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 52413
_Spectral_peak_list.ID 2
_Spectral_peak_list.Name TOCSY_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 2
_Spectral_peak_list.Experiment_name '2D 1H-H 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 1H
#INAME 2 1H
1 8.714 8.714 1 U 1.417e+06 0.00e+00 m 0 25 25 0
2 4.794 8.714 1 U 6.921e+05 0.00e+00 m 0 27 25 0
3 2.762 8.714 1 U 9.013e+05 0.00e+00 m 0 29 25 0
4 2.657 8.714 1 U 9.761e+05 0.00e+00 m 0 30 25 0
5 6.888 7.579 1 U 1.649e+06 0.00e+00 m 0 35 34 0
6 7.579 7.579 1 U 5.712e+06 0.00e+00 m 0 34 34 0
7 6.885 6.885 1 U 6.755e+06 0.00e+00 m 0 35 35 0
8 8.504 8.504 1 U 2.986e+06 0.00e+00 m 0 39 39 0
9 4.241 8.503 1 U 2.152e+06 0.00e+00 m 0 41 39 0
10 1.877 8.503 1 U 2.248e+05 0.00e+00 m 0 44 39 0
11 1.766 8.503 1 U 3.122e+05 0.00e+00 m 0 43 39 0
12 1.628 8.503 1 U 4.583e+05 0.00e+00 m 0 47 39 0
13 3.181 8.501 1 U 8.311e+04 0.00e+00 m 0 51 39 0
14 3.181 8.501 1 U 8.311e+04 0.00e+00 m 0 52 39 0
15 3.182 4.250 1 U 1.255e+05 0.00e+00 m 0 51 41 0
16 3.182 4.250 1 U 1.255e+05 0.00e+00 m 0 52 41 0
17 1.877 4.242 1 U 6.444e+04 0.00e+00 m 0 44 41 0
18 1.767 4.242 1 U 8.056e+04 0.00e+00 m 0 43 41 0
19 1.636 4.242 1 U 9.624e+04 0.00e+00 m 0 47 41 0
20 1.631 1.766 1 U 6.299e+05 0.00e+00 m 0 47 43 0
21 1.771 1.875 1 U 2.386e+05 0.00e+00 m 0 43 44 0
22 1.636 1.871 1 U 6.598e+05 0.00e+00 m 0 47 44 0
23 1.875 3.179 1 U 5.366e+05 0.00e+00 m 0 44 51 0
24 1.767 3.179 1 U 5.313e+05 0.00e+00 m 0 43 51 0
25 1.628 3.178 1 U 9.703e+05 0.00e+00 m 0 47 51 0
26 1.875 3.179 1 U 5.366e+05 0.00e+00 m 0 44 52 0
27 1.767 3.179 1 U 5.313e+05 0.00e+00 m 0 43 52 0
28 1.628 3.178 1 U 9.703e+05 0.00e+00 m 0 47 52 0
29 4.239 7.316 1 U 4.440e+04 0.00e+00 m 0 41 55 0
30 3.178 7.318 1 U 1.328e+06 0.00e+00 m 0 51 55 0
31 3.178 7.318 1 U 1.328e+06 0.00e+00 m 0 52 55 0
32 1.875 7.317 1 U 2.206e+05 0.00e+00 m 0 44 55 0
33 1.765 7.317 1 U 2.241e+05 0.00e+00 m 0 43 55 0
34 1.627 7.316 1 U 3.691e+05 0.00e+00 m 0 47 55 0
35 8.476 8.476 1 U 1.954e+06 0.00e+00 m 0 65 65 0
36 3.899 8.477 1 U 2.191e+06 0.00e+00 m 0 67 65 0
37 8.171 8.170 1 U 3.170e+06 0.00e+00 m 0 72 72 0
38 3.827 8.169 1 U 2.924e+06 0.00e+00 m 0 74 72 0
39 7.987 7.987 1 U 1.863e+06 0.00e+00 m 0 79 79 0
40 4.394 7.987 1 U 1.456e+06 0.00e+00 m 0 81 79 0
41 2.805 7.987 1 U 1.586e+06 0.00e+00 m 0 83 79 0
42 2.804 4.391 1 U 2.529e+04 0.00e+00 m 0 83 81 0
43 6.744 6.978 1 U 2.612e+06 0.00e+00 m 0 93 91 0
44 6.977 6.977 1 U 1.521e+07 0.00e+00 m 0 91 91 0
45 6.977 6.977 1 U 1.521e+07 0.00e+00 m 0 98 91 0
46 6.744 6.744 1 U 1.387e+07 0.00e+00 m 0 96 93 0
47 6.744 6.978 1 U 2.612e+06 0.00e+00 m 0 93 98 0
48 6.977 6.977 1 U 1.521e+07 0.00e+00 m 0 91 98 0
49 6.977 6.977 1 U 1.521e+07 0.00e+00 m 0 98 98 0
50 4.658 8.287 1 U 8.868e+05 0.00e+00 m 0 104 102 0
51 2.704 8.287 1 U 1.002e+06 0.00e+00 m 0 106 102 0
52 2.563 8.287 1 U 1.118e+06 0.00e+00 m 0 107 102 0
53 6.819 7.511 1 U 1.469e+06 0.00e+00 m 0 112 111 0
54 7.512 7.512 1 U 4.986e+06 0.00e+00 m 0 111 111 0
55 6.818 6.818 1 U 6.018e+06 0.00e+00 m 0 112 112 0
56 4.496 8.116 1 U 1.094e+06 0.00e+00 m 0 118 116 0
57 3.151 8.115 1 U 6.310e+05 0.00e+00 m 0 120 116 0
58 2.961 8.115 1 U 7.642e+05 0.00e+00 m 0 121 116 0
59 3.148 4.496 1 U 2.760e+02 0.00e+00 m 0 120 118 0
60 2.958 4.499 1 U 1.155e+04 0.00e+00 m 0 121 118 0
61 4.480 7.228 1 U 1.200e+05 0.00e+00 m 0 118 128 0
62 4.480 7.228 1 U 1.200e+05 0.00e+00 m 0 118 136 0
63 3.917 8.396 1 U 9.900e+05 0.00e+00 m 0 141 139 0
64 3.845 8.396 1 U 9.568e+05 0.00e+00 m 0 142 139 0
65 3.839 3.916 1 U 7.515e+05 0.00e+00 m 0 142 142 0
66 4.303 8.064 1 U 2.224e+06 0.00e+00 m 0 148 146 0
67 2.959 8.064 1 U 6.633e+04 0.00e+00 m 0 162 146 0
68 1.827 8.064 1 U 3.628e+05 0.00e+00 m 0 150 146 0
69 1.731 8.064 1 U 5.167e+05 0.00e+00 m 0 158 146 0
70 1.649 8.064 1 U 4.280e+05 0.00e+00 m 0 159 146 0
71 1.394 8.064 1 U 3.657e+05 0.00e+00 m 0 154 146 0
72 1.813 4.297 1 U 1.140e+05 0.00e+00 m 0 150 148 0
73 1.715 4.296 1 U 1.009e+05 0.00e+00 m 0 158 148 0
74 1.404 4.301 1 U 4.954e+04 0.00e+00 m 0 154 148 0
75 2.958 4.303 1 U 2.966e+04 0.00e+00 m 0 162 148 0
76 1.412 1.830 1 U 4.591e+05 0.00e+00 m 0 154 150 0
77 1.648 1.826 1 U 7.275e+05 0.00e+00 m 0 159 150 0
78 1.397 1.728 1 U 3.707e+05 0.00e+00 m 0 154 158 0
79 1.644 1.732 1 U 8.415e+05 0.00e+00 m 0 159 158 0
80 1.400 1.650 1 U 1.032e+06 0.00e+00 m 0 154 159 0
81 1.650 2.957 1 U 1.263e+06 0.00e+00 m 0 159 162 0
82 1.400 2.956 1 U 5.251e+05 0.00e+00 m 0 154 162 0
83 1.730 2.956 1 U 4.852e+05 0.00e+00 m 0 158 162 0
84 1.828 2.956 1 U 4.715e+05 0.00e+00 m 0 150 162 0
85 2.958 7.533 1 U 8.597e+05 0.00e+00 m 0 162 166 0
86 7.533 7.533 1 U 1.383e+06 0.00e+00 m 0 167 166 0
87 4.300 7.534 1 U 1.049e+04 0.00e+00 m 0 148 166 0
88 1.827 7.532 1 U 1.155e+05 0.00e+00 m 0 150 166 0
89 1.728 7.533 1 U 1.217e+05 0.00e+00 m 0 158 166 0
90 1.650 7.533 1 U 5.172e+05 0.00e+00 m 0 159 166 0
91 1.398 7.533 1 U 1.997e+05 0.00e+00 m 0 154 166 0
92 4.441 8.295 1 U 1.566e+06 0.00e+00 m 0 173 171 0
93 3.832 8.296 1 U 4.237e+06 0.00e+00 m 0 175 171 0
94 3.827 4.434 1 U 2.127e+04 0.00e+00 m 0 175 173 0
95 4.108 8.077 1 U 3.703e+06 0.00e+00 m 0 183 181 0
96 2.038 8.076 1 U 7.954e+05 0.00e+00 m 0 185 181 0
97 0.852 8.077 1 U 1.144e+06 0.00e+00 m 0 189 181 0
98 0.852 8.077 1 U 1.144e+06 0.00e+00 m 0 193 181 0
99 2.040 4.106 1 U 2.596e+05 0.00e+00 m 0 185 183 0
100 0.854 4.107 1 U 3.633e+05 0.00e+00 m 0 189 183 0
101 0.854 4.107 1 U 3.633e+05 0.00e+00 m 0 193 183 0
102 0.854 2.036 1 U 1.123e+06 0.00e+00 m 0 189 185 0
103 0.854 2.036 1 U 1.123e+06 0.00e+00 m 0 193 185 0
104 2.037 2.037 1 U 1.704e+06 0.00e+00 m 0 185 185 0
105 4.291 8.276 1 U 2.677e+06 0.00e+00 m 0 201 199 0
106 1.797 8.275 1 U 4.199e+05 0.00e+00 m 0 203 199 0
107 1.694 8.275 1 U 5.765e+05 0.00e+00 m 0 204 199 0
108 1.586 8.275 1 U 5.997e+05 0.00e+00 m 0 207 199 0
109 3.146 8.275 1 U 2.438e+05 0.00e+00 m 0 211 199 0
110 3.146 8.275 1 U 2.438e+05 0.00e+00 m 0 212 199 0
111 7.204 8.276 1 U 8.120e+04 0.00e+00 m 0 218 199 0
112 1.581 4.286 1 U 6.197e+04 0.00e+00 m 0 207 201 0
113 1.588 1.797 1 U 6.840e+05 0.00e+00 m 0 207 203 0
114 1.701 1.799 1 U 4.039e+05 0.00e+00 m 0 204 203 0
115 1.586 1.696 1 U 6.155e+05 0.00e+00 m 0 207 204 0
116 1.798 3.148 1 U 8.004e+05 0.00e+00 m 0 203 211 0
117 1.695 3.148 1 U 7.983e+05 0.00e+00 m 0 204 211 0
118 1.580 3.148 1 U 1.013e+06 0.00e+00 m 0 207 211 0
119 1.798 3.148 1 U 8.004e+05 0.00e+00 m 0 203 212 0
120 1.695 3.148 1 U 7.983e+05 0.00e+00 m 0 204 212 0
121 1.580 3.148 1 U 1.013e+06 0.00e+00 m 0 207 212 0
122 1.799 7.204 1 U 4.051e+05 0.00e+00 m 0 203 218 0
123 1.691 7.203 1 U 4.273e+05 0.00e+00 m 0 204 218 0
124 1.582 7.203 1 U 4.662e+05 0.00e+00 m 0 207 218 0
125 3.150 7.202 1 U 2.049e+06 0.00e+00 m 0 211 218 0
126 3.150 7.202 1 U 2.049e+06 0.00e+00 m 0 212 218 0
127 4.286 7.202 1 U 1.057e+05 0.00e+00 m 0 201 218 0
128 7.203 7.203 1 U 3.685e+06 0.00e+00 m 0 218 218 0
129 4.478 8.188 1 U 1.531e+06 0.00e+00 m 0 227 225 0
130 3.221 8.190 1 U 1.630e+06 0.00e+00 m 0 229 225 0
131 3.078 8.189 1 U 1.916e+06 0.00e+00 m 0 230 225 0
132 7.231 8.188 1 U 5.064e+04 0.00e+00 m 0 238 225 0
133 3.215 4.478 1 U 1.153e+05 0.00e+00 m 0 229 227 0
134 3.073 4.480 1 U 1.315e+05 0.00e+00 m 0 230 227 0
135 3.075 7.227 1 U 2.656e+05 0.00e+00 m 0 230 238 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 . 'not observed' 6002.4 Hz . . . . . . 52413 2
stop_
loop_
_Spectral_peak_software.Software_ID
_Spectral_peak_software.Software_label
_Spectral_peak_software.Method_ID
_Spectral_peak_software.Method_label
_Spectral_peak_software.Entry_ID
_Spectral_peak_software.Spectral_peak_list_ID
1 $software_1 . . 52413 2
stop_
save_