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 30412
_Spectral_peak_list.ID 1
_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 '2D 1H-1H TOCSY'
_Spectral_peak_list.Experiment_class .
_Spectral_peak_list.Experiment_type .
_Spectral_peak_list.Number_of_spectral_dimensions 2
_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 2
# INAME 1 H
# INAME 2 h
# CYANAFORMAT Hh
1 5.205 7.915 1 T 1.200e+07 0.00e+00 a 0 44 42 0
2 2.697 7.917 1 T 1.488e+07 0.00e+00 a 0 47 42 0
3 3.182 7.918 1 T 2.976e+07 0.00e+00 a 0 46 42 0
4 5.061 7.840 1 T 1.303e+07 0.00e+00 a 0 159 157 0
7 4.260 7.980 1 T 5.912e+06 0.00e+00 a 0 56 70 0
8 4.138 7.982 1 T 1.518e+07 0.00e+00 a 0 72 70 0
9 4.470 8.411 1 T 2.186e+07 0.00e+00 a 0 176 190 0
10 4.227 8.411 1 T 2.307e+07 0.00e+00 a 0 192 190 0
11 1.429 8.411 1 T 4.542e+07 0.00e+00 a 0 193 190 0
12 4.234 7.466 1 T 1.535e+07 0.00e+00 a 0 202 200 0
13 4.234 8.016 1 T 1.179e+07 0.00e+00 a 0 202 221 0
14 4.993 8.021 1 T 5.694e+06 0.00e+00 a 0 223 221 0
15 4.985 8.355 1 T 9.474e+06 0.00e+00 a 0 223 232 0
16 3.852 8.353 1 T 3.046e+07 0.00e+00 a 0 235 232 0
17 4.053 8.354 1 T 2.462e+07 0.00e+00 a 0 234 232 0
18 4.427 7.851 1 T 1.558e+07 0.00e+00 a 0 33 31 0
19 4.420 7.912 1 T 7.210e+06 0.00e+00 a 0 33 42 0
20 3.962 7.849 1 T 2.655e+07 0.00e+00 a 0 37 31 0
21 4.327 8.246 1 T 1.819e+07 0.00e+00 a 0 22 20 0
22 3.269 8.246 1 T 1.283e+07 0.00e+00 a 0 25 20 0
23 2.814 8.246 1 T 3.069e+07 0.00e+00 a 0 24 20 0
24 4.590 8.246 1 T 8.827e+06 0.00e+00 a 0 11 20 0
25 4.588 8.834 1 T 1.596e+07 0.00e+00 a 0 11 9 0
26 3.211 8.834 1 T 2.833e+07 0.00e+00 a 0 13 9 0
27 2.722 8.834 1 T 2.701e+07 0.00e+00 a 0 14 9 0
28 3.787 8.829 1 T 1.412e+07 0.00e+00 a 0 5 9 0
29 3.922 8.832 1 T 3.379e+07 0.00e+00 a 0 4 9 0
30 3.783 8.687 1 T 3.186e+07 0.00e+00 a 0 5 2 0
31 3.918 8.691 1 T 5.148e+07 0.00e+00 a 0 4 2 0
32 4.107 8.688 1 T 2.266e+07 0.00e+00 a 0 276 2 0
33 4.109 8.313 1 T 3.163e+07 0.00e+00 a 0 276 273 0
34 4.099 7.390 1 T 1.217e+07 0.00e+00 a 0 149 147 0
35 1.305 7.393 1 T 2.395e+07 0.00e+00 a 0 150 147 0
36 4.091 7.837 1 T 9.257e+06 0.00e+00 a 0 149 157 0
37 4.156 7.903 1 T 2.332e+07 0.00e+00 a 0 125 123 0
38 3.005 7.900 1 T 3.126e+07 0.00e+00 a 0 128 123 0
39 3.185 7.903 1 T 5.232e+07 0.00e+00 a 0 127 123 0
40 4.410 8.094 1 T 1.840e+07 0.00e+00 a 0 99 97 0
41 4.372 9.020 1 T 1.491e+07 0.00e+00 a 0 110 108 0
42 4.234 9.020 1 T 1.107e+07 0.00e+00 a 0 102 108 0
43 3.258 9.022 1 T 4.511e+06 0.00e+00 a 0 101 108 0
45 3.996 8.133 1 T 2.790e+07 0.00e+00 a 0 269 266 0
46 4.282 8.133 1 T 2.535e+07 0.00e+00 a 0 258 266 0
47 4.281 8.179 1 T 1.237e+07 0.00e+00 a 0 258 256 0
48 1.377 8.179 1 T 2.520e+07 0.00e+00 a 0 259 256 0
49 1.380 8.212 1 T 2.584e+07 0.00e+00 a 0 249 246 0
50 4.362 8.183 1 T 2.064e+07 0.00e+00 a 0 248 256 0
51 4.360 8.213 1 T 1.778e+07 0.00e+00 a 0 248 246 0
52 4.002 8.212 1 T 1.278e+07 0.00e+00 a 0 242 246 0
53 3.846 8.212 1 T 1.885e+07 0.00e+00 a 0 241 246 0
54 4.014 8.437 1 T 1.846e+07 0.00e+00 a 0 242 239 0
55 3.846 8.442 1 T 2.288e+07 0.00e+00 a 0 241 239 0
56 2.861 9.022 1 T 4.693e+07 0.00e+00 a 0 114 108 0
58 2.854 7.900 1 T 3.789e+07 0.00e+00 a 0 114 123 0
60 3.203 7.400 1 T 1.093e+07 0.00e+00 a 0 84 86 0
61 3.206 7.987 1 T 5.424e+06 0.00e+00 a 0 84 70 0
62 2.730 8.017 1 T 1.874e+07 0.00e+00 a 0 226 221 0
63 3.302 8.020 1 T 9.051e+06 0.00e+00 a 0 225 221 0
64 3.258 8.092 1 T 2.840e+07 0.00e+00 a 0 101 97 0
65 3.198 8.093 1 T 1.170e+07 0.00e+00 a 0 84 97 0
66 3.213 8.244 1 T 1.308e+07 0.00e+00 a 0 13 20 0
67 2.728 8.244 1 T 2.559e+07 0.00e+00 a 0 14 20 0
68 3.041 7.835 1 T 1.336e+07 0.00e+00 a 0 161 157 0
69 3.251 7.837 1 T 7.847e+06 0.00e+00 a 0 162 157 0
70 1.892 7.985 1 T 3.660e+07 0.00e+00 a 0 76 70 0
71 1.640 7.985 1 T 4.957e+06 0.00e+00 a 0 79 70 0
72 1.726 7.983 1 T 1.358e+07 0.00e+00 a 0 78 70 0
73 1.888 8.093 1 T 1.804e+07 0.00e+00 a 0 76 97 0
74 1.890 7.398 1 T 8.035e+06 0.00e+00 a 0 76 86 0
75 1.639 7.397 1 T 2.145e+06 0.00e+00 a 0 79 86 0
76 1.730 7.399 1 T 3.208e+06 0.00e+00 a 0 78 86 0
77 0.784 7.460 1 T 1.304e+07 0.00e+00 a 0 214 200 0
78 1.179 7.464 1 T 1.299e+07 0.00e+00 a 0 211 200 0
79 1.971 7.463 1 T 1.426e+07 0.00e+00 a 0 204 200 0
81 1.601 7.464 1 T 9.197e+06 0.00e+00 a 0 212 200 0
82 3.041 7.463 1 T 1.554e+07 0.00e+00 a 0 161 170 0
83 3.248 7.460 1 T 2.423e+07 0.00e+00 a 0 162 170 0
84 3.004 7.393 1 T 8.741e+06 0.00e+00 a 0 128 86 0
85 4.402 7.460 1 T 8.194e+06 0.00e+00 a 0 99 170 0
86 3.005 7.099 1 T 2.753e+07 0.00e+00 a 0 128 130 0
87 3.191 7.100 1 T 2.404e+07 0.00e+00 a 0 127 130 0
88 3.004 6.797 1 T 6.244e+06 0.00e+00 a 0 128 131 0
89 3.186 6.795 1 T 5.536e+06 0.00e+00 a 0 127 131 0
90 2.856 6.951 1 T 1.649e+07 0.00e+00 a 0 114 119 0
91 2.855 7.996 1 T 2.225e+07 0.00e+00 a 0 114 118 0
92 4.154 7.101 1 T 1.826e+07 0.00e+00 a 0 125 130 0
93 7.903 9.021 1 T 1.174e+07 0.00e+00 a 0 123 108 0
94 8.096 9.021 1 T 2.349e+07 0.00e+00 a 0 97 108 0
95 8.245 8.831 1 T 2.022e+07 0.00e+00 a 0 20 9 0
96 8.194 8.445 1 T 9.501e+06 0.00e+00 a 0 246 239 0
97 7.465 8.409 1 T 2.147e+07 0.00e+00 a 0 200 190 0
98 8.017 8.355 1 T 1.276e+07 0.00e+00 a 0 221 232 0
99 7.852 8.244 1 T 2.095e+07 0.00e+00 a 0 31 20 0
101 7.467 8.017 1 T 1.964e+07 0.00e+00 a 0 200 221 0
102 7.398 7.836 1 T 1.749e+07 0.00e+00 a 0 147 157 0
103 7.393 7.900 1 T 1.516e+07 0.00e+00 a 0 147 123 0
104 5.202 4.070 1 T 3.897e+07 0.00e+00 a 0 44 66 0
105 5.204 3.915 1 T 2.593e+07 0.00e+00 a 0 44 65 0
106 5.054 3.471 1 T 2.307e+07 0.00e+00 a 0 159 186 0
107 5.052 3.385 1 T 1.407e+07 0.00e+00 a 0 159 185 0
110 4.261 2.359 1 T 2.136e+07 0.00e+00 a 0 56 58 0
112 4.259 1.979 1 T 1.160e+07 0.00e+00 a 0 56 59 0
113 4.261 2.048 1 T 5.804e+06 0.00e+00 a 0 56 62 0
114 4.256 2.111 1 T 5.554e+06 0.00e+00 a 0 56 63 0
116 4.469 2.261 1 T 1.714e+07 0.00e+00 a 0 176 178 0
117 4.470 1.938 1 T 2.433e+07 0.00e+00 a 0 176 184 0
118 3.918 8.311 1 T 1.963e+07 0.00e+00 a 0 275 273 0
119 4.410 9.022 1 T 1.023e+07 0.00e+00 a 0 99 108 0
#121 4.468 8.018 1 T 4.654e+06 0.00e+00 a 0 176 221 0
122 3.473 8.411 1 T 8.669e+06 0.00e+00 a 0 186 190 0
123 3.379 8.410 1 T 3.239e+06 0.00e+00 a 0 185 190 0
124 3.468 7.841 1 T 4.418e+06 0.00e+00 a 0 186 157 0
125 3.386 7.839 1 T 7.322e+06 0.00e+00 a 0 185 157 0
126 2.815 7.849 1 T 6.123e+06 0.00e+00 a 0 24 31 0
127 3.295 8.354 1 T 4.620e+06 0.00e+00 a 0 225 232 0
128 2.737 8.352 1 T 5.386e+06 0.00e+00 a 0 226 232 0
129 4.326 6.952 1 T 6.395e+06 0.00e+00 a 0 110 119 0
130 3.284 6.951 1 T 1.623e+07 0.00e+00 a 0 225 119 0
131 2.730 6.953 1 T 4.689e+06 0.00e+00 a 0 226 119 0
132 5.054 8.412 1 T 4.313e+06 0.00e+00 a 0 159 190 0
133 4.413 7.398 1 T 3.686e+06 0.00e+00 a 0 99 147 0
134 3.914 7.983 1 T 8.934e+06 0.00e+00 a 0 65 70 0
135 4.082 7.984 1 T 6.220e+06 0.00e+00 a 0 66 70 0
136 3.961 7.917 1 T 4.436e+06 0.00e+00 a 0 37 42 0
137 4.331 7.851 1 T 7.763e+06 0.00e+00 a 0 22 31 0
138 4.412 8.753 1 T 5.801e+06 0.00e+00 a 0 99 167 0
139 4.242 8.755 1 T 2.441e+06 0.00e+00 a 0 102 167 0
140 3.257 8.755 1 T 2.559e+06 0.00e+00 a 0 101 167 0
141 1.300 8.752 1 T 1.613e+07 0.00e+00 a 0 150 167 0
143 8.311 8.690 1 T 4.003e+06 0.00e+00 a 0 273 2 0
144 8.685 8.833 1 T 4.352e+06 0.00e+00 a 0 2 9 0
146 4.594 7.853 1 T 2.729e+06 0.00e+00 a 0 11 31 0
147 2.712 7.848 1 T 2.610e+06 0.00e+00 a 0 14 31 0
149 5.201 7.987 1 T 2.413e+06 0.00e+00 a 0 44 70 0
150 7.989 9.022 1 T 3.653e+06 0.00e+00 a 0 70 108 0
151 7.983 8.092 1 T 2.254e+07 0.00e+00 a 0 70 97 0
152 2.703 8.098 1 T 2.640e+06 0.00e+00 a 0 47 97 0
154 3.179 8.096 1 T 8.436e+06 0.00e+00 a 0 46 97 0
155 2.853 8.095 1 T 4.187e+06 0.00e+00 a 0 114 97 0
156 1.941 8.409 1 T 0.000e+00 0.00e+00 - 0 184 190 0
157 2.265 8.409 1 T 0.000e+00 0.00e+00 - 0 178 190 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 2 . 11 ppm . . . 4.79 . . 30412 1
2 . . H 1 H 1 . 11 ppm . . . 4.79 . . 30412 1
stop_
save_