a 0 0 0 0 0
84 0.890 22.999 0.725 9 T 4.192e+10 0.00e+00 a 0 0 0 0 0
85 0.894 23.022 0.811 9 T 2.572e+10 0.00e+00 a 0 0 0 0 0
86 0.893 23.029 1.779 9 T 1.069e+10 0.00e+00 a 0 0 0 0 0
87 0.893 23.033 2.345 9 T 1.965e+10 0.00e+00 a 0 0 0 0 0
88 0.888 23.068 2.242 9 T 2.930e+10 0.00e+00 a 0 0 0 0 0
89 0.893 23.039 3.677 9 T 2.432e+10 0.00e+00 a 0 0 0 0 0
90 0.949 25.919 0.722 9 T 1.780e+10 0.00e+00 a 0 0 0 0 0
91 0.948 25.852 2.237 9 T 1.874e+10 0.00e+00 a 0 0 0 0 0
92 0.946 25.816 3.674 9 T 1.068e+10 0.00e+00 a 0 0 0 0 0
93 1.512 26.985 0.925 9 T 1.678e+10 0.00e+00 a 0 0 0 0 0
94 1.503 26.986 0.822 9 T 2.555e+10 0.00e+00 a 0 0 0 0 0
95 4.229 59.087 2.177 9 T 3.767e+10 0.00e+00 a 0 0 0 0 0
96 4.201 59.520 7.016 9 T 1.475e+10 0.00e+00 a 0 0 0 0 0
97 2.219 30.426 6.812 9 T 1.672e+10 0.00e+00 a 0 0 0 0 0
98 2.309 36.977 2.174 9 T 2.462e+10 0.00e+00 a 0 0 0 0 0
99 2.312 37.039 6.810 9 T 1.556e+10 0.00e+00 a 0 0 0 0 0
100 2.415 37.054 2.174 9 T 2.160e+10 0.00e+00 a 0 0 0 0 0
101 2.420 36.983 6.814 9 T 1.220e+10 0.00e+00 a 0 0 0 0 0
102 3.765 60.920 0.934 9 T 2.041e+10 0.00e+00 a 0 0 0 0 0
103 3.768 60.811 0.821 9 T 1.174e+10 0.00e+00 a 0 0 0 0 0
104 1.575 31.736 0.937 9 T 1.309e+10 0.00e+00 a 0 0 0 0 0
105 1.585 31.796 0.826 9 T 1.120e+10 0.00e+00 a 0 0 0 0 0
106 1.353 27.444 0.727 9 T 1.651e+10 0.00e+00 a 0 0 0 0 0
107 1.362 27.231 7.096 9 T 1.296e+10 0.00e+00 a 0 0 0 0 0
108 1.345 27.321 4.812 9 T 7.054e+09 0.00e+00 a 0 0 0 0 0
109 3.868 60.716 0.910 9 T 8.924e+09 0.00e+00 a 0 0 0 0 0
110 3.864 60.694 0.725 9 T 1.666e+10 0.00e+00 a 0 0 0 0 0
111 3.864 60.577 0.820 9 T 1.554e+10 0.00e+00 a 0 0 0 0 0
112 1.902 32.682 0.724 9 T 8.676e+09 0.00e+00 a 0 0 0 0 0
113 1.366 27.335 0.812 9 T 1.408e+10 0.00e+00 a 0 0 0 0 0
114 1.375 27.200 4.293 9 T 8.780e+09 0.00e+00 a 0 0 0 0 0
115 1.359 27.109 7.447 9 T 8.576e+09 0.00e+00 a 0 0 0 0 0
116 2.724 41.724 0.814 9 T 1.203e+10 0.00e+00 a 0 0 0 0 0
117 2.726 41.744 0.729 9 T 2.585e+10 0.00e+00 a 0 0 0 0 0
118 2.837 41.676 0.814 9 T 1.408e+10 0.00e+00 a 0 0 0 0 0
119 2.839 41.731 0.723 9 T 3.101e+10 0.00e+00 a 0 0 0 0 0
120 1.634 29.609 0.809 9 T 1.231e+10 0.00e+00 a 0 0 0 0 0
121 1.643 29.572 0.723 9 T 2.313e+10 0.00e+00 a 0 0 0 0 0
122 4.163 58.834 2.176 9 T 1.690e+10 0.00e+00 a 0 0 0 0 0
123 1.939 30.436 2.175 9 T 3.099e+10 0.00e+00 a 0 0 0 0 0
124 2.015 30.500 2.177 9 T 3.079e+10 0.00e+00 a 0 0 0 0 0
125 3.199 43.565 2.175 9 T 2.934e+10 0.00e+00 a 0 0 0 0 0
126 3.368 43.529 2.174 9 T 2.380e+10 0.00e+00 a 0 0 0 0 0
127 3.370 43.591 2.470 9 T 5.451e+09 0.00e+00 a 0 0 0 0 0
128 1.730 27.168 2.174 9 T 3.523e+10 0.00e+00 a 0 0 0 0 0
129 1.730 27.269 2.460 9 T 6.085e+09 0.00e+00 a 0 0 0 0 0
130 1.839 27.217 2.176 9 T 3.417e+10 0.00e+00 a 0 0 0 0 0
131 1.824 27.258 2.457 9 T 5.989e+09 0.00e+00 a 0 0 0 0 0
132 1.829 27.071 0.819 9 T 1.698e+10 0.00e+00 a 0 0 0 0 0
133 4.073 57.805 2.173 9 T 1.370e+10 0.00e+00 a 0 0 0 0 0
134 4.080 57.903 0.928 9 T 1.298e+10 0.00e+00 a 0 0 0 0 0
135 4.083 57.788 0.822 9 T 3.592e+10 0.00e+00 a 0 0 0 0 0
136 4.083 57.805 0.649 9 T 1.347e+10 0.00e+00 a 0 0 0 0 0
137 4.068 57.819 7.029 9 T 8.112e+09 0.00e+00 a 0 0 0 0 0
138 1.588 42.124 7.433 9 T 1.010e+10 0.00e+00 a 0 0 0 0 0
139 1.590 42.366 4.277 9 T 6.347e+09 0.00e+00 a 0 0 0 0 0
140 1.026 23.368 0.917 9 T 2.668e+10 0.00e+00 a 0 0 0 0 0
141 1.025 23.320 0.821 9 T 1.008e+11 0.00e+00 a 0 0 0 0 0
142 1.027 23.340 0.654 9 T 2.420e+10 0.00e+00 a 0 0 0 0 0
143 1.028 23.263 1.672 9 T 2.451e+10 0.00e+00 a 0 0 0 0 0
144 1.029 23.370 1.570 9 T 8.754e+09 0.00e+00 a 0 0 0 0 0
145 1.028 23.312 2.168 9 T 2.223e+10 0.00e+00 a 0 0 0 0 0
146 1.021 23.474 2.074 9 T 1.088e+10 0.00e+00 a 0 0 0 0 0
147 1.026 23.284 1.994 9 T 2.716e+10 0.00e+00 a 0 0 0 0 0
148 1.027 23.263 3.076 9 T 1.064e+10 0.00e+00 a 0 0 0 0 0
149 1.019 23.671 2.494 9 T 5.460e+09 0.00e+00 a 0 0 0 0 0
150 1.027 23.285 4.268 9 T 3.358e+10 0.00e+00 a 0 0 0 0 0
152 1.028 23.338 4.018 9 T 1.208e+10 0.00e+00 a 0 0 0 0 0
153 1.027 23.298 3.923 9 T 1.537e+10 0.00e+00 a 0 0 0 0 0
154 1.028 23.290 3.772 9 T 1.483e+10 0.00e+00 a 0 0 0 0 0
155 1.029 23.431 7.112 9 T 1.107e+10 0.00e+00 a 0 0 0 0 0
156 1.026 23.277 7.035 9 T 3.993e+10 0.00e+00 a 0 0 0 0 0
157 1.025 23.257 6.815 9 T 1.852e+10 0.00e+00 a 0 0 0 0 0
158 0.816 26.293 0.650 9 T 1.267e+10 0.00e+00 a 0 0 0 0 0
159 0.813 26.273 1.052 9 T 8.503e+09 0.00e+00 a 0 0 0 0 0
160 0.810 26.264 0.931 9 T 4.976e+10 0.00e+00 a 0 0 0 0 0
161 0.809 26.255 1.673 9 T 2.726e+10 0.00e+00 a 0 0 0 0 0
162 0.810 26.335 1.565 9 T 7.956e+09 0.00e+00 a 0 0 0 0 0
163 0.812 26.192 1.992 9 T 1.834e+10 0.00e+00 a 0 0 0 0 0
164 0.809 26.192 2.174 9 T 2.839e+10 0.00e+00 a 0 0 0 0 0
165 0.811 26.192 2.436 9 T 1.687e+10 0.00e+00 a 0 0 0 0 0
166 0.808 26.342 3.047 9 T 8.583e+09 0.00e+00 a 0 0 0 0 0
167 0.819 26.274 4.021 9 T 1.380e+10 0.00e+00 a 0 0 0 0 0
168 0.813 26.319 3.929 9 T 1.155e+10 0.00e+00 a 0 0 0 0 0
169 0.811 26.252 4.270 9 T 2.386e+10 0.00e+00 a 0 0 0 0 0
170 0.811 26.261 7.033 9 T 3.643e+10 0.00e+00 a 0 0 0 0 0
171 0.809 26.255 6.810 9 T 2.126e+10 0.00e+00 a 0 0 0 0 0
172 1.513 27.092 2.191 9 T 7.700e+09 0.00e+00 a 0 0 0 0 0
173 3.972 58.006 0.930 9 T 2.380e+10 0.00e+00 a 0 0 0 0 0
174 3.976 58.088 0.825 9 T 1.869e+10 0.00e+00 a 0 0 0 0 0
175 1.490 41.850 0.933 9 T 1.104e+10 0.00e+00 a 0 0 0 0 0
176 2.159 41.925 0.932 9 T 8.708e+09 0.00e+00 a 0 0 0 0 0
178 1.188 23.997 0.928 9 T 4.689e+10 0.00e+00 a 0 0 0 0 0
179 1.190 23.979 0.825 9 T 3.312e+10 0.00e+00 a 0 0 0 0 0
180 1.192 23.979 2.023 9 T 1.702e+10 0.00e+00 a 0 0 0 0 0
181 1.190 24.056 1.860 9 T 1.127e+10 0.00e+00 a 0 0 0 0 0
182 1.184 24.087 2.286 9 T 1.123e+10 0.00e+00 a 0 0 0 0 0
183 1.190 23.938 3.832 9 T 1.252e+10 0.00e+00 a 0 0 0 0 0
184 1.188 24.041 3.532 9 T 1.133e+10 0.00e+00 a 0 0 0 0 0
185 1.191 24.016 4.285 9 T 1.593e+10 0.00e+00 a 0 0 0 0 0
186 1.189 23.965 7.442 9 T 1.948e+10 0.00e+00 a 0 0 0 0 0
187 1.188 23.998 7.094 9 T 5.613e+10 0.00e+00 a 0 0 0 0 0
188 1.186 24.001 7.021 9 T 2.571e+10 0.00e+00 a 0 0 0 0 0
189 1.163 26.734 0.919 9 T 3.291e+10 0.00e+00 a 0 0 0 0 0
190 1.164 26.671 0.823 9 T 5.776e+10 0.00e+00 a 0 0 0 0 0
191 1.161 26.703 0.734 9 T 2.838e+10 0.00e+00 a 0 0 0 0 0
192 1.158 26.641 1.021 9 T 1.251e+10 0.00e+00 a 0 0 0 0 0
193 1.158 26.720 0.619 9 T 7.354e+09 0.00e+00 a 0 0 0 0 0
194 1.158 26.739 0.237 9 T 6.608e+09 0.00e+00 a 0 0 0 0 0
195 1.160 26.670 2.021 9 T 1.223e+10 0.00e+00 a 0 0 0 0 0
196 1.157 26.758 1.909 9 T 8.512e+09 0.00e+00 a 0 0 0 0 0
197 1.164 26.656 1.816 9 T 1.235e+10 0.00e+00 a 0 0 0 0 0
198 1.159 26.700 1.613 9 T 8.844e+09 0.00e+00 a 0 0 0 0 0
199 1.165 26.727 2.288 9 T 8.240e+09 0.00e+00 a 0 0 0 0 0
201 1.166 26.682 3.532 9 T 2.659e+10 0.00e+00 a 0 0 0 0 0
202 1.162 26.479 3.678 9 T 7.213e+09 0.00e+00 a 0 0 0 0 0
203 1.171 26.777 4.271 9 T 8.862e+09 0.00e+00 a 0 0 0 0 0
204 1.161 26.549 7.096 9 T 1.260e+10 0.00e+00 a 0 0 0 0 0
205 1.325 42.324 0.819 9 T 1.626e+10 0.00e+00 a 0 0 0 0 0
207 1.333 42.491 0.634 9 T 8.048e+09 0.00e+00 a 0 0 0 0 0
208 1.943 42.326 0.815 9 T 1.865e+10 0.00e+00 a 0 0 0 0 0
209 0.849 26.061 0.655 9 T 1.646e+10 0.00e+00 a 0 0 0 0 0
210 0.846 26.003 2.172 9 T 3.831e+10 0.00e+00 a 0 0 0 0 0
211 0.844 26.061 2.079 9 T 1.405e+10 0.00e+00 a 0 0 0 0 0
212 0.843 26.044 1.992 9 T 2.445e+10 0.00e+00 a 0 0 0 0 0
213 0.847 26.021 2.451 9 T 4.360e+10 0.00e+00 a 0 0 0 0 0
214 0.845 25.904 3.775 9 T 1.029e+10 0.00e+00 a 0 0 0 0 0
215 0.846 25.996 4.124 9 T 2.203e+10 0.00e+00 a 0 0 0 0 0
216 3.648 55.148 0.826 9 T 1.676e+10 0.00e+00 a 0 0 0 0 0
218 3.649 55.156 0.653 9 T 3.734e+10 0.00e+00 a 0 0 0 0 0
219 0.612 17.805 0.922 9 T 2.275e+10 0.00e+00 a 0 0 0 0 0
220 0.609 17.801 0.822 9 T 7.487e+10 0.00e+00 a 0 0 0 0 0
221 0.607 17.822 1.687 9 T 1.266e+10 0.00e+00 a 0 0 0 0 0
222 0.608 17.759 1.993 9 T 7.265e+09 0.00e+00 a 0 0 0 0 0
223 0.612 17.721 3.921 9 T 9.083e+09 0.00e+00 a 0 0 0 0 0
224 0.611 17.758 7.092 9 T 2.903e+10 0.00e+00 a 0 0 0 0 0
225 0.608 17.902 7.441 9 T 1.986e+10 0.00e+00 a 0 0 0 0 0
226 0.611 17.793 7.018 9 T 1.781e+10 0.00e+00 a 0 0 0 0 0
227 1.778 29.638 7.095 9 T 1.220e+10 0.00e+00 a 0 0 0 0 0
228 1.781 29.720 7.030 9 T 1.558e+10 0.00e+00 a 0 0 0 0 0
229 2.943 41.816 7.092 9 T 7.568e+09 0.00e+00 a 0 0 0 0 0
230 2.943 41.872 7.012 9 T 1.019e+10 0.00e+00 a 0 0 0 0 0
231 4.165 54.855 1.538 9 T 8.276e+09 0.00e+00 a 0 0 0 0 0
232 1.523 18.267 0.838 9 T 6.689e+09 0.00e+00 a 0 0 0 0 0
233 4.243 52.273 0.650 9 T 1.174e+10 0.00e+00 a 0 0 0 0 0
234 1.425 18.379 0.652 9 T 1.011e+11 0.00e+00 a 0 0 0 0 0
235 1.424 18.349 0.822 9 T 2.647e+10 0.00e+00 a 0 0 0 0 0
236 1.430 18.334 0.715 9 T 1.825e+10 0.00e+00 a 0 0 0 0 0
237 1.430 18.576 3.777 9 T 8.107e+09 0.00e+00 a 0 0 0 0 0
238 1.420 18.315 7.097 9 T 6.841e+09 0.00e+00 a 0 0 0 0 0
240 4.251 55.679 7.085 9 T 6.811e+09 0.00e+00 a 0 0 0 0 0
241 4.247 55.578 7.439 9 T 1.125e+10 0.00e+00 a 0 0 0 0 0
242 4.258 55.809 0.833 9 T 1.071e+10 0.00e+00 a 0 0 0 0 0
243 0.711 25.338 1.573 9 T 1.712e+10 0.00e+00 a 0 0 0 0 0
244 0.715 25.302 1.678 9 T 2.585e+10 0.00e+00 a 0 0 0 0 0
245 0.716 25.302 1.996 9 T 1.714e+10 0.00e+00 a 0 0 0 0 0
246 0.712 25.319 4.063 9 T 2.168e+10 0.00e+00 a 0 0 0 0 0
247 0.714 25.313 3.921 9 T 3.193e+10 0.00e+00 a 0 0 0 0 0
248 0.711 25.411 3.787 9 T 1.076e+10 0.00e+00 a 0 0 0 0 0
249 0.715 25.337 4.015 9 T 2.486e+10 0.00e+00 a 0 0 0 0 0
250 0.717 25.309 4.360 9 T 2.537e+10 0.00e+00 a 0 0 0 0 0
251 0.715 25.256 7.092 9 T 2.248e+10 0.00e+00 a 0 0 0 0 0
252 0.714 25.352 7.441 9 T 3.203e+10 0.00e+00 a 0 0 0 0 0
253 1.787 27.155 0.652 9 T 1.643e+10 0.00e+00 a 0 0 0 0 0
254 1.781 27.101 7.441 9 T 1.142e+10 0.00e+00 a 0 0 0 0 0
255 1.777 27.110 7.097 9 T 9.819e+09 0.00e+00 a 0 0 0 0 0
256 1.785 27.105 0.815 9 T 1.327e+10 0.00e+00 a 0 0 0 0 0
257 4.319 55.272 4.811 9 T 3.768e+10 0.00e+00 a 0 0 0 0 0
258 4.321 55.260 7.442 9 T 1.501e+10 0.00e+00 a 0 0 0 0 0
259 4.332 55.408 7.097 9 T 8.414e+09 0.00e+00 a 0 0 0 0 0
260 2.987 43.574 7.090 9 T 1.953e+10 0.00e+00 a 0 0 0 0 0
261 2.983 43.657 7.018 9 T 1.835e+10 0.00e+00 a 0 0 0 0 0
262 2.979 43.458 7.440 9 T 7.533e+09 0.00e+00 a 0 0 0 0 0
263 2.990 43.540 4.282 9 T 9.495e+09 0.00e+00 a 0 0 0 0 0
264 1.675 26.542 1.020 9 T 8.730e+09 0.00e+00 a 0 0 0 0 0
265 1.683 26.609 0.830 9 T 1.100e+10 0.00e+00 a 0 0 0 0 0
266 3.539 64.954 1.174 9 T 1.045e+10 0.00e+00 a 0 0 0 0 0
267 0.722 14.576 0.907 9 T 2.056e+10 0.00e+00 a 0 0 0 0 0
268 0.721 14.693 1.176 9 T 1.354e+10 0.00e+00 a 0 0 0 0 0
269 0.717 14.693 1.356 9 T 9.511e+09 0.00e+00 a 0 0 0 0 0
270 0.715 14.640 1.582 9 T 1.248e+10 0.00e+00 a 0 0 0 0 0
271 0.717 14.509 1.655 9 T 1.344e+10 0.00e+00 a 0 0 0 0 0
272 0.716 14.595 1.800 9 T 6.016e+09 0.00e+00 a 0 0 0 0 0
273 0.721 14.544 2.729 9 T 1.190e+10 0.00e+00 a 0 0 0 0 0
274 0.721 14.586 2.848 9 T 1.593e+10 0.00e+00 a 0 0 0 0 0
275 0.710 14.715 3.865 9 T 1.210e+10 0.00e+00 a 0 0 0 0 0
276 0.813 16.475 0.920 9 T 1.015e+10 0.00e+00 a 0 0 0 0 0
277 0.811 16.521 1.175 9 T 2.357e+10 0.00e+00 a 0 0 0 0 0
278 0.812 16.430 1.369 9 T 7.817e+09 0.00e+00 a 0 0 0 0 0
279 0.813 16.489 1.637 9 T 1.240e+10 0.00e+00 a 0 0 0 0 0
280 0.807 16.488 1.581 9 T 1.237e+10 0.00e+00 a 0 0 0 0 0
281 0.809 16.477 3.767 9 T 6.277e+09 0.00e+00 a 0 0 0 0 0
282 0.803 16.465 3.869 9 T 1.116e+10 0.00e+00 a 0 0 0 0 0
283 0.807 16.494 3.947 9 T 8.122e+09 0.00e+00 a 0 0 0 0 0
284 1.860 28.977 1.169 9 T 9.190e+09 0.00e+00 a 0 0 0 0 0
285 0.932 25.942 0.824 9 T 2.131e+10 0.00e+00 a 0 0 0 0 0
286 0.932 26.015 1.533 9 T 1.156e+10 0.00e+00 a 0 0 0 0 0
287 0.932 26.114 1.605 9 T 1.067e+10 0.00e+00 a 0 0 0 0 0
288 0.937 25.836 2.128 9 T 7.819e+09 0.00e+00 a 0 0 0 0 0
289 0.931 25.827 3.767 9 T 1.010e+10 0.00e+00 a 0 0 0 0 0
290 0.945 25.709 3.673 9 T 4.651e+09 0.00e+00 a 0 0 0 0 0
291 0.922 23.882 3.978 9 T 1.097e+10 0.00e+00 a 0 0 0 0 0
292 0.934 23.772 1.520 9 T 1.199e+10 0.00e+00 a 0 0 0 0 0
293 0.927 23.817 1.191 9 T 1.979e+10 0.00e+00 a 0 0 0 0 0
294 0.935 23.777 1.710 9 T 6.756e+09 0.00e+00 a 0 0 0 0 0
295 0.932 23.746 0.820 9 T 1.302e+10 0.00e+00 a 0 0 0 0 0
296 0.923 23.816 0.623 9 T 6.509e+09 0.00e+00 a 0 0 0 0 0
297 0.810 25.219 0.744 9 T 2.615e+10 0.00e+00 a 0 0 0 0 0
298 0.809 25.182 0.619 9 T 2.927e+10 0.00e+00 a 0 0 0 0 0
299 0.807 25.193 1.204 9 T 2.180e+10 0.00e+00 a 0 0 0 0 0
300 0.809 25.274 1.031 9 T 1.841e+10 0.00e+00 a 0 0 0 0 0
301 0.821 25.091 1.605 9 T 7.598e+09 0.00e+00 a 0 0 0 0 0
302 0.806 25.331 1.510 9 T 1.497e+10 0.00e+00 a 0 0 0 0 0
303 0.812 25.058 4.344 9 T 6.746e+09 0.00e+00 a 0 0 0 0 0
304 0.809 25.168 3.646 9 T 9.171e+09 0.00e+00 a 0 0 0 0 0
305 0.836 23.087 0.747 9 T 9.368e+09 0.00e+00 a 0 0 0 0 0
306 0.833 23.126 1.204 9 T 1.735e+10 0.00e+00 a 0 0 0 0 0
307 0.845 23.055 1.482 9 T 9.430e+09 0.00e+00 a 0 0 0 0 0
308 0.835 23.068 2.791 9 T 1.148e+10 0.00e+00 a 0 0 0 0 0
309 0.834 23.167 4.336 9 T 1.234e+10 0.00e+00 a 0 0 0 0 0
310 4.007 62.744 0.834 9 T 1.084e+10 0.00e+00 a 0 0 0 0 0
311 3.998 62.812 0.739 9 T 1.176e+10 0.00e+00 a 0 0 0 0 0
312 0.806 25.290 1.625 9 T 9.421e+09 0.00e+00 a 0 0 0 0 0
313 0.647 12.235 0.728 9 T 2.134e+10 0.00e+00 a 0 0 0 0 0
314 0.646 12.234 0.850 9 T 3.356e+10 0.00e+00 a 0 0 0 0 0
315 0.648 12.228 1.037 9 T 9.762e+09 0.00e+00 a 0 0 0 0 0
316 0.651 12.293 1.322 9 T 7.344e+09 0.00e+00 a 0 0 0 0 0
317 0.647 12.239 1.433 9 T 4.874e+10 0.00e+00 a 0 0 0 0 0
318 0.647 12.205 1.804 9 T 1.208e+10 0.00e+00 a 0 0 0 0 0
319 0.645 12.192 3.652 9 T 3.922e+10 0.00e+00 a 0 0 0 0 0
320 0.644 12.243 4.247 9 T 1.157e+10 0.00e+00 a 0 0 0 0 0
321 0.645 12.230 4.078 9 T 8.818e+09 0.00e+00 a 0 0 0 0 0
322 0.814 19.056 0.641 9 T 8.607e+09 0.00e+00 a 0 0 0 0 0
323 0.818 19.165 1.037 9 T 2.393e+10 0.00e+00 a 0 0 0 0 0
324 0.815 19.088 1.149 9 T 5.565e+09 0.00e+00 a 0 0 0 0 0
325 0.816 19.217 1.433 9 T 6.127e+09 0.00e+00 a 0 0 0 0 0
326 0.812 19.196 1.343 9 T 8.572e+09 0.00e+00 a 0 0 0 0 0
327 0.812 19.120 1.949 9 T 1.175e+10 0.00e+00 a 0 0 0 0 0
328 0.814 19.125 1.831 9 T 1.132e+10 0.00e+00 a 0 0 0 0 0
329 0.812 19.128 4.083 9 T 2.174e+10 0.00e+00 a 0 0 0 0 0
330 2.451 31.379 0.856 9 T 1.842e+10 0.00e+00 a 0 0 0 0 0
;
loop_
_Spectral_dim.ID
_Spectral_dim.Axis_code
_Spectral_dim.Spectrometer_frequency
_Spectral_dim.Atom_type
_Spectral_dim.Atom_isotope_number
_Spectral_dim.Spectral_region
_Spectral_dim.Magnetization_linkage_ID
_Spectral_dim.Under_sampling_type
_Spectral_dim.Sweep_width
_Spectral_dim.Sweep_width_units
_Spectral_dim.Value_first_point
_Spectral_dim.Absolute_peak_positions
_Spectral_dim.Acquisition
_Spectral_dim.Center_frequency_offset
_Spectral_dim.Encoding_code
_Spectral_dim.Encoded_reduced_dimension_ID
_Spectral_dim.Entry_ID
_Spectral_dim.Spectral_peak_list_ID
1 . . H 1 HN . . 13.6639 ppm . . . 4.696 . . 34575 9
2 . . N 15 N . . 26.9663 ppm . . . 116.0 . . 34575 9
3 . . H 1 H . . 11.1133 ppm . . . 4.696 . . 34575 9
stop_
save_