#########################
    #  Spectral peak lists  #
    #########################

save_spectral_peaks_1D_1H
   _Spectral_peak_list.Sf_category                    spectral_peak_list
   _Spectral_peak_list.Sf_framecode                   spectral_peaks_1D_1H
   _Spectral_peak_list.Entry_ID                       bmse011667
   _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                '1D 1H'
   _Spectral_peak_list.Number_of_spectral_dimensions  1
   _Spectral_peak_list.Assigned_chem_shift_list_ID    1
   _Spectral_peak_list.Details                        'F1: 1H'

   loop_
      _Spectral_dim.ID
      _Spectral_dim.Spectrometer_frequency
      _Spectral_dim.Atom_type
      _Spectral_dim.Atom_isotope_number
      _Spectral_dim.Spectral_region
      _Spectral_dim.Sweep_width
      _Spectral_dim.Sweep_width_units
      _Spectral_dim.Entry_ID
      _Spectral_dim.Spectral_peak_list_ID

     1   600.1728185   H   1   'Full H'   12.0157698570257   ppm   bmse011667   1    

   stop_

   loop_
      _Spectral_peak_software.Software_ID
      _Spectral_peak_software.Software_label
      _Spectral_peak_software.Entry_ID
      _Spectral_peak_software.Spectral_peak_list_ID

     1   $software_topspin   bmse011667   1    

   stop_

   loop_
      _Peak.ID
      _Peak.Entry_ID
      _Peak.Spectral_peak_list_ID

     1    bmse011667   1    
     2    bmse011667   1    
     3    bmse011667   1    
     4    bmse011667   1    
     5    bmse011667   1    
     6    bmse011667   1    
     7    bmse011667   1    
     8    bmse011667   1    
     9    bmse011667   1    
     10   bmse011667   1    
     11   bmse011667   1    
     12   bmse011667   1    
     13   bmse011667   1    

   stop_

   loop_
      _Peak_char.Peak_ID
      _Peak_char.Spectral_dim_ID
      _Peak_char.Chem_shift_val
      _Peak_char.Details
      _Peak_char.Entry_ID
      _Peak_char.Spectral_peak_list_ID

     1    1   3.0669   m_6H      bmse011667   1    
     2    1   6.7233   d_2H      bmse011667   1    
     3    1   7.1025   m_1H      bmse011667   1    
     4    1   3.7095   m_2H      bmse011667   1    
     5    1   2.6026   DMSO      bmse011667   1    
     6    1   7.7022   m_1H      bmse011667   1    
     7    1   8.1722   m_1H      bmse011667   1    
     8    1   3.8248   t_1H      bmse011667   1    
     9    1   7.2765   m_3H      bmse011667   1    
     10   1   7.1529   d_1H      bmse011667   1    
     11   1   2.7953   m_3H      bmse011667   1    
     12   1   7.3835   m_3H_Q1   bmse011667   1    
     13   1   2.8888   m_2H      bmse011667   1    

   stop_

   loop_
      _Peak_coupling.ID
      _Peak_coupling.Peak_ID
      _Peak_coupling.Spectral_dim_ID
      _Peak_coupling.Coupling_val
      _Peak_coupling.Entry_ID
      _Peak_coupling.Spectral_peak_list_ID

     1    1    1   0.0000   bmse011667   1    
     2    2    1   7.3726   bmse011667   1    
     3    3    1   7.8128   bmse011667   1    
     4    4    1   6.1072   bmse011667   1    
     5    5    1   1.9532   bmse011667   1    
     6    6    1   3.4112   bmse011667   1    
     7    7    1   5.0618   bmse011667   1    
     8    8    1   6.5473   bmse011667   1    
     9    9    1   4.0915   bmse011667   1    
     10   10   1   6.9325   bmse011667   1    
     11   11   1   6.4923   bmse011667   1    
     12   12   1   3.5370   bmse011667   1    
     13   13   1   6.1072   bmse011667   1    

   stop_

   loop_
      _Spectral_transition.ID
      _Spectral_transition.Entry_ID
      _Spectral_transition.Spectral_peak_list_ID

     1    bmse011667   1    
     2    bmse011667   1    
     3    bmse011667   1    
     4    bmse011667   1    
     5    bmse011667   1    
     6    bmse011667   1    
     7    bmse011667   1    
     8    bmse011667   1    
     9    bmse011667   1    
     10   bmse011667   1    
     11   bmse011667   1    
     12   bmse011667   1    
     13   bmse011667   1    
     14   bmse011667   1    
     15   bmse011667   1    
     16   bmse011667   1    
     17   bmse011667   1    
     18   bmse011667   1    
     19   bmse011667   1    
     20   bmse011667   1    
     21   bmse011667   1    
     22   bmse011667   1    
     23   bmse011667   1    
     24   bmse011667   1    
     25   bmse011667   1    
     26   bmse011667   1    
     27   bmse011667   1    
     28   bmse011667   1    
     29   bmse011667   1    
     30   bmse011667   1    
     31   bmse011667   1    
     32   bmse011667   1    
     33   bmse011667   1    
     34   bmse011667   1    
     35   bmse011667   1    
     36   bmse011667   1    
     37   bmse011667   1    
     38   bmse011667   1    
     39   bmse011667   1    
     40   bmse011667   1    
     41   bmse011667   1    
     42   bmse011667   1    
     43   bmse011667   1    
     44   bmse011667   1    
     45   bmse011667   1    
     46   bmse011667   1    
     47   bmse011667   1    
     48   bmse011667   1    
     49   bmse011667   1    
     50   bmse011667   1    
     51   bmse011667   1    
     52   bmse011667   1    
     53   bmse011667   1    
     54   bmse011667   1    
     55   bmse011667   1    
     56   bmse011667   1    
     57   bmse011667   1    
     58   bmse011667   1    

   stop_

   loop_
      _Spectral_transition_char.Spectral_transition_ID
      _Spectral_transition_char.Spectral_dim_ID
      _Spectral_transition_char.Chem_shift_val
      _Spectral_transition_char.Entry_ID
      _Spectral_transition_char.Spectral_peak_list_ID

     1    1   3.0669   bmse011667   1    
     2    1   6.7172   bmse011667   1    
     3    1   6.7295   bmse011667   1    
     4    1   7.0960   bmse011667   1    
     5    1   7.1090   bmse011667   1    
     6    1   3.7197   bmse011667   1    
     7    1   3.7096   bmse011667   1    
     8    1   3.6993   bmse011667   1    
     9    1   2.5961   bmse011667   1    
     10   1   2.5996   bmse011667   1    
     11   1   2.6027   bmse011667   1    
     12   1   2.6056   bmse011667   1    
     13   1   2.6091   bmse011667   1    
     14   1   7.7164   bmse011667   1    
     15   1   7.7137   bmse011667   1    
     16   1   7.7036   bmse011667   1    
     17   1   7.7009   bmse011667   1    
     18   1   7.6908   bmse011667   1    
     19   1   7.6880   bmse011667   1    
     20   1   8.1765   bmse011667   1    
     21   1   8.1680   bmse011667   1    
     22   1   3.8139   bmse011667   1    
     23   1   3.8249   bmse011667   1    
     24   1   3.8357   bmse011667   1    
     25   1   7.3140   bmse011667   1    
     26   1   7.3043   bmse011667   1    
     27   1   7.3017   bmse011667   1    
     28   1   7.2907   bmse011667   1    
     29   1   7.2804   bmse011667   1    
     30   1   7.2775   bmse011667   1    
     31   1   7.2693   bmse011667   1    
     32   1   7.2649   bmse011667   1    
     33   1   7.2617   bmse011667   1    
     34   1   7.2518   bmse011667   1    
     35   1   7.2419   bmse011667   1    
     36   1   7.2390   bmse011667   1    
     37   1   7.1471   bmse011667   1    
     38   1   7.1587   bmse011667   1    
     39   1   2.8007   bmse011667   1    
     40   1   2.7899   bmse011667   1    
     41   1   7.4247   bmse011667   1    
     42   1   7.4141   bmse011667   1    
     43   1   7.4115   bmse011667   1    
     44   1   7.4049   bmse011667   1    
     45   1   7.4027   bmse011667   1    
     46   1   7.4000   bmse011667   1    
     47   1   7.3886   bmse011667   1    
     48   1   7.3787   bmse011667   1    
     49   1   7.3761   bmse011667   1    
     50   1   7.3673   bmse011667   1    
     51   1   7.3668   bmse011667   1    
     52   1   7.3648   bmse011667   1    
     53   1   7.3615   bmse011667   1    
     54   1   7.3549   bmse011667   1    
     55   1   7.3422   bmse011667   1    
     56   1   2.8990   bmse011667   1    
     57   1   2.8885   bmse011667   1    
     58   1   2.8786   bmse011667   1    

   stop_

save_