Content for NMR-STAR saveframe, "spectral_peak_list_8"
save_spectral_peak_list_8
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode spectral_peak_list_8
_Spectral_peak_list.Entry_ID 6693
_Spectral_peak_list.ID 6
_Spectral_peak_list.Sample_ID 1
_Spectral_peak_list.Sample_label $sample_BoR11.BoR11-21.3-NC-GF-6.5_BoR11.004
_Spectral_peak_list.Sample_condition_list_ID 1
_Spectral_peak_list.Sample_condition_list_label $conditions_1
_Spectral_peak_list.Experiment_ID 1
_Spectral_peak_list.Experiment_name hCBCAcoNH
_Spectral_peak_list.Number_of_spectral_dimensions 3
_Spectral_peak_list.Details .
_Spectral_peak_list.Text_data_format .
_Spectral_peak_list.Text_data .
loop_
_Spectral_dim.ID
_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.Center_frequency_offset
_Spectral_dim.Encoding_code
_Spectral_dim.Encoded_reduced_dimension_ID
_Spectral_dim.Entry_ID
_Spectral_dim.Spectral_peak_list_ID
2 N 15 N . . 11499.21 . . . . 6693 6
3 H 1 H-C . . 1800.00 . . . . 6693 6
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
3 $Sparky . . 6693 6
5 $AutoStructure . . 6693 6
6 $SPINS . . 6693 6
stop_
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_Peak.ID
_Peak.Figure_of_merit
_Peak.Details
_Peak.Entry_ID
_Peak.Spectral_peak_list_ID
1 . . 6693 6
10 . . 6693 6
11 . . 6693 6
12 . . 6693 6
13 . . 6693 6
14 . . 6693 6
15 . . 6693 6
16 . . 6693 6
2 . . 6693 6
3 . . 6693 6
4 . . 6693 6
5 . . 6693 6
6 . . 6693 6
7 . . 6693 6
8 . . 6693 6
9 . . 6693 6
stop_
loop_
_Peak_general_char.Peak_ID
_Peak_general_char.Intensity_val
_Peak_general_char.Intensity_val_err
_Peak_general_char.Measurement_method
_Peak_general_char.Entry_ID
_Peak_general_char.Spectral_peak_list_ID
1 1031237.875 . . 6693 6
2 978526.750 . . 6693 6
3 825666.125 . . 6693 6
4 825666.125 . . 6693 6
5 571267.750 . . 6693 6
6 545278.812 . . 6693 6
7 2782062.500 . . 6693 6
8 2420010.000 . . 6693 6
9 3041547.000 . . 6693 6
10 3191507.750 . . 6693 6
11 786349.938 . . 6693 6
12 675995.375 . . 6693 6
13 768548.750 . . 6693 6
14 688098.812 . . 6693 6
15 2244088.250 . . 6693 6
16 2505823.750 . . 6693 6
stop_
loop_
_Peak_char.Peak_ID
_Peak_char.Spectral_dim_ID
_Peak_char.Chem_shift_val
_Peak_char.Chem_shift_val_err
_Peak_char.Line_width_val
_Peak_char.Line_width_val_err
_Peak_char.Phase_val
_Peak_char.Phase_val_err
_Peak_char.Decay_rate_val
_Peak_char.Decay_rate_val_err
_Peak_char.Coupling_pattern
_Peak_char.Bounding_box_upper_val
_Peak_char.Bounding_box_lower_val
_Peak_char.Bounding_box_range_val
_Peak_char.Details
_Peak_char.Derivation_method_ID
_Peak_char.Entry_ID
_Peak_char.Spectral_peak_list_ID
1 1 7.216 . . . . . . . . . . . . . 6693 6
2 2 108.303 . . . . . . . . . . . . . 6693 6
3 1 6.881 . . . . . . . . . . . . . 6693 6
4 2 108.326 . . . . . . . . . . . . . 6693 6
5 1 7.624 . . . . . . . . . . . . . 6693 6
6 2 109.362 . . . . . . . . . . . . . 6693 6
7 1 7.634 . . . . . . . . . . . . . 6693 6
8 2 109.341 . . . . . . . . . . . . . 6693 6
9 1 7.748 . . . . . . . . . . . . . 6693 6
10 2 111.393 . . . . . . . . . . . . . 6693 6
11 1 7.383 . . . . . . . . . . . . . 6693 6
12 2 111.370 . . . . . . . . . . . . . 6693 6
13 1 7.308 . . . . . . . . . . . . . 6693 6
14 2 112.556 . . . . . . . . . . . . . 6693 6
15 1 6.908 . . . . . . . . . . . . . 6693 6
16 2 112.553 . . . . . . . . . . . . . 6693 6
17 1 6.918 . . . . . . . . . . . . . 6693 6
18 2 113.199 . . . . . . . . . . . . . 6693 6
19 1 7.694 . . . . . . . . . . . . . 6693 6
20 2 113.182 . . . . . . . . . . . . . 6693 6
21 1 8.054 . . . . . . . . . . . . . 6693 6
22 2 113.632 . . . . . . . . . . . . . 6693 6
23 1 7.757 . . . . . . . . . . . . . 6693 6
24 2 113.553 . . . . . . . . . . . . . 6693 6
25 1 8.026 . . . . . . . . . . . . . 6693 6
26 2 114.001 . . . . . . . . . . . . . 6693 6
27 1 7.638 . . . . . . . . . . . . . 6693 6
28 2 114.030 . . . . . . . . . . . . . 6693 6
29 1 6.692 . . . . . . . . . . . . . 6693 6
30 2 114.204 . . . . . . . . . . . . . 6693 6
31 1 8.061 . . . . . . . . . . . . . 6693 6
32 2 114.175 . . . . . . . . . . . . . 6693 6
stop_
save_