######################### # Spectral peak lists # ######################### save_spectral_peaks_1D_1H_set01 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peaks_1D_1H_set01 _Spectral_peak_list.Entry_ID bmse001319 _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.Experiment_ID 1 _Spectral_peak_list.Experiment_name '1D 1H' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 1 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID 1 _Spectral_peak_list.Assigned_chem_shift_list_label $chem_shift_set01 _Spectral_peak_list.Details 'F1: 1H' _Spectral_peak_list.Text_data_format . _Spectral_peak_list.Text_data . 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 'Full H' . . 16.03 ppm . . . . . . bmse001319 1 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 $software_topspin . . bmse001319 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Peak_ID _Spectral_transition.Figure_of_merit _Spectral_transition.Details _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 . . . bmse001319 1 2 . . . bmse001319 1 3 . . . bmse001319 1 4 . . . bmse001319 1 5 . . . bmse001319 1 6 . . . bmse001319 1 7 . . . bmse001319 1 8 . . . bmse001319 1 9 . . . bmse001319 1 10 . . . bmse001319 1 11 . . . bmse001319 1 12 . . . bmse001319 1 13 . . . bmse001319 1 14 . . . bmse001319 1 15 . . . bmse001319 1 16 . . . bmse001319 1 17 . . . bmse001319 1 18 . . . bmse001319 1 19 . . . bmse001319 1 20 . . . bmse001319 1 21 . . . bmse001319 1 22 . . . bmse001319 1 23 . . . bmse001319 1 24 . . . bmse001319 1 25 . . . bmse001319 1 26 . . . bmse001319 1 27 . . . bmse001319 1 28 . . . bmse001319 1 29 . . . bmse001319 1 30 . . . bmse001319 1 31 . . . bmse001319 1 32 . . . bmse001319 1 33 . . . bmse001319 1 34 . . . bmse001319 1 35 . . . bmse001319 1 36 . . . bmse001319 1 37 . . . bmse001319 1 38 . . . bmse001319 1 39 . . . bmse001319 1 40 . . . bmse001319 1 41 . . . bmse001319 1 42 . . . bmse001319 1 43 . . . bmse001319 1 44 . . . bmse001319 1 45 . . . bmse001319 1 46 . . . bmse001319 1 47 . . . bmse001319 1 48 . . . bmse001319 1 49 . . . bmse001319 1 50 . . . bmse001319 1 51 . . . bmse001319 1 52 . . . bmse001319 1 53 . . . bmse001319 1 54 . . . bmse001319 1 55 . . . bmse001319 1 56 . . . bmse001319 1 57 . . . bmse001319 1 58 . . . bmse001319 1 59 . . . bmse001319 1 60 . . . bmse001319 1 61 . . . bmse001319 1 62 . . . bmse001319 1 63 . . . bmse001319 1 64 . . . bmse001319 1 65 . . . bmse001319 1 66 . . . bmse001319 1 67 . . . bmse001319 1 68 . . . bmse001319 1 69 . . . bmse001319 1 70 . . . bmse001319 1 71 . . . bmse001319 1 72 . . . bmse001319 1 73 . . . bmse001319 1 74 . . . bmse001319 1 75 . . . bmse001319 1 76 . . . bmse001319 1 77 . . . bmse001319 1 78 . . . bmse001319 1 79 . . . bmse001319 1 80 . . . bmse001319 1 81 . . . bmse001319 1 82 . . . bmse001319 1 83 . . . bmse001319 1 84 . . . bmse001319 1 85 . . . bmse001319 1 86 . . . bmse001319 1 87 . . . bmse001319 1 88 . . . bmse001319 1 89 . . . bmse001319 1 90 . . . bmse001319 1 91 . . . bmse001319 1 92 . . . bmse001319 1 93 . . . bmse001319 1 94 . . . bmse001319 1 95 . . . bmse001319 1 96 . . . bmse001319 1 97 . . . bmse001319 1 98 . . . bmse001319 1 99 . . . bmse001319 1 100 . . . bmse001319 1 101 . . . bmse001319 1 102 . . . bmse001319 1 103 . . . bmse001319 1 104 . . . bmse001319 1 105 . . . bmse001319 1 106 . . . bmse001319 1 107 . . . bmse001319 1 108 . . . bmse001319 1 109 . . . bmse001319 1 110 . . . bmse001319 1 111 . . . bmse001319 1 112 . . . bmse001319 1 113 . . . bmse001319 1 114 . . . bmse001319 1 115 . . . bmse001319 1 116 . . . bmse001319 1 117 . . . bmse001319 1 118 . . . bmse001319 1 119 . . . bmse001319 1 120 . . . bmse001319 1 stop_ loop_ _Spectral_transition_general_char.Spectral_transition_ID _Spectral_transition_general_char.Peak_ID _Spectral_transition_general_char.Intensity_val _Spectral_transition_general_char.Intensity_val_err _Spectral_transition_general_char.Measurement_method _Spectral_transition_general_char.Entry_ID _Spectral_transition_general_char.Spectral_peak_list_ID 1 . 14.19 . 'relative height' bmse001319 1 2 . 13.49 . 'relative height' bmse001319 1 3 . 0.49 . 'relative height' bmse001319 1 4 . 14.07 . 'relative height' bmse001319 1 5 . 13.67 . 'relative height' bmse001319 1 6 . 6.11 . 'relative height' bmse001319 1 7 . 5.89 . 'relative height' bmse001319 1 8 . 2.29 . 'relative height' bmse001319 1 9 . 6.02 . 'relative height' bmse001319 1 10 . 5.98 . 'relative height' bmse001319 1 11 . 5.89 . 'relative height' bmse001319 1 12 . 2.27 . 'relative height' bmse001319 1 13 . 8.78 . 'relative height' bmse001319 1 14 . 5.99 . 'relative height' bmse001319 1 15 . 7.86 . 'relative height' bmse001319 1 16 . 4.63 . 'relative height' bmse001319 1 17 . 7.74 . 'relative height' bmse001319 1 18 . 4.86 . 'relative height' bmse001319 1 19 . 1.37 . 'relative height' bmse001319 1 20 . 1.63 . 'relative height' bmse001319 1 21 . 2.85 . 'relative height' bmse001319 1 22 . 3.04 . 'relative height' bmse001319 1 23 . 3.00 . 'relative height' bmse001319 1 24 . 2.37 . 'relative height' bmse001319 1 25 . 2.99 . 'relative height' bmse001319 1 26 . 1.35 . 'relative height' bmse001319 1 27 . 3.04 . 'relative height' bmse001319 1 28 . 4.52 . 'relative height' bmse001319 1 29 . 2.93 . 'relative height' bmse001319 1 30 . 4.23 . 'relative height' bmse001319 1 31 . 2.79 . 'relative height' bmse001319 1 32 . 1.14 . 'relative height' bmse001319 1 33 . 1.03 . 'relative height' bmse001319 1 34 . 0.46 . 'relative height' bmse001319 1 35 . 0.46 . 'relative height' bmse001319 1 36 . 0.81 . 'relative height' bmse001319 1 37 . 0.82 . 'relative height' bmse001319 1 38 . 1.03 . 'relative height' bmse001319 1 39 . 1.99 . 'relative height' bmse001319 1 40 . 2.00 . 'relative height' bmse001319 1 41 . 1.17 . 'relative height' bmse001319 1 42 . 2.96 . 'relative height' bmse001319 1 43 . 3.48 . 'relative height' bmse001319 1 44 . 2.71 . 'relative height' bmse001319 1 45 . 2.12 . 'relative height' bmse001319 1 46 . 3.16 . 'relative height' bmse001319 1 47 . 3.66 . 'relative height' bmse001319 1 48 . 3.35 . 'relative height' bmse001319 1 49 . 2.88 . 'relative height' bmse001319 1 50 . 4.26 . 'relative height' bmse001319 1 51 . 1.95 . 'relative height' bmse001319 1 52 . 4.78 . 'relative height' bmse001319 1 53 . 2.00 . 'relative height' bmse001319 1 54 . 2.91 . 'relative height' bmse001319 1 55 . 3.04 . 'relative height' bmse001319 1 56 . 3.67 . 'relative height' bmse001319 1 57 . 2.83 . 'relative height' bmse001319 1 58 . 1.51 . 'relative height' bmse001319 1 59 . 2.16 . 'relative height' bmse001319 1 60 . 2.16 . 'relative height' bmse001319 1 61 . 1.81 . 'relative height' bmse001319 1 62 . 2.66 . 'relative height' bmse001319 1 63 . 2.14 . 'relative height' bmse001319 1 64 . 2.18 . 'relative height' bmse001319 1 65 . 2.30 . 'relative height' bmse001319 1 66 . 2.24 . 'relative height' bmse001319 1 67 . 1.65 . 'relative height' bmse001319 1 68 . 2.97 . 'relative height' bmse001319 1 69 . 1.89 . 'relative height' bmse001319 1 70 . 2.48 . 'relative height' bmse001319 1 71 . 1.65 . 'relative height' bmse001319 1 72 . 1.65 . 'relative height' bmse001319 1 73 . 2.54 . 'relative height' bmse001319 1 74 . 2.27 . 'relative height' bmse001319 1 75 . 2.09 . 'relative height' bmse001319 1 76 . 1.65 . 'relative height' bmse001319 1 77 . 1.99 . 'relative height' bmse001319 1 78 . 1.58 . 'relative height' bmse001319 1 79 . 1.01 . 'relative height' bmse001319 1 80 . 1.83 . 'relative height' bmse001319 1 81 . 1.24 . 'relative height' bmse001319 1 82 . 2.21 . 'relative height' bmse001319 1 83 . 1.37 . 'relative height' bmse001319 1 84 . 1.80 . 'relative height' bmse001319 1 85 . 3.79 . 'relative height' bmse001319 1 86 . 2.47 . 'relative height' bmse001319 1 87 . 1.16 . 'relative height' bmse001319 1 88 . 2.34 . 'relative height' bmse001319 1 89 . 3.53 . 'relative height' bmse001319 1 90 . 2.19 . 'relative height' bmse001319 1 91 . 2.23 . 'relative height' bmse001319 1 92 . 2.45 . 'relative height' bmse001319 1 93 . 2.46 . 'relative height' bmse001319 1 94 . 2.25 . 'relative height' bmse001319 1 95 . 2.45 . 'relative height' bmse001319 1 96 . 3.25 . 'relative height' bmse001319 1 97 . 2.29 . 'relative height' bmse001319 1 98 . 2.95 . 'relative height' bmse001319 1 99 . 1.18 . 'relative height' bmse001319 1 100 . 1.11 . 'relative height' bmse001319 1 101 . 1.14 . 'relative height' bmse001319 1 102 . 1.01 . 'relative height' bmse001319 1 103 . 0.82 . 'relative height' bmse001319 1 104 . 7.52 . 'relative height' bmse001319 1 105 . 1.50 . 'relative height' bmse001319 1 106 . 1.62 . 'relative height' bmse001319 1 107 . 1.94 . 'relative height' bmse001319 1 108 . 1.92 . 'relative height' bmse001319 1 109 . 1.80 . 'relative height' bmse001319 1 110 . 1.84 . 'relative height' bmse001319 1 111 . 1.99 . 'relative height' bmse001319 1 112 . 1.76 . 'relative height' bmse001319 1 113 . 1.77 . 'relative height' bmse001319 1 114 . 1.94 . 'relative height' bmse001319 1 115 . 1.78 . 'relative height' bmse001319 1 116 . 1.71 . 'relative height' bmse001319 1 117 . 1.67 . 'relative height' bmse001319 1 118 . 1.63 . 'relative height' bmse001319 1 119 . 1.38 . 'relative height' bmse001319 1 120 . 1.21 . 'relative height' bmse001319 1 stop_ loop_ _Spectral_transition_char.Spectral_transition_ID _Spectral_transition_char.Peak_ID _Spectral_transition_char.Spectral_dim_ID _Spectral_transition_char.Chem_shift_val _Spectral_transition_char.Chem_shift_val_err _Spectral_transition_char.Line_width_val _Spectral_transition_char.Line_width_val_err _Spectral_transition_char.Phase_val _Spectral_transition_char.Phase_val_err _Spectral_transition_char.Decay_rate_val _Spectral_transition_char.Decay_rate_val_err _Spectral_transition_char.Bounding_box_upper_val _Spectral_transition_char.Bounding_box_lower_val _Spectral_transition_char.Bounding_box_width_val _Spectral_transition_char.Derivation_method_ID _Spectral_transition_char.Entry_ID _Spectral_transition_char.Spectral_peak_list_ID 1 . 1 6.2283 . . . . . . . . . . . bmse001319 1 2 . 1 6.2213 . . . . . . . . . . . bmse001319 1 3 . 1 5.5117 . . . . . . . . . . . bmse001319 1 4 . 1 5.4987 . . . . . . . . . . . bmse001319 1 5 . 1 5.4924 . . . . . . . . . . . bmse001319 1 6 . 1 5.2766 . . . . . . . . . . . bmse001319 1 7 . 1 5.2724 . . . . . . . . . . . bmse001319 1 8 . 1 5.2682 . . . . . . . . . . . bmse001319 1 9 . 1 5.0746 . . . . . . . . . . . bmse001319 1 10 . 1 5.0735 . . . . . . . . . . . bmse001319 1 11 . 1 5.0704 . . . . . . . . . . . bmse001319 1 12 . 1 5.0664 . . . . . . . . . . . bmse001319 1 13 . 1 4.9006 . . . . . . . . . . . bmse001319 1 14 . 1 4.8187 . . . . . . . . . . . bmse001319 1 15 . 1 4.8167 . . . . . . . . . . . bmse001319 1 16 . 1 3.9868 . . . . . . . . . . . bmse001319 1 17 . 1 3.9683 . . . . . . . . . . . bmse001319 1 18 . 1 3.9498 . . . . . . . . . . . bmse001319 1 19 . 1 2.9449 . . . . . . . . . . . bmse001319 1 20 . 1 2.9350 . . . . . . . . . . . bmse001319 1 21 . 1 2.9284 . . . . . . . . . . . bmse001319 1 22 . 1 2.9186 . . . . . . . . . . . bmse001319 1 23 . 1 2.9132 . . . . . . . . . . . bmse001319 1 24 . 1 2.9068 . . . . . . . . . . . bmse001319 1 25 . 1 2.9027 . . . . . . . . . . . bmse001319 1 26 . 1 2.8957 . . . . . . . . . . . bmse001319 1 27 . 1 2.8889 . . . . . . . . . . . bmse001319 1 28 . 1 2.8833 . . . . . . . . . . . bmse001319 1 29 . 1 2.8772 . . . . . . . . . . . bmse001319 1 30 . 1 2.8660 . . . . . . . . . . . bmse001319 1 31 . 1 2.8595 . . . . . . . . . . . bmse001319 1 32 . 1 2.8520 . . . . . . . . . . . bmse001319 1 33 . 1 2.8486 . . . . . . . . . . . bmse001319 1 34 . 1 2.5952 . . . . . . . . . . . bmse001319 1 35 . 1 2.5914 . . . . . . . . . . . bmse001319 1 36 . 1 2.5785 . . . . . . . . . . . bmse001319 1 37 . 1 2.5750 . . . . . . . . . . . bmse001319 1 38 . 1 2.5653 . . . . . . . . . . . bmse001319 1 39 . 1 2.5616 . . . . . . . . . . . bmse001319 1 40 . 1 2.5578 . . . . . . . . . . . bmse001319 1 41 . 1 2.5537 . . . . . . . . . . . bmse001319 1 42 . 1 2.5445 . . . . . . . . . . . bmse001319 1 43 . 1 2.5410 . . . . . . . . . . . bmse001319 1 44 . 1 2.5363 . . . . . . . . . . . bmse001319 1 45 . 1 2.5316 . . . . . . . . . . . bmse001319 1 46 . 1 2.5288 . . . . . . . . . . . bmse001319 1 47 . 1 2.5242 . . . . . . . . . . . bmse001319 1 48 . 1 2.5225 . . . . . . . . . . . bmse001319 1 49 . 1 2.5200 . . . . . . . . . . . bmse001319 1 50 . 1 2.5170 . . . . . . . . . . . bmse001319 1 51 . 1 2.5126 . . . . . . . . . . . bmse001319 1 52 . 1 2.5059 . . . . . . . . . . . bmse001319 1 53 . 1 2.5008 . . . . . . . . . . . bmse001319 1 54 . 1 2.4965 . . . . . . . . . . . bmse001319 1 55 . 1 2.4905 . . . . . . . . . . . bmse001319 1 56 . 1 2.4813 . . . . . . . . . . . bmse001319 1 57 . 1 2.4705 . . . . . . . . . . . bmse001319 1 58 . 1 2.2727 . . . . . . . . . . . bmse001319 1 59 . 1 2.2644 . . . . . . . . . . . bmse001319 1 60 . 1 2.2611 . . . . . . . . . . . bmse001319 1 61 . 1 2.2561 . . . . . . . . . . . bmse001319 1 62 . 1 2.2532 . . . . . . . . . . . bmse001319 1 63 . 1 2.2461 . . . . . . . . . . . bmse001319 1 64 . 1 2.2447 . . . . . . . . . . . bmse001319 1 65 . 1 2.2384 . . . . . . . . . . . bmse001319 1 66 . 1 2.2348 . . . . . . . . . . . bmse001319 1 67 . 1 2.2302 . . . . . . . . . . . bmse001319 1 68 . 1 2.2267 . . . . . . . . . . . bmse001319 1 69 . 1 2.2186 . . . . . . . . . . . bmse001319 1 70 . 1 2.1902 . . . . . . . . . . . bmse001319 1 71 . 1 2.1785 . . . . . . . . . . . bmse001319 1 72 . 1 2.1777 . . . . . . . . . . . bmse001319 1 73 . 1 2.1697 . . . . . . . . . . . bmse001319 1 74 . 1 2.1645 . . . . . . . . . . . bmse001319 1 75 . 1 2.1583 . . . . . . . . . . . bmse001319 1 76 . 1 2.1529 . . . . . . . . . . . bmse001319 1 77 . 1 2.1439 . . . . . . . . . . . bmse001319 1 78 . 1 2.1322 . . . . . . . . . . . bmse001319 1 79 . 1 1.9850 . . . . . . . . . . . bmse001319 1 80 . 1 1.9697 . . . . . . . . . . . bmse001319 1 81 . 1 1.9664 . . . . . . . . . . . bmse001319 1 82 . 1 1.9584 . . . . . . . . . . . bmse001319 1 83 . 1 1.9544 . . . . . . . . . . . bmse001319 1 84 . 1 1.9511 . . . . . . . . . . . bmse001319 1 85 . 1 1.9431 . . . . . . . . . . . bmse001319 1 86 . 1 1.9398 . . . . . . . . . . . bmse001319 1 87 . 1 1.9359 . . . . . . . . . . . bmse001319 1 88 . 1 1.9277 . . . . . . . . . . . bmse001319 1 89 . 1 1.9245 . . . . . . . . . . . bmse001319 1 90 . 1 1.9090 . . . . . . . . . . . bmse001319 1 91 . 1 1.9065 . . . . . . . . . . . bmse001319 1 92 . 1 1.8967 . . . . . . . . . . . bmse001319 1 93 . 1 1.8945 . . . . . . . . . . . bmse001319 1 94 . 1 1.8889 . . . . . . . . . . . bmse001319 1 95 . 1 1.8849 . . . . . . . . . . . bmse001319 1 96 . 1 1.8795 . . . . . . . . . . . bmse001319 1 97 . 1 1.8772 . . . . . . . . . . . bmse001319 1 98 . 1 1.8676 . . . . . . . . . . . bmse001319 1 99 . 1 1.8625 . . . . . . . . . . . bmse001319 1 100 . 1 1.8581 . . . . . . . . . . . bmse001319 1 101 . 1 1.8527 . . . . . . . . . . . bmse001319 1 102 . 1 1.8506 . . . . . . . . . . . bmse001319 1 103 . 1 1.8408 . . . . . . . . . . . bmse001319 1 104 . 1 1.5787 . . . . . . . . . . . bmse001319 1 105 . 1 1.4637 . . . . . . . . . . . bmse001319 1 106 . 1 1.4521 . . . . . . . . . . . bmse001319 1 107 . 1 1.4429 . . . . . . . . . . . bmse001319 1 108 . 1 1.4407 . . . . . . . . . . . bmse001319 1 109 . 1 1.4374 . . . . . . . . . . . bmse001319 1 110 . 1 1.4317 . . . . . . . . . . . bmse001319 1 111 . 1 1.4290 . . . . . . . . . . . bmse001319 1 112 . 1 1.4262 . . . . . . . . . . . bmse001319 1 113 . 1 1.4200 . . . . . . . . . . . bmse001319 1 114 . 1 1.4167 . . . . . . . . . . . bmse001319 1 115 . 1 1.4145 . . . . . . . . . . . bmse001319 1 116 . 1 1.4087 . . . . . . . . . . . bmse001319 1 117 . 1 1.4057 . . . . . . . . . . . bmse001319 1 118 . 1 1.4032 . . . . . . . . . . . bmse001319 1 119 . 1 1.3938 . . . . . . . . . . . bmse001319 1 120 . 1 1.3829 . . . . . . . . . . . bmse001319 1 stop_ save_ ######################### # Spectral peak lists # ######################### save_spectral_peaks_1D_13C_set01 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peaks_1D_13C_set01 _Spectral_peak_list.Entry_ID bmse001319 _Spectral_peak_list.ID 2 _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.Experiment_ID 3 _Spectral_peak_list.Experiment_name '1D 13C' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 1 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID 1 _Spectral_peak_list.Assigned_chem_shift_list_label $chem_shift_set01 _Spectral_peak_list.Details 'F1: 13C' _Spectral_peak_list.Text_data_format . _Spectral_peak_list.Text_data . 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 . . C 13 'Full C' . . 248.61 ppm . . . . . . bmse001319 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 3 $software_topspin . . bmse001319 2 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Peak_ID _Spectral_transition.Figure_of_merit _Spectral_transition.Details _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 . . . bmse001319 2 2 . . . bmse001319 2 3 . . . bmse001319 2 4 . . . bmse001319 2 5 . . . bmse001319 2 6 . . . bmse001319 2 7 . . . bmse001319 2 8 . . . bmse001319 2 9 . . . bmse001319 2 10 . . . bmse001319 2 11 . . . bmse001319 2 12 . . . bmse001319 2 13 . . . bmse001319 2 14 . . . bmse001319 2 15 . . . bmse001319 2 stop_ loop_ _Spectral_transition_general_char.Spectral_transition_ID _Spectral_transition_general_char.Peak_ID _Spectral_transition_general_char.Intensity_val _Spectral_transition_general_char.Intensity_val_err _Spectral_transition_general_char.Measurement_method _Spectral_transition_general_char.Entry_ID _Spectral_transition_general_char.Spectral_peak_list_ID 1 . 0.36 . 'relative height' bmse001319 2 2 . 0.61 . 'relative height' bmse001319 2 3 . 0.61 . 'relative height' bmse001319 2 4 . 0.67 . 'relative height' bmse001319 2 5 . 1.21 . 'relative height' bmse001319 2 6 . 1.20 . 'relative height' bmse001319 2 7 . 1.36 . 'relative height' bmse001319 2 8 . 1.21 . 'relative height' bmse001319 2 9 . 1.46 . 'relative height' bmse001319 2 10 . 1.45 . 'relative height' bmse001319 2 11 . 1.21 . 'relative height' bmse001319 2 12 . 1.11 . 'relative height' bmse001319 2 13 . 1.41 . 'relative height' bmse001319 2 14 . 1.40 . 'relative height' bmse001319 2 15 . 1.30 . 'relative height' bmse001319 2 stop_ loop_ _Spectral_transition_char.Spectral_transition_ID _Spectral_transition_char.Peak_ID _Spectral_transition_char.Spectral_dim_ID _Spectral_transition_char.Chem_shift_val _Spectral_transition_char.Chem_shift_val_err _Spectral_transition_char.Line_width_val _Spectral_transition_char.Line_width_val_err _Spectral_transition_char.Phase_val _Spectral_transition_char.Phase_val_err _Spectral_transition_char.Decay_rate_val _Spectral_transition_char.Decay_rate_val_err _Spectral_transition_char.Bounding_box_upper_val _Spectral_transition_char.Bounding_box_lower_val _Spectral_transition_char.Bounding_box_width_val _Spectral_transition_char.Derivation_method_ID _Spectral_transition_char.Entry_ID _Spectral_transition_char.Spectral_peak_list_ID 1 . 1 170.3057 . . . . . . . . . . . bmse001319 2 2 . 1 151.2507 . . . . . . . . . . . bmse001319 2 3 . 1 149.2269 . . . . . . . . . . . bmse001319 2 4 . 1 139.7134 . . . . . . . . . . . bmse001319 2 5 . 1 120.2359 . . . . . . . . . . . bmse001319 2 6 . 1 112.6201 . . . . . . . . . . . bmse001319 2 7 . 1 109.6133 . . . . . . . . . . . bmse001319 2 8 . 1 85.2699 . . . . . . . . . . . bmse001319 2 9 . 1 52.0140 . . . . . . . . . . . bmse001319 2 10 . 1 47.5825 . . . . . . . . . . . bmse001319 2 11 . 1 45.0988 . . . . . . . . . . . bmse001319 2 12 . 1 36.2879 . . . . . . . . . . . bmse001319 2 13 . 1 32.5887 . . . . . . . . . . . bmse001319 2 14 . 1 30.9275 . . . . . . . . . . . bmse001319 2 15 . 1 30.2990 . . . . . . . . . . . bmse001319 2 stop_ loop_ _Assigned_spectral_transition.Spectral_transition_ID _Assigned_spectral_transition.Spectral_dim_ID _Assigned_spectral_transition.Contribution_fractional_val _Assigned_spectral_transition.Peak_ID _Assigned_spectral_transition.Set_ID _Assigned_spectral_transition.Magnetization_linkage_ID _Assigned_spectral_transition.Assembly_atom_ID _Assigned_spectral_transition.Val _Assigned_spectral_transition.Assigned_chem_shift_list_ID _Assigned_spectral_transition.Atom_chem_shift_ID _Assigned_spectral_transition.Entity_assembly_ID _Assigned_spectral_transition.Entity_ID _Assigned_spectral_transition.Comp_index_ID _Assigned_spectral_transition.Comp_ID _Assigned_spectral_transition.Atom_ID _Assigned_spectral_transition.Figure_of_merit _Assigned_spectral_transition.Resonance_ID _Assigned_spectral_transition.Details _Assigned_spectral_transition.Entry_ID _Assigned_spectral_transition.Spectral_peak_list_ID 1 1 . . . . 15 170.3057 1 . 1 1 1 BMET001319 C15 . . . bmse001319 2 2 1 . . . . 9 151.2507 1 . 1 1 1 BMET001319 C9 . . . bmse001319 2 3 1 . . . . 8 149.2269 1 . 1 1 1 BMET001319 C8 . . . bmse001319 2 4 1 . . . . 10 139.7134 1 . 1 1 1 BMET001319 C10 . . . bmse001319 2 5 1 . . . . 3 120.2359 1 . 1 1 1 BMET001319 C3 . . . bmse001319 2 6 1 . . . . 1 112.6201 1 . 1 1 1 BMET001319 C1 . . . bmse001319 2 7 1 . . . . 2 109.6133 1 . 1 1 1 BMET001319 C2 . . . bmse001319 2 8 1 . . . . 14 85.2699 1 . 1 1 1 BMET001319 C14 . . . bmse001319 2 9 1 . . . . 13 52.0140 1 . 1 1 1 BMET001319 C13 . . . bmse001319 2 10 1 . . . . 11 47.5825 1 . 1 1 1 BMET001319 C11 . . . bmse001319 2 11 1 . . . . 12 45.0988 1 . 1 1 1 BMET001319 C12 . . . bmse001319 2 12 1 . . . . 4 36.2879 1 . 1 1 1 BMET001319 C4 . . . bmse001319 2 13 1 . . . . 5 32.5887 1 . 1 1 1 BMET001319 C5 . . . bmse001319 2 14 1 . . . . 7 30.9275 1 . 1 1 1 BMET001319 C7 . . . bmse001319 2 15 1 . . . . 6 30.2990 1 . 1 1 1 BMET001319 C6 . . . bmse001319 2 stop_ save_ ######################### # Spectral peak lists # ######################### save_spectral_peaks_1D_DEPT90_set01 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peaks_1D_DEPT90_set01 _Spectral_peak_list.Entry_ID bmse001319 _Spectral_peak_list.ID 3 _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.Experiment_ID 4 _Spectral_peak_list.Experiment_name '1D DEPT90' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 1 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID 1 _Spectral_peak_list.Assigned_chem_shift_list_label $chem_shift_set01 _Spectral_peak_list.Details 'F1: 13C' _Spectral_peak_list.Text_data_format . _Spectral_peak_list.Text_data . 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 . . C 13 'Full C' . . 236.77 ppm . . . . . . bmse001319 3 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 $software_topspin . . bmse001319 3 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Peak_ID _Spectral_transition.Figure_of_merit _Spectral_transition.Details _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 . . . bmse001319 3 2 . . . bmse001319 3 3 . . . bmse001319 3 4 . . . bmse001319 3 stop_ loop_ _Spectral_transition_general_char.Spectral_transition_ID _Spectral_transition_general_char.Peak_ID _Spectral_transition_general_char.Intensity_val _Spectral_transition_general_char.Intensity_val_err _Spectral_transition_general_char.Measurement_method _Spectral_transition_general_char.Entry_ID _Spectral_transition_general_char.Spectral_peak_list_ID 1 . 12.36 . 'relative height' bmse001319 3 2 . 13.67 . 'relative height' bmse001319 3 3 . 15.00 . 'relative height' bmse001319 3 4 . 14.20 . 'relative height' bmse001319 3 stop_ loop_ _Spectral_transition_char.Spectral_transition_ID _Spectral_transition_char.Peak_ID _Spectral_transition_char.Spectral_dim_ID _Spectral_transition_char.Chem_shift_val _Spectral_transition_char.Chem_shift_val_err _Spectral_transition_char.Line_width_val _Spectral_transition_char.Line_width_val_err _Spectral_transition_char.Phase_val _Spectral_transition_char.Phase_val_err _Spectral_transition_char.Decay_rate_val _Spectral_transition_char.Decay_rate_val_err _Spectral_transition_char.Bounding_box_upper_val _Spectral_transition_char.Bounding_box_lower_val _Spectral_transition_char.Bounding_box_width_val _Spectral_transition_char.Derivation_method_ID _Spectral_transition_char.Entry_ID _Spectral_transition_char.Spectral_peak_list_ID 1 . 1 85.2666 . . . . . . . . . . . bmse001319 3 2 . 1 52.0125 . . . . . . . . . . . bmse001319 3 3 . 1 47.5784 . . . . . . . . . . . bmse001319 3 4 . 1 45.0968 . . . . . . . . . . . bmse001319 3 stop_ save_ ######################### # Spectral peak lists # ######################### save_spectral_peaks_1D_DEPT135_set01 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peaks_1D_DEPT135_set01 _Spectral_peak_list.Entry_ID bmse001319 _Spectral_peak_list.ID 4 _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.Experiment_ID 5 _Spectral_peak_list.Experiment_name '1D DEPT135' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 1 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID 1 _Spectral_peak_list.Assigned_chem_shift_list_label $chem_shift_set01 _Spectral_peak_list.Details 'F1: 13C' _Spectral_peak_list.Text_data_format . _Spectral_peak_list.Text_data . 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 . . C 13 'Full C' . . 236.77 ppm . . . . . . bmse001319 4 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 $software_topspin . . bmse001319 4 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Peak_ID _Spectral_transition.Figure_of_merit _Spectral_transition.Details _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 . . . bmse001319 4 2 . . . bmse001319 4 3 . . . bmse001319 4 4 . . . bmse001319 4 5 . . . bmse001319 4 6 . . . bmse001319 4 7 . . . bmse001319 4 8 . . . bmse001319 4 9 . . . bmse001319 4 10 . . . bmse001319 4 11 . . . bmse001319 4 stop_ loop_ _Spectral_transition_general_char.Spectral_transition_ID _Spectral_transition_general_char.Peak_ID _Spectral_transition_general_char.Intensity_val _Spectral_transition_general_char.Intensity_val_err _Spectral_transition_general_char.Measurement_method _Spectral_transition_general_char.Entry_ID _Spectral_transition_general_char.Spectral_peak_list_ID 1 . -9.42 . 'relative height' bmse001319 4 2 . -8.23 . 'relative height' bmse001319 4 3 . -12.53 . 'relative height' bmse001319 4 4 . 4.14 . 'relative height' bmse001319 4 5 . 6.03 . 'relative height' bmse001319 4 6 . 5.58 . 'relative height' bmse001319 4 7 . 6.66 . 'relative height' bmse001319 4 8 . -6.78 . 'relative height' bmse001319 4 9 . -6.62 . 'relative height' bmse001319 4 10 . -11.82 . 'relative height' bmse001319 4 11 . -15.00 . 'relative height' bmse001319 4 stop_ loop_ _Spectral_transition_char.Spectral_transition_ID _Spectral_transition_char.Peak_ID _Spectral_transition_char.Spectral_dim_ID _Spectral_transition_char.Chem_shift_val _Spectral_transition_char.Chem_shift_val_err _Spectral_transition_char.Line_width_val _Spectral_transition_char.Line_width_val_err _Spectral_transition_char.Phase_val _Spectral_transition_char.Phase_val_err _Spectral_transition_char.Decay_rate_val _Spectral_transition_char.Decay_rate_val_err _Spectral_transition_char.Bounding_box_upper_val _Spectral_transition_char.Bounding_box_lower_val _Spectral_transition_char.Bounding_box_width_val _Spectral_transition_char.Derivation_method_ID _Spectral_transition_char.Entry_ID _Spectral_transition_char.Spectral_peak_list_ID 1 . 1 120.2334 . . . . . . . . . . . bmse001319 4 2 . 1 112.6173 . . . . . . . . . . . bmse001319 4 3 . 1 109.6103 . . . . . . . . . . . bmse001319 4 4 . 1 85.2675 . . . . . . . . . . . bmse001319 4 5 . 1 52.0152 . . . . . . . . . . . bmse001319 4 6 . 1 47.5781 . . . . . . . . . . . bmse001319 4 7 . 1 45.0995 . . . . . . . . . . . bmse001319 4 8 . 1 36.2883 . . . . . . . . . . . bmse001319 4 9 . 1 32.5890 . . . . . . . . . . . bmse001319 4 10 . 1 30.9281 . . . . . . . . . . . bmse001319 4 11 . 1 30.2995 . . . . . . . . . . . bmse001319 4 stop_ save_ ######################### # Spectral peak lists # ######################### save_spectral_peaks_2D_1H-13C_HSQC_set01 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peaks_2D_1H-13C_HSQC_set01 _Spectral_peak_list.Entry_ID bmse001319 _Spectral_peak_list.ID 5 _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.Experiment_ID 6 _Spectral_peak_list.Experiment_name '2D 1H-13C HSQC' _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 $chem_shift_set01 _Spectral_peak_list.Details 'F1: 13C, F2: 1H' _Spectral_peak_list.Text_data_format . _Spectral_peak_list.Text_data . 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 . . C 13 'Full C' . . 165.00 ppm . . . . . . bmse001319 5 2 . . H 1 'Full H' . . 12.99 ppm . . . . . . bmse001319 5 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 $software_topspin . . bmse001319 5 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Peak_ID _Spectral_transition.Figure_of_merit _Spectral_transition.Details _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 . . . bmse001319 5 2 . . . bmse001319 5 3 . . . bmse001319 5 4 . . . bmse001319 5 5 . . . bmse001319 5 6 . . . bmse001319 5 7 . . . bmse001319 5 8 . . . bmse001319 5 9 . . . bmse001319 5 10 . . . bmse001319 5 11 . . . bmse001319 5 12 . . . bmse001319 5 13 . . . bmse001319 5 14 . . . bmse001319 5 15 . . . bmse001319 5 16 . . . bmse001319 5 17 . . . bmse001319 5 stop_ loop_ _Spectral_transition_general_char.Spectral_transition_ID _Spectral_transition_general_char.Peak_ID _Spectral_transition_general_char.Intensity_val _Spectral_transition_general_char.Intensity_val_err _Spectral_transition_general_char.Measurement_method _Spectral_transition_general_char.Entry_ID _Spectral_transition_general_char.Spectral_peak_list_ID 1 . 290318.56 . 'relative height' bmse001319 5 2 . 229083.74 . 'relative height' bmse001319 5 3 . 298698.52 . 'relative height' bmse001319 5 4 . 288035.46 . 'relative height' bmse001319 5 5 . 296882.90 . 'relative height' bmse001319 5 6 . 303976.24 . 'relative height' bmse001319 5 7 . 149916.94 . 'relative height' bmse001319 5 8 . 140944.41 . 'relative height' bmse001319 5 9 . 163741.68 . 'relative height' bmse001319 5 10 . 146639.26 . 'relative height' bmse001319 5 11 . 127987.74 . 'relative height' bmse001319 5 12 . 131333.45 . 'relative height' bmse001319 5 13 . 173738.08 . 'relative height' bmse001319 5 14 . 89501.13 . 'relative height' bmse001319 5 15 . 92153.11 . 'relative height' bmse001319 5 16 . 116307.08 . 'relative height' bmse001319 5 17 . 110956.89 . 'relative height' bmse001319 5 stop_ loop_ _Spectral_transition_char.Spectral_transition_ID _Spectral_transition_char.Peak_ID _Spectral_transition_char.Spectral_dim_ID _Spectral_transition_char.Chem_shift_val _Spectral_transition_char.Chem_shift_val_err _Spectral_transition_char.Line_width_val _Spectral_transition_char.Line_width_val_err _Spectral_transition_char.Phase_val _Spectral_transition_char.Phase_val_err _Spectral_transition_char.Decay_rate_val _Spectral_transition_char.Decay_rate_val_err _Spectral_transition_char.Bounding_box_upper_val _Spectral_transition_char.Bounding_box_lower_val _Spectral_transition_char.Bounding_box_width_val _Spectral_transition_char.Derivation_method_ID _Spectral_transition_char.Entry_ID _Spectral_transition_char.Spectral_peak_list_ID 1 . 1 120.3518 . . . . . . . . . . . bmse001319 5 1 . 2 5.4904 . . . . . . . . . . . bmse001319 5 2 . 1 120.3591 . . . . . . . . . . . bmse001319 5 2 . 2 6.2143 . . . . . . . . . . . bmse001319 5 3 . 1 112.7174 . . . . . . . . . . . bmse001319 5 3 . 2 4.8087 . . . . . . . . . . . bmse001319 5 4 . 1 112.7174 . . . . . . . . . . . bmse001319 5 4 . 2 4.8944 . . . . . . . . . . . bmse001319 5 5 . 1 109.7068 . . . . . . . . . . . bmse001319 5 5 . 2 5.0612 . . . . . . . . . . . bmse001319 5 6 . 1 109.6843 . . . . . . . . . . . bmse001319 5 6 . 2 5.2627 . . . . . . . . . . . bmse001319 5 7 . 1 85.3949 . . . . . . . . . . . bmse001319 5 7 . 2 3.9684 . . . . . . . . . . . bmse001319 5 8 . 1 52.0458 . . . . . . . . . . . bmse001319 5 8 . 2 2.8578 . . . . . . . . . . . bmse001319 5 9 . 1 47.6492 . . . . . . . . . . . bmse001319 5 9 . 2 2.9121 . . . . . . . . . . . bmse001319 5 10 . 1 45.1539 . . . . . . . . . . . bmse001319 5 10 . 2 2.8804 . . . . . . . . . . . bmse001319 5 11 . 1 36.3607 . . . . . . . . . . . bmse001319 5 11 . 2 2.1558 . . . . . . . . . . . bmse001319 5 12 . 1 36.4201 . . . . . . . . . . . bmse001319 5 12 . 2 2.4909 . . . . . . . . . . . bmse001319 5 13 . 1 32.7365 . . . . . . . . . . . bmse001319 5 13 . 2 2.5317 . . . . . . . . . . . bmse001319 5 14 . 1 31.0136 . . . . . . . . . . . bmse001319 5 14 . 2 1.4221 . . . . . . . . . . . bmse001319 5 15 . 1 31.0730 . . . . . . . . . . . bmse001319 5 15 . 2 2.2328 . . . . . . . . . . . bmse001319 5 16 . 1 30.4194 . . . . . . . . . . . bmse001319 5 16 . 2 1.8795 . . . . . . . . . . . bmse001319 5 17 . 1 30.4194 . . . . . . . . . . . bmse001319 5 17 . 2 1.9384 . . . . . . . . . . . bmse001319 5 stop_ save_