Content for NMR-STAR saveframe, "spectral_peak_list_2"
save_spectral_peak_list_2
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode spectral_peak_list_2
_Spectral_peak_list.Entry_ID 34259
_Spectral_peak_list.ID 2
_Spectral_peak_list.Sample_ID 1
_Spectral_peak_list.Sample_label $sample_1
_Spectral_peak_list.Sample_condition_list_ID 1
_Spectral_peak_list.Sample_condition_list_label $sample_conditions_1
_Spectral_peak_list.Experiment_ID 1
_Spectral_peak_list.Experiment_name '3D 1H-13C NOESY aromatic'
_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 .
_Spectral_peak_list.Assigned_chem_shift_list_label .
_Spectral_peak_list.Details .
_Spectral_peak_list.Text_data_format text
_Spectral_peak_list.Text_data
;
# Number of dimensions 3
# FORMAT xeasy3D
# INAME 1 H
# INAME 2 HC
# INAME 3 C
# SPECTRUM C13NOESY H HC C
1 5.344 7.335 114.315 1 U -6.390E+05 0.000E+00 e 0 740 744 734
2 2.677 7.337 114.245 1 U -7.420E+05 0.000E+00 e 0 784 744 734
3 9.746 7.332 114.265 1 U -6.240E+06 0.000E+00 e 0 741 744 734
4 7.139 7.332 114.270 1 U -2.910E+07 0.000E+00 e 0 743 744 734
5 2.472 7.336 114.280 1 U -8.890E+05 0.000E+00 e 0 785 744 734
6 0.319 7.331 114.230 1 U -5.330E+05 0.000E+00 e 0 309 744 734
7 7.970 5.836 132.535 1 U 2.470E+06 0.000E+00 e 0 262 256 249
8 7.497 5.835 132.510 1 U 4.110E+06 0.000E+00 e 0 0 0 0
9 6.900 5.835 132.515 1 U 4.750E+06 0.000E+00 e 0 0 0 0
10 6.199 5.836 132.530 1 U 2.180E+07 0.000E+00 e 0 0 0 0
11 4.714 5.836 132.520 1 U 1.340E+06 0.000E+00 e 0 0 0 0
12 4.190 5.835 132.530 1 U 6.840E+06 0.000E+00 e 0 252 256 249
13 3.719 5.836 132.510 1 U 1.090E+06 0.000E+00 e 0 230 256 249
14 3.070 5.835 132.530 1 U 7.700E+06 0.000E+00 e 0 253 256 249
15 2.790 5.836 132.530 1 U 8.140E+06 0.000E+00 e 0 254 256 249
16 0.799 5.835 132.525 1 U 3.250E+06 0.000E+00 e 0 0 0 0
17 7.962 7.397 132.188 1 U 4.820E+06 0.000E+00 e 0 262 268 260
18 6.857 7.396 132.188 1 U 2.360E+07 0.000E+00 e 0 269 268 260
19 4.314 7.396 132.188 1 U 6.200E+06 0.000E+00 e 0 263 268 260
20 1.120 7.397 132.208 1 U 1.130E+06 0.000E+00 e 0 0 0 0
21 2.152 7.064 132.319 1 U 1.420E+06 0.000E+00 e 0 593 489 482
22 9.139 7.059 132.279 1 U 1.460E+06 0.000E+00 e 0 494 489 482
23 8.807 7.062 132.253 1 U 1.070E+06 0.000E+00 e 0 596 489 482
24 8.255 7.061 132.243 1 U 1.700E+06 0.000E+00 e 0 603 489 482
25 6.798 7.062 132.253 1 U 3.230E+07 0.000E+00 e 0 490 489 482
26 5.563 7.062 132.264 1 U 3.590E+06 0.000E+00 e 0 597 489 482
27 4.705 7.062 132.253 1 U 9.210E+06 0.000E+00 e 0 485 489 482
28 4.066 7.061 132.228 1 U 1.430E+06 0.000E+00 e 0 0 0 0
29 3.226 7.061 132.274 1 U 5.330E+06 0.000E+00 e 0 486 489 482
30 2.655 7.062 132.269 1 U 5.540E+06 0.000E+00 e 0 487 489 482
31 1.964 7.059 132.289 1 U 2.410E+06 0.000E+00 e 0 590 489 482
32 1.794 7.062 132.243 1 U 3.310E+06 0.000E+00 e 0 591 489 482
33 0.924 7.060 132.248 1 U 1.480E+06 0.000E+00 e 0 599 489 482
34 8.398 6.202 132.208 1 U 6.780E+05 0.000E+00 e 0 0 0 0
35 5.350 7.539 132.032 1 U 1.060E+06 0.000E+00 e 0 740 759 750
36 2.283 7.539 132.082 1 U 1.720E+06 0.000E+00 e 0 0 0 0
37 8.465 7.536 132.097 1 U 3.070E+06 0.000E+00 e 0 0 0 0
38 7.960 7.535 132.097 1 U 1.520E+06 0.000E+00 e 0 0 0 0
39 6.962 7.536 131.987 1 U 2.010E+07 0.000E+00 e 0 760 759 750
40 6.201 7.537 132.133 1 U 2.040E+06 0.000E+00 e 0 257 759 750
41 4.667 7.535 132.087 1 U 5.240E+06 0.000E+00 e 0 754 759 750
42 4.246 7.536 132.087 1 U 5.150E+06 0.000E+00 e 0 708 759 750
43 3.439 7.536 132.103 1 U 6.870E+06 0.000E+00 e 0 0 0 0
44 2.497 7.533 132.057 1 U 1.560E+06 0.000E+00 e 0 739 759 750
45 1.631 7.536 132.092 1 U 4.670E+06 0.000E+00 e 0 710 759 750
46 1.102 7.536 132.047 1 U 2.010E+06 0.000E+00 e 0 879 759 750
47 0.797 7.535 132.072 1 U 3.720E+06 0.000E+00 e 0 310 759 750
48 0.304 7.535 132.072 1 U 1.570E+06 0.000E+00 e 0 309 759 750
49 3.728 7.398 132.173 1 U 1.500E+06 0.000E+00 e 0 230 268 260
50 7.697 7.394 132.168 1 U 1.590E+06 0.000E+00 e 0 0 0 0
51 3.402 7.396 132.178 1 U 5.920E+06 0.000E+00 e 0 264 268 260
52 2.760 7.396 132.163 1 U 6.920E+06 0.000E+00 e 0 265 268 260
53 1.617 7.391 132.130 1 U 5.730E+06 0.000E+00 e 0 0 0 0
54 0.824 7.396 132.178 1 U 1.580E+07 0.000E+00 e 0 234 268 260
55 0.258 7.396 132.173 1 U 5.350E+06 0.000E+00 e 0 0 0 0
56 -0.017 7.397 132.168 1 U 1.770E+06 0.000E+00 e 0 616 268 260
57 8.337 7.387 132.118 1 U 1.000E+06 0.000E+00 e 0 275 268 260
58 3.091 7.386 132.032 1 U 2.060E+06 0.000E+00 e 0 0 0 0
59 8.606 7.382 131.977 1 U 9.520E+05 0.000E+00 e 0 903 900 891
60 4.683 7.379 131.886 1 U 2.270E+06 0.000E+00 e 0 0 0 0
61 -0.211 7.381 131.936 1 U 2.480E+06 0.000E+00 e 0 722 900 891
62 2.148 7.371 132.037 1 U 1.570E+06 0.000E+00 e 0 691 900 891
63 3.756 7.313 131.926 1 U 6.070E+05 0.000E+00 e 0 690 899 890
64 2.143 7.310 131.901 1 U 1.190E+06 0.000E+00 e 0 691 899 890
65 1.596 7.309 131.886 1 U 3.400E+06 0.000E+00 e 0 0 0 0
66 -0.211 7.309 131.891 1 U 3.020E+06 0.000E+00 e 0 722 899 890
67 1.817 6.209 132.007 1 U 5.500E+05 0.000E+00 e 0 0 0 0
68 9.115 6.204 132.067 1 U 1.440E+06 0.000E+00 e 0 0 0 0
69 7.948 6.204 132.138 1 U 7.730E+05 0.000E+00 e 0 0 0 0
70 6.926 6.204 132.092 1 U 4.210E+07 0.000E+00 e 0 811 810 801
71 4.714 6.203 132.118 1 U 1.770E+06 0.000E+00 e 0 0 0 0
72 4.458 6.205 132.118 1 U 2.310E+06 0.000E+00 e 0 805 810 801
73 3.976 6.203 132.097 1 U 2.190E+06 0.000E+00 e 0 816 810 801
74 3.689 6.204 132.097 1 U 4.070E+06 0.000E+00 e 0 146 810 801
75 3.411 6.204 132.113 1 U 3.390E+06 0.000E+00 e 0 817 810 801
76 3.069 6.201 132.133 1 U 1.220E+06 0.000E+00 e 0 253 810 801
77 2.848 6.204 132.118 1 U 6.410E+06 0.000E+00 e 0 806 810 801
78 2.170 6.203 132.123 1 U 5.610E+06 0.000E+00 e 0 807 810 801
79 1.130 6.203 132.118 1 U 1.820E+06 0.000E+00 e 0 149 810 801
80 0.767 6.204 132.092 1 U 6.850E+06 0.000E+00 e 0 0 0 0
81 0.257 6.200 132.052 1 U 1.110E+06 0.000E+00 e 0 151 810 801
82 -0.182 6.203 132.118 1 U 4.870E+06 0.000E+00 e 0 150 810 801
83 8.604 7.312 131.811 1 U 1.650E+06 0.000E+00 e 0 903 899 890
84 3.107 7.314 131.841 1 U 3.170E+06 0.000E+00 e 0 895 899 890
85 8.834 7.310 131.871 1 U 1.650E+06 0.000E+00 e 0 893 899 890
86 4.682 7.310 131.831 1 U 3.520E+06 0.000E+00 e 0 894 899 890
87 2.842 7.310 131.846 1 U 4.250E+06 0.000E+00 e 0 896 899 890
88 5.165 7.301 131.755 1 U 6.310E+05 0.000E+00 e 0 93 899 890
89 4.069 7.178 131.609 1 U 7.470E+05 0.000E+00 e 0 932 962 955
90 7.815 7.129 131.710 1 U 2.840E+06 0.000E+00 e 0 956 961 954
91 3.097 7.127 131.680 1 U 6.130E+06 0.000E+00 e 0 958 961 954
92 4.503 7.122 131.715 1 U 3.930E+06 0.000E+00 e 0 957 961 954
93 2.936 7.117 131.695 1 U 3.690E+06 0.000E+00 e 0 959 961 954
94 3.094 7.188 131.468 1 U 2.430E+06 0.000E+00 e 0 0 0 0
95 2.936 7.188 131.489 1 U 2.040E+06 0.000E+00 e 0 0 0 0
96 4.507 7.186 131.524 1 U 2.160E+06 0.000E+00 e 0 0 0 0
97 1.532 7.183 131.554 1 U 8.160E+05 0.000E+00 e 0 0 0 0
98 9.006 7.040 131.484 1 U 2.210E+06 0.000E+00 e 0 629 635 626
99 5.237 7.036 131.403 1 U 6.380E+05 0.000E+00 e 0 621 635 626
100 3.864 7.036 131.489 1 U 1.730E+06 0.000E+00 e 0 314 635 626
101 3.574 7.040 131.509 1 U 2.270E+06 0.000E+00 e 0 681 635 626
102 3.419 7.039 131.504 1 U 3.340E+06 0.000E+00 e 0 631 635 626
103 2.795 7.036 131.534 1 U 3.180E+06 0.000E+00 e 0 632 635 626
104 1.608 7.038 131.494 1 U 5.640E+06 0.000E+00 e 0 683 635 626
105 0.800 7.038 131.408 1 U 4.090E+06 0.000E+00 e 0 0 0 0
106 0.224 7.039 131.363 1 U 2.470E+06 0.000E+00 e 0 98 635 626
107 -0.013 7.039 131.333 1 U 1.120E+06 0.000E+00 e 0 616 635 626
108 5.685 6.982 131.373 1 U 5.400E+05 0.000E+00 e 0 604 110 102
109 1.495 6.978 131.428 1 U 5.890E+06 0.000E+00 e 0 607 110 102
110 8.795 6.977 131.428 1 U 2.210E+06 0.000E+00 e 0 0 0 0
111 1.812 6.970 131.207 1 U 4.530E+06 0.000E+00 e 0 305 760 751
112 7.534 6.969 131.252 1 U 1.420E+07 0.000E+00 e 0 759 760 751
113 4.273 6.969 131.156 1 U 2.700E+06 0.000E+00 e 0 0 0 0
114 3.414 6.957 131.151 1 U 2.610E+06 0.000E+00 e 0 264 636 627
115 1.623 6.957 131.081 1 U 5.370E+06 0.000E+00 e 0 0 0 0
116 0.233 6.951 131.093 1 U 4.620E+06 0.000E+00 e 0 98 636 627
117 -0.014 6.949 131.110 1 U 1.500E+06 0.000E+00 e 0 616 636 627
118 7.961 6.926 130.829 1 U 1.680E+06 0.000E+00 e 0 0 0 0
119 7.236 6.924 130.819 1 U 2.290E+06 0.000E+00 e 0 190 811 802
120 6.205 6.924 130.915 1 U 2.930E+07 0.000E+00 e 0 810 811 802
121 4.139 6.924 130.854 1 U 1.760E+06 0.000E+00 e 0 182 811 802
122 3.719 6.924 130.885 1 U 4.530E+06 0.000E+00 e 0 230 811 802
123 3.411 6.927 130.945 1 U 1.800E+06 0.000E+00 e 0 817 811 802
124 3.065 6.924 130.849 1 U 2.490E+06 0.000E+00 e 0 253 811 802
125 2.790 6.924 130.940 1 U 3.450E+06 0.000E+00 e 0 254 811 802
126 0.803 6.926 130.885 1 U 1.300E+07 0.000E+00 e 0 0 0 0
127 -0.178 6.922 130.829 1 U 2.370E+06 0.000E+00 e 0 150 811 802
128 7.957 6.865 130.603 1 U 1.140E+06 0.000E+00 e 0 0 0 0
129 5.833 6.862 130.452 1 U 1.370E+06 0.000E+00 e 0 256 269 261
130 6.191 6.856 130.477 1 U 1.770E+06 0.000E+00 e 0 257 269 261
131 1.630 6.860 130.437 1 U 2.850E+06 0.000E+00 e 0 710 269 261
132 0.244 6.857 130.432 1 U 4.770E+06 0.000E+00 e 0 0 0 0
133 -0.183 6.859 130.437 1 U 1.660E+06 0.000E+00 e 0 150 269 261
134 7.543 6.858 130.376 1 U 3.200E+06 0.000E+00 e 0 759 269 261
135 7.395 6.858 130.391 1 U 1.430E+07 0.000E+00 e 0 268 269 261
136 4.306 6.857 130.381 1 U 9.310E+05 0.000E+00 e 0 263 269 261
137 3.428 6.857 130.381 1 U 2.880E+06 0.000E+00 e 0 0 0 0
138 1.087 6.857 130.391 1 U 3.410E+06 0.000E+00 e 0 879 269 261
139 0.818 6.858 130.397 1 U 1.210E+07 0.000E+00 e 0 234 269 261
140 0.658 6.858 130.351 1 U 4.980E+06 0.000E+00 e 0 121 269 261
141 8.445 6.848 130.356 1 U 4.670E+05 0.000E+00 e 0 0 0 0
142 7.879 7.173 129.627 1 U 7.630E+05 0.000E+00 e 0 701 897 892
143 3.098 7.174 129.617 1 U 7.030E+05 0.000E+00 e 0 0 0 0
144 2.150 7.166 129.566 1 U 3.820E+06 0.000E+00 e 0 691 897 892
145 0.820 7.166 129.551 1 U 6.550E+05 0.000E+00 e 0 99 897 892
146 -0.211 7.166 129.566 1 U 1.650E+06 0.000E+00 e 0 722 897 892
147 7.361 7.164 129.566 1 U 1.640E+07 0.000E+00 e 0 900 897 892
148 3.760 7.163 129.571 1 U 2.890E+06 0.000E+00 e 0 690 897 892
149 1.586 7.162 129.561 1 U 4.270E+06 0.000E+00 e 0 0 0 0
150 1.244 7.127 129.748 1 U 1.450E+06 0.000E+00 e 0 0 0 0
151 2.018 6.926 129.707 1 U 3.110E+06 0.000E+00 e 0 0 0 0
152 1.794 6.926 129.668 1 U 2.110E+06 0.000E+00 e 0 305 757 752
153 3.084 6.965 128.992 1 U 5.200E+05 0.000E+00 e 0 253 808 803
154 -0.174 6.963 128.947 1 U 7.230E+05 0.000E+00 e 0 150 808 803
155 7.949 6.956 129.108 1 U 1.010E+06 0.000E+00 e 0 229 808 803
156 6.204 6.956 128.937 1 U 2.850E+06 0.000E+00 e 0 810 808 803
157 3.713 6.957 128.982 1 U 2.300E+06 0.000E+00 e 0 230 808 803
158 0.812 6.957 128.987 1 U 7.130E+06 0.000E+00 e 0 0 0 0
159 8.136 6.950 129.164 1 U 5.550E+05 0.000E+00 e 0 220 808 803
160 7.246 6.949 129.093 1 U 1.240E+06 0.000E+00 e 0 190 808 803
161 2.780 6.949 128.952 1 U 4.790E+05 0.000E+00 e 0 254 808 803
162 4.038 6.961 128.912 1 U 2.060E+06 0.000E+00 e 0 222 808 803
163 -0.017 6.807 128.368 1 U 1.570E+06 0.000E+00 e 0 616 633 628
164 7.395 6.800 128.399 1 U 2.170E+06 0.000E+00 e 0 268 633 628
165 6.958 6.802 128.368 1 U 8.120E+06 0.000E+00 e 0 636 633 628
166 4.301 6.806 128.277 1 U 7.910E+05 0.000E+00 e 0 263 633 628
167 3.398 6.803 128.343 1 U 2.250E+06 0.000E+00 e 0 264 633 628
168 1.808 6.805 128.424 1 U 5.760E+05 0.000E+00 e 0 0 0 0
169 1.636 6.806 128.368 1 U 3.050E+06 0.000E+00 e 0 0 0 0
170 0.802 6.804 128.384 1 U 2.760E+06 0.000E+00 e 0 0 0 0
171 0.225 6.799 128.389 1 U 2.310E+06 0.000E+00 e 0 98 633 628
172 2.756 6.796 128.384 1 U 1.500E+06 0.000E+00 e 0 265 633 628
173 9.747 5.354 126.849 1 U 1.320E+07 0.000E+00 e 0 741 740 731
174 4.247 5.373 126.768 1 U 5.390E+06 0.000E+00 e 0 0 0 0
175 1.818 5.355 126.753 1 U 1.360E+06 0.000E+00 e 0 305 740 731
176 8.474 5.353 126.829 1 U 2.560E+06 0.000E+00 e 0 0 0 0
177 7.531 5.353 126.798 1 U 2.580E+06 0.000E+00 e 0 759 740 731
178 7.353 5.354 126.783 1 U 1.340E+06 0.000E+00 e 0 0 0 0
179 6.953 5.354 126.803 1 U 4.230E+06 0.000E+00 e 0 760 740 731
180 3.461 5.356 126.753 1 U 1.140E+06 0.000E+00 e 0 755 740 731
181 3.057 5.354 126.808 1 U 3.160E+06 0.000E+00 e 0 738 740 731
182 2.501 5.354 126.818 1 U 5.390E+06 0.000E+00 e 0 739 740 731
183 1.388 5.354 126.824 1 U 2.350E+06 0.000E+00 e 0 0 0 0
184 1.134 5.355 126.798 1 U 4.910E+05 0.000E+00 e 0 307 740 731
185 0.811 5.354 126.793 1 U 1.010E+06 0.000E+00 e 0 310 740 731
186 0.314 5.353 126.818 1 U 3.000E+06 0.000E+00 e 0 309 740 731
187 9.738 7.129 124.433 1 U 8.330E+05 0.000E+00 e 0 741 743 733
188 7.326 7.129 124.373 1 U 2.060E+07 0.000E+00 e 0 744 743 733
189 7.555 7.027 121.751 1 U 1.050E+06 0.000E+00 e 0 0 0 0
190 7.366 7.026 121.695 1 U 1.460E+07 0.000E+00 e 0 742 745 735
191 4.351 7.027 121.695 1 U 9.350E+05 0.000E+00 e 0 0 0 0
192 3.054 7.022 121.494 1 U 6.060E+05 0.000E+00 e 0 0 0 0
193 2.501 7.023 121.635 1 U 5.750E+05 0.000E+00 e 0 0 0 0
194 7.031 7.376 120.760 1 U 1.370E+07 0.000E+00 e 0 745 742 732
195 0.308 7.372 120.875 1 U 8.090E+05 0.000E+00 e 0 309 742 732
196 8.471 7.377 120.800 1 U 1.220E+06 0.000E+00 e 0 0 0 0
197 6.840 7.378 120.805 1 U 1.010E+06 0.000E+00 e 0 0 0 0
198 4.342 7.376 120.822 1 U 5.750E+06 0.000E+00 e 0 737 742 732
199 3.052 7.377 120.841 1 U 3.040E+06 0.000E+00 e 0 738 742 732
200 2.504 7.375 120.788 1 U 2.160E+06 0.000E+00 e 0 0 0 0
201 4.713 7.130 120.261 1 U 4.350E+06 0.000E+00 e 0 17 20 15
202 7.530 6.199 119.144 1 U 3.320E+06 0.000E+00 e 0 759 257 250
203 4.721 6.199 119.152 1 U 7.460E+06 0.000E+00 e 0 0 0 0
204 4.453 6.198 119.114 1 U 2.440E+06 0.000E+00 e 0 0 0 0
205 2.165 6.199 119.149 1 U 1.130E+06 0.000E+00 e 0 0 0 0
206 1.088 6.202 119.179 1 U 1.220E+06 0.000E+00 e 0 879 257 250
207 0.771 6.200 119.134 1 U 8.930E+06 0.000E+00 e 0 855 257 250
208 7.966 6.197 119.126 1 U 6.620E+05 0.000E+00 e 0 0 0 0
209 6.888 6.198 119.144 1 U 4.230E+06 0.000E+00 e 0 266 257 250
210 5.835 6.199 119.139 1 U 2.180E+07 0.000E+00 e 0 256 257 250
211 4.191 6.200 119.104 1 U 1.170E+06 0.000E+00 e 0 252 257 250
212 3.071 6.197 119.124 1 U 1.470E+06 0.000E+00 e 0 253 257 250
213 2.814 6.194 119.144 1 U 1.700E+06 0.000E+00 e 0 0 0 0
214 1.522 6.197 119.194 1 U 1.090E+06 0.000E+00 e 0 0 0 0
215 1.968 6.807 118.537 1 U 7.020E+05 0.000E+00 e 0 590 490 483
216 8.811 6.801 118.470 1 U 1.000E+06 0.000E+00 e 0 596 490 483
217 8.258 6.799 118.404 1 U 3.450E+06 0.000E+00 e 0 603 490 483
218 7.065 6.800 118.419 1 U 3.670E+07 0.000E+00 e 0 489 490 483
219 5.565 6.799 118.450 1 U 2.750E+06 0.000E+00 e 0 597 490 483
220 4.898 6.800 118.460 1 U 6.220E+05 0.000E+00 e 0 460 490 483
221 4.719 6.800 118.414 1 U 9.740E+06 0.000E+00 e 0 0 0 0
222 4.556 6.801 118.500 1 U 8.420E+05 0.000E+00 e 0 0 0 0
223 4.054 6.799 118.440 1 U 2.920E+06 0.000E+00 e 0 0 0 0
224 3.219 6.799 118.465 1 U 1.230E+06 0.000E+00 e 0 0 0 0
225 2.611 6.800 118.429 1 U 3.070E+06 0.000E+00 e 0 461 490 483
226 2.341 6.801 118.409 1 U 1.800E+06 0.000E+00 e 0 462 490 483
227 1.493 6.800 118.419 1 U 8.420E+06 0.000E+00 e 0 607 490 483
228 0.924 6.803 118.424 1 U 1.500E+06 0.000E+00 e 0 599 490 483
229 7.356 6.797 118.450 1 U 1.740E+06 0.000E+00 e 0 0 0 0
230 2.059 7.535 131.976 1 U 1.330E+06 0.000E+00 e 0 0 0 0
231 1.469 7.532 132.097 1 U 2.630E+06 0.000E+00 e 0 0 0 0
232 0.812 7.314 131.935 1 U 1.400E+06 0.000E+00 e 0 0 0 0
233 1.521 7.056 132.235 1 U 3.090E+06 0.000E+00 e 0 0 0 0
234 5.859 7.061 132.335 1 U 1.930E+06 0.000E+00 e 0 0 0 0
235 7.845 7.186 131.561 1 U 9.180E+05 0.000E+00 e 0 0 0 0
236 1.083 7.185 131.344 1 U 7.450E+05 0.000E+00 e 0 0 0 0
237 1.276 7.182 131.344 1 U 5.260E+05 0.000E+00 e 0 0 0 0
238 1.265 7.036 131.372 1 U 1.470E+06 0.000E+00 e 0 0 0 0
239 8.477 7.040 131.651 1 U 1.050E+06 0.000E+00 e 0 0 0 0
240 8.647 7.037 131.354 1 U 7.770E+05 0.000E+00 e 0 0 0 0
241 4.273 6.969 131.151 1 U 2.700E+06 0.000E+00 e 0 0 0 0
242 7.401 6.961 131.151 1 U 3.680E+06 0.000E+00 e 0 0 0 0
243 1.308 6.962 131.138 1 U 2.990E+06 0.000E+00 e 0 0 0 0
244 1.180 6.961 131.151 1 U 2.670E+06 0.000E+00 e 0 0 0 0
245 7.974 6.967 131.050 1 U 1.000E+06 0.000E+00 e 0 0 0 0
246 5.346 6.977 131.429 1 U 3.660E+06 0.000E+00 e 0 105 110 102
247 2.683 6.978 131.450 1 U 4.810E+06 0.000E+00 e 0 107 110 102
248 2.737 6.978 131.450 1 U 4.980E+06 0.000E+00 e 0 106 110 102
249 4.853 7.037 131.542 1 U 2.030E+06 0.000E+00 e 0 630 635 626
250 4.034 6.924 130.839 1 U 1.600E+06 0.000E+00 e 0 0 0 0
251 7.500 6.926 130.839 1 U 4.090E+06 0.000E+00 e 0 0 0 0
252 7.431 6.921 129.745 1 U 1.790E+06 0.000E+00 e 0 0 0 0
253 2.118 6.926 129.745 1 U 2.380E+06 0.000E+00 e 0 0 0 0
254 3.146 7.130 120.254 1 U 3.440E+06 0.000E+00 e 0 0 0 0
255 1.787 6.802 118.423 1 U 9.750E+05 0.000E+00 e 0 0 0 0
256 5.732 6.798 118.398 1 U 7.280E+05 0.000E+00 e 0 0 0 0
257 4.391 6.801 118.429 1 U 2.080E+06 0.000E+00 e 0 5 490 483
258 5.886 6.797 118.331 1 U 2.660E+05 0.000E+00 e 0 4 490 483
259 1.676 6.802 118.398 1 U 7.500E+05 0.000E+00 e 0 0 0 0
260 3.438 6.200 119.158 1 U 2.460E+06 0.000E+00 e 0 0 0 0
261 8.463 6.201 119.126 1 U 5.350E+05 0.000E+00 e 0 0 0 0
262 9.127 6.195 119.126 1 U 3.750E+05 0.000E+00 e 0 0 0 0
263 -0.189 6.199 119.274 1 U 6.390E+05 0.000E+00 e 0 0 0 0
264 4.161 6.205 132.191 1 U 8.250E+05 0.000E+00 e 0 0 0 0
265 2.169 5.836 132.509 1 U 4.290E+05 0.000E+00 e 0 0 0 0
266 3.419 5.836 132.509 1 U 5.750E+05 0.000E+00 e 0 0 0 0
267 8.364 5.838 132.509 1 U 6.880E+05 0.000E+00 e 0 0 0 0
268 4.384 7.062 132.429 1 U 6.850E+05 0.000E+00 e 0 0 0 0
269 5.941 6.701 132.550 1 U 7.420E+04 0.000E+00 e 0 0 0 0
270 7.354 7.063 132.313 1 U 3.430E+06 0.000E+00 e 0 0 0 0
271 5.836 7.397 132.304 1 U 1.890E+06 0.000E+00 e 0 0 0 0
272 4.309 6.923 129.978 1 U 1.500E+06 0.000E+00 e 0 0 0 0
273 4.720 8.220 137.587 1 U -4.690E+06 0.000E+00 e 0 17 21 16
274 8.792 6.881 131.045 1 U 1.180E+06 0.000E+00 e 0 0 111 103
275 2.711 6.887 131.074 1 U 1.930E+06 0.000E+00 e 0 0 0 0
276 1.776 6.881 130.932 1 U 2.500E+06 0.000E+00 e 0 0 0 0
277 1.500 6.886 131.087 1 U 2.340E+06 0.000E+00 e 0 0 0 0
278 1.997 6.883 130.952 1 U 2.100E+06 0.000E+00 e 0 0 0 0
279 2.019 6.972 131.199 1 U 2.370E+06 0.000E+00 e 0 0 0 0
280 2.109 6.884 131.087 1 U 1.800E+06 0.000E+00 e 0 0 0 0
281 5.358 6.878 131.045 1 U 7.690E+05 0.000E+00 e 0 0 0 0
282 1.980 6.915 131.061 1 U 1.540E+06 0.000E+00 e 0 0 108 0
283 5.850 6.920 130.867 1 U 1.020E+06 0.000E+00 e 0 256 811 802
;
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 H . . 16 ppm . . . 4.7 . . 34259 2
2 . . C 13 C-aromatic . aliased 19 ppm . . . 125.6 . . 34259 2
3 . . H 1 H-aromatic . . 12.7 ppm . . . 4.7 . . 34259 2
stop_
save_