######################### # Spectral peak lists # ######################### 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 34634 _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 2 _Spectral_peak_list.Experiment_name '2D 1H-1H NOESY' _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 1Hy #INAME 2 1Hx 2 9.997 9.997 1 U 1.180e+05 0.00e+00 - 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0 108 0 0 924 3.852 1.463 1 U 1.102e+03 0.00e+00 - 0 108 0 0 925 3.852 1.581 1 U 9.606e+02 0.00e+00 - 0 108 0 0 926 2.650 7.429 1 U 1.724e+03 0.00e+00 - 0 331 0 0 927 4.388 7.807 1 U 7.929e+02 0.00e+00 - 0 45 116 0 928 4.236 7.959 1 U 1.015e+03 0.00e+00 - 0 144 194 0 929 4.236 7.507 1 U 4.297e+02 0.00e+00 - 0 144 220 0 930 7.941 7.941 1 U 4.211e+04 0.00e+00 - 0 187 187 0 931 8.632 8.190 1 U 1.215e+03 0.00e+00 - 0 165 142 0 932 8.631 7.943 1 U 1.943e+03 0.00e+00 - 0 165 187 0 933 8.189 8.631 1 U 1.211e+03 0.00e+00 - 0 142 165 0 934 7.943 8.631 1 U 1.779e+03 0.00e+00 - 0 187 165 0 935 7.808 8.190 1 U 1.435e+03 0.00e+00 - 0 116 142 0 936 8.190 7.807 1 U 3.301e+03 0.00e+00 - 0 142 116 0 937 8.190 7.841 1 U 4.887e+02 0.00e+00 - 0 142 106 0 938 9.997 7.289 1 U 5.801e+03 0.00e+00 - 0 76 79 0 940 2.972 7.110 1 U 7.259e+03 0.00e+00 - 0 146 161 0 941 3.073 7.110 1 U 5.925e+03 0.00e+00 - 0 147 161 0 942 3.073 7.156 1 U 2.203e+03 0.00e+00 - 0 147 162 0 943 2.972 7.156 1 U 2.464e+03 0.00e+00 - 0 146 162 0 944 8.190 7.111 1 U 7.407e+02 0.00e+00 - 0 142 161 0 945 8.631 7.111 1 U 9.208e+02 0.00e+00 - 0 165 161 0 946 3.247 7.260 1 U 4.949e+03 0.00e+00 - 0 207 210 0 947 3.128 7.260 1 U 5.830e+03 0.00e+00 - 0 208 210 0 948 4.236 7.111 1 U 7.877e+03 0.00e+00 - 0 144 161 0 949 4.236 7.156 1 U 3.027e+03 0.00e+00 - 0 144 162 0 950 4.295 7.209 1 U 2.141e+03 0.00e+00 - 0 61 73 0 952 3.193 7.210 1 U 2.995e+03 0.00e+00 - 0 63 73 0 953 2.972 8.634 1 U 1.676e+03 0.00e+00 - 0 146 165 0 954 4.295 1.850 1 U 2.559e+03 0.00e+00 - 0 61 122 0 955 3.969 2.199 1 U 1.726e+03 0.00e+00 - 0 118 306 0 956 4.236 1.976 1 U 3.286e+03 0.00e+00 - 0 144 200 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 . . 8400 Hz . . . 4.70 . . 34634 1 2 . . H 1 H . . 8400 Hz . . . 4.70 . . 34634 1 stop_ save_