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                         34366
   _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                    2
   _Spectral_peak_list.Experiment_name                  '2D 1H-1H NOESY'
   _Spectral_peak_list.Experiment_class                 .
   _Spectral_peak_list.Experiment_type                  .
   _Spectral_peak_list.Number_of_spectral_dimensions    2
   _Spectral_peak_list.Chemical_shift_list              .
   _Spectral_peak_list.Assigned_chem_shift_list_ID      1
   _Spectral_peak_list.Assigned_chem_shift_list_label   $assigned_chemical_shifts_1
   _Spectral_peak_list.Details                          .
   _Spectral_peak_list.Text_data_format                 text
   _Spectral_peak_list.Text_data
;
# Number of dimensions 2
# INAME 1 H1y
# INAME 2 H1x
   2   4.426   7.531 1 U          1.012e+04  0.00e+00 -   0   63   74 0
   3   4.426   8.242 1 U          1.049e+04  0.00e+00 -   0   63   61 0
   5   3.161   8.242 1 U          9.486e+03  0.00e+00 -   0   65   61 0
   7   7.531   9.905 1 U          1.798e+04  0.00e+00 -   0   74   78 0
   9   7.531   7.531 1 U          1.352e+05  0.00e+00 -   0   74   74 0
  10   7.300   7.300 1 U          1.104e+06  0.00e+00 -   0   81   81 0
  14   6.753   6.753 1 U          9.821e+04  0.00e+00 -   0   79   79 0
  16   7.257   7.257 1 U          9.949e+06  0.00e+00 -   0   75   75 0
  23   3.946   8.235 1 U          2.307e+04  0.00e+00 -   0  110  108 0
  24   3.980   8.235 1 U          4.320e+03  0.00e+00 -   0  114  108 0
  32   4.275   7.669 1 U          6.927e+03  0.00e+00 -   0   27   25 0
  33   1.947   7.669 1 U          8.108e+03  0.00e+00 -   0   29   25 0
  38   3.161   7.531 1 U          1.297e+04  0.00e+00 -   0   65   74 0
  39   4.062   7.255 1 U          1.754e+04  0.00e+00 -   0   87   85 0
  40   2.869   7.255 1 U          3.972e+03  0.00e+00 -   0   90   85 0
  42   2.418   7.255 1 U          3.886e+03  0.00e+00 -   0   89   85 0
  44   3.345   8.242 1 U          6.781e+03  0.00e+00 -   0   66   61 0
  50   4.301   8.062 1 U          8.425e+03  0.00e+00 -   0  146  144 0
  51   3.161   8.062 1 U          1.020e+04  0.00e+00 -   0  150  144 0
  53   3.704   8.287 1 U          6.950e+03  0.00e+00 -   0  169  167 0
  55   1.460   8.287 1 U          8.498e+03  0.00e+00 -   0  171  167 0
  56   1.339   8.287 1 U          7.623e+03  0.00e+00 -   0  175  167 0
  57   0.725   8.287 1 U          8.897e+03  0.00e+00 -   0  186  167 0
  63   4.074   7.747 1 U          1.091e+04  0.00e+00 -   0  120  118 0
  67   1.900   7.747 1 U          1.481e+04  0.00e+00 -   0  124  118 0
  68   1.666   7.747 1 U          3.455e+03  0.00e+00 -   0  132  118 0
  69   1.421   7.747 1 U          5.520e+03  0.00e+00 -   0  127  118 0
  76   4.165   7.601 1 U          2.057e+04  0.00e+00 -   0  198  196 0
  78   1.700   7.601 1 U          1.831e+04  0.00e+00 -   0  205  196 0
  79   1.604   7.601 1 U          9.683e+03  0.00e+00 -   0  204  196 0
  81   2.869   7.007 1 U          1.022e+04  0.00e+00 -   0   90  104 0
  82   4.062   7.007 1 U          1.215e+04  0.00e+00 -   0   87  104 0
  83   4.301   7.132 1 U          2.863e+04  0.00e+00 -   0  146  163 0
  85   3.161   7.132 1 U          2.758e+04  0.00e+00 -   0  150  163 0
  92   3.726   7.601 1 U          1.037e+04  0.00e+00 -   0  192  196 0
  93   3.829   7.601 1 U          7.611e+03  0.00e+00 -   0  191  196 0
  94   3.829   8.071 1 U          1.794e+04  0.00e+00 -   0  191  189 0
  95   3.726   8.071 1 U          1.916e+04  0.00e+00 -   0  192  189 0
  99   3.932   7.603 1 U          1.587e+04  0.00e+00 -   0  226  224 0
 107   0.746   7.603 1 U          1.226e+04  0.00e+00 -   0  229  224 0
 108   0.588   7.603 1 U          5.568e+03  0.00e+00 -   0  238  224 0
 109   4.249   8.020 1 U          1.279e+04  0.00e+00 -   0  247  245 0
 110   1.696   8.020 1 U          2.904e+04  0.00e+00 -   0  251  245 0
 111   1.531   8.020 1 U          1.289e+04  0.00e+00 -   0  253  245 0
 112   0.845   8.020 1 U          1.802e+04  0.00e+00 -   0  264  245 0
 116   0.746   8.020 1 U          8.118e+03  0.00e+00 -   0  229  245 0
 143   4.503   7.669 1 U          1.602e+04  0.00e+00 -   0    4   25 0
 144   3.239   7.669 1 U          7.522e+03  0.00e+00 -   0    8   25 0
 149   9.905   7.300 1 U          2.593e+04  0.00e+00 -   0   78   81 0
 150   9.905   7.531 1 U          2.813e+04  0.00e+00 -   0   78   74 0
 169   8.287   8.287 1 U          2.805e+04  0.00e+00 -   0  167  167 0
 170   8.235   8.235 1 U          7.113e+04  0.00e+00 -   0  108  108 0
 171   8.071   8.071 1 U          3.927e+04  0.00e+00 -   0  189  189 0
 172   8.020   8.020 1 U          5.611e+04  0.00e+00 -   0  245  245 0
 173   8.062   8.062 1 U          2.092e+04  0.00e+00 -   0  144  144 0
 174   7.669   7.669 1 U          3.468e+04  0.00e+00 -   0   25   25 0
 175   7.747   7.747 1 U          2.904e+04  0.00e+00 -   0  118  118 0
 176   8.242   8.242 1 U         -8.843e+03  0.00e+00 -   0   61   61 0
 177   7.601   7.601 1 U          5.302e+04  0.00e+00 -   0  196  196 0
 178   7.603   7.603 1 U          5.362e+04  0.00e+00 -   0  224  224 0
 185   7.397   7.397 1 U          4.946e+04  0.00e+00 -   0  138  138 0
 186   7.255   7.255 1 U         -8.828e+06  0.00e+00 -   0   85   85 0
 187   7.270   7.270 1 U         -1.037e+06  0.00e+00 -   0  212  212 0
 188   7.007   7.007 1 U          2.363e+05  0.00e+00 -   0  104  104 0
 189   7.132   7.132 1 U          1.492e+06  0.00e+00 -   0  163  163 0
 193   9.905   9.905 1 U          5.627e+04  0.00e+00 -   0   78   78 0
 194   0.747   9.905 1 U          5.705e+03  0.00e+00 -   0   40   78 0
 204   7.747   8.062 1 U          5.070e+03  0.00e+00 -   0  118  144 0
 206   8.287   8.071 1 U          1.059e+04  0.00e+00 -   0  167  189 0
 207   8.071   8.287 1 U          5.406e+03  0.00e+00 -   0  189  167 0
 209   8.062   8.287 1 U          5.241e+03  0.00e+00 -   0  144  167 0
 210   8.235   7.747 1 U          5.536e+03  0.00e+00 -   0  108  118 0
 211   7.747   8.235 1 U          6.492e+03  0.00e+00 -   0  118  108 0
 215   8.235   7.255 1 U          5.383e+03  0.00e+00 -   0  108   85 0
 217   7.255   8.235 1 U          3.721e+03  0.00e+00 -   0   85  108 0
 224   7.132   8.287 1 U          3.750e+03  0.00e+00 -   0  163  167 0
 225   8.287   7.132 1 U          1.048e+04  0.00e+00 -   0    0  163 0
 233   8.062   7.132 1 U          1.125e+04  0.00e+00 -   0  144    0 0
 234   7.132   8.062 1 U          3.568e+03  0.00e+00 -   0  163  144 0
 239   7.255   7.007 1 U          1.025e+04  0.00e+00 -   0   85  104 0
 242   7.007   7.255 1 U          7.425e+03  0.00e+00 -   0  104   85 0
 244   0.588   0.588 1 U          7.898e+05  0.00e+00 -   0  238  238 0
 245   0.747   0.747 1 U          1.953e+07  0.00e+00 -   0   40   40 0
 246   0.845   0.845 1 U          2.254e+06  0.00e+00 -   0  264  264 0
 247   0.746   0.746 1 U         -1.800e+07  0.00e+00 -   0  229  229 0
 248   1.338   1.338 1 U         -4.956e+05  0.00e+00 -   0  126  126 0
 249   1.421   1.421 1 U          1.015e+05  0.00e+00 -   0  127  127 0
 250   1.339   1.339 1 U          5.813e+05  0.00e+00 -   0  175  175 0
 251   1.460   1.460 1 U          1.192e+05  0.00e+00 -   0  171  171 0
 252   1.546   1.546 1 U          1.289e+05  0.00e+00 -   0  172  172 0
 254   1.666   1.666 1 U          4.434e+05  0.00e+00 -   0  132  132 0
 255   1.604   1.604 1 U          1.313e+05  0.00e+00 -   0  204  204 0
 256   1.700   1.700 1 U          5.818e+05  0.00e+00 -   0  205  205 0
 257   1.900   1.900 1 U          1.156e+05  0.00e+00 -   0  124  124 0
 258   1.954   1.954 1 U          7.540e+04  0.00e+00 -   0  202  202 0
 259   2.410   2.410 1 U          1.885e+04  0.00e+00 -   0   49   49 0
 260   2.813   2.813 1 U          3.063e+04  0.00e+00 -   0   53   53 0
 261   2.418   2.418 1 U          9.954e+03  0.00e+00 -   0   89   89 0
 262   2.951   2.951 1 U          5.897e+05  0.00e+00 -   0  136  136 0
 263   3.161   3.161 1 U          5.788e+04  0.00e+00 -   0  150  150 0
 264   2.869   2.869 1 U          2.033e+04  0.00e+00 -   0   90   90 0
 266   3.161   3.161 1 U          5.788e+04  0.00e+00 -   0   65   65 0
 268   3.169   3.169 1 U          7.702e+04  0.00e+00 -   0  208  208 0
 269   3.247   3.247 1 U          1.238e+05  0.00e+00 -   0  209  209 0
 270   3.345   3.345 1 U          8.266e+04  0.00e+00 -   0   66   66 0
 271   3.239   3.239 1 U          2.625e+05  0.00e+00 -   0    8    8 0
 272   3.829   3.829 1 U          8.082e+04  0.00e+00 -   0  191  191 0
 273   3.726   3.726 1 U          8.258e+04  0.00e+00 -   0  192  192 0
 274   4.275   4.275 1 U          7.403e+04  0.00e+00 -   0   27   27 0
 275   3.932   3.932 1 U         -2.543e+04  0.00e+00 -   0  226  226 0
 276   3.980   3.980 1 U          4.825e+04  0.00e+00 -   0  114  114 0
 278   4.074   4.074 1 U          3.111e+05  0.00e+00 -   0  120  120 0
 279   4.165   4.165 1 U          3.561e+05  0.00e+00 -   0  198  198 0
 280   4.062   4.062 1 U         -1.329e+05  0.00e+00 -   0   87   87 0
 281   4.701   4.701 1 U          2.153e+04  0.00e+00 -   0   45   45 0
 282   4.249   4.249 1 U          2.322e+05  0.00e+00 -   0  247  247 0
 283   4.301   4.301 1 U          1.193e+05  0.00e+00 -   0  146  146 0
 284   4.426   4.426 1 U          6.635e+04  0.00e+00 -   0   63   63 0
 285   1.900   4.426 1 U          6.179e+03  0.00e+00 -   0  124   63 0
 289   2.869   4.062 1 U          3.937e+03  0.00e+00 -   0   90   87 0
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 292   1.460   3.946 1 U          7.738e+03  0.00e+00 -   0  171  110 0
 295   1.696   1.696 1 U         -4.302e+05  0.00e+00 -   0  251  251 0
 299   1.696   3.726 1 U          4.147e+03  0.00e+00 -   0  251  192 0
 301   1.696   3.829 1 U          2.395e+03  0.00e+00 -   0  251  191 0
 302   4.503   4.503 1 U          5.699e+04  0.00e+00 -   0    4    4 0
 303   3.239   4.503 1 U          1.375e+04  0.00e+00 -   0    8    4 0
 306   3.829   1.696 1 U          2.659e+03  0.00e+00 -   0  191  251 0
 309   4.426   1.900 1 U          4.244e+03  0.00e+00 -   0   63  124 0
 313   4.503   3.239 1 U          2.124e+04  0.00e+00 -   0    4    8 0
 316   1.700   3.169 1 U          1.211e+04  0.00e+00 -   0  205  208 0
 317   1.700   3.247 1 U          1.098e+04  0.00e+00 -   0  205  209 0
 318   3.247   1.700 1 U          8.105e+03  0.00e+00 -   0  209  205 0
 319   3.247   1.604 1 U          8.446e+03  0.00e+00 -   0  209  204 0
 322   3.169   1.700 1 U          8.747e+03  0.00e+00 -   0  208  205 0
 323   3.169   1.604 1 U          1.002e+04  0.00e+00 -   0  208  204 0
 324   1.421   2.951 1 U          1.405e+04  0.00e+00 -   0  127  136 0
 325   1.338   2.951 1 U          3.993e+03  0.00e+00 -   0  126  136 0
 326   2.951   1.421 1 U          8.658e+03  0.00e+00 -   0  136  127 0
 327   2.951   1.338 1 U          1.309e+03  0.00e+00 -   0  136  126 0
 328   1.666   2.951 1 U          3.059e+04  0.00e+00 -   0  132  136 0
 329   2.951   1.666 1 U          2.298e+04  0.00e+00 -   0  136  132 0
 330   1.728   7.603 1 U          8.332e+03  0.00e+00 -   0  228  224 0
 331   1.273   7.603 1 U          9.045e+03  0.00e+00 -   0  236  224 0
 332   0.994   7.603 1 U          9.636e+03  0.00e+00 -   0  235  224 0
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 341   4.165   1.604 1 U          1.112e+04  0.00e+00 -   0  198  204 0
 342   3.247   1.954 1 U          5.952e+03  0.00e+00 -   0  209  202 0
 343   3.169   1.954 1 U          6.953e+03  0.00e+00 -   0  208  202 0
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 345   1.606   3.247 1 U          1.187e+04  0.00e+00 -   0  204  209 0
 347   2.418   2.869 1 U          5.760e+03  0.00e+00 -   0   89   90 0
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 352   3.169   3.247 1 U          1.106e+05  0.00e+00 -   0  208  209 0
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 368   1.421   1.338 1 U          1.860e+04  0.00e+00 -   0  127  126 0
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 370   1.954   1.700 1 U          1.895e+04  0.00e+00 -   0  202  205 0
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 372   1.666   1.900 1 U          1.152e+04  0.00e+00 -   0  132  124 0
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 421   1.273   0.994 1 U          3.236e+04  0.00e+00 -   0  236  235 0
 422   1.728   0.994 1 U          9.147e+03  0.00e+00 -   0  228  235 0
 423   1.728   0.746 1 U          4.923e+04  0.00e+00 -   0  228  229 0
 424   1.728   0.588 1 U          2.147e+04  0.00e+00 -   0  228  238 0
 425   1.728   1.273 1 U          1.547e+04  0.00e+00 -   0  228  236 0
 426   0.588   1.728 1 U          1.470e+04  0.00e+00 -   0  238  228 0
 427   0.746   1.728 1 U          2.730e+04  0.00e+00 -   0  229  228 0
 428   0.994   1.728 1 U          1.126e+04  0.00e+00 -   0  235  228 0
 429   1.273   1.728 1 U          1.472e+04  0.00e+00 -   0  236  228 0
 430   1.696   0.845 1 U          1.263e+05  0.00e+00 -   0  251  264 0
 431   0.845   1.696 1 U          5.615e+04  0.00e+00 -   0  264  251 0
 432   0.588   3.932 1 U          1.470e+04  0.00e+00 -   0  238  226 0
 433   0.746   3.932 1 U          3.406e+04  0.00e+00 -   0  229  226 0
 434   0.994   3.932 1 U          1.516e+04  0.00e+00 -   0  235  226 0
 435   1.273   3.932 1 U          1.261e+04  0.00e+00 -   0  236  226 0
 436   1.728   3.932 1 U          3.072e+04  0.00e+00 -   0  228  226 0
 437   3.932   0.588 1 U          1.491e+04  0.00e+00 -   0  226  238 0
 438   3.932   0.746 1 U          4.319e+04  0.00e+00 -   0  226  229 0
 439   3.932   0.994 1 U          8.602e+03  0.00e+00 -   0  226  235 0
 440   3.932   1.273 1 U          8.079e+03  0.00e+00 -   0  226  236 0
 441   3.932   1.728 1 U          2.243e+04  0.00e+00 -   0  226  228 0
 443   4.701   2.813 1 U          1.425e+04  0.00e+00 -   0   45   53 0
 444   4.701   2.410 1 U          9.886e+03  0.00e+00 -   0   45   49 0
 445   2.051   4.701 1 U          1.996e+02  0.00e+00 -   0    0   45 0
 446   2.256   4.701 1 U          1.159e+03  0.00e+00 -   0    0   45 0
 447   0.747   4.275 1 U          3.152e+04  0.00e+00 -   0   40   27 0
 448   1.947   1.947 1 U          1.261e+05  0.00e+00 -   0   29   29 0
 449   0.747   1.947 1 U          3.700e+04  0.00e+00 -   0   40   29 0
 450   1.947   0.747 1 U          5.116e+04  0.00e+00 -   0   29   40 0
 451   4.275   0.747 1 U          4.049e+04  0.00e+00 -   0   27   40 0
 452   1.947   4.275 1 U          1.686e+04  0.00e+00 -   0   29   27 0
 453   2.951   1.900 1 U          2.455e+03  0.00e+00 -   0  136  124 0
 454   0.845   4.249 1 U          7.076e+04  0.00e+00 -   0  264  247 0
 455   4.249   0.845 1 U          8.638e+04  0.00e+00 -   0  247  264 0
 457   4.249   1.696 1 U          1.665e+04  0.00e+00 -   0  247  251 0
 458   1.696   4.249 1 U          3.200e+04  0.00e+00 -   0  251  247 0
 468   6.905   7.300 1 U          8.445e+04  0.00e+00 -   0   82   81 0
 469   6.905   6.905 1 U          1.748e+05  0.00e+00 -   0   82   82 0
 470   7.257   6.753 1 U          3.436e+04  0.00e+00 -   0   75   79 0
 472   8.062   8.235 1 U          3.532e+03  0.00e+00 -   0  144  108 0
 474   3.704   3.704 1 U          1.157e+05  0.00e+00 -   0  169  169 0
 479   7.132   4.301 1 U          1.996e+04  0.00e+00 -   0  163  146 0
 482   7.007   4.062 1 U          5.247e+03  0.00e+00 -   0  104   87 0
 483   7.531   4.426 1 U          5.311e+03  0.00e+00 -   0   74   63 0
 484   7.255   4.062 1 U          8.511e+03  0.00e+00 -   0   85   87 0
 485   7.255   4.426 1 U          6.805e+03  0.00e+00 -   0   85   63 0
 486   8.242   4.426 1 U          1.176e+04  0.00e+00 -   0   61   63 0
 488   7.428   7.428 1 U          8.061e+05  0.00e+00 -   0   21   21 0
 489   7.428   4.503 1 U          9.692e+03  0.00e+00 -   0   21    4 0
 490   7.248   4.503 1 U          4.754e+02  0.00e+00 -   0    0    4 0
 492   8.062   4.301 1 U          1.384e+04  0.00e+00 -   0  144  146 0
 493   8.287   4.301 1 U          6.814e+03  0.00e+00 -   0  167  146 0
 505   8.235   4.062 1 U          5.760e+03  0.00e+00 -   0  108   87 0
 507   7.601   4.165 1 U          2.487e+04  0.00e+00 -   0  196  198 0
 509   7.747   4.074 1 U          1.371e+04  0.00e+00 -   0  118  120 0
 510   8.062   4.074 1 U          1.165e+04  0.00e+00 -   0  144  120 0
 512   8.235   3.946 1 U          2.610e+04  0.00e+00 -   0  108  110 0
 513   8.235   3.980 1 U          2.845e+03  0.00e+00 -   0  108  114 0
 517   8.287   3.704 1 U          7.170e+03  0.00e+00 -   0  167  169 0
 518   8.071   3.726 1 U          9.840e+03  0.00e+00 -   0  189  192 0
 519   8.071   3.829 1 U          1.053e+04  0.00e+00 -   0  189  191 0
 521   8.020   3.932 1 U          1.106e+04  0.00e+00 -   0  245  226 0
 522   7.669   4.275 1 U          7.761e+03  0.00e+00 -   0   25   27 0
 527   7.603   3.932 1 U          1.857e+04  0.00e+00 -   0  224  226 0
 533   8.242   3.345 1 U          3.134e+03  0.00e+00 -   0   61   66 0
 539   8.242   3.161 1 U          6.589e+03  0.00e+00 -   0   61   65 0
 540   7.255   3.161 1 U          1.063e+04  0.00e+00 -   0    0   65 0
 541   7.531   3.161 1 U          5.134e+03  0.00e+00 -   0   74   65 0
 542   7.270   3.169 1 U          1.383e+04  0.00e+00 -   0  212  208 0
 543   7.270   3.247 1 U          1.810e+04  0.00e+00 -   0  212  209 0
 549   7.132   3.161 1 U          7.964e+03  0.00e+00 -   0  163  150 0
 562   3.704   1.460 1 U          6.771e+03  0.00e+00 -   0  169  171 0
 563   3.704   1.339 1 U          7.954e+03  0.00e+00 -   0  169  175 0
 564   3.704   1.546 1 U          9.066e+03  0.00e+00 -   0  169  172 0
 565   1.546   3.704 1 U          1.213e+04  0.00e+00 -   0  172  169 0
 566   1.460   3.704 1 U          6.882e+03  0.00e+00 -   0  171  169 0
 567   1.339   3.704 1 U          1.176e+04  0.00e+00 -   0  175  169 0
 569   4.074   1.421 1 U          1.260e+04  0.00e+00 -   0  120  127 0
 570   4.074   1.338 1 U          3.330e+03  0.00e+00 -   0  120  126 0
 571   4.074   1.900 1 U          1.963e+04  0.00e+00 -   0  120  124 0
 572   1.900   4.074 1 U          3.527e+04  0.00e+00 -   0  124  120 0
 573   1.666   4.074 1 U          1.298e+04  0.00e+00 -   0  132  120 0
 574   1.421   4.074 1 U          1.528e+04  0.00e+00 -   0  127  120 0
 575   4.074   1.666 1 U          1.069e+04  0.00e+00 -   0  120  132 0
 576   1.338   4.074 1 U          4.759e+03  0.00e+00 -   0  126  120 0
 585   7.669   1.947 1 U          7.303e+03  0.00e+00 -   0   25   29 0
 586   7.601   1.954 1 U          1.993e+04  0.00e+00 -   0  196  202 0
 588   8.062   1.900 1 U          4.773e+03  0.00e+00 -   0  144  124 0
 591   7.747   1.900 1 U          1.077e+04  0.00e+00 -   0  118  124 0
 592   8.020   1.728 1 U          1.054e+04  0.00e+00 -   0  245  228 0
 595   7.603   1.728 1 U          1.177e+04  0.00e+00 -   0  224  228 0
 596   8.020   1.696 1 U          1.570e+04  0.00e+00 -   0  245  251 0
 597   7.601   1.700 1 U          1.231e+04  0.00e+00 -   0  196  205 0
 601   8.287   1.546 1 U          8.815e+03  0.00e+00 -   0  167  172 0
 603   8.287   1.460 1 U          8.827e+03  0.00e+00 -   0  167  171 0
 604   8.287   1.339 1 U          6.283e+03  0.00e+00 -   0  167  175 0
 605   8.071   1.546 1 U          7.839e+03  0.00e+00 -   0  189  172 0
 606   8.071   1.460 1 U          5.992e+03  0.00e+00 -   0  189  171 0
 607   8.071   1.339 1 U          4.619e+03  0.00e+00 -   0  189  175 0
 615   7.603   1.273 1 U          7.181e+03  0.00e+00 -   0  224  236 0
 616   8.020   1.273 1 U          4.055e+03  0.00e+00 -   0  245  236 0
 619   8.020   0.845 1 U          2.555e+04  0.00e+00 -   0  245  264 0
 620   8.020   0.746 1 U          1.102e+04  0.00e+00 -   0  245  229 0
 621   8.020   0.588 1 U          3.761e+03  0.00e+00 -   0  245  238 0
 622   7.603   0.588 1 U          7.204e+03  0.00e+00 -   0  224  238 0
 623   7.603   0.746 1 U          1.736e+04  0.00e+00 -   0  224  229 0
 641   4.275   1.947 1 U          1.508e+04  0.00e+00 -   0   27   29 0
 659   1.546   8.287 1 U          1.108e+04  0.00e+00 -   0  172  167 0
 666   3.345   7.531 1 U          9.647e+03  0.00e+00 -   0   66   74 0
 669   2.869   8.235 1 U          5.376e+03  0.00e+00 -   0   90  108 0
 684   3.161   8.287 1 U          6.647e+03  0.00e+00 -   0  150  167 0
 686   4.301   8.287 1 U          4.773e+03  0.00e+00 -   0  146  167 0
 695   1.546   8.071 1 U          8.019e+03  0.00e+00 -   0  172  189 0
 696   1.460   8.071 1 U          5.828e+03  0.00e+00 -   0  171  189 0
 697   1.339   8.071 1 U          6.198e+03  0.00e+00 -   0  175  189 0
 698   0.725   8.071 1 U          5.883e+03  0.00e+00 -   0  186  189 0
 700   4.701   8.242 1 U          1.302e+04  0.00e+00 -   0   45   61 0
 702   3.345   7.255 1 U          1.181e+04  0.00e+00 -   0   66    0 0
 704   3.161   7.007 1 U          4.680e+03  0.00e+00 -   0   65  104 0
 712   4.074   8.062 1 U          9.912e+03  0.00e+00 -   0  120  144 0
 713   1.900   8.062 1 U          7.795e+03  0.00e+00 -   0  124  144 0
 718   3.247   7.270 1 U          2.026e+04  0.00e+00 -   0  209  212 0
 723   4.426   7.255 1 U          9.936e+03  0.00e+00 -   0   63   85 0
 726   3.169   7.270 1 U          9.407e+03  0.00e+00 -   0  208  212 0
 752   3.704   8.020 1 U          5.378e+03  0.00e+00 -   0  169  245 0
 764   1.728   3.704 1 U          6.492e+03  0.00e+00 -   0  228  169 0
 765   2.418   7.007 1 U          8.158e+03  0.00e+00 -   0   89  104 0
 766   7.601   8.071 1 U          9.594e+03  0.00e+00 -   0  196  189 0
 767   2.418   7.134 1 U          3.761e+03  0.00e+00 -   0   89  105 0
 768   2.869   7.134 1 U          5.640e+03  0.00e+00 -   0   90  105 0
 771   4.062   7.134 1 U          1.104e+04  0.00e+00 -   0   87  105 0
 773   3.932   8.020 1 U          9.168e+03  0.00e+00 -   0  226  245 0
 774   7.603   8.020 1 U          1.504e+04  0.00e+00 -   0  224  245 0
 776   4.275   4.156 1 U          1.762e+04  0.00e+00 -   0   27  302 0
 777   4.156   4.275 1 U          1.424e+04  0.00e+00 -   0  302   27 0
 778   4.156   4.156 1 U         -1.386e+05  0.00e+00 -   0  302  302 0
 780   4.156   2.813 1 U          8.704e+03  0.00e+00 -   0  302   53 0
 781   4.156   2.410 1 U          5.890e+03  0.00e+00 -   0  302   49 0
 783   3.239   7.428 1 U          4.666e+04  0.00e+00 -   0    8   21 0
 784   4.503   7.428 1 U          3.027e+04  0.00e+00 -   0    4   21 0
 785   0.747   7.669 1 U          1.780e+04  0.00e+00 -   0   40   25 0
 786   7.669   0.747 1 U          2.187e+04  0.00e+00 -   0   25   40 0
 787   6.905   6.753 1 U          3.872e+04  0.00e+00 -   0   82   79 0
 788   6.753   6.905 1 U          4.621e+04  0.00e+00 -   0   79   82 0
 789   6.753   7.257 1 U          4.409e+04  0.00e+00 -   0   79   75 0
 790   7.300   6.905 1 U          7.054e+04  0.00e+00 -   0   81   82 0
 792   3.161   7.257 1 U          2.930e+04  0.00e+00 -   0   65    0 0
 793   3.946   3.946 1 U          6.289e+05  0.00e+00 -   0  110  110 0
 794   1.954   7.601 1 U          3.332e+04  0.00e+00 -   0  202  196 0
 795   0.725   0.725 1 U          1.939e+06  0.00e+00 -   0  186  186 0
 796   3.704   0.725 1 U          3.436e+04  0.00e+00 -   0  169  186 0
 798   1.954   7.270 1 U          1.019e+04  0.00e+00 -   0    0  212 0
 799   1.708   7.270 1 U          6.191e+03  0.00e+00 -   0    0  212 0
 800   1.605   7.270 1 U          1.087e+04  0.00e+00 -   0    0  212 0
 801   8.020   7.603 1 U          1.766e+04  0.00e+00 -   0  245  224 0
 802   1.912   8.235 1 U          4.131e+03  0.00e+00 -   0  124  108 0
 803   0.747   7.428 1 U          1.620e+04  0.00e+00 -   0   40   21 0
 805   1.460   7.132 1 U          1.297e+04  0.00e+00 -   0  171  163 0
 806   1.546   7.132 1 U          7.408e+03  0.00e+00 -   0  172  163 0
 808   1.950   3.169 1 U          1.329e+04  0.00e+00 -   0  202  208 0
 809   1.953   3.247 1 U          1.247e+04  0.00e+00 -   0  202  209 0
 810   0.845   3.932 1 U          8.308e+03  0.00e+00 -   0  264  226 0
 812   8.062   7.747 1 U          5.150e+03  0.00e+00 -   0  144  118 0
 813   1.900   2.951 1 U          6.115e+03  0.00e+00 -   0  124  136 0
 814   0.746   3.169 1 U          4.241e+03  0.00e+00 -   0    0    0 0
 815   0.746   3.247 1 U          9.313e+03  0.00e+00 -   0    0    0 0
 818   7.133   0.588 1 U          1.675e+04  0.00e+00 -   0    0  238 0
 820   7.120   0.725 1 U          3.677e+04  0.00e+00 -   0    0  186 0
 821   7.134   0.994 1 U          1.720e+03  0.00e+00 -   0    0  235 0
 822   7.603   0.994 1 U          7.318e+03  0.00e+00 -   0  224  235 0
 823   8.020   0.994 1 U          2.656e+03  0.00e+00 -   0  245  235 0
 824   3.932   0.845 1 U          9.203e+03  0.00e+00 -   0  226  264 0
 826   3.239   7.006 1 U          6.190e+03  0.00e+00 -   0    8    0 0
 831   3.946   7.748 1 U          9.946e+03  0.00e+00 -   0  110  118 0
 832   4.062   8.235 1 U          7.094e+03  0.00e+00 -   0   87  108 0
 833   3.239   7.305 1 U          5.573e+03  0.00e+00 -   0    8   22 0
 834   0.747   7.299 1 U          1.591e+04  0.00e+00 -   0    0    0 0
 835   2.813   8.242 1 U          5.752e+03  0.00e+00 -   0   53   61 0
 836   2.410   8.242 1 U          8.420e+03  0.00e+00 -   0   49   61 0
 837   4.503   7.305 1 U          6.186e+03  0.00e+00 -   0    4   22 0
 839   4.275   8.242 1 U          2.435e+03  0.00e+00 -   0   27   61 0
 840   4.426   7.747 1 U          2.471e+03  0.00e+00 -   0   63  118 0
 841   4.062   3.161 1 U          3.586e+03  0.00e+00 -   0   87  150 0
 842   3.946   1.547 1 U          6.387e+03  0.00e+00 -   0  110  172 0
 843   3.946   1.460 1 U          6.306e+03  0.00e+00 -   0  110  171 0
 844   4.301   7.601 1 U          6.491e+03  0.00e+00 -   0  146  196 0
 845   3.704   1.730 1 U          6.090e+03  0.00e+00 -   0  169  228 0
 846   3.704   0.994 1 U          4.364e+03  0.00e+00 -   0  169  235 0
 847   3.704   0.588 1 U          7.602e+03  0.00e+00 -   0  169  238 0
 848   4.701   7.533 1 U          4.812e+03  0.00e+00 -   0   45   74 0
 849   7.303   9.905 1 U          1.488e+04  0.00e+00 -   0   81   78 0
 850   4.275   7.428 1 U          3.989e+03  0.00e+00 -   0   27   21 0
 851   0.725   7.007 1 U          1.398e+04  0.00e+00 -   0  186  104 0
 852   3.161   7.173 1 U          6.751e+03  0.00e+00 -   0  150  164 0
 853   4.301   7.173 1 U          4.288e+03  0.00e+00 -   0  146  164 0
 854   7.173   7.173 1 U          9.960e+05  0.00e+00 -   0  164  164 0
 855   0.588   7.174 1 U          1.529e+04  0.00e+00 -   0  238  164 0
 856   0.588   7.133 1 U          2.218e+04  0.00e+00 -   0  238  163 0
 857   0.845   7.604 1 U          5.957e+03  0.00e+00 -   0  264  224 0
 858   1.273   7.133 1 U          6.356e+03  0.00e+00 -   0  236  163 0
 859   0.994   7.135 1 U          5.576e+03  0.00e+00 -   0  235  163 0
 860   1.696   6.985 1 U          5.648e+03  0.00e+00 -   0  251  310 0
 861   8.020   6.985 1 U          7.034e+03  0.00e+00 -   0  245  310 0
 862   6.985   8.020 1 U          8.227e+03  0.00e+00 -   0  310  245 0
 863   6.985   6.985 1 U          1.343e+05  0.00e+00 -   0  310  310 0
 864   8.242   7.532 1 U          1.641e+04  0.00e+00 -   0   61   74 0
 865   0.845   6.985 1 U          4.004e+03  0.00e+00 -   0  264  310 0
 866   3.161   6.756 1 U          4.773e+03  0.00e+00 -   0    0   79 0
 867   4.062   6.756 1 U          4.750e+03  0.00e+00 -   0   87   79 0
 868   3.946   8.288 1 U          5.118e+03  0.00e+00 -   0  110  167 0
 869   0.994   3.705 1 U          6.572e+03  0.00e+00 -   0  235  169 0
 870   0.746   3.705 1 U          2.079e+04  0.00e+00 -   0  229  169 0
 871   0.588   3.705 1 U          6.757e+03  0.00e+00 -   0  238  169 0
 872   4.165   8.020 1 U          2.947e+03  0.00e+00 -   0  198  245 0
;

   loop_
      _Spectral_dim.ID
      _Spectral_dim.Axis_code
      _Spectral_dim.Spectrometer_frequency
      _Spectral_dim.Atom_type
      _Spectral_dim.Atom_isotope_number
      _Spectral_dim.Spectral_region
      _Spectral_dim.Magnetization_linkage_ID
      _Spectral_dim.Under_sampling_type
      _Spectral_dim.Sweep_width
      _Spectral_dim.Sweep_width_units
      _Spectral_dim.Value_first_point
      _Spectral_dim.Absolute_peak_positions
      _Spectral_dim.Acquisition
      _Spectral_dim.Center_frequency_offset
      _Spectral_dim.Encoding_code
      _Spectral_dim.Encoded_reduced_dimension_ID
      _Spectral_dim.Entry_ID
      _Spectral_dim.Spectral_peak_list_ID

      1   .   .   H   1   H   .   .   14   ppm   .   .   .   4.76   .   .   34366   1
      2   .   .   H   1   H   .   .   14   ppm   .   .   .   4.76   .   .   34366   1
   stop_
save_