Content for NMR-STAR saveframe, "spectral_peak_list_1"

    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                         34402
   _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                  '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 H1
#INAME 2 H1
   1   0.820   7.897 0 U          1.248e+03  0.00e+00 -   0  130  116 0
# HG2 I3/H R6
   2   7.897   0.820 0 U          1.556e+03  0.00e+00 -   0  116  130 0
# H R6/HG2 I3
   3   1.356   7.897 0 U          7.172e+02  0.00e+00 -   0  139  116 0
# HG2 K5/H R6
   4   7.897   1.356 0 U          1.276e+03  0.00e+00 -   0  116  139 0
# H R6/HG2 K5
   5   4.045   0.834 0 U          4.194e+03  0.00e+00 -   0  117  195 0
# HA R6/HD1 I9
   6   0.834   4.045 0 U          8.112e+03  0.00e+00 -   0  195  117 0
# HD1 I9/HA R6
   7   1.507   1.507 0 U          4.678e+04  0.00e+00 -   0  178  178 0
# HG13/HG13 I3
   8   1.507   0.820 0 U          4.113e+03  0.00e+00 -   0  178  130 0
# HG13/HG2 I3
   9   1.507   1.073 0 U          1.886e+04  0.00e+00 -   0  178  131 0
# HG13/HG12 I3
  10   1.507   3.708 0 U          2.526e+03  0.00e+00 -   0  178  107 0
# HG13/HA I3
  11   1.507   1.984 0 U          2.847e+03  0.00e+00 -   0  178  129 0
# HG13/HB I3
  12   1.507   0.874 0 U          7.666e+03  0.00e+00 -   0  178  193 0
# HG13/HD1 I3
  13   1.507   8.601 0 U          3.345e+03  0.00e+00 -   0  178  106 0
# HG13/H I3
  14   4.108   4.108 0 U          1.779e+05  0.00e+00 -   0  119  119 0
# HA/HA L10
  15   4.108   0.860 0 U          3.353e+03  0.00e+00 -   0  119  148 0
# HA/HD1 L10
  16   4.108   0.885 0 U          9.833e+03  0.00e+00 -   0  119  189 0
# HA/HD2 L10
  17   4.108   1.596 0 U          6.124e+03  0.00e+00 -   0  119  146 0
# HA/HB3 L10
  18   4.108   1.694 0 U          2.533e+03  0.00e+00 -   0  119  147 0
# HA/HG L10
  19   4.108   7.704 0 U          5.003e+03  0.00e+00 -   0  119  118 0
# HA/H L10
  20   4.108   1.758 0 U          6.394e+03  0.00e+00 -   0  119  145 0
# HA/HB2 L10
  21   4.108   7.508 0 U          2.488e+03  0.00e+00 -   0  119  124 0
# HA L10/H V11
  22   1.398   1.398 0 U          1.158e+05  0.00e+00 -   0  134  134 0
# HG2/HG2 K8
  23   1.398   1.741 0 U          3.412e+03  0.00e+00 -   0  134  207 0
# HG2/HD K8
  24   1.398   1.877 0 U          3.947e+03  0.00e+00 -   0  134  133 0
# HG2/HB3 K8
  25   1.398   2.902 0 U          1.778e+03  0.00e+00 -   0  134  211 0
# HG2/HE K8
  26   1.398   3.847 0 U          3.819e+03  0.00e+00 -   0  134  109 0
# HG2/HA K8
  27   1.398   1.931 0 U          2.688e+03  0.00e+00 -   0  134  132 0
# HG2/HB2 K8
  28   1.398   8.291 0 U          1.212e+03  0.00e+00 -   0  134  108 0
# HG2/H K8
  29   1.398   1.688 0 U          1.843e+04  0.00e+00 -   0  134  140 0
# HG2/HG3 K8
  30   0.820   1.507 0 U          7.155e+03  0.00e+00 -   0  130  178 0
# HG2/HG13 I3
  31   0.820   0.820 0 U          1.187e+06  0.00e+00 -   0  130  130 0
# HG2/HG2 I3
  32   0.820   1.073 0 U          9.400e+03  0.00e+00 -   0  130  131 0
# HG2/HG12 I3
  33   0.820   8.166 0 U          4.986e+03  0.00e+00 -   0  130  110 0
# HG2 I3/H V4
  34   0.820   3.708 0 U          1.585e+04  0.00e+00 -   0  130  107 0
# HG2/HA I3
  35   0.820   1.984 0 U          2.749e+04  0.00e+00 -   0  130  129 0
# HG2/HB I3
  36   0.820   0.874 0 U          1.644e+05  0.00e+00 -   0  130  193 0
# HG2/HD1 I3
  37   0.820   8.601 0 U          3.753e+03  0.00e+00 -   0  130  106 0
# HG2/H I3
  38   4.045   4.045 0 U          1.620e+05  0.00e+00 -   0  117  117 0
# HA/HA R6
  39   4.045   0.896 0 U          3.816e+03  0.00e+00 -   0  117  152 0
# HA R6/HG2 I9
  40   4.045   1.441 0 U          2.547e+03  0.00e+00 -   0  117  144 0
# HA/HG3 R6
  41   4.045   1.765 0 U          1.095e+04  0.00e+00 -   0  117  142 0
# HA/HB R6
  42   4.045   7.897 0 U          4.540e+03  0.00e+00 -   0  117  116 0
# HA/H R6
  43   4.045   1.907 0 U          4.423e+03  0.00e+00 -   0  117  151 0
# HA R6/HB I9
  44   4.045   1.507 0 U          3.346e+03  0.00e+00 -   0  117  143 0
# HA/HG2 R6
  45   4.045   3.057 0 U          6.385e+03  0.00e+00 -   0  117  141 0
# HA/HD R6
  46   4.045   7.546 0 U          1.818e+03  0.00e+00 -   0  117  120 0
# HA R6/H I9
  47   4.045   7.642 0 U          1.109e+03  0.00e+00 -   0  117  210 0
# HA/HE R6
  48   4.045   8.323 0 U          2.386e+03  0.00e+00 -   0  117  112 0
# HA R6/H F7
  49   1.073   1.507 0 U          1.612e+04  0.00e+00 -   0  131  178 0
# HG12/HG13 I3
  50   1.073   0.820 0 U          5.646e+03  0.00e+00 -   0  131  130 0
# HG12/HG2 I3
  51   1.073   1.073 0 U          9.383e+04  0.00e+00 -   0  131  131 0
# HG12/HG12 I3
  52   1.073   3.708 0 U          3.295e+03  0.00e+00 -   0  131  107 0
# HG12/HA I3
  53   1.073   1.984 0 U          2.584e+03  0.00e+00 -   0  131  129 0
# HG12/HB I3
  54   1.073   0.874 0 U          2.181e+04  0.00e+00 -   0  131  193 0
# HG12/HD1 I3
  55   1.073   8.601 0 U          1.919e+03  0.00e+00 -   0  131  106 0
# HG12/H I3
  56   1.040   1.040 0 U          5.524e+05  0.00e+00 -   0  127  127 0
# HG2/HG2 V4
  57   1.040   8.166 0 U          9.962e+03  0.00e+00 -   0  127  110 0
# HG2/H V4
  58   1.040   8.055 0 U          2.295e+03  0.00e+00 -   0  127  114 0
# HG2 V4/H K5
  59   1.040   3.643 0 U          1.243e+04  0.00e+00 -   0  127  111 0
# HG2/HA V4
  60   1.040   2.073 0 U          1.820e+04  0.00e+00 -   0  127  126 0
# HG2/HB V4
  61   1.040   0.982 0 U          1.581e+04  0.00e+00 -   0  127  128 0
# HG2/HG1 V4
  62   0.896   4.045 0 U          4.434e+03  0.00e+00 -   0  152  117 0
# HG2 I9/HA R6
  63   0.896   0.896 0 U          1.280e+06  0.00e+00 -   0  152  152 0
# HG2/HG2 I9
  64   0.896   1.201 0 U          8.285e+03  0.00e+00 -   0  152  198 0
# HG2/HG12 I9
  65   0.896   0.834 0 U          1.389e+05  0.00e+00 -   0  152  195 0
# HG2/HD1 I9
  66   0.896   3.848 0 U          1.608e+04  0.00e+00 -   0  152  121 0
# HG2/HA I9
  67   0.896   1.907 0 U          3.674e+04  0.00e+00 -   0  152  151 0
# HG2/HB I9
  68   0.896   1.636 0 U          7.229e+03  0.00e+00 -   0  152  200 0
# HG2/HG13 I9
  69   0.896   7.546 0 U          7.438e+03  0.00e+00 -   0  152  120 0
# HG2/H I9
  70   0.896   7.704 0 U          4.474e+03  0.00e+00 -   0  152  118 0
# HG2 I9/H L10
  71   1.441   4.045 0 U          2.234e+03  0.00e+00 -   0  144  117 0
# HG3/HA R6
  72   1.441   1.441 0 U          6.790e+04  0.00e+00 -   0  144  144 0
# HG3/HG3 R6
  73   1.441   1.765 0 U          6.571e+03  0.00e+00 -   0  144  142 0
# HG3/HB R6
  74   1.441   7.897 0 U          1.514e+03  0.00e+00 -   0  144  116 0
# HG3/H R6
  75   1.441   1.507 0 U          4.938e+04  0.00e+00 -   0  144  143 0
# HG3/HG2 R6
  76   1.441   3.057 0 U          4.278e+03  0.00e+00 -   0  144  141 0
# HG3/HD R6
  77   1.441   7.642 0 U          9.924e+02  0.00e+00 -   0  144  210 0
# HG3/HE R6
  78   3.109   3.109 0 U          7.193e+04  0.00e+00 -   0  160  160 0
# HB3/HB3 F2
  79   3.109   7.311 0 U          5.268e+02  0.00e+00 -   0  160  216 0
# HB3/HE F2
  80   3.109   3.233 0 U          5.957e+04  0.00e+00 -   0  160  159 0
# HB3/HB2 F2
  81   3.109   7.261 0 U          3.622e+03  0.00e+00 -   0  160  215 0
# HB3/HD F2
  82   3.109   4.470 0 U          5.352e+03  0.00e+00 -   0  160  158 0
# HB3/HA F2
  83   3.109   8.601 0 U          1.654e+03  0.00e+00 -   0  160  106 0
# HB3 F2/H I3
  84   0.860   4.108 0 U          1.023e+04  0.00e+00 -   0  148  119 0
# HD1/HA L10
  85   0.860   0.860 0 U          1.152e+06  0.00e+00 -   0  148  148 0
# HD1/HD1 L10
  86   0.860   0.885 0 U          5.615e+05  0.00e+00 -   0  148  189 0
# HD1/HD2 L10
  87   0.860   1.596 0 U          7.447e+03  0.00e+00 -   0  148  146 0
# HD1/HB3 L10
  88   0.860   1.694 0 U          3.731e+02  0.00e+00 -   0  148  147 0
# HD1/HG L10
  89   0.860   4.240 0 U          1.954e+03  0.00e+00 -   0  148  113 0
# HD1 L10/HA F7
  90   0.860   7.704 0 U          1.442e+03  0.00e+00 -   0  148  118 0
# HD1/H L10
  91   0.860   1.758 0 U          3.511e+03  0.00e+00 -   0  148  145 0
# HD1/HB2 L10
  92   8.166   0.820 0 U          4.028e+03  0.00e+00 -   0  110  130 0
# H V4/HG2 I3
  93   8.166   1.040 0 U          1.081e+04  0.00e+00 -   0  110  127 0
# H/HG2 V4
  94   8.166   8.166 0 U          9.367e+04  0.00e+00 -   0  110  110 0
# H/H V4
  95   8.166   3.708 0 U          4.524e+03  0.00e+00 -   0  110  107 0
# H V4/HA I3
  96   8.166   8.055 0 U          7.855e+03  0.00e+00 -   0  110  114 0
# H V4/H K5
  97   8.166   3.643 0 U          6.004e+03  0.00e+00 -   0  110  111 0
# H/HA V4
  98   8.166   2.073 0 U          1.131e+04  0.00e+00 -   0  110  126 0
# H/HB V4
  99   8.166   1.984 0 U          7.250e+03  0.00e+00 -   0  110  129 0
# H V4/HB I3
 100   8.166   0.982 0 U          2.804e+03  0.00e+00 -   0  110  128 0
# H/HG1 V4
 101   8.166   0.874 0 U          1.178e+03  0.00e+00 -   0  110  193 0
# H V4/HD1 I3
 102   8.166   8.601 0 U          5.984e+03  0.00e+00 -   0  110  106 0
# H V4/H I3
 103   1.201   0.896 0 U          9.322e+03  0.00e+00 -   0  198  152 0
# HG12/HG2 I9
 104   1.201   1.201 0 U          2.381e+06  0.00e+00 -   0  198  198 0
# HG12/HG12 I9
 105   1.201   0.834 0 U          8.439e+03  0.00e+00 -   0  198  195 0
# HG12/HD1 I9
 106   1.201   3.848 0 U          4.481e+03  0.00e+00 -   0  198  121 0
# HG12/HA I9
 107   1.201   1.907 0 U          5.276e+02  0.00e+00 -   0  198  151 0
# HG12/HB I9
 108   1.201   1.636 0 U          1.752e+04  0.00e+00 -   0  198  200 0
# HG12/HG13 I9
 109   1.201   7.546 0 U          2.265e+03  0.00e+00 -   0  198  120 0
# HG12/H I9
 110   0.834   0.896 0 U          4.171e+04  0.00e+00 -   0  195  152 0
# HD1/HG2 I9
 111   0.834   1.201 0 U          9.755e+03  0.00e+00 -   0  195  198 0
# HD1/HG12 I9
 112   0.834   0.834 0 U          1.084e+06  0.00e+00 -   0  195  195 0
# HD1/HD1 I9
 113   0.834   3.848 0 U          4.412e+03  0.00e+00 -   0  195  121 0
# HD1/HA I9
 114   0.834   1.907 0 U          1.192e+04  0.00e+00 -   0  195  151 0
# HD1/HB I9
 115   0.834   1.636 0 U          1.065e+04  0.00e+00 -   0  195  200 0
# HD1/HG13 I9
 116   0.834   7.546 0 U          2.827e+03  0.00e+00 -   0  195  120 0
# HD1/H I9
 117   0.885   4.108 0 U          1.251e+04  0.00e+00 -   0  189  119 0
# HD2/HA L10
 118   0.885   0.860 0 U         -9.235e+05  0.00e+00 -   0  189  148 0
# HD2/HD1 L10
 119   0.885   0.885 0 U          2.463e+06  0.00e+00 -   0  189  189 0
# HD2/HD2 L10
 120   0.885   1.596 0 U          9.581e+03  0.00e+00 -   0  189  146 0
# HD2/HB3 L10
 121   0.885   1.694 0 U          3.720e+03  0.00e+00 -   0  189  147 0
# HD2/HG L10
 122   0.885   4.240 0 U          5.154e+03  0.00e+00 -   0  189  113 0
# HD2 L10/HA F7
 123   0.885   7.704 0 U          4.192e+03  0.00e+00 -   0  189  118 0
# HD2/H L10
 124   0.885   1.758 0 U          1.304e+04  0.00e+00 -   0  189  145 0
# HD2/HB2 L10
 125   0.885   7.120 0 U         -2.589e+02  0.00e+00 -   0  189  217 0
# HD2 L10/HD F7
 126   0.885   7.508 0 U          7.360e+02  0.00e+00 -   0  189  124 0
# HD2 L10/H V11
 127   3.708   1.507 0 U          3.741e+03  0.00e+00 -   0  107  178 0
# HA/HG13 I3
 128   3.708   0.820 0 U          8.865e+03  0.00e+00 -   0  107  130 0
# HA/HG2 I3
 129   3.708   1.073 0 U          5.566e+03  0.00e+00 -   0  107  131 0
# HA/HG12 I3
 130   3.708   8.166 0 U          3.527e+03  0.00e+00 -   0  107  110 0
# HA I3/H V4
 131   3.708   3.708 0 U          1.112e+05  0.00e+00 -   0  107  107 0
# HA/HA I3
 132   3.708   1.765 0 U          3.594e+03  0.00e+00 -   0  107  142 0
# HA I3/HB R6
 133   3.708   1.984 0 U          4.651e+03  0.00e+00 -   0  107  129 0
# HA/HB I3
 134   3.708   7.897 0 U          1.617e+03  0.00e+00 -   0  107  116 0
# HA I3/H R6
 135   3.708   7.261 0 U          1.165e+03  0.00e+00 -   0  107  215 0
# HA I3/HD F2
 136   3.708   0.874 0 U          3.813e+03  0.00e+00 -   0  107  193 0
# HA/HD1 I3
 137   3.708   8.601 0 U          3.924e+03  0.00e+00 -   0  107  106 0
# HA/H I3
 138   1.741   1.398 0 U          4.461e+03  0.00e+00 -   0  207  134 0
# HD/HG2 K8
 139   1.741   1.741 0 U          1.400e+05  0.00e+00 -   0  207  207 0
# HD/HD K8
 140   1.741   1.877 0 U          6.615e+03  0.00e+00 -   0  207  133 0
# HD/HB3 K8
 141   1.741   2.902 0 U          7.016e+02  0.00e+00 -   0  207  211 0
# HD/HE K8
 142   1.741   3.847 0 U          1.299e+03  0.00e+00 -   0  207  109 0
# HD/HA K8
 143   1.741   1.931 0 U          3.165e+03  0.00e+00 -   0  207  132 0
# HD/HB2 K8
 144   1.741   8.291 0 U          1.936e+03  0.00e+00 -   0  207  108 0
# HD/H K8
 145   1.741   1.688 0 U          4.016e+04  0.00e+00 -   0  207  140 0
# HD/HG3 K8
 146   8.055   1.040 0 U          2.659e+03  0.00e+00 -   0  114  127 0
# H K5/HG2 V4
 147   8.055   8.166 0 U          9.492e+03  0.00e+00 -   0  114  110 0
# H K5/H V4
 148   8.055   8.055 0 U          1.257e+05  0.00e+00 -   0  114  114 0
# H/H K5
 149   8.055   1.633 0 U          1.929e+03  0.00e+00 -   0  114  137 0
# H/HD K5
 150   8.055   3.643 0 U          6.020e+03  0.00e+00 -   0  114  111 0
# H K5/HA V4
 151   8.055   2.073 0 U          7.391e+03  0.00e+00 -   0  114  126 0
# H K5/HB V4
 152   8.055   1.356 0 U          1.991e+03  0.00e+00 -   0  114  139 0
# H/HG2 K5
 153   8.055   7.897 0 U          7.628e+03  0.00e+00 -   0  114  116 0
# H K5/H R6
 154   8.055   2.922 0 U          5.985e+02  0.00e+00 -   0  114  213 0
# H/HE K5
 155   8.055   1.798 0 U          8.851e+03  0.00e+00 -   0  114  136 0
# H/HB3 K5
 156   8.055   0.982 0 U          3.405e+03  0.00e+00 -   0  114  128 0
# H K5/HG1 V4
 157   8.055   3.955 0 U          1.026e+04  0.00e+00 -   0  114  115 0
# H/HA K5
 158   8.055   4.470 0 U          2.158e+03  0.00e+00 -   0  114  158 0
# H K5/HA F2
 159   8.055   1.504 0 U          4.458e+03  0.00e+00 -   0  114  138 0
# H/HG3 K5
 160   8.055   1.835 0 U          1.390e+04  0.00e+00 -   0  114  135 0
# H/HB2 K5
 161   1.633   8.055 0 U          1.471e+03  0.00e+00 -   0  137  114 0
# HD/H K5
 162   1.633   1.633 0 U         -2.481e+05  0.00e+00 -   0  137  137 0
# HD/HD K5
 163   1.633   1.356 0 U          1.205e+04  0.00e+00 -   0  137  139 0
# HD/HG2 K5
 164   1.633   2.922 0 U          1.263e+04  0.00e+00 -   0  137  213 0
# HD/HE K5
 165   1.633   1.798 0 U          7.196e+03  0.00e+00 -   0  137  136 0
# HD/HB3 K5
 166   1.633   3.955 0 U          2.513e+03  0.00e+00 -   0  137  115 0
# HD/HA K5
 167   1.633   1.504 0 U          3.498e+04  0.00e+00 -   0  137  138 0
# HD/HG3 K5
 168   1.633   1.835 0 U          3.731e+03  0.00e+00 -   0  137  135 0
# HD/HB2 K5
 169   7.311   3.109 0 U          7.055e+02  0.00e+00 -   0  216  160 0
# HE/HB3 F2
 170   7.311   7.311 0 U          2.829e+05  0.00e+00 -   0  216  216 0
# HE/HE F2
 171   7.311   3.233 0 U          3.185e+02  0.00e+00 -   0  216  159 0
# HE/HB2 F2
 172   7.311   7.261 0 U          6.495e+04  0.00e+00 -   0  216  215 0
# HE/HD F2
 173   7.311   4.470 0 U          4.512e+02  0.00e+00 -   0  216  158 0
# HE/HA F2
 174   3.643   1.040 0 U          1.136e+04  0.00e+00 -   0  111  127 0
# HA/HG2 V4
 175   3.643   8.166 0 U          4.999e+03  0.00e+00 -   0  111  110 0
# HA/H V4
 176   3.643   8.055 0 U          3.974e+03  0.00e+00 -   0  111  114 0
# HA V4/H K5
 177   3.643   3.643 0 U          1.437e+05  0.00e+00 -   0  111  111 0
# HA/HA V4
 178   3.643   2.073 0 U          5.457e+03  0.00e+00 -   0  111  126 0
# HA/HB V4
 179   3.643   3.103 0 U          3.645e+03  0.00e+00 -   0  111  123 0
# HA V4/HB3 F7
 180   3.643   0.982 0 U          9.312e+03  0.00e+00 -   0  111  128 0
# HA/HG1 V4
 181   3.643   8.323 0 U          2.818e+03  0.00e+00 -   0  111  112 0
# HA V4/H F7
 182   3.643   3.236 0 U          4.978e+03  0.00e+00 -   0  111  122 0
# HA V4/HB2 F7
 183   2.073   1.040 0 U          6.883e+03  0.00e+00 -   0  126  127 0
# HB/HG2 V4
 184   2.073   8.166 0 U          5.653e+03  0.00e+00 -   0  126  110 0
# HB/H V4
 185   2.073   8.055 0 U          3.190e+03  0.00e+00 -   0  126  114 0
# HB V4/H K5
 186   2.073   3.643 0 U          2.938e+03  0.00e+00 -   0  126  111 0
# HB/HA V4
 187   2.073   2.073 0 U          9.506e+04  0.00e+00 -   0  126  126 0
# HB/HB V4
 188   2.073   0.982 0 U          6.249e+03  0.00e+00 -   0  126  128 0
# HB/HG1 V4
 189   3.103   3.643 0 U          3.270e+03  0.00e+00 -   0  123  111 0
# HB3 F7/HA V4
 190   3.103   3.103 0 U          9.728e+04  0.00e+00 -   0  123  123 0
# HB3/HB3 F7
 191   3.103   7.077 0 U         -4.149e+02  0.00e+00 -   0  123  218 0
# HB3/HE F7
 192   3.103   4.240 0 U          6.463e+03  0.00e+00 -   0  123  113 0
# HB3/HA F7
 193   3.103   8.291 0 U          1.608e+03  0.00e+00 -   0  123  108 0
# HB3 F7/H K8
 194   3.103   7.120 0 U          3.761e+03  0.00e+00 -   0  123  217 0
# HB3/HD F7
 195   3.103   8.323 0 U          9.624e+03  0.00e+00 -   0  123  112 0
# HB3/H F7
 196   3.103   3.236 0 U          7.381e+03  0.00e+00 -   0  123  122 0
# HB3/HB2 F7
 197   1.765   4.045 0 U          8.073e+03  0.00e+00 -   0  142  117 0
# HB/HA R6
 198   1.765   1.441 0 U          6.172e+03  0.00e+00 -   0  142  144 0
# HB/HG3 R6
 199   1.765   3.708 0 U          2.236e+03  0.00e+00 -   0  142  107 0
# HB R6/HA I3
 200   1.765   1.765 0 U          8.650e+04  0.00e+00 -   0  142  142 0
# HB/HB R6
 201   1.765   7.897 0 U          7.332e+03  0.00e+00 -   0  142  116 0
# HB/H R6
 202   1.765   1.507 0 U          8.259e+03  0.00e+00 -   0  142  143 0
# HB/HG2 R6
 203   1.765   3.057 0 U          3.434e+03  0.00e+00 -   0  142  141 0
# HB/HD R6
 204   1.765   7.642 0 U          1.475e+03  0.00e+00 -   0  142  210 0
# HB/HE R6
 205   3.917   3.917 0 U          3.416e+04  0.00e+00 -   0  174  174 0
# HA2/HA2 G1
 206   3.917   3.831 0 U          4.225e+04  0.00e+00 -   0  174  176 0
# HA2/HA3 G1
 207   1.356   8.055 0 U          1.172e+03  0.00e+00 -   0  139  114 0
# HG2/H K5
 208   1.356   1.633 0 U          7.156e+03  0.00e+00 -   0  139  137 0
# HG2/HD K5
 209   1.356   1.356 0 U          1.652e+05  0.00e+00 -   0  139  139 0
# HG2/HG2 K5
 210   1.356   2.922 0 U          1.795e+03  0.00e+00 -   0  139  213 0
# HG2/HE K5
 211   1.356   1.798 0 U          3.472e+03  0.00e+00 -   0  139  136 0
# HG2/HB3 K5
 212   1.356   3.955 0 U          2.114e+03  0.00e+00 -   0  139  115 0
# HG2/HA K5
 213   1.356   1.504 0 U          2.565e+04  0.00e+00 -   0  139  138 0
# HG2/HG3 K5
 214   1.356   1.835 0 U          2.410e+03  0.00e+00 -   0  139  135 0
# HG2/HB2 K5
 215   3.848   0.896 0 U          9.736e+03  0.00e+00 -   0  121  152 0
# HA/HG2 I9
 216   3.848   1.201 0 U          6.869e+03  0.00e+00 -   0  121  198 0
# HA/HG12 I9
 217   3.848   0.834 0 U          3.365e+03  0.00e+00 -   0  121  195 0
# HA/HD1 I9
 218   3.848   3.848 0 U          4.594e+05  0.00e+00 -   0  121  121 0
# HA/HA I9
 219   3.848   1.907 0 U          5.676e+03  0.00e+00 -   0  121  151 0
# HA/HB I9
 220   3.848   1.636 0 U          5.204e+03  0.00e+00 -   0  121  200 0
# HA/HG13 I9
 221   3.848   7.546 0 U          9.537e+03  0.00e+00 -   0  121  120 0
# HA/H I9
 222   3.848   7.704 0 U          4.219e+03  0.00e+00 -   0  121  118 0
# HA I9/H L10
 223   1.877   1.398 0 U          6.312e+03  0.00e+00 -   0  133  134 0
# HB3/HG2 K8
 224   1.877   1.741 0 U          7.682e+03  0.00e+00 -   0  133  207 0
# HB3/HD K8
 225   1.877   1.877 0 U          9.670e+04  0.00e+00 -   0  133  133 0
# HB3/HB3 K8
 226   1.877   2.902 0 U          9.959e+02  0.00e+00 -   0  133  211 0
# HB3/HE K8
 227   1.877   3.847 0 U          9.154e+03  0.00e+00 -   0  133  109 0
# HB3/HA K8
 228   1.877   1.931 0 U          6.744e+04  0.00e+00 -   0  133  132 0
# HB3/HB2 K8
 229   1.877   8.291 0 U          5.533e+03  0.00e+00 -   0  133  108 0
# HB3/H K8
 230   1.877   1.688 0 U          1.592e+04  0.00e+00 -   0  133  140 0
# HB3/HG3 K8
 231   1.984   1.507 0 U          4.123e+03  0.00e+00 -   0  129  178 0
# HB/HG13 I3
 232   1.984   0.820 0 U          8.135e+03  0.00e+00 -   0  129  130 0
# HB/HG2 I3
 233   1.984   1.073 0 U          3.490e+03  0.00e+00 -   0  129  131 0
# HB/HG12 I3
 234   1.984   8.166 0 U          4.381e+03  0.00e+00 -   0  129  110 0
# HB I3/H V4
 235   1.984   3.708 0 U          2.137e+03  0.00e+00 -   0  129  107 0
# HB/HA I3
 236   1.984   1.984 0 U          9.313e+04  0.00e+00 -   0  129  129 0
# HB/HB I3
 237   1.984   0.874 0 U          5.253e+03  0.00e+00 -   0  129  193 0
# HB/HD1 I3
 238   1.984   8.601 0 U          7.637e+03  0.00e+00 -   0  129  106 0
# HB/H I3
 239   7.897   4.045 0 U          8.213e+03  0.00e+00 -   0  116  117 0
# H/HA R6
 240   7.897   1.441 0 U          2.848e+03  0.00e+00 -   0  116  144 0
# H/HG3 R6
 241   7.897   3.708 0 U          2.459e+03  0.00e+00 -   0  116  107 0
# H R6/HA I3
 242   7.897   8.055 0 U          6.646e+03  0.00e+00 -   0  116  114 0
# H R6/H K5
 243   7.897   1.765 0 U          1.926e+04  0.00e+00 -   0  116  142 0
# H/HB R6
 244   7.897   7.897 0 U          1.106e+05  0.00e+00 -   0  116  116 0
# H/H R6
 245   7.897   1.507 0 U          4.343e+03  0.00e+00 -   0  116  143 0
# H/HG2 R6
 246   7.897   3.057 0 U          1.724e+03  0.00e+00 -   0  116  141 0
# H/HD R6
 247   7.897   3.955 0 U          3.940e+03  0.00e+00 -   0  116  115 0
# H R6/HA K5
 248   7.897   7.642 0 U          1.089e+03  0.00e+00 -   0  116  210 0
# H/HE R6
 249   7.897   8.323 0 U          8.842e+03  0.00e+00 -   0  116  112 0
# H R6/H F7
 250   2.902   1.398 0 U          2.718e+03  0.00e+00 -   0  211  134 0
# HE/HG2 K8
 251   2.902   1.741 0 U          1.416e+03  0.00e+00 -   0  211  207 0
# HE/HD K8
 252   2.902   1.877 0 U          1.370e+03  0.00e+00 -   0  211  133 0
# HE/HB3 K8
 253   2.902   2.902 0 U          3.724e+05  0.00e+00 -   0  211  211 0
# HE/HE K8
 254   2.902   3.847 0 U          6.377e+02  0.00e+00 -   0  211  109 0
# HE/HA K8
 255   2.902   1.931 0 U          8.733e+02  0.00e+00 -   0  211  132 0
# HE/HB2 K8
 256   2.902   0.982 0 U          3.032e+03  0.00e+00 -   0  211  128 0
# HE K8/HG1 V4
 257   2.902   8.291 0 U          4.630e+02  0.00e+00 -   0  211  108 0
# HE/H K8
 258   2.902   1.688 0 U          5.558e+03  0.00e+00 -   0  211  140 0
# HE/HG3 K8
 259   3.233   3.109 0 U          1.113e+05  0.00e+00 -   0  159  160 0
# HB2/HB3 F2
 260   3.233   7.311 0 U          4.479e+02  0.00e+00 -   0  159  216 0
# HB2/HE F2
 261   3.233   3.233 0 U          3.689e+03  0.00e+00 -   0  159  159 0
# HB2/HB2 F2
 262   3.233   7.261 0 U          2.901e+03  0.00e+00 -   0  159  215 0
# HB2/HD F2
 263   3.233   4.470 0 U          5.792e+03  0.00e+00 -   0  159  158 0
# HB2/HA F2
 264   3.233   8.601 0 U          1.487e+03  0.00e+00 -   0  159  106 0
# HB2 F2/H I3
 265   2.922   8.055 0 U          3.399e+02  0.00e+00 -   0  213  114 0
# HE/H K5
 266   2.922   1.633 0 U          1.037e+04  0.00e+00 -   0  213  137 0
# HE/HD K5
 267   2.922   1.356 0 U          3.151e+03  0.00e+00 -   0  213  139 0
# HE/HG2 K5
 268   2.922   2.922 0 U          5.840e+05  0.00e+00 -   0  213  213 0
# HE/HE K5
 269   2.922   1.798 0 U          7.832e+02  0.00e+00 -   0  213  136 0
# HE/HB3 K5
 270   2.922   3.955 0 U          1.060e+02  0.00e+00 -   0  213  115 0
# HE/HA K5
 271   2.922   1.504 0 U          3.171e+03  0.00e+00 -   0  213  138 0
# HE/HG3 K5
 272   2.922   1.835 0 U          8.832e+02  0.00e+00 -   0  213  135 0
# HE/HB2 K5
 273   1.907   4.045 0 U          3.682e+03  0.00e+00 -   0  151  117 0
# HB I9/HA R6
 274   1.907   0.896 0 U          9.908e+03  0.00e+00 -   0  151  152 0
# HB/HG2 I9
 275   1.907   1.201 0 U          3.159e+03  0.00e+00 -   0  151  198 0
# HB/HG12 I9
 276   1.907   0.834 0 U          6.157e+03  0.00e+00 -   0  151  195 0
# HB/HD1 I9
 277   1.907   3.848 0 U          8.301e+03  0.00e+00 -   0  151  121 0
# HB/HA I9
 278   1.907   1.907 0 U          1.401e+05  0.00e+00 -   0  151  151 0
# HB/HB I9
 279   1.907   1.636 0 U          6.477e+03  0.00e+00 -   0  151  200 0
# HB/HG13 I9
 280   1.907   7.546 0 U          9.055e+03  0.00e+00 -   0  151  120 0
# HB/H I9
 281   1.907   7.704 0 U          4.061e+03  0.00e+00 -   0  151  118 0
# HB I9/H L10
 282   1.596   4.108 0 U          6.546e+03  0.00e+00 -   0  146  119 0
# HB3/HA L10
 283   1.596   0.860 0 U          4.862e+03  0.00e+00 -   0  146  148 0
# HB3/HD1 L10
 284   1.596   0.885 0 U          1.079e+04  0.00e+00 -   0  146  189 0
# HB3/HD2 L10
 285   1.596   1.596 0 U          1.552e+05  0.00e+00 -   0  146  146 0
# HB3/HB3 L10
 286   1.596   1.694 0 U          4.162e+04  0.00e+00 -   0  146  147 0
# HB3/HG L10
 287   1.596   4.240 0 U          2.829e+03  0.00e+00 -   0  146  113 0
# HB3 L10/HA F7
 288   1.596   7.704 0 U          6.009e+03  0.00e+00 -   0  146  118 0
# HB3/H L10
 289   1.596   1.758 0 U          4.118e+04  0.00e+00 -   0  146  145 0
# HB3/HB2 L10
 290   1.596   7.508 0 U          2.683e+03  0.00e+00 -   0  146  124 0
# HB3 L10/H V11
 291   2.022   2.022 0 U          1.068e+05  0.00e+00 -   0  150  150 0
# HB/HB V11
 292   2.022   0.764 0 U          1.487e+04  0.00e+00 -   0  150  191 0
# HB/HG2 V11
 293   2.022   3.987 0 U          5.133e+03  0.00e+00 -   0  150  125 0
# HB/HA V11
 294   2.022   0.751 0 U          3.882e+02  0.00e+00 -   0  150  149 0
# HB/HG1 V11
 295   2.022   7.508 0 U          2.341e+03  0.00e+00 -   0  150  124 0
# HB/H V11
 296   1.507   4.045 0 U          2.980e+03  0.00e+00 -   0  143  117 0
# HG2/HA R6
 297   1.507   1.441 0 U          4.046e+04  0.00e+00 -   0  143  144 0
# HG2/HG3 R6
 298   1.507   1.765 0 U          9.917e+03  0.00e+00 -   0  143  142 0
# HG2/HB R6
 299   1.507   7.897 0 U          2.431e+03  0.00e+00 -   0  143  116 0
# HG2/H R6
 300   1.507   1.507 0 U          4.678e+04  0.00e+00 -   0  143  143 0
# HG2/HG2 R6
 301   1.507   3.057 0 U          5.396e+03  0.00e+00 -   0  143  141 0
# HG2/HD R6
 302   1.507   7.642 0 U          1.492e+03  0.00e+00 -   0  143  210 0
# HG2/HE R6
 303   1.694   4.108 0 U          3.293e+03  0.00e+00 -   0  147  119 0
# HG/HA L10
 304   1.694   0.860 0 U          2.146e+03  0.00e+00 -   0  147  148 0
# HG/HD1 L10
 305   1.694   0.885 0 U          7.175e+03  0.00e+00 -   0  147  189 0
# HG/HD2 L10
 306   1.694   1.596 0 U          3.214e+04  0.00e+00 -   0  147  146 0
# HG/HB3 L10
 307   1.694   1.694 0 U          1.828e+05  0.00e+00 -   0  147  147 0
# HG/HG L10
 308   1.694   7.704 0 U          4.731e+03  0.00e+00 -   0  147  118 0
# HG/H L10
 309   1.694   1.758 0 U          2.788e+04  0.00e+00 -   0  147  145 0
# HG/HB2 L10
 310   0.764   2.022 0 U         -3.890e+03  0.00e+00 -   0  191  150 0
# HG2/HB V11
 311   0.764   0.764 0 U          7.780e+05  0.00e+00 -   0  191  191 0
# HG2/HG2 V11
 312   0.764   3.987 0 U          3.456e+03  0.00e+00 -   0  191  125 0
# HG2/HA V11
 313   0.764   0.751 0 U         -1.903e+05  0.00e+00 -   0  191  149 0
# HG2/HG1 V11
 314   0.764   7.508 0 U          2.970e+03  0.00e+00 -   0  191  124 0
# HG2/H V11
 315   3.847   1.398 0 U          6.098e+03  0.00e+00 -   0  109  134 0
# HA/HG2 K8
 316   3.847   1.741 0 U          1.617e+03  0.00e+00 -   0  109  207 0
# HA/HD K8
 317   3.847   1.877 0 U          8.220e+03  0.00e+00 -   0  109  133 0
# HA/HB3 K8
 318   3.847   2.902 0 U          9.169e+02  0.00e+00 -   0  109  211 0
# HA/HE K8
 319   3.847   3.847 0 U         -1.092e+05  0.00e+00 -   0  109  109 0
# HA/HA K8
 320   3.847   1.931 0 U          6.328e+03  0.00e+00 -   0  109  132 0
# HA/HB2 K8
 321   3.847   0.751 0 U          7.224e+03  0.00e+00 -   0  109  149 0
# HA K8/HG1 V11
 322   3.847   8.291 0 U          6.219e+03  0.00e+00 -   0  109  108 0
# HA/H K8
 323   3.847   1.688 0 U          5.066e+03  0.00e+00 -   0  109  140 0
# HA/HG3 K8
 324   7.077   3.103 0 U          5.648e+02  0.00e+00 -   0  218  123 0
# HE/HB3 F7
 325   7.077   7.077 0 U          2.280e+05  0.00e+00 -   0  218  218 0
# HE/HE F7
 326   7.077   4.240 0 U          5.118e+02  0.00e+00 -   0  218  113 0
# HE/HA F7
 327   7.077   7.120 0 U          9.675e+04  0.00e+00 -   0  218  217 0
# HE/HD F7
 328   7.077   8.323 0 U          1.012e+02  0.00e+00 -   0  218  112 0
# HE/H F7
 329   7.077   3.236 0 U          8.627e+02  0.00e+00 -   0  218  122 0
# HE/HB2 F7
 330   4.240   0.860 0 U          3.811e+02  0.00e+00 -   0  113  148 0
# HA F7/HD1 L10
 331   4.240   0.885 0 U          2.148e+03  0.00e+00 -   0  113  189 0
# HA F7/HD2 L10
 332   4.240   3.103 0 U          3.341e+03  0.00e+00 -   0  113  123 0
# HA/HB3 F7
 333   4.240   1.596 0 U          1.658e+03  0.00e+00 -   0  113  146 0
# HA F7/HB3 L10
 334   4.240   7.077 0 U         -3.304e+02  0.00e+00 -   0  113  218 0
# HA/HE F7
 335   4.240   4.240 0 U          7.095e+04  0.00e+00 -   0  113  113 0
# HA/HA F7
 336   4.240   7.704 0 U          9.114e+02  0.00e+00 -   0  113  118 0
# HA F7/H L10
 337   4.240   1.758 0 U          2.268e+03  0.00e+00 -   0  113  145 0
# HA F7/HB2 L10
 338   4.240   8.291 0 U          9.172e+02  0.00e+00 -   0  113  108 0
# HA F7/H K8
 339   4.240   7.120 0 U          2.088e+03  0.00e+00 -   0  113  217 0
# HA/HD F7
 340   4.240   8.323 0 U          2.932e+03  0.00e+00 -   0  113  112 0
# HA/H F7
 341   4.240   3.236 0 U          2.719e+03  0.00e+00 -   0  113  122 0
# HA/HB2 F7
 342   1.798   8.055 0 U          6.166e+03  0.00e+00 -   0  136  114 0
# HB3/H K5
 343   1.798   1.633 0 U          8.043e+03  0.00e+00 -   0  136  137 0
# HB3/HD K5
 344   1.798   1.356 0 U          4.387e+03  0.00e+00 -   0  136  139 0
# HB3/HG2 K5
 345   1.798   2.922 0 U          9.456e+02  0.00e+00 -   0  136  213 0
# HB3/HE K5
 346   1.798   1.798 0 U          8.687e+04  0.00e+00 -   0  136  136 0
# HB3/HB3 K5
 347   1.798   3.955 0 U          5.907e+03  0.00e+00 -   0  136  115 0
# HB3/HA K5
 348   1.798   1.504 0 U          5.241e+03  0.00e+00 -   0  136  138 0
# HB3/HG3 K5
 349   1.798   1.835 0 U          5.620e+04  0.00e+00 -   0  136  135 0
# HB3/HB2 K5
 350   3.987   2.022 0 U          7.672e+03  0.00e+00 -   0  125  150 0
# HA/HB V11
 351   3.987   0.764 0 U          9.871e+03  0.00e+00 -   0  125  191 0
# HA/HG2 V11
 352   3.987   3.987 0 U          1.754e+05  0.00e+00 -   0  125  125 0
# HA/HA V11
 353   3.987   0.751 0 U          1.521e+03  0.00e+00 -   0  125  149 0
# HA/HG1 V11
 354   3.987   7.508 0 U          5.397e+03  0.00e+00 -   0  125  124 0
# HA/H V11
 355   3.057   4.045 0 U          5.787e+03  0.00e+00 -   0  141  117 0
# HD/HA R6
 356   3.057   1.441 0 U          4.854e+03  0.00e+00 -   0  141  144 0
# HD/HG3 R6
 357   3.057   1.765 0 U          4.964e+03  0.00e+00 -   0  141  142 0
# HD/HB R6
 358   3.057   7.897 0 U          9.465e+02  0.00e+00 -   0  141  116 0
# HD/H R6
 359   3.057   1.507 0 U          5.511e+03  0.00e+00 -   0  141  143 0
# HD/HG2 R6
 360   3.057   3.057 0 U          1.655e+05  0.00e+00 -   0  141  141 0
# HD/HD R6
 361   3.057   7.642 0 U          3.648e+03  0.00e+00 -   0  141  210 0
# HD/HE R6
 362   1.636   0.896 0 U          7.664e+03  0.00e+00 -   0  200  152 0
# HG13/HG2 I9
 363   1.636   1.201 0 U          2.319e+04  0.00e+00 -   0  200  198 0
# HG13/HG12 I9
 364   1.636   0.834 0 U          2.859e+03  0.00e+00 -   0  200  195 0
# HG13/HD1 I9
 365   1.636   3.848 0 U          3.488e+03  0.00e+00 -   0  200  121 0
# HG13/HA I9
 366   1.636   1.907 0 U          4.283e+03  0.00e+00 -   0  200  151 0
# HG13/HB I9
 367   1.636   1.636 0 U          7.566e+05  0.00e+00 -   0  200  200 0
# HG13/HG13 I9
 368   1.636   7.546 0 U          4.485e+03  0.00e+00 -   0  200  120 0
# HG13/H I9
 369   7.546   4.045 0 U          2.676e+03  0.00e+00 -   0  120  117 0
# H I9/HA R6
 370   7.546   0.896 0 U          5.123e+03  0.00e+00 -   0  120  152 0
# H/HG2 I9
 371   7.546   1.201 0 U          4.813e+03  0.00e+00 -   0  120  198 0
# H/HG12 I9
 372   7.546   0.834 0 U          2.683e+03  0.00e+00 -   0  120  195 0
# H/HD1 I9
 373   7.546   3.848 0 U          1.202e+04  0.00e+00 -   0  120  121 0
# H/HA I9
 374   7.546   1.907 0 U          1.753e+04  0.00e+00 -   0  120  151 0
# H/HB I9
 375   7.546   1.636 0 U          9.507e+03  0.00e+00 -   0  120  200 0
# H/HG13 I9
 376   7.546   7.546 0 U          1.233e+05  0.00e+00 -   0  120  120 0
# H/H I9
 377   7.546   7.704 0 U          8.952e+03  0.00e+00 -   0  120  118 0
# H I9/H L10
 378   7.546   8.291 0 U          6.630e+03  0.00e+00 -   0  120  108 0
# H I9/H K8
 379   3.831   3.917 0 U          4.073e+04  0.00e+00 -   0  176  174 0
# HA3/HA2 G1
 380   3.831   3.831 0 U          1.836e+05  0.00e+00 -   0  176  176 0
# HA3/HA3 G1
 381   7.704   4.108 0 U          8.368e+03  0.00e+00 -   0  118  119 0
# H/HA L10
 382   7.704   0.896 0 U          5.162e+03  0.00e+00 -   0  118  152 0
# H L10/HG2 I9
 383   7.704   0.860 0 U          1.235e+03  0.00e+00 -   0  118  148 0
# H/HD1 L10
 384   7.704   0.885 0 U          1.720e+03  0.00e+00 -   0  118  189 0
# H/HD2 L10
 385   7.704   3.848 0 U          5.874e+03  0.00e+00 -   0  118  121 0
# H L10/HA I9
 386   7.704   1.907 0 U          7.933e+03  0.00e+00 -   0  118  151 0
# H L10/HB I9
 387   7.704   1.596 0 U          8.365e+03  0.00e+00 -   0  118  146 0
# H/HB3 L10
 388   7.704   1.694 0 U          7.021e+03  0.00e+00 -   0  118  147 0
# H/HG L10
 389   7.704   4.240 0 U          3.096e+03  0.00e+00 -   0  118  113 0
# H L10/HA F7
 390   7.704   7.546 0 U          1.094e+04  0.00e+00 -   0  118  120 0
# H L10/H I9
 391   7.704   7.704 0 U          1.179e+05  0.00e+00 -   0  118  118 0
# H/H L10
 392   7.704   1.758 0 U          1.336e+04  0.00e+00 -   0  118  145 0
# H/HB2 L10
 393   7.704   7.508 0 U          6.399e+03  0.00e+00 -   0  118  124 0
# H L10/H V11
 394   7.261   3.109 0 U          3.966e+03  0.00e+00 -   0  215  160 0
# HD/HB3 F2
 395   7.261   3.708 0 U          1.391e+03  0.00e+00 -   0  215  107 0
# HD F2/HA I3
 396   7.261   7.311 0 U          2.310e+05  0.00e+00 -   0  215  216 0
# HD/HE F2
 397   7.261   3.233 0 U          3.099e+03  0.00e+00 -   0  215  159 0
# HD/HB2 F2
 398   7.261   7.261 0 U          4.362e+05  0.00e+00 -   0  215  215 0
# HD/HD F2
 399   7.261   4.470 0 U          2.444e+03  0.00e+00 -   0  215  158 0
# HD/HA F2
 400   1.931   1.398 0 U          4.542e+03  0.00e+00 -   0  132  134 0
# HB2/HG2 K8
 401   1.931   1.741 0 U          3.528e+03  0.00e+00 -   0  132  207 0
# HB2/HD K8
 402   1.931   1.877 0 U          4.113e+04  0.00e+00 -   0  132  133 0
# HB2/HB3 K8
 403   1.931   2.902 0 U          4.670e+02  0.00e+00 -   0  132  211 0
# HB2/HE K8
 404   1.931   3.847 0 U          6.060e+03  0.00e+00 -   0  132  109 0
# HB2/HA K8
 405   1.931   1.931 0 U          6.432e+04  0.00e+00 -   0  132  132 0
# HB2/HB2 K8
 406   1.931   8.291 0 U          4.303e+03  0.00e+00 -   0  132  108 0
# HB2/H K8
 407   1.931   1.688 0 U          6.457e+03  0.00e+00 -   0  132  140 0
# HB2/HG3 K8
 408   0.982   1.040 0 U          9.199e+03  0.00e+00 -   0  128  127 0
# HG1/HG2 V4
 409   0.982   8.166 0 U          4.674e+03  0.00e+00 -   0  128  110 0
# HG1/H V4
 410   0.982   8.055 0 U          3.981e+03  0.00e+00 -   0  128  114 0
# HG1 V4/H K5
 411   0.982   3.643 0 U          1.478e+04  0.00e+00 -   0  128  111 0
# HG1/HA V4
 412   0.982   2.073 0 U          3.106e+04  0.00e+00 -   0  128  126 0
# HG1/HB V4
 413   0.982   2.902 0 U          5.211e+03  0.00e+00 -   0  128  211 0
# HG1 V4/HE K8
 414   0.982   0.982 0 U          9.657e+05  0.00e+00 -   0  128  128 0
# HG1/HG1 V4
 415   0.982   3.955 0 U          4.141e+03  0.00e+00 -   0  128  115 0
# HG1 V4/HA K5
 416   3.955   8.055 0 U          4.424e+03  0.00e+00 -   0  115  114 0
# HA/H K5
 417   3.955   1.633 0 U          1.672e+03  0.00e+00 -   0  115  137 0
# HA/HD K5
 418   3.955   1.356 0 U          2.598e+03  0.00e+00 -   0  115  139 0
# HA/HG2 K5
 419   3.955   7.897 0 U          1.716e+03  0.00e+00 -   0  115  116 0
# HA K5/H R6
 420   3.955   2.922 0 U          8.375e+02  0.00e+00 -   0  115  213 0
# HA/HE K5
 421   3.955   1.798 0 U          3.371e+03  0.00e+00 -   0  115  136 0
# HA/HB3 K5
 422   3.955   0.982 0 U          1.761e+03  0.00e+00 -   0  115  128 0
# HA K5/HG1 V4
 423   3.955   3.955 0 U          1.286e+05  0.00e+00 -   0  115  115 0
# HA/HA K5
 424   3.955   8.291 0 U          1.582e+03  0.00e+00 -   0  115  108 0
# HA K5/H K8
 425   3.955   1.504 0 U          2.623e+03  0.00e+00 -   0  115  138 0
# HA/HG3 K5
 426   3.955   1.835 0 U          5.454e+03  0.00e+00 -   0  115  135 0
# HA/HB2 K5
 427   3.955   1.688 0 U          2.469e+03  0.00e+00 -   0  115  140 0
# HA K5/HG3 K8
 428   7.642   4.045 0 U          1.927e+03  0.00e+00 -   0  210  117 0
# HE/HA R6
 429   7.642   1.441 0 U          2.870e+03  0.00e+00 -   0  210  144 0
# HE/HG3 R6
 430   7.642   1.765 0 U          4.777e+03  0.00e+00 -   0  210  142 0
# HE/HB R6
 431   7.642   7.897 0 U          8.070e+02  0.00e+00 -   0  210  116 0
# HE/H R6
 432   7.642   1.507 0 U          3.238e+03  0.00e+00 -   0  210  143 0
# HE/HG2 R6
 433   7.642   3.057 0 U          9.461e+03  0.00e+00 -   0  210  141 0
# HE/HD R6
 434   7.642   7.642 0 U          1.591e+05  0.00e+00 -   0  210  210 0
# HE/HE R6
 435   4.470   3.109 0 U         -1.321e+01  0.00e+00 -   0  158  160 0
# HA/HB3 F2
 436   4.470   8.055 0 U          1.650e+02  0.00e+00 -   0  158  114 0
# HA F2/H K5
 437   4.470   7.311 0 U          4.598e+01  0.00e+00 -   0  158  216 0
# HA/HE F2
 438   4.470   3.233 0 U          1.102e+02  0.00e+00 -   0  158  159 0
# HA/HB2 F2
 439   4.470   7.261 0 U          2.038e+02  0.00e+00 -   0  158  215 0
# HA/HD F2
 440   4.470   4.470 0 U          7.170e+03  0.00e+00 -   0  158  158 0
# HA/HA F2
 441   4.470   8.601 0 U          2.858e+02  0.00e+00 -   0  158  106 0
# HA F2/H I3
 442   1.758   4.108 0 U          6.803e+03  0.00e+00 -   0  145  119 0
# HB2/HA L10
 443   1.758   0.860 0 U          2.054e+03  0.00e+00 -   0  145  148 0
# HB2/HD1 L10
 444   1.758   0.885 0 U          1.168e+04  0.00e+00 -   0  145  189 0
# HB2/HD2 L10
 445   1.758   1.596 0 U          3.703e+04  0.00e+00 -   0  145  146 0
# HB2/HB3 L10
 446   1.758   1.694 0 U          3.896e+04  0.00e+00 -   0  145  147 0
# HB2/HG L10
 447   1.758   4.240 0 U          3.218e+03  0.00e+00 -   0  145  113 0
# HB2 L10/HA F7
 448   1.758   7.704 0 U          7.530e+03  0.00e+00 -   0  145  118 0
# HB2/H L10
 449   1.758   1.758 0 U          1.357e+05  0.00e+00 -   0  145  145 0
# HB2/HB2 L10
 450   1.758   7.508 0 U          2.653e+03  0.00e+00 -   0  145  124 0
# HB2 L10/H V11
 451   0.751   2.022 0 U          3.396e+04  0.00e+00 -   0  149  150 0
# HG1/HB V11
 452   0.751   0.764 0 U          8.863e+05  0.00e+00 -   0  149  191 0
# HG1/HG2 V11
 453   0.751   3.847 0 U          6.551e+03  0.00e+00 -   0  149  109 0
# HG1 V11/HA K8
 454   0.751   3.987 0 U          1.069e+04  0.00e+00 -   0  149  125 0
# HG1/HA V11
 455   0.751   0.751 0 U          2.595e+05  0.00e+00 -   0  149  149 0
# HG1/HG1 V11
 456   0.751   7.120 0 U          3.689e+03  0.00e+00 -   0  149  217 0
# HG1 V11/HD F7
 457   0.751   7.508 0 U          9.982e+03  0.00e+00 -   0  149  124 0
# HG1/H V11
 458   8.291   1.398 0 U          3.267e+03  0.00e+00 -   0  108  134 0
# H/HG2 K8
 459   8.291   1.741 0 U          3.283e+03  0.00e+00 -   0  108  207 0
# H/HD K8
 460   8.291   3.103 0 U          5.757e+03  0.00e+00 -   0  108  123 0
# H K8/HB3 F7
 461   8.291   1.877 0 U          9.129e+03  0.00e+00 -   0  108  133 0
# H/HB3 K8
 462   8.291   2.902 0 U          5.111e+02  0.00e+00 -   0  108  211 0
# H/HE K8
 463   8.291   3.847 0 U          1.107e+04  0.00e+00 -   0  108  109 0
# H/HA K8
 464   8.291   4.240 0 U          5.718e+03  0.00e+00 -   0  108  113 0
# H K8/HA F7
 465   8.291   7.546 0 U          8.537e+03  0.00e+00 -   0  108  120 0
# H K8/H I9
 466   8.291   1.931 0 U          1.430e+04  0.00e+00 -   0  108  132 0
# H/HB2 K8
 467   8.291   3.955 0 U          3.612e+03  0.00e+00 -   0  108  115 0
# H K8/HA K5
 468   8.291   8.291 0 U          1.406e+05  0.00e+00 -   0  108  108 0
# H/H K8
 469   8.291   1.688 0 U          8.510e+03  0.00e+00 -   0  108  140 0
# H/HG3 K8
 470   8.291   3.236 0 U          8.824e+03  0.00e+00 -   0  108  122 0
# H K8/HB2 F7
 471   0.874   1.507 0 U          1.954e+04  0.00e+00 -   0  193  178 0
# HD1/HG13 I3
 472   0.874   0.820 0 U         -1.338e+04  0.00e+00 -   0  193  130 0
# HD1/HG2 I3
 473   0.874   1.073 0 U          3.543e+04  0.00e+00 -   0  193  131 0
# HD1/HG12 I3
 474   0.874   8.166 0 U          2.721e+03  0.00e+00 -   0  193  110 0
# HD1 I3/H V4
 475   0.874   3.708 0 U          6.607e+03  0.00e+00 -   0  193  107 0
# HD1/HA I3
 476   0.874   1.984 0 U          5.893e+03  0.00e+00 -   0  193  129 0
# HD1/HB I3
 477   0.874   0.874 0 U          1.331e+06  0.00e+00 -   0  193  193 0
# HD1/HD1 I3
 478   0.874   8.601 0 U          2.821e+03  0.00e+00 -   0  193  106 0
# HD1/H I3
 479   1.504   8.055 0 U          1.579e+03  0.00e+00 -   0  138  114 0
# HG3/H K5
 480   1.504   1.633 0 U          2.649e+04  0.00e+00 -   0  138  137 0
# HG3/HD K5
 481   1.504   1.356 0 U          1.740e+04  0.00e+00 -   0  138  139 0
# HG3/HG2 K5
 482   1.504   2.922 0 U          1.792e+03  0.00e+00 -   0  138  213 0
# HG3/HE K5
 483   1.504   1.798 0 U          2.679e+03  0.00e+00 -   0  138  136 0
# HG3/HB3 K5
 484   1.504   3.955 0 U          1.846e+03  0.00e+00 -   0  138  115 0
# HG3/HA K5
 485   1.504   1.504 0 U          9.430e+04  0.00e+00 -   0  138  138 0
# HG3/HG3 K5
 486   1.504   1.835 0 U          2.745e+03  0.00e+00 -   0  138  135 0
# HG3/HB2 K5
 487   7.120   0.885 0 U          6.825e+03  0.00e+00 -   0  217  189 0
# HD F7/HD2 L10
 488   7.120   3.103 0 U          1.236e+04  0.00e+00 -   0  217  123 0
# HD/HB3 F7
 489   7.120   7.077 0 U         -1.751e+05  0.00e+00 -   0  217  218 0
# HD/HE F7
 490   7.120   4.240 0 U          1.443e+04  0.00e+00 -   0  217  113 0
# HD/HA F7
 491   7.120   0.751 0 U          1.152e+04  0.00e+00 -   0  217  149 0
# HD F7/HG1 V11
 492   7.120   7.120 0 U          1.602e+06  0.00e+00 -   0  217  217 0
# HD/HD F7
 493   7.120   8.323 0 U          6.045e+03  0.00e+00 -   0  217  112 0
# HD/H F7
 494   7.120   3.236 0 U          1.212e+04  0.00e+00 -   0  217  122 0
# HD/HB2 F7
 495   8.323   4.045 0 U          3.579e+03  0.00e+00 -   0  112  117 0
# H F7/HA R6
 496   8.323   3.643 0 U          2.974e+03  0.00e+00 -   0  112  111 0
# H F7/HA V4
 497   8.323   3.103 0 U          1.369e+04  0.00e+00 -   0  112  123 0
# H/HB3 F7
 498   8.323   7.897 0 U          8.237e+03  0.00e+00 -   0  112  116 0
# H F7/H R6
 499   8.323   7.077 0 U         -1.288e+02  0.00e+00 -   0  112  218 0
# H/HE F7
 500   8.323   4.240 0 U          7.671e+03  0.00e+00 -   0  112  113 0
# H/HA F7
 501   8.323   7.120 0 U          2.048e+03  0.00e+00 -   0  112  217 0
# H/HD F7
 502   8.323   8.323 0 U          1.050e+05  0.00e+00 -   0  112  112 0
# H/H F7
 503   8.323   3.236 0 U          9.821e+03  0.00e+00 -   0  112  122 0
# H/HB2 F7
 504   1.835   8.055 0 U          6.079e+03  0.00e+00 -   0  135  114 0
# HB2/H K5
 505   1.835   1.633 0 U          6.755e+03  0.00e+00 -   0  135  137 0
# HB2/HD K5
 506   1.835   1.356 0 U          5.057e+03  0.00e+00 -   0  135  139 0
# HB2/HG2 K5
 507   1.835   2.922 0 U          8.423e+02  0.00e+00 -   0  135  213 0
# HB2/HE K5
 508   1.835   1.798 0 U          3.591e+04  0.00e+00 -   0  135  136 0
# HB2/HB3 K5
 509   1.835   3.955 0 U          5.157e+03  0.00e+00 -   0  135  115 0
# HB2/HA K5
 510   1.835   1.504 0 U          4.493e+03  0.00e+00 -   0  135  138 0
# HB2/HG3 K5
 511   1.835   1.835 0 U          9.546e+04  0.00e+00 -   0  135  135 0
# HB2/HB2 K5
 512   7.508   4.108 0 U          3.077e+03  0.00e+00 -   0  124  119 0
# H V11/HA L10
 513   7.508   0.885 0 U          2.288e+03  0.00e+00 -   0  124  189 0
# H V11/HD2 L10
 514   7.508   1.596 0 U          3.469e+03  0.00e+00 -   0  124  146 0
# H V11/HB3 L10
 515   7.508   2.022 0 U          4.185e+03  0.00e+00 -   0  124  150 0
# H/HB V11
 516   7.508   0.764 0 U          1.045e+04  0.00e+00 -   0  124  191 0
# H/HG2 V11
 517   7.508   3.987 0 U          5.383e+03  0.00e+00 -   0  124  125 0
# H/HA V11
 518   7.508   7.704 0 U          6.521e+03  0.00e+00 -   0  124  118 0
# H V11/H L10
 519   7.508   1.758 0 U          3.199e+03  0.00e+00 -   0  124  145 0
# H V11/HB2 L10
 520   7.508   0.751 0 U          2.206e+03  0.00e+00 -   0  124  149 0
# H/HG1 V11
 521   7.508   7.508 0 U          1.130e+05  0.00e+00 -   0  124  124 0
# H/H V11
 522   8.601   1.507 0 U          8.267e+03  0.00e+00 -   0  106  178 0
# H/HG13 I3
 523   8.601   0.820 0 U          3.691e+03  0.00e+00 -   0  106  130 0
# H/HG2 I3
 524   8.601   1.073 0 U          5.081e+03  0.00e+00 -   0  106  131 0
# H/HG12 I3
 525   8.601   3.109 0 U          3.232e+03  0.00e+00 -   0  106  160 0
# H I3/HB3 F2
 526   8.601   8.166 0 U          7.138e+03  0.00e+00 -   0  106  110 0
# H I3/H V4
 527   8.601   3.708 0 U          6.506e+03  0.00e+00 -   0  106  107 0
# H/HA I3
 528   8.601   1.984 0 U          1.550e+04  0.00e+00 -   0  106  129 0
# H/HB I3
 529   8.601   3.233 0 U          1.759e+03  0.00e+00 -   0  106  159 0
# H I3/HB2 F2
 530   8.601   4.470 0 U          6.098e+03  0.00e+00 -   0  106  158 0
# H I3/HA F2
 531   8.601   0.874 0 U          2.714e+03  0.00e+00 -   0  106  193 0
# H/HD1 I3
 532   8.601   8.601 0 U          9.951e+04  0.00e+00 -   0  106  106 0
# H/H I3
 533   1.688   1.398 0 U          2.400e+04  0.00e+00 -   0  140  134 0
# HG3/HG2 K8
 534   1.688   1.741 0 U          3.650e+04  0.00e+00 -   0  140  207 0
# HG3/HD K8
 535   1.688   1.877 0 U          1.089e+04  0.00e+00 -   0  140  133 0
# HG3/HB3 K8
 536   1.688   2.902 0 U          6.896e+03  0.00e+00 -   0  140  211 0
# HG3/HE K8
 537   1.688   3.847 0 U          4.877e+03  0.00e+00 -   0  140  109 0
# HG3/HA K8
 538   1.688   1.931 0 U          8.178e+03  0.00e+00 -   0  140  132 0
# HG3/HB2 K8
 539   1.688   3.955 0 U          2.788e+03  0.00e+00 -   0  140  115 0
# HG3 K8/HA K5
 540   1.688   8.291 0 U          4.962e+03  0.00e+00 -   0  140  108 0
# HG3/H K8
 541   1.688   1.688 0 U          3.471e+05  0.00e+00 -   0  140  140 0
# HG3/HG3 K8
 542   3.236   3.643 0 U          2.818e+03  0.00e+00 -   0  122  111 0
# HB2 F7/HA V4
 543   3.236   3.103 0 U         -6.436e+04  0.00e+00 -   0  122  123 0
# HB2/HB3 F7
 544   3.236   7.077 0 U         -1.746e+02  0.00e+00 -   0  122  218 0
# HB2/HE F7
 545   3.236   4.240 0 U          3.273e+03  0.00e+00 -   0  122  113 0
# HB2/HA F7
 546   3.236   8.291 0 U          1.883e+03  0.00e+00 -   0  122  108 0
# HB2 F7/H K8
 547   3.236   7.120 0 U          2.436e+03  0.00e+00 -   0  122  217 0
# HB2/HD F7
 548   3.236   8.323 0 U          5.573e+03  0.00e+00 -   0  122  112 0
# HB2/H F7
 549   3.236   3.236 0 U          1.303e+05  0.00e+00 -   0  122  122 0
# HB2/HB2 F7
;

   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   .   .   6313.131   Hz   .   .   .   4.7   .   .   34402   1
      2   .   .   H   1   H   .   .   6302.010   Hz   .   .   .   4.7   .   .   34402   1
   stop_
save_