Content for NMR-STAR saveframe, "spectral_peak_list_1"
save_spectral_peak_list_1
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode spectral_peak_list_1
_Spectral_peak_list.Entry_ID 34557
_Spectral_peak_list.ID 1
_Spectral_peak_list.Name .
_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.Chem_shift_reference_ID 1
_Spectral_peak_list.Chem_shift_reference_label $chem_shift_reference_1
_Spectral_peak_list.Experiment_ID 12
_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 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 H
#INAME 2 C
#INAME 3 HC
#SPECTRUM C13NOESY H C HC
1 6.692 117.703 6.692 1 T 1.308e+08 0.00e+00 a 0 678 683 678 0
2 6.795 118.088 6.797 1 T 4.073e+08 0.00e+00 a 0 1390 1395 1390 0
3 4.792 117.733 6.692 1 T 1.378e+06 0.00e+00 a 0 0 0 0 0
4 4.254 117.724 6.693 1 T 1.767e+06 0.00e+00 a 0 672 683 678 0
5 3.969 117.666 6.694 1 T 1.116e+06 0.00e+00 a 0 0 0 0 0
6 3.098 117.658 6.693 1 T 2.445e+06 0.00e+00 a 0 674 683 678 0
7 6.925 117.704 6.692 1 T 2.999e+07 0.00e+00 a 0 677 0 678 0
8 7.083 118.086 6.797 1 T 2.004e+07 0.00e+00 a 0 1389 0 1390 0
10 6.695 132.779 6.930 1 T 2.968e+07 0.00e+00 a 0 678 688 677 0
11 6.925 132.749 6.930 1 T 1.040e+08 0.00e+00 a 0 677 688 677 0
12 1.443 117.687 6.692 1 T 3.486e+06 0.00e+00 a 0 0 0 0 0
13 0.265 117.704 6.693 1 T 4.164e+06 0.00e+00 a 0 0 0 0 0
14 0.623 117.704 6.692 1 T 2.583e+06 0.00e+00 a 0 0 0 0 0
17 4.257 132.755 6.931 1 T 8.299e+06 0.00e+00 a 0 672 688 677 0
18 3.128 132.776 6.930 1 T 1.096e+07 0.00e+00 a 0 674 688 677 0
19 0.264 132.772 6.930 1 T 4.354e+06 0.00e+00 a 0 0 0 0 0
20 0.622 132.765 6.929 1 T 3.549e+06 0.00e+00 a 0 0 0 0 0
21 4.008 132.795 6.927 1 T 1.769e+06 0.00e+00 a 0 0 0 0 0
22 1.996 132.799 6.927 1 T 9.381e+05 0.00e+00 a 0 0 0 0 0
23 1.441 132.795 6.932 1 T 1.623e+06 0.00e+00 a 0 0 0 0 0
24 1.287 132.753 6.927 1 T 1.154e+06 0.00e+00 a 0 0 0 0 0
26 7.085 133.315 7.089 1 T 4.145e+08 0.00e+00 a 0 1389 1400 1389 0
27 6.797 133.325 7.089 1 T 2.173e+07 0.00e+00 a 0 1390 1400 1389 0
29 4.361 133.318 7.088 1 T 2.336e+06 0.00e+00 a 0 1384 1400 1389 0
30 3.034 133.341 7.088 1 T 4.905e+06 0.00e+00 a 0 1386 1400 1389 0
31 2.897 133.311 7.088 1 T 4.781e+06 0.00e+00 a 0 1387 1400 1389 0
32 1.677 132.688 6.937 1 T 1.011e+06 0.00e+00 a 0 0 0 0 0
33 1.132 132.679 6.931 1 T 1.712e+06 0.00e+00 a 0 0 0 0 0
34 4.031 132.157 6.932 1 T 2.184e+06 0.00e+00 a 0 924 0 0 0
35 3.482 132.123 6.945 1 T 8.995e+05 0.00e+00 a 0 0 0 0 0
36 3.320 132.150 6.937 1 T 3.175e+06 0.00e+00 a 0 926 0 0 0
37 3.031 132.134 6.936 1 T 3.305e+06 0.00e+00 a 0 927 0 0 0
38 1.263 132.126 6.938 1 T 1.026e+06 0.00e+00 a 0 739 0 0 0
39 7.279 131.397 7.277 1 T 7.164e+07 0.00e+00 a 0 250 254 250 0
40 7.272 131.381 7.180 1 T 4.843e+07 0.00e+00 a 0 250 256 251 0
41 7.185 131.383 7.276 1 T 3.757e+07 0.00e+00 a 0 251 254 250 0
42 7.178 131.379 7.180 1 T 7.525e+07 0.00e+00 a 0 251 256 251 0
43 4.258 131.421 7.276 1 T 1.362e+06 0.00e+00 a 0 245 254 250 0
44 3.217 131.372 7.279 1 T 1.036e+06 0.00e+00 a 0 248 254 250 0
45 3.058 131.391 7.275 1 T 1.030e+06 0.00e+00 a 0 247 254 250 0
46 4.252 131.374 7.179 1 T 3.105e+06 0.00e+00 a 0 245 256 251 0
47 3.221 131.358 7.182 1 T 2.490e+06 0.00e+00 a 0 248 256 251 0
48 3.057 131.375 7.180 1 T 3.028e+06 0.00e+00 a 0 247 256 251 0
49 1.999 131.350 7.182 1 T 8.474e+05 0.00e+00 a 0 0 0 0 0
50 1.867 131.403 7.183 1 T 1.204e+06 0.00e+00 a 0 0 0 0 0
51 1.525 131.375 7.179 1 T 1.541e+06 0.00e+00 a 0 0 0 0 0
52 1.278 131.337 7.271 1 T 6.409e+05 0.00e+00 a 0 0 0 0 0
53 1.295 131.331 7.178 1 T 8.485e+05 0.00e+00 a 0 0 0 0 0
54 0.817 131.380 7.277 1 T 2.098e+06 0.00e+00 a 0 0 0 0 0
55 0.623 131.345 7.273 1 T 1.484e+06 0.00e+00 a 0 0 0 0 0
56 0.622 131.396 7.178 1 T 1.301e+06 0.00e+00 a 0 0 0 0 0
57 0.819 131.419 7.181 1 T 2.785e+06 0.00e+00 a 0 0 0 0 0
58 4.265 130.801 6.799 1 T 1.420e+06 0.00e+00 a 0 0 0 0 0
59 1.845 131.419 7.275 1 T 9.427e+05 0.00e+00 a 0 0 0 0 0
60 1.586 131.470 7.277 1 T 1.026e+06 0.00e+00 a 0 0 0 0 0
61 0.263 131.366 7.177 1 T 8.435e+05 0.00e+00 a 0 0 0 0 0
62 0.259 131.528 7.277 1 T 6.908e+05 0.00e+00 a 0 0 0 0 0
63 7.285 129.701 7.291 1 T 5.923e+07 0.00e+00 a 0 259 258 259 0
65 6.795 130.825 6.795 1 T 2.627e+07 0.00e+00 a 0 930 939 930 0
66 6.915 130.807 6.797 1 T 7.157e+06 0.00e+00 a 0 929 939 930 0
67 6.837 132.239 6.935 1 T 5.633e+06 0.00e+00 a 0 930 933 929 0
68 6.714 129.438 6.714 1 T 1.430e+07 0.00e+00 a 0 938 937 938 0
69 1.952 132.215 6.936 1 T 1.587e+06 0.00e+00 a 0 0 0 0 0
70 1.819 132.198 6.936 1 T 4.857e+06 0.00e+00 a 0 0 0 0 0
71 0.882 132.215 6.937 1 T 2.799e+06 0.00e+00 a 0 0 0 0 0
72 0.769 132.224 6.935 1 T 2.175e+06 0.00e+00 a 0 0 0 0 0
73 0.616 130.851 6.800 1 T 1.827e+06 0.00e+00 a 0 0 0 0 0
74 0.902 130.822 6.796 1 T 1.251e+06 0.00e+00 a 0 0 0 0 0
75 1.959 130.940 6.792 1 T 1.345e+06 0.00e+00 a 0 0 0 0 0
76 1.815 130.827 6.795 1 T 2.485e+06 0.00e+00 a 0 0 0 0 0
77 3.126 130.861 6.797 1 T 1.102e+06 0.00e+00 a 0 0 0 0 0
78 0.616 129.497 6.718 1 T 1.203e+06 0.00e+00 a 0 0 0 0 0
79 0.907 129.375 6.714 1 T 8.749e+05 0.00e+00 a 0 0 0 0 0
80 6.822 132.749 6.930 1 T 7.736e+06 0.00e+00 a 0 0 0 0 0
82 0.617 129.734 7.292 1 T 8.153e+05 0.00e+00 a 0 0 0 0 0
83 0.782 129.673 7.288 1 T 8.992e+05 0.00e+00 a 0 0 0 0 0
84 0.900 129.636 7.280 1 T 8.479e+05 0.00e+00 a 0 0 0 0 0
85 1.274 129.649 7.294 1 T 7.180e+05 0.00e+00 a 0 0 0 0 0
87 1.831 129.704 7.284 1 T 5.973e+05 0.00e+00 a 0 0 0 0 0
88 0.923 131.473 7.180 1 T 1.147e+06 0.00e+00 a 0 0 0 0 0
89 6.692 113.131 6.899 1 T 2.038e+05 0.00e+00 a 0 0 0 0 0
90 6.488 113.131 6.810 1 T 3.388e+05 0.00e+00 a 0 0 0 0 0
91 6.406 113.131 6.677 1 T 3.648e+05 0.00e+00 a 0 0 0 0 0
92 7.260 113.131 7.361 1 T 3.098e+05 0.00e+00 a 0 0 0 0 0
93 7.117 113.131 7.188 1 T 2.469e+05 0.00e+00 a 0 0 0 0 0
94 7.023 113.131 7.066 1 T -4.527e+04 0.00e+00 a 0 0 0 0 0
95 6.963 113.131 7.078 1 T 9.874e+04 0.00e+00 a 0 0 0 0 0
96 6.827 113.131 3.223 1 T 2.317e+05 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 H-aromatic . . 13.96 ppm . . . 4.79 . . 34557 1
2 . . H 1 H . . 13.00 ppm . . . 4.79 . . 34557 1
3 . . C 13 C-aromatic . . 24.00 ppm . . . 125.13 . . 34557 1
stop_
save_