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                         30763
   _Spectral_peak_list.ID                               1
   _Spectral_peak_list.Name                             .
   _Spectral_peak_list.Sample_ID                        1
   _Spectral_peak_list.Sample_label                     $sample_1
   _Spectral_peak_list.Sample_condition_list_ID         1
   _Spectral_peak_list.Sample_condition_list_label      $sample_conditions_1
   _Spectral_peak_list.Chem_shift_reference_ID          1
   _Spectral_peak_list.Chem_shift_reference_label       $chem_shift_reference_1
   _Spectral_peak_list.Experiment_ID                    8
   _Spectral_peak_list.Experiment_name                  '3D SIMUTANEOUS 1H, 15N, 13C NOESY'
   _Spectral_peak_list.Experiment_class                 .
   _Spectral_peak_list.Experiment_type                  .
   _Spectral_peak_list.Number_of_spectral_dimensions    3
   _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                          '15N NOE peaks'
   _Spectral_peak_list.Text_data_format                 text
   _Spectral_peak_list.Text_data
;
# Number of dimensions 3
#INAME 1 15N
#INAME 2 H1
#INAME 3 1H
   2 123.774   4.528   8.477 1 U         -2.822e+04  0.00e+00 m   0   51   29   52 0 #N 4, HA 3, HN 4, 
   3 123.774   1.839   8.477 1 U         -3.647e+03  0.00e+00 m   0   51   31   52 0 #N 4, HB2 3, HN 4, 
   4 123.774   1.780   8.477 1 U         -4.522e+03  0.00e+00 m   0   51   32   52 0 #N 4, HB3 3, HN 4, 
   5 123.774   1.468   8.477 1 U         -2.315e+03  0.00e+00 m   0   51   35   52 0 #N 4, HG2 3, HN 4, 
   6 123.774   1.425   8.477 1 U         -2.839e+03  0.00e+00 m   0   51   36   52 0 #N 4, HG3 3, HN 4, 
   7 123.774   1.652   8.477 1 U         -1.032e+03  0.00e+00 m   0   51   39   52 0 #N 4, HD2 3, HN 4, 
  11 126.474   8.477   8.393 1 U         -5.367e+03  0.00e+00 m   0   69   52   70 0 #N 5, HN 4, HN 5, 
  12 126.474   4.939   8.393 1 U         -2.895e+04  0.00e+00 m   0   69   54   70 0 #N 5, HA 4, HN 5, 
  13 126.474   2.165   8.393 1 U         -2.855e+03  0.00e+00 m   0   69   56   70 0 #N 5, HB 4, HN 5, 
  14 126.474   0.856   8.393 1 U         -2.304e+04  0.00e+00 m   0   69   57   70 0 #N 5, QG1 4, HN 5, 
  15 126.474   0.996   8.393 1 U         -5.841e+03  0.00e+00 m   0   69   58   70 0 #N 5, QG2 4, HN 5, 
  16 126.797   8.393   8.883 1 U         -2.803e+03  0.00e+00 m   0   87   70   88 0 #N 6, HN 5, HN 6, 
  17 126.797   5.157   8.883 1 U         -2.813e+04  0.00e+00 m   0   87   72   88 0 #N 6, HA 5, HN 6, 
  18 126.797   1.727   8.883 1 U         -6.556e+03  0.00e+00 m   0   87   74   88 0 #N 6, HB 5, HN 6, 
  19 126.797   0.887   8.883 1 U         -1.073e+04  0.00e+00 m   0   87   75   88 0 #N 6, QG1 5, HN 6, 
  20 126.797   0.754   8.883 1 U         -2.291e+04  0.00e+00 m   0   87   76   88 0 #N 6, QG2 5, HN 6, 
  21 130.099   8.883   8.725 1 U         -3.897e+03  0.00e+00 m   0  110   88  111 0 #N 7, HN 6, HN 7, 
  22 130.099   5.461   8.725 1 U         -2.561e+04  0.00e+00 m   0  110   90  111 0 #N 7, HA 6, HN 7, 
  23 130.099   2.866   8.725 1 U         -1.886e+03  0.00e+00 m   0  110   92  111 0 #N 7, HB2 6, HN 7, 
  24 130.099   2.548   8.725 1 U         -2.703e+03  0.00e+00 m   0  110   93  111 0 #N 7, HB3 6, HN 7, 
  26 130.099   6.920   8.725 1 U         -3.293e+03  0.00e+00 m   0  110  108  111 0 #N 7, QD 6, HN 7, 
  27 115.631   8.725   8.116 1 U         -2.315e+03  0.00e+00 m   0  132  111  133 0 #N 8, HN 7, HN 8, 
  28 115.631   5.365   8.116 1 U         -2.959e+04  0.00e+00 m   0  132  113  133 0 #N 8, HA 7, HN 8, 
  29 115.631   1.485   8.116 1 U         -2.164e+03  0.00e+00 m   0  132  115  133 0 #N 8, HB2 7, HN 8, 
  30 115.631   0.945   8.116 1 U         -6.210e+03  0.00e+00 m   0  132  116  133 0 #N 8, HB3 7, HN 8, 
  31 115.631   1.211   8.116 1 U         -5.206e+03  0.00e+00 m   0  132  119  133 0 #N 8, HG 7, HN 8, 
  32 115.631   0.574   8.116 1 U         -2.012e+04  0.00e+00 m   0  132  120  133 0 #N 8, QD1 7, HN 8, 
  33 115.631   0.647   8.116 1 U         -3.466e+03  0.00e+00 m   0  132  121  133 0 #N 8, QD2 7, HN 8, 
  34 118.290   8.116   8.318 1 U         -2.835e+03  0.00e+00 m   0  142  133  143 0 #N 9, HN 8, HN 9, 
  35 118.290   4.577   8.318 1 U         -2.192e+04  0.00e+00 m   0  142  135  143 0 #N 9, HA 8, HN 9, 
  36 118.290   3.286   8.318 1 U         -2.883e+03  0.00e+00 m   0  142  137  143 0 #N 9, HB2 8, HN 9, 
  37 118.290   3.799   8.318 1 U         -3.265e+03  0.00e+00 m   0  142  138  143 0 #N 9, HB3 8, HN 9, 
  38 121.660   8.318   8.287 1 U         -7.108e+04  0.00e+00 m   0  153  143  154 0 #N 10, HN 9, HN 10, 
  39 121.660   4.871   8.287 1 U         -9.884e+03  0.00e+00 m   0  153  145  154 0 #N 10, HA 9, HN 10, 
  41 121.660   3.070   8.287 1 U         -1.297e+04  0.00e+00 m   0  153  148  154 0 #N 10, HB3 9, HN 10, 
  42 126.131   8.287   9.026 1 U         -1.093e+04  0.00e+00 m   0  164  154  165 0 #N 11, HN 10, HN 11, 
  43 126.131   4.858   9.026 1 U         -1.632e+04  0.00e+00 m   0  164  156  165 0 #N 11, HA 10, HN 11, 
  44 126.131   3.057   9.026 1 U         -1.093e+03  0.00e+00 m   0  164  158  165 0 #N 11, HB2 10, HN 11, 
  45 126.131   2.549   9.026 1 U         -3.494e+03  0.00e+00 m   0  164  159  165 0 #N 11, HB3 10, HN 11, 
  46 119.136   9.026   8.306 1 U         -1.452e+04  0.00e+00 m   0  182  165  183 0 #N 12, HN 11, HN 12, 
  47 119.136   3.994   8.306 1 U         -5.102e+03  0.00e+00 m   0  182  167  183 0 #N 12, HA 11, HN 12, 
  48 119.136   2.115   8.306 1 U         -2.507e+04  0.00e+00 m   0  182  169  183 0 #N 12, HB2 11, HN 12, 
  49 119.136   2.218   8.306 1 U         -3.595e+04  0.00e+00 m   0  182  170  183 0 #N 12, HB3 11, HN 12, 
  50 119.136   2.477   8.306 1 U         -4.311e+03  0.00e+00 m   0  182  173  183 0 #N 12, HG2 11, HN 12, 
  51 119.136   2.519   8.306 1 U         -3.128e+03  0.00e+00 m   0  182  174  183 0 #N 12, HG3 11, HN 12, 
  54 119.899   8.306   7.727 1 U         -2.940e+04  0.00e+00 m   0  197  183  198 0 #N 13, HN 12, HN 13, 
  55 119.899   4.147   7.727 1 U         -5.728e+03  0.00e+00 m   0  197  185  198 0 #N 13, HA 12, HN 13, 
  56 119.899   2.185   7.727 1 U         -3.640e+04  0.00e+00 m   0  197  187  198 0 #N 13, HB2 12, HN 13, 
  57 119.899   2.212   7.727 1 U         -2.163e+04  0.00e+00 m   0  197  188  198 0 #N 13, HB3 12, HN 13, 
  58 119.899   2.195   7.727 1 U         -2.163e+04  0.00e+00 m   0  197  191  198 0 #N 13, HG2 12, HN 13, 
  59 119.899   2.421   7.727 1 U         -2.546e+03  0.00e+00 m   0  197  192  198 0 #N 13, HG3 12, HN 13, 
  60 120.959   7.727   8.086 1 U         -1.579e+04  0.00e+00 m   0  218  198  219 0 #N 14, HN 13, HN 14, 
  61 120.959   3.734   8.086 1 U         -2.326e+03  0.00e+00 m   0  218  200  219 0 #N 14, HA 13, HN 14, 
  62 120.959   2.144   8.086 1 U         -1.183e+04  0.00e+00 m   0  218  202  219 0 #N 14, HB 13, HN 14, 
  63 120.959   1.113   8.086 1 U         -5.857e+03  0.00e+00 m   0  218  203  219 0 #N 14, QG2 13, HN 14, 
  64 120.959   1.727   8.086 1 U         -1.395e+03  0.00e+00 m   0  218  209  219 0 #N 14, HG12 13, HN 14, 
  65 120.959   1.053   8.086 1 U         -5.166e+03  0.00e+00 m   0  218  210  219 0 #N 14, HG13 13, HN 14, 
  66 120.959   0.848   8.086 1 U         -1.409e+03  0.00e+00 m   0  218  212  219 0 #N 14, QD1 13, HN 14, 
  67 119.194   8.086   8.121 1 U         -3.795e+04  0.00e+00 m   0  239  219  240 0 #N 15, HN 14, HN 15, 
  68 119.194   3.504   8.121 1 U         -2.815e+03  0.00e+00 m   0  239  221  240 0 #N 15, HA 14, HN 15, 
  69 119.194   2.070   8.121 1 U         -2.220e+04  0.00e+00 m   0  239  223  240 0 #N 15, HB 14, HN 15, 
  70 119.194   0.945   8.121 1 U         -9.248e+03  0.00e+00 m   0  239  224  240 0 #N 15, QG2 14, HN 15, 
  71 119.194   1.910   8.121 1 U         -2.278e+03  0.00e+00 m   0  239  230  240 0 #N 15, HG12 14, HN 15, 
  72 119.194   1.024   8.121 1 U         -1.566e+03  0.00e+00 m   0  239  231  240 0 #N 15, HG13 14, HN 15, 
  73 119.194   0.897   8.121 1 U         -3.040e+03  0.00e+00 m   0  239  233  240 0 #N 15, QD1 14, HN 15, 
  74 119.136   8.121   7.792 1 U         -1.258e+04  0.00e+00 m   0  254  240  255 0 #N 16, HN 15, HN 16, 
  75 119.136   4.032   7.792 1 U         -1.983e+04  0.00e+00 m   0  254  242  255 0 #N 16, HA 15, HN 16, 
  76 119.136   2.097   7.792 1 U         -2.635e+04  0.00e+00 m   0  254  244  255 0 #N 16, HB2 15, HN 16, 
  77 119.136   2.193   7.792 1 U         -1.247e+04  0.00e+00 m   0  254  245  255 0 #N 16, HB3 15, HN 16, 
  78 119.136   2.362   7.792 1 U         -7.953e+03  0.00e+00 m   0  254  248  255 0 #N 16, HG2 15, HN 16, 
  79 119.136   2.502   7.792 1 U         -1.377e+03  0.00e+00 m   0  254  249  255 0 #N 16, HG3 15, HN 16, 
  80 120.411   7.792   8.392 1 U         -1.264e+04  0.00e+00 m   0  269  255  270 0 #N 17, HN 16, HN 17, 
  81 120.411   4.031   8.392 1 U         -7.317e+03  0.00e+00 m   0  269  257  270 0 #N 17, HA 16, HN 17, 
  82 120.411   2.113   8.392 1 U         -7.646e+03  0.00e+00 m   0  269  259  270 0 #N 17, HB2 16, HN 17, 
  83 120.411   1.967   8.392 1 U         -6.572e+03  0.00e+00 m   0  269  260  270 0 #N 17, HB3 16, HN 17, 
  84 120.411   2.159   8.392 1 U         -6.042e+03  0.00e+00 m   0  269  263  270 0 #N 17, HG2 16, HN 17, 
  85 120.411   2.318   8.392 1 U         -1.291e+03  0.00e+00 m   0  269  264  270 0 #N 17, HG3 16, HN 17, 
  86 115.233   8.392   8.534 1 U         -1.491e+04  0.00e+00 m   0  287  270  288 0 #N 18, HN 17, HN 18, 
  87 115.233   3.259   8.534 1 U         -3.953e+03  0.00e+00 m   0  287  272  288 0 #N 18, HA 17, HN 18, 
  88 115.233   1.540   8.534 1 U         -1.466e+04  0.00e+00 m   0  287  274  288 0 #N 18, HB 17, HN 18, 
  89 115.233   0.095   8.534 1 U         -5.696e+03  0.00e+00 m   0  287  275  288 0 #N 18, QG1 17, HN 18, 
  90 115.233   0.208   8.534 1 U         -7.317e+03  0.00e+00 m   0  287  276  288 0 #N 18, QG2 17, HN 18, 
  91 121.809   8.534   7.987 1 U         -1.577e+04  0.00e+00 m   0  297  288  298 0 #N 19, HN 18, HN 19, 
  92 121.809   4.061   7.987 1 U         -1.232e+04  0.00e+00 m   0  297  290  298 0 #N 19, HA 18, HN 19, 
  93 121.809   3.994   7.987 1 U         -2.037e+04  0.00e+00 m   0  297  294  298 0 #N 19, QB 18, HN 19, 
  95 120.493   7.987   7.794 1 U         -1.847e+04  0.00e+00 m   0  322  298  323 0 #N 20, HN 19, HN 20, 
  96 120.493   4.114   7.794 1 U         -7.498e+03  0.00e+00 m   0  322  300  323 0 #N 20, HA 19, HN 20, 
  97 120.493   1.889   7.794 1 U         -2.986e+04  0.00e+00 m   0  322  304  323 0 #N 20, QB 19, HN 20, 
  99 120.493   1.568   7.794 1 U         -5.166e+03  0.00e+00 m   0  322  306  323 0 #N 20, HG2 19, HN 20, 
 100 120.493   1.407   7.794 1 U         -4.973e+03  0.00e+00 m   0  322  307  323 0 #N 20, HG3 19, HN 20, 
 101 120.493   1.668   7.794 1 U         -5.463e+03  0.00e+00 m   0  322  312  323 0 #N 20, QD 19, HN 20, 
 105 119.770   7.794   8.511 1 U         -1.436e+04  0.00e+00 m   0  347  323  348 0 #N 21, HN 20, HN 21, 
 106 119.770   4.194   8.511 1 U         -4.556e+03  0.00e+00 m   0  347  325  348 0 #N 21, HA 20, HN 21, 
 107 119.770   1.990   8.511 1 U         -1.088e+04  0.00e+00 m   0  347  327  348 0 #N 21, HB2 20, HN 21, 
 108 119.770   1.853   8.511 1 U         -7.907e+03  0.00e+00 m   0  347  328  348 0 #N 21, HB3 20, HN 21, 
 109 119.770   1.437   8.511 1 U         -3.914e+03  0.00e+00 m   0  347  331  348 0 #N 21, HG2 20, HN 21, 
 110 119.770   1.328   8.511 1 U         -2.695e+03  0.00e+00 m   0  347  332  348 0 #N 21, HG3 20, HN 21, 
 111 119.770   1.638   8.511 1 U         -1.670e+03  0.00e+00 m   0  347  337  348 0 #N 21, QD 20, HN 21, 
 115 117.677   8.511   7.934 1 U         -1.900e+04  0.00e+00 m   0  357  348  358 0 #N 22, HN 21, HN 22, 
 116 117.677   3.870   7.934 1 U         -6.451e+03  0.00e+00 m   0  357  350  358 0 #N 22, HA 21, HN 22, 
 117 117.677   1.535   7.934 1 U         -2.433e+04  0.00e+00 m   0  357  351  358 0 #N 22, QB 21, HN 22, 
 118 119.558   7.934   8.185 1 U         -2.362e+04  0.00e+00 m   0  372  358  373 0 #N 23, HN 22, HN 23, 
 119 119.558   4.094   8.185 1 U         -1.012e+04  0.00e+00 m   0  372  360  373 0 #N 23, HA 22, HN 23, 
 120 119.558   2.187   8.185 1 U         -2.783e+04  0.00e+00 m   0  372  362  373 0 #N 23, HB2 22, HN 23, 
 121 119.558   2.107   8.185 1 U         -4.607e+03  0.00e+00 m   0  372  363  373 0 #N 23, HB3 22, HN 23, 
 122 119.558   2.267   8.185 1 U         -3.713e+04  0.00e+00 m   0  372  366  373 0 #N 23, HG2 22, HN 23, 
 123 119.558   2.397   8.185 1 U         -2.578e+03  0.00e+00 m   0  372  367  373 0 #N 23, HG3 22, HN 23, 
 124 113.767   8.185   7.868 1 U         -1.525e+04  0.00e+00 m   0  387  373  388 0 #N 24, HN 23, HN 24, 
 125 113.767   3.989   7.868 1 U         -5.431e+03  0.00e+00 m   0  387  375  388 0 #N 24, HA 23, HN 24, 
 126 113.767   2.058   7.868 1 U         -6.234e+03  0.00e+00 m   0  387  377  388 0 #N 24, HB2 23, HN 24, 
 127 113.767   2.235   7.868 1 U         -1.989e+04  0.00e+00 m   0  387  378  388 0 #N 24, HB3 23, HN 24, 
 128 113.767   2.461   7.868 1 U         -1.520e+03  0.00e+00 m   0  387  381  388 0 #N 24, HG2 23, HN 24, 
 129 113.767   2.239   7.868 1 U         -1.989e+04  0.00e+00 m   0  387  382  388 0 #N 24, HG3 23, HN 24, 
 130 108.123   7.868   7.692 1 U         -2.153e+04  0.00e+00 m   0  402  388  403 0 #N 25, HN 24, HN 25, 
 131 108.123   4.298   7.692 1 U         -6.516e+03  0.00e+00 m   0  402  390  403 0 #N 25, HA 24, HN 25, 
 132 108.123   1.170   7.692 1 U         -3.161e+03  0.00e+00 m   0  402  392  403 0 #N 25, HB2 24, HN 25, 
 133 108.123   1.896   7.692 1 U         -2.731e+03  0.00e+00 m   0  402  393  403 0 #N 25, HB3 24, HN 25, 
 134 108.123   2.228   7.692 1 U         -4.732e+03  0.00e+00 m   0  402  396  403 0 #N 25, HG2 24, HN 25, 
 135 108.123   2.263   7.692 1 U         -4.981e+03  0.00e+00 m   0  402  397  403 0 #N 25, HG3 24, HN 25, 
 136 118.211   7.692   8.076 1 U         -2.741e+04  0.00e+00 m   0  409  403  410 0 #N 26, HN 25, HN 26, 
 137 118.211   3.813   8.076 1 U         -1.260e+04  0.00e+00 m   0  409  405  410 0 #N 26, HA1 25, HN 26, 
 138 118.211   3.951   8.076 1 U         -7.976e+03  0.00e+00 m   0  409  406  410 0 #N 26, HA2 25, HN 26, 
 139 123.599   8.076   8.819 1 U         -1.494e+03  0.00e+00 m   0  432  410  433 0 #N 27, HN 26, HN 27, 
 140 123.599   4.832   8.819 1 U         -2.886e+04  0.00e+00 m   0  432  412  433 0 #N 27, HA 26, HN 27, 
 141 123.599   2.620   8.819 1 U         -4.737e+03  0.00e+00 m   0  432  414  433 0 #N 27, HB2 26, HN 27, 
 142 123.599   2.901   8.819 1 U         -1.625e+04  0.00e+00 m   0  432  415  433 0 #N 27, HB3 26, HN 27, 
 144 123.599   6.798   8.819 1 U         -3.783e+03  0.00e+00 m   0  432  429  433 0 #N 27, QD 26, HN 27, 
 145 120.849   8.819   7.765 1 U         -2.306e+03  0.00e+00 m   0  443  433  444 0 #N 28, HN 27, HN 28, 
 146 120.849   4.762   7.765 1 U         -4.306e+04  0.00e+00 m   0  443  435  444 0 #N 28, HA 27, HN 28, 
 147 120.849   2.884   7.765 1 U         -3.863e+03  0.00e+00 m   0  443  437  444 0 #N 28, HB2 27, HN 28, 
 148 120.849   2.547   7.765 1 U         -4.147e+03  0.00e+00 m   0  443  438  444 0 #N 28, HB3 27, HN 28, 
 149 126.901   7.765   8.577 1 U         -1.526e+03  0.00e+00 m   0  464  444  465 0 #N 29, HN 28, HN 29, 
 150 126.901   4.573   8.577 1 U         -2.526e+04  0.00e+00 m   0  464  446  465 0 #N 29, HA 28, HN 29, 
 151 126.901   1.510   8.577 1 U         -4.925e+03  0.00e+00 m   0  464  448  465 0 #N 29, HB 28, HN 29, 
 152 126.901   0.658   8.577 1 U         -6.909e+03  0.00e+00 m   0  464  449  465 0 #N 29, QG2 28, HN 29, 
 153 126.901   1.377   8.577 1 U         -3.561e+03  0.00e+00 m   0  464  455  465 0 #N 29, HG12 28, HN 29, 
 154 126.901   0.859   8.577 1 U         -7.657e+03  0.00e+00 m   0  464  456  465 0 #N 29, HG13 28, HN 29, 
 155 126.901   0.610   8.577 1 U         -4.419e+03  0.00e+00 m   0  464  458  465 0 #N 29, QD1 28, HN 29, 
 156 115.255   8.577   8.750 1 U         -2.107e+03  0.00e+00 m   0  482  465  483 0 #N 30, HN 29, HN 30, 
 157 115.255   4.806   8.750 1 U         -3.372e+04  0.00e+00 m   0  482  467  483 0 #N 30, HA 29, HN 30, 
 158 115.255   2.124   8.750 1 U         -5.351e+03  0.00e+00 m   0  482  469  483 0 #N 30, HB2 29, HN 30, 
 159 115.255   1.993   8.750 1 U         -3.891e+03  0.00e+00 m   0  482  470  483 0 #N 30, HB3 29, HN 30, 
 160 115.255   2.521   8.750 1 U         -4.431e+03  0.00e+00 m   0  482  473  483 0 #N 30, HG2 29, HN 30, 
 161 115.255   2.267   8.750 1 U         -4.294e+03  0.00e+00 m   0  482  474  483 0 #N 30, HG3 29, HN 30, 
 164 114.044   8.750   8.822 1 U         -3.948e+03  0.00e+00 m   0  495  483  496 0 #N 31, HN 30, HN 31, 
 165 114.044   5.665   8.822 1 U         -2.683e+04  0.00e+00 m   0  495  485  496 0 #N 31, HA 30, HN 31, 
 166 114.044   4.324   8.822 1 U         -1.009e+04  0.00e+00 m   0  495  487  496 0 #N 31, HB 30, HN 31, 
 167 114.044   1.251   8.822 1 U         -7.169e+03  0.00e+00 m   0  495  488  496 0 #N 31, QG2 30, HN 31, 
 168 122.434   8.822   8.132 1 U         -2.263e+03  0.00e+00 m   0  505  496  506 0 #N 32, HN 31, HN 32, 
 169 122.434   4.677   8.132 1 U         -2.767e+04  0.00e+00 m   0  505  498  506 0 #N 32, HA 31, HN 32, 
 170 122.434   3.076   8.132 1 U         -3.486e+03  0.00e+00 m   0  505  500  506 0 #N 32, HB2 31, HN 32, 
 171 122.434   3.785   8.132 1 U         -3.141e+03  0.00e+00 m   0  505  501  506 0 #N 32, HB3 31, HN 32, 
 172 122.762   8.132   8.672 1 U         -1.550e+04  0.00e+00 m   0  519  506  520 0 #N 33, HN 32, HN 33, 
 173 122.762   5.490   8.672 1 U         -3.233e+03  0.00e+00 m   0  519  508  520 0 #N 33, HA 32, HN 33, 
 178 123.428   8.672   8.406 1 U         -1.854e+03  0.00e+00 m   0  530  520  531 0 #N 34, HN 33, HN 34, 
 179 123.428   4.778   8.406 1 U         -3.377e+04  0.00e+00 m   0  530  522  531 0 #N 34, HA 33, HN 34, 
 180 123.428   3.024   8.406 1 U         -2.562e+03  0.00e+00 m   0  530  524  531 0 #N 34, HB2 33, HN 34, 
 181 123.428   2.384   8.406 1 U         -2.337e+03  0.00e+00 m   0  530  525  531 0 #N 34, HB3 33, HN 34, 
 182 118.569   8.406   8.009 1 U         -1.513e+04  0.00e+00 m   0  555  531  556 0 #N 35, HN 34, HN 35, 
 183 118.569   3.706   8.009 1 U         -5.294e+03  0.00e+00 m   0  555  533  556 0 #N 35, HA 34, HN 35, 
 184 118.569   1.781   8.009 1 U         -1.559e+04  0.00e+00 m   0  555  537  556 0 #N 35, QB 34, HN 35, 
 186 118.569   1.365   8.009 1 U         -1.072e+04  0.00e+00 m   0  555  541  556 0 #N 35, QG 34, HN 35, 
 188 118.569   1.622   8.009 1 U         -3.709e+03  0.00e+00 m   0  555  545  556 0 #N 35, QD 34, HN 35, 
 190 118.569   2.992   8.009 1 U         -2.594e+03  0.00e+00 m   0  555  549  556 0 #N 35, HE2 34, HN 35, 
 192 120.475   8.009   7.554 1 U         -2.368e+04  0.00e+00 m   0  580  556  581 0 #N 36, HN 35, HN 36, 
 193 120.475   3.861   7.554 1 U         -6.130e+03  0.00e+00 m   0  580  558  581 0 #N 36, HA 35, HN 36, 
 194 120.475   1.911   7.554 1 U         -2.831e+04  0.00e+00 m   0  580  562  581 0 #N 36, QB 35, HN 36, 
 196 120.475   1.498   7.554 1 U         -2.558e+03  0.00e+00 m   0  580  564  581 0 #N 36, HG2 35, HN 36, 
 197 120.475   1.388   7.554 1 U         -3.743e+03  0.00e+00 m   0  580  565  581 0 #N 36, HG3 35, HN 36, 
 198 120.475   1.677   7.554 1 U         -2.346e+03  0.00e+00 m   0  580  570  581 0 #N 36, QD 35, HN 36, 
 202 118.349   7.554   7.501 1 U         -2.169e+04  0.00e+00 m   0  595  581  596 0 #N 37, HN 36, HN 37, 
 203 118.349   4.042   7.501 1 U         -3.516e+03  0.00e+00 m   0  595  583  596 0 #N 37, HA 36, HN 37, 
 204 118.349   2.021   7.501 1 U         -4.120e+04  0.00e+00 m   0  595  587  596 0 #N 37, QB 36, HN 37, 
 206 118.349   2.183   7.501 1 U         -3.269e+03  0.00e+00 m   0  595  589  596 0 #N 37, HG2 36, HN 37, 
 207 118.349   2.274   7.501 1 U         -1.846e+03  0.00e+00 m   0  595  590  596 0 #N 37, HG3 36, HN 37, 
 208 121.911   7.501   8.591 1 U         -1.268e+04  0.00e+00 m   0  616  596  617 0 #N 38, HN 37, HN 38, 
 209 121.911   3.657   8.591 1 U         -2.855e+03  0.00e+00 m   0  616  598  617 0 #N 38, HA 37, HN 38, 
 210 121.911   2.017   8.591 1 U         -2.516e+04  0.00e+00 m   0  616  600  617 0 #N 38, HB 37, HN 38, 
 211 121.911   0.691   8.591 1 U         -1.716e+04  0.00e+00 m   0  616  601  617 0 #N 38, QG2 37, HN 38, 
 212 121.911   1.055   8.591 1 U         -1.283e+03  0.00e+00 m   0  616  607  617 0 #N 38, HG12 37, HN 38, 
 213 121.911   1.928   8.591 1 U         -8.737e+03  0.00e+00 m   0  616  608  617 0 #N 38, HG13 37, HN 38, 
 214 121.911   0.693   8.591 1 U         -1.716e+04  0.00e+00 m   0  616  610  617 0 #N 38, QD1 37, HN 38, 
 215 119.599   8.591   7.849 1 U         -1.049e+04  0.00e+00 m   0  637  617  638 0 #N 39, HN 38, HN 39, 
 216 119.599   3.514   7.849 1 U         -1.809e+03  0.00e+00 m   0  637  619  638 0 #N 39, HA 38, HN 39, 
 217 119.599   1.980   7.849 1 U         -1.536e+04  0.00e+00 m   0  637  621  638 0 #N 39, HB 38, HN 39, 
 218 119.599   0.891   7.849 1 U         -6.483e+03  0.00e+00 m   0  637  622  638 0 #N 39, QG2 38, HN 39, 
 219 119.599   1.679   7.849 1 U         -5.953e+03  0.00e+00 m   0  637  628  638 0 #N 39, HG12 38, HN 39, 
 220 119.599   0.956   7.849 1 U         -9.350e+02  0.00e+00 m   0  637  629  638 0 #N 39, HG13 38, HN 39, 
 221 119.599   0.704   7.849 1 U         -4.754e+03  0.00e+00 m   0  637  631  638 0 #N 39, QD1 38, HN 39, 
 222 118.381   7.849   8.068 1 U         -9.612e+03  0.00e+00 m   0  648  638  649 0 #N 40, HN 39, HN 40, 
 223 118.381   4.340   8.068 1 U         -3.891e+03  0.00e+00 m   0  648  640  649 0 #N 40, HA 39, HN 40, 
 224 118.381   2.753   8.068 1 U         -6.853e+03  0.00e+00 m   0  648  642  649 0 #N 40, HB2 39, HN 40, 
 225 118.381   2.679   8.068 1 U         -9.146e+03  0.00e+00 m   0  648  643  649 0 #N 40, HB3 39, HN 40, 
 226 121.053   8.068   8.575 1 U         -1.007e+04  0.00e+00 m   0  674  649  675 0 #N 41, HN 40, HN 41, 
 227 121.053   3.887   8.575 1 U         -2.076e+03  0.00e+00 m   0  674  651  675 0 #N 41, HA 40, HN 41, 
 228 121.053   1.937   8.575 1 U         -4.823e+03  0.00e+00 m   0  674  653  675 0 #N 41, HB2 40, HN 41, 
 229 121.053   1.987   8.575 1 U         -7.885e+03  0.00e+00 m   0  674  654  675 0 #N 41, HB3 40, HN 41, 
 230 121.053   2.177   8.575 1 U         -3.012e+03  0.00e+00 m   0  674  657  675 0 #N 41, HG2 40, HN 41, 
 231 121.053   1.662   8.575 1 U         -2.944e+03  0.00e+00 m   0  674  658  675 0 #N 41, HG3 40, HN 41, 
 234 121.487   8.575   8.340 1 U         -1.218e+04  0.00e+00 m   0  696  675  697 0 #N 42, HN 41, HN 42, 
 235 121.487   4.144   8.340 1 U         -3.325e+03  0.00e+00 m   0  696  677  697 0 #N 42, HA 41, HN 42, 
 236 121.487   2.112   8.340 1 U         -7.101e+03  0.00e+00 m   0  696  679  697 0 #N 42, HB2 41, HN 42, 
 237 121.487   1.271   8.340 1 U         -4.686e+03  0.00e+00 m   0  696  680  697 0 #N 42, HB3 41, HN 42, 
 238 121.487   1.779   8.340 1 U         -7.657e+03  0.00e+00 m   0  696  683  697 0 #N 42, HG 41, HN 42, 
 239 121.487   0.681   8.340 1 U         -3.478e+03  0.00e+00 m   0  696  684  697 0 #N 42, QD1 41, HN 42, 
 240 121.487   0.726   8.340 1 U         -5.752e+03  0.00e+00 m   0  696  685  697 0 #N 42, QD2 41, HN 42, 
 241 115.916   8.340   7.482 1 U         -1.215e+04  0.00e+00 m   0  721  697  722 0 #N 43, HN 42, HN 43, 
 242 115.916   4.036   7.482 1 U         -5.037e+03  0.00e+00 m   0  721  699  722 0 #N 43, HA 42, HN 43, 
 243 115.916   1.936   7.482 1 U         -7.192e+03  0.00e+00 m   0  721  701  722 0 #N 43, HB2 42, HN 43, 
 244 115.916   1.996   7.482 1 U         -1.418e+04  0.00e+00 m   0  721  702  722 0 #N 43, HB3 42, HN 43, 
 245 115.916   1.394   7.482 1 U         -9.540e+02  0.00e+00 m   0  721  705  722 0 #N 43, HG2 42, HN 43, 
 246 115.916   1.625   7.482 1 U         -6.435e+03  0.00e+00 m   0  721  706  722 0 #N 43, HG3 42, HN 43, 
 247 115.916   1.677   7.482 1 U         -1.996e+04  0.00e+00 m   0  721  711  722 0 #N 43, QD 42, HN 43, 
 251 115.504   7.482   8.069 1 U         -1.438e+04  0.00e+00 m   0  747  722  748 0 #N 44, HN 43, HN 44, 
 252 115.504   4.265   8.069 1 U         -2.900e+04  0.00e+00 m   0  747  724  748 0 #N 44, HA 43, HN 44, 
 253 115.504   1.723   8.069 1 U         -4.368e+03  0.00e+00 m   0  747  726  748 0 #N 44, HB2 43, HN 44, 
 254 115.504   2.014   8.069 1 U         -3.217e+03  0.00e+00 m   0  747  727  748 0 #N 44, HB3 43, HN 44, 
 255 115.504   1.754   8.069 1 U         -2.099e+03  0.00e+00 m   0  747  730  748 0 #N 44, HG2 43, HN 44, 
 256 115.504   1.676   8.069 1 U         -8.237e+03  0.00e+00 m   0  747  731  748 0 #N 44, HG3 43, HN 44, 
 259 113.910   8.069   8.024 1 U         -3.136e+04  0.00e+00 m   0  773  748  774 0 #N 45, HN 44, HN 45, 
 260 113.910   4.269   8.024 1 U         -1.554e+04  0.00e+00 m   0  773  750  774 0 #N 45, HA 44, HN 45, 
 261 113.910   2.094   8.024 1 U         -4.470e+03  0.00e+00 m   0  773  754  774 0 #N 45, QB 44, HN 45, 
 263 113.910   1.653   8.024 1 U         -4.510e+03  0.00e+00 m   0  773  758  774 0 #N 45, QG 44, HN 45, 
 265 113.910   3.265   8.024 1 U         -1.116e+03  0.00e+00 m   0  773  762  774 0 #N 45, QD 44, HN 45, 
 267 116.556   8.024   7.204 1 U         -2.548e+04  0.00e+00 m   0  787  774  788 0 #N 46, HN 45, HN 46, 
 268 116.556   4.953   7.204 1 U         -1.040e+04  0.00e+00 m   0  787  776  788 0 #N 46, HA 45, HN 46, 
 269 116.556   2.810   7.204 1 U         -2.397e+03  0.00e+00 m   0  787  778  788 0 #N 46, HB2 45, HN 46, 
 270 116.556   2.585   7.204 1 U         -2.900e+03  0.00e+00 m   0  787  779  788 0 #N 46, HB3 45, HN 46, 
 273 125.470   7.204   8.972 1 U         -1.099e+03  0.00e+00 m   0  808  788  809 0 #N 47, HN 46, HN 47, 
 274 125.470   4.105   8.972 1 U         -1.720e+04  0.00e+00 m   0  808  790  809 0 #N 47, HA 46, HN 47, 
 275 125.470   1.440   8.972 1 U         -2.863e+03  0.00e+00 m   0  808  792  809 0 #N 47, HB 46, HN 47, 
 276 125.470   0.699   8.972 1 U         -9.362e+03  0.00e+00 m   0  808  793  809 0 #N 47, QG2 46, HN 47, 
 277 125.470   0.853   8.972 1 U         -2.045e+03  0.00e+00 m   0  808  799  809 0 #N 47, HG12 46, HN 47, 
 278 125.470   1.401   8.972 1 U         -2.190e+03  0.00e+00 m   0  808  800  809 0 #N 47, HG13 46, HN 47, 
 279 125.470   0.739   8.972 1 U         -7.033e+03  0.00e+00 m   0  808  802  809 0 #N 47, QD1 46, HN 47, 
 280 119.295   8.972   7.817 1 U         -2.513e+04  0.00e+00 m   0  819  809  820 0 #N 48, HN 47, HN 48, 
 281 119.295   4.842   7.817 1 U         -4.698e+03  0.00e+00 m   0  819  811  820 0 #N 48, HA 47, HN 48, 
 282 119.295   2.574   7.817 1 U         -6.813e+03  0.00e+00 m   0  819  813  820 0 #N 48, HB2 47, HN 48, 
 283 119.295   2.716   7.817 1 U         -4.703e+03  0.00e+00 m   0  819  814  820 0 #N 48, HB3 47, HN 48, 
 284 122.213   7.817   9.092 1 U         -3.948e+03  0.00e+00 m   0  837  820  838 0 #N 49, HN 48, HN 49, 
 285 122.213   5.430   9.092 1 U         -3.286e+04  0.00e+00 m   0  837  822  838 0 #N 49, HA 48, HN 49, 
 286 122.213   2.126   9.092 1 U         -2.451e+03  0.00e+00 m   0  837  824  838 0 #N 49, HB2 48, HN 49, 
 287 122.213   1.982   9.092 1 U         -5.343e+03  0.00e+00 m   0  837  825  838 0 #N 49, HB3 48, HN 49, 
 288 122.213   2.375   9.092 1 U         -4.715e+03  0.00e+00 m   0  837  830  838 0 #N 49, QG 48, HN 49, 
 290 122.213   1.730   9.092 1 U         -1.415e+03  0.00e+00 m   0  837  831  838 0 #N 49, QE 48, HN 49, 
 291 126.911   9.092   8.894 1 U         -1.971e+03  0.00e+00 m   0  858  838  859 0 #N 50, HN 49, HN 50, 
 292 126.911   5.419   8.894 1 U         -3.086e+04  0.00e+00 m   0  858  840  859 0 #N 50, HA 49, HN 50, 
 293 126.911   1.526   8.894 1 U         -5.527e+03  0.00e+00 m   0  858  842  859 0 #N 50, HB 49, HN 50, 
 294 126.911   0.760   8.894 1 U         -2.224e+04  0.00e+00 m   0  858  843  859 0 #N 50, QG2 49, HN 50, 
 295 126.911   1.344   8.894 1 U         -8.964e+03  0.00e+00 m   0  858  849  859 0 #N 50, HG12 49, HN 50, 
 296 126.911   0.783   8.894 1 U         -1.738e+04  0.00e+00 m   0  858  850  859 0 #N 50, HG13 49, HN 50, 
 297 126.911   0.628   8.894 1 U         -7.896e+03  0.00e+00 m   0  858  852  859 0 #N 50, QD1 49, HN 50, 
 298 125.411   8.894   8.574 1 U         -1.355e+03  0.00e+00 m   0  879  859  880 0 #N 51, HN 50, HN 51, 
 299 125.411   4.895   8.574 1 U         -1.461e+04  0.00e+00 m   0  879  861  880 0 #N 51, HA 50, HN 51, 
 300 125.411   1.719   8.574 1 U         -1.554e+03  0.00e+00 m   0  879  863  880 0 #N 51, HB 50, HN 51, 
 301 125.411   0.744   8.574 1 U         -1.495e+04  0.00e+00 m   0  879  864  880 0 #N 51, QG2 50, HN 51, 
 302 125.411   1.406   8.574 1 U         -1.482e+03  0.00e+00 m   0  879  870  880 0 #N 51, HG12 50, HN 51, 
 303 125.411   0.720   8.574 1 U         -1.963e+04  0.00e+00 m   0  879  871  880 0 #N 51, HG13 50, HN 51, 
 304 125.411   0.881   8.574 1 U         -4.238e+03  0.00e+00 m   0  879  873  880 0 #N 51, QD1 50, HN 51, 
 305 126.411   8.574   8.252 1 U         -1.508e+03  0.00e+00 m   0  897  880  898 0 #N 52, HN 51, HN 52, 
 306 126.411   4.937   8.252 1 U         -2.172e+04  0.00e+00 m   0  897  882  898 0 #N 52, HA 51, HN 52, 
 307 126.411   1.790   8.252 1 U         -1.769e+03  0.00e+00 m   0  897  884  898 0 #N 52, HB 51, HN 52, 
 308 126.411   0.708   8.252 1 U         -1.791e+04  0.00e+00 m   0  897  885  898 0 #N 52, QG1 51, HN 52, 
 309 126.411   0.688   8.252 1 U         -1.791e+04  0.00e+00 m   0  897  886  898 0 #N 52, QG2 51, HN 52, 
 310 120.527   8.252   8.434 1 U         -2.871e+03  0.00e+00 m   0  922  898  923 0 #N 53, HN 52, HN 53, 
 311 120.527   5.742   8.434 1 U         -2.706e+04  0.00e+00 m   0  922  900  923 0 #N 53, HA 52, HN 53, 
 312 120.527   1.957   8.434 1 U         -5.696e+03  0.00e+00 m   0  922  902  923 0 #N 53, HB2 52, HN 53, 
 313 120.527   1.545   8.434 1 U         -5.230e+03  0.00e+00 m   0  922  903  923 0 #N 53, HB3 52, HN 53, 
 314 120.527   1.642   8.434 1 U         -7.942e+03  0.00e+00 m   0  922  906  923 0 #N 53, HG2 52, HN 53, 
 315 120.527   1.377   8.434 1 U         -3.499e+03  0.00e+00 m   0  922  907  923 0 #N 53, HG3 52, HN 53, 
 316 120.527   1.619   8.434 1 U         -7.942e+03  0.00e+00 m   0  922  910  923 0 #N 53, HD2 52, HN 53, 
 317 120.527   1.424   8.434 1 U         -4.476e+03  0.00e+00 m   0  922  911  923 0 #N 53, HD3 52, HN 53, 
 320 124.060   8.434   8.445 1 U         -7.154e+04  0.00e+00 m   0  935  923  936 0 #N 54, HN 53, HN 54, 
 321 124.060   4.795   8.445 1 U         -2.426e+04  0.00e+00 m   0  935  925  936 0 #N 54, HA 53, HN 54, 
 322 124.060   4.299   8.445 1 U         -4.584e+03  0.00e+00 m   0  935  927  936 0 #N 54, HB 53, HN 54, 
 323 124.060   0.886   8.445 1 U         -8.555e+03  0.00e+00 m   0  935  928  936 0 #N 54, QG2 53, HN 54, 
 324 121.687   8.445   8.268 1 U         -1.716e+04  0.00e+00 m   0  950  936  951 0 #N 55, HN 54, HN 55, 
 325 121.687   4.402   8.268 1 U         -3.249e+03  0.00e+00 m   0  950  938  951 0 #N 55, HA 54, HN 55, 
 326 121.687   1.978   8.268 1 U         -1.849e+03  0.00e+00 m   0  950  940  951 0 #N 55, HB2 54, HN 55, 
 327 121.687   2.451   8.268 1 U         -8.710e+02  0.00e+00 m   0  950  941  951 0 #N 55, HB3 54, HN 55, 
 330 127.275   8.268   8.639 1 U         -3.269e+03  0.00e+00 m   0  961  951  962 0 #N 56, HN 55, HN 56, 
 331 127.275   4.698   8.639 1 U         -2.854e+04  0.00e+00 m   0  961  953  962 0 #N 56, HA 55, HN 56, 
 332 127.275   2.974   8.639 1 U         -3.317e+03  0.00e+00 m   0  961  955  962 0 #N 56, HB2 55, HN 56, 
 333 127.275   2.599   8.639 1 U         -3.153e+03  0.00e+00 m   0  961  956  962 0 #N 56, HB3 55, HN 56, 
 334 119.516   8.639   8.378 1 U         -1.195e+04  0.00e+00 m   0  986  962  987 0 #N 57, HN 56, HN 57, 
 335 119.516   3.737   8.378 1 U         -4.306e+03  0.00e+00 m   0  986  964  987 0 #N 57, HA 56, HN 57, 
 336 119.516   1.855   8.378 1 U         -1.654e+04  0.00e+00 m   0  986  968  987 0 #N 57, QB 56, HN 57, 
 340 119.516   1.710   8.378 1 U         -1.602e+03  0.00e+00 m   0  986  976  987 0 #N 57, QD 56, HN 57, 
 342 119.516   2.971   8.378 1 U         -1.610e+03  0.00e+00 m   0  986  980  987 0 #N 57, QE 56, HN 57, 
 344 115.830   8.378   7.777 1 U         -3.018e+04  0.00e+00 m   0 1001  987 1002 0 #N 58, HN 57, HN 58, 
 345 115.830   4.107   7.777 1 U         -7.567e+03  0.00e+00 m   0 1001  989 1002 0 #N 58, HA 57, HN 58, 
 346 115.830   2.132   7.777 1 U         -1.836e+04  0.00e+00 m   0 1001  991 1002 0 #N 58, HB2 57, HN 58, 
 347 115.830   2.084   7.777 1 U         -1.661e+04  0.00e+00 m   0 1001  992 1002 0 #N 58, HB3 57, HN 58, 
 348 115.830   2.324   7.777 1 U         -6.042e+03  0.00e+00 m   0 1001  997 1002 0 #N 58, QG 57, HN 58, 
 350 120.077   7.777   7.654 1 U         -1.226e+04  0.00e+00 m   0 1011 1002 1012 0 #N 59, HN 58, HN 59, 
 351 120.077   4.240   7.654 1 U         -2.269e+03  0.00e+00 m   0 1011 1004 1012 0 #N 59, HA 58, HN 59, 
 352 120.077   3.608   7.654 1 U         -2.574e+03  0.00e+00 m   0 1011 1006 1012 0 #N 59, HB2 58, HN 59, 
 353 120.077   3.825   7.654 1 U         -3.596e+03  0.00e+00 m   0 1011 1007 1012 0 #N 59, HB3 58, HN 59, 
 354 114.178   7.654   7.933 1 U         -1.498e+04  0.00e+00 m   0 1032 1012 1033 0 #N 60, HN 59, HN 60, 
 355 114.178   3.324   7.933 1 U         -4.981e+03  0.00e+00 m   0 1032 1014 1033 0 #N 60, HA 59, HN 60, 
 356 114.178   1.827   7.933 1 U         -1.847e+04  0.00e+00 m   0 1032 1016 1033 0 #N 60, HB 59, HN 60, 
 357 114.178   0.792   7.933 1 U         -1.351e+04  0.00e+00 m   0 1032 1017 1033 0 #N 60, QG2 59, HN 60, 
 358 114.178   1.596   7.933 1 U         -3.624e+03  0.00e+00 m   0 1032 1023 1033 0 #N 60, HG12 59, HN 60, 
 359 114.178   0.597   7.933 1 U         -2.184e+03  0.00e+00 m   0 1032 1024 1033 0 #N 60, HG13 59, HN 60, 
 360 114.178   0.686   7.933 1 U         -3.817e+03  0.00e+00 m   0 1032 1026 1033 0 #N 60, QD1 59, HN 60, 
 361 120.392   7.933   7.772 1 U         -1.743e+04  0.00e+00 m   0 1042 1033 1043 0 #N 61, HN 60, HN 61, 
 362 120.392   3.948   7.772 1 U         -2.163e+04  0.00e+00 m   0 1042 1035 1043 0 #N 61, HA 60, HN 61, 
 363 120.392   3.986   7.772 1 U         -3.040e+04  0.00e+00 m   0 1042 1037 1043 0 #N 61, HB2 60, HN 61, 
 364 120.392   4.024   7.772 1 U         -1.438e+04  0.00e+00 m   0 1042 1038 1043 0 #N 61, HB3 60, HN 61, 
 365 118.610   7.772   8.117 1 U         -1.239e+04  0.00e+00 m   0 1057 1043 1058 0 #N 62, HN 61, HN 62, 
 366 118.610   3.971   8.117 1 U         -3.993e+03  0.00e+00 m   0 1057 1045 1058 0 #N 62, HA 61, HN 62, 
 367 118.610   2.153   8.117 1 U         -6.974e+03  0.00e+00 m   0 1057 1047 1058 0 #N 62, HB2 61, HN 62, 
 368 118.610   2.002   8.117 1 U         -6.733e+03  0.00e+00 m   0 1057 1048 1058 0 #N 62, HB3 61, HN 62, 
 369 118.610   2.356   8.117 1 U         -1.674e+03  0.00e+00 m   0 1057 1051 1058 0 #N 62, HG2 61, HN 62, 
 370 118.610   2.194   8.117 1 U         -3.325e+03  0.00e+00 m   0 1057 1052 1058 0 #N 62, HG3 61, HN 62, 
 371 119.241   8.117   8.575 1 U         -1.199e+04  0.00e+00 m   0 1078 1058 1079 0 #N 63, HN 62, HN 63, 
 372 119.241   3.421   8.575 1 U         -3.032e+03  0.00e+00 m   0 1078 1060 1079 0 #N 63, HA 62, HN 63, 
 373 119.241   1.810   8.575 1 U         -1.170e+04  0.00e+00 m   0 1078 1062 1079 0 #N 63, HB 62, HN 63, 
 374 119.241   0.559   8.575 1 U         -1.577e+04  0.00e+00 m   0 1078 1063 1079 0 #N 63, QG2 62, HN 63, 
 375 119.241   1.616   8.575 1 U         -1.434e+04  0.00e+00 m   0 1078 1069 1079 0 #N 63, HG12 62, HN 63, 
 376 119.241   0.823   8.575 1 U         -3.914e+03  0.00e+00 m   0 1078 1070 1079 0 #N 63, HG13 62, HN 63, 
 377 119.241   0.557   8.575 1 U         -1.577e+04  0.00e+00 m   0 1078 1072 1079 0 #N 63, QD1 62, HN 63, 
 378 117.220   8.575   7.673 1 U         -1.345e+04  0.00e+00 m   0 1099 1079 1100 0 #N 64, HN 63, HN 64, 
 379 117.220   3.199   7.673 1 U         -3.766e+03  0.00e+00 m   0 1099 1081 1100 0 #N 64, HA 63, HN 64, 
 380 117.220   1.454   7.673 1 U         -1.536e+04  0.00e+00 m   0 1099 1083 1100 0 #N 64, HB 63, HN 64, 
 381 117.220   0.047   7.673 1 U         -1.054e+04  0.00e+00 m   0 1099 1084 1100 0 #N 64, QG2 63, HN 64, 
 382 117.220   0.527   7.673 1 U         -5.833e+03  0.00e+00 m   0 1099 1090 1100 0 #N 64, HG12 63, HN 64, 
 383 117.220   1.609   7.673 1 U         -1.396e+04  0.00e+00 m   0 1099 1091 1100 0 #N 64, HG13 63, HN 64, 
 384 117.220   0.513   7.673 1 U         -4.997e+03  0.00e+00 m   0 1099 1093 1100 0 #N 64, QD1 63, HN 64, 
 385 114.597   7.673   7.404 1 U         -2.018e+04  0.00e+00 m   0 1124 1100 1125 0 #N 65, HN 64, HN 65, 
 386 114.597   3.804   7.404 1 U         -5.142e+03  0.00e+00 m   0 1124 1102 1125 0 #N 65, HA 64, HN 65, 
 387 114.597   1.864   7.404 1 U         -2.715e+04  0.00e+00 m   0 1124 1106 1125 0 #N 65, QB 64, HN 65, 
 389 114.597   1.386   7.404 1 U         -2.326e+03  0.00e+00 m   0 1124 1108 1125 0 #N 65, HG2 64, HN 65, 
 390 114.597   1.578   7.404 1 U         -3.333e+03  0.00e+00 m   0 1124 1109 1125 0 #N 65, HG3 64, HN 65, 
 391 114.597   1.670   7.404 1 U         -3.100e+03  0.00e+00 m   0 1124 1114 1125 0 #N 65, QD 64, HN 65, 
 395 120.063   7.404   8.655 1 U         -1.110e+04  0.00e+00 m   0 1142 1125 1143 0 #N 66, HN 65, HN 66, 
 396 120.063   4.215   8.655 1 U         -2.445e+03  0.00e+00 m   0 1142 1127 1143 0 #N 66, HA 65, HN 66, 
 397 120.063   2.092   8.655 1 U         -3.357e+03  0.00e+00 m   0 1142 1129 1143 0 #N 66, HB2 65, HN 66, 
 398 120.063   2.004   8.655 1 U         -3.341e+03  0.00e+00 m   0 1142 1130 1143 0 #N 66, HB3 65, HN 66, 
 399 120.063   2.266   8.655 1 U         -2.008e+03  0.00e+00 m   0 1142 1133 1143 0 #N 66, HG2 65, HN 66, 
 403 121.130   8.655   8.316 1 U         -1.271e+04  0.00e+00 m   0 1160 1143 1161 0 #N 67, HN 66, HN 67, 
 404 121.130   3.687   8.316 1 U         -3.285e+03  0.00e+00 m   0 1160 1145 1161 0 #N 67, HA 66, HN 67, 
 405 121.130   2.196   8.316 1 U         -9.714e+03  0.00e+00 m   0 1160 1147 1161 0 #N 67, HB 66, HN 67, 
 406 121.130   0.824   8.316 1 U         -1.452e+04  0.00e+00 m   0 1160 1148 1161 0 #N 67, QG1 66, HN 67, 
 407 121.130   0.760   8.316 1 U         -8.941e+03  0.00e+00 m   0 1160 1149 1161 0 #N 67, QG2 66, HN 67, 
 408 118.349   8.316   7.809 1 U         -1.183e+04  0.00e+00 m   0 1182 1161 1183 0 #N 68, HN 67, HN 68, 
 409 118.349   4.089   7.809 1 U         -9.873e+03  0.00e+00 m   0 1182 1163 1183 0 #N 68, HA 67, HN 68, 
 410 118.349   1.825   7.809 1 U         -1.007e+04  0.00e+00 m   0 1182 1165 1183 0 #N 68, HB2 67, HN 68, 
 411 118.349   1.508   7.809 1 U         -6.026e+03  0.00e+00 m   0 1182 1166 1183 0 #N 68, HB3 67, HN 68, 
 412 118.349   1.785   7.809 1 U         -7.055e+03  0.00e+00 m   0 1182 1169 1183 0 #N 68, HG 67, HN 68, 
 413 118.349   0.813   7.809 1 U         -6.146e+03  0.00e+00 m   0 1182 1170 1183 0 #N 68, QD1 67, HN 68, 
 414 118.349   0.799   7.809 1 U         -6.146e+03  0.00e+00 m   0 1182 1171 1183 0 #N 68, QD2 67, HN 68, 
 415 112.915   7.809   7.932 1 U         -1.652e+04  0.00e+00 m   0 1193 1183 1194 0 #N 69, HN 68, HN 69, 
 416 112.915   4.626   7.932 1 U         -8.271e+03  0.00e+00 m   0 1193 1185 1194 0 #N 69, HA 68, HN 69, 
 417 112.915   2.740   7.932 1 U         -8.850e+03  0.00e+00 m   0 1193 1187 1194 0 #N 69, HB2 68, HN 69, 
 418 112.915   2.692   7.932 1 U         -9.089e+03  0.00e+00 m   0 1193 1188 1194 0 #N 69, HB3 68, HN 69, 
 419 110.368   7.932   8.171 1 U         -9.112e+03  0.00e+00 m   0 1203 1194 1204 0 #N 70, HN 69, HN 70, 
 420 110.368   4.423   8.171 1 U         -3.959e+03  0.00e+00 m   0 1203 1196 1204 0 #N 70, HA 69, HN 70, 
 421 110.368   4.067   8.171 1 U         -4.754e+03  0.00e+00 m   0 1203 1198 1204 0 #N 70, HB2 69, HN 70, 
 422 110.368   4.039   8.171 1 U         -2.300e+03  0.00e+00 m   0 1203 1199 1204 0 #N 70, HB3 69, HN 70, 
 423 122.165   8.171   7.564 1 U         -1.398e+04  0.00e+00 m   0 1210 1204 1211 0 #N 71, HN 70, HN 71, 
 424 122.165   3.880   7.564 1 U         -5.760e+03  0.00e+00 m   0 1210 1206 1211 0 #N 71, HA1 70, HN 71, 
 425 122.165   4.197   7.564 1 U         -6.331e+03  0.00e+00 m   0 1210 1207 1211 0 #N 71, HA2 70, HN 71, 
 426 119.550   7.564   7.831 1 U         -2.462e+03  0.00e+00 m   0 1220 1211 1221 0 #N 72, HN 71, HN 72, 
 427 119.550   4.436   7.831 1 U         -2.484e+04  0.00e+00 m   0 1220 1213 1221 0 #N 72, HA 71, HN 72, 
 428 119.550   1.154   7.831 1 U         -1.788e+04  0.00e+00 m   0 1220 1214 1221 0 #N 72, QB 71, HN 72, 
 429 121.224   7.831   8.403 1 U         -2.642e+03  0.00e+00 m   0 1245 1221 1246 0 #N 73, HN 72, HN 73, 
 430 121.224   4.670   8.403 1 U         -3.658e+04  0.00e+00 m   0 1245 1223 1246 0 #N 73, HA 72, HN 73, 
 431 121.224   1.821   8.403 1 U         -1.303e+04  0.00e+00 m   0 1245 1225 1246 0 #N 73, HB2 72, HN 73, 
 432 121.224   1.990   8.403 1 U         -7.442e+03  0.00e+00 m   0 1245 1226 1246 0 #N 73, HB3 72, HN 73, 
 433 121.224   1.572   8.403 1 U         -3.398e+03  0.00e+00 m   0 1245 1229 1246 0 #N 73, HG2 72, HN 73, 
 434 121.224   1.648   8.403 1 U         -4.101e+03  0.00e+00 m   0 1245 1230 1246 0 #N 73, HG3 72, HN 73, 
 435 121.224   1.679   8.403 1 U         -4.766e+03  0.00e+00 m   0 1245 1235 1246 0 #N 73, QD 72, HN 73, 
 439 127.786   8.403   7.934 1 U         -2.030e+03  0.00e+00 m   0 1263 1246 1264 0 #N 74, HN 73, HN 74, 
 440 127.786   5.722   7.934 1 U         -2.776e+04  0.00e+00 m   0 1263 1248 1264 0 #N 74, HA 73, HN 74, 
 441 127.786   1.800   7.934 1 U         -4.249e+03  0.00e+00 m   0 1263 1250 1264 0 #N 74, HB 73, HN 74, 
 442 127.786   0.897   7.934 1 U         -1.316e+04  0.00e+00 m   0 1263 1251 1264 0 #N 74, QG1 73, HN 74, 
 443 127.786   0.721   7.934 1 U         -2.490e+04  0.00e+00 m   0 1263 1252 1264 0 #N 74, QG2 73, HN 74, 
 444 125.496   7.934   8.688 1 U         -1.942e+03  0.00e+00 m   0 1285 1264 1286 0 #N 75, HN 74, HN 75, 
 445 125.496   4.657   8.688 1 U         -2.346e+04  0.00e+00 m   0 1285 1266 1286 0 #N 75, HA 74, HN 75, 
 446 125.496   0.880   8.688 1 U         -6.315e+03  0.00e+00 m   0 1285 1268 1286 0 #N 75, HB2 74, HN 75, 
 447 125.496  -0.002   8.688 1 U         -2.099e+03  0.00e+00 m   0 1285 1269 1286 0 #N 75, HB3 74, HN 75, 
 448 125.496   0.900   8.688 1 U         -6.315e+03  0.00e+00 m   0 1285 1272 1286 0 #N 75, HG 74, HN 75, 
 449 125.496   0.359   8.688 1 U         -1.999e+03  0.00e+00 m   0 1285 1273 1286 0 #N 75, QD1 74, HN 75, 
 450 125.496   0.494   8.688 1 U         -1.918e+04  0.00e+00 m   0 1285 1274 1286 0 #N 75, QD2 74, HN 75, 
 451 126.349   8.688   9.303 1 U         -1.006e+03  0.00e+00 m   0 1306 1286 1307 0 #N 76, HN 75, HN 76, 
 452 126.349   4.447   9.303 1 U         -1.879e+04  0.00e+00 m   0 1306 1288 1307 0 #N 76, HA 75, HN 76, 
 453 126.349   1.990   9.303 1 U         -5.270e+03  0.00e+00 m   0 1306 1290 1307 0 #N 76, HB 75, HN 76, 
 454 126.349   0.645   9.303 1 U         -8.714e+03  0.00e+00 m   0 1306 1291 1307 0 #N 76, QG2 75, HN 76, 
 455 126.349   1.352   9.303 1 U         -1.363e+03  0.00e+00 m   0 1306 1297 1307 0 #N 76, HG12 75, HN 76, 
 456 126.349   1.140   9.303 1 U         -2.988e+03  0.00e+00 m   0 1306 1298 1307 0 #N 76, HG13 75, HN 76, 
 457 126.349   0.509   9.303 1 U         -4.391e+03  0.00e+00 m   0 1306 1300 1307 0 #N 76, QD1 75, HN 76, 
 458 110.744   9.303   7.383 1 U         -1.747e+03  0.00e+00 m   0 1328 1307 1329 0 #N 77, HN 76, HN 77, 
 459 110.744   5.562   7.383 1 U         -3.150e+04  0.00e+00 m   0 1328 1309 1329 0 #N 77, HA 76, HN 77, 
 460 110.744   1.960   7.383 1 U         -2.371e+03  0.00e+00 m   0 1328 1311 1329 0 #N 77, HB2 76, HN 77, 
 461 110.744   1.102   7.383 1 U         -5.166e+03  0.00e+00 m   0 1328 1312 1329 0 #N 77, HB3 76, HN 77, 
 462 110.744   1.470   7.383 1 U         -1.672e+03  0.00e+00 m   0 1328 1315 1329 0 #N 77, HG 76, HN 77, 
 463 110.744   0.753   7.383 1 U         -9.555e+03  0.00e+00 m   0 1328 1316 1329 0 #N 77, QD1 76, HN 77, 
 464 110.744   0.779   7.383 1 U         -7.430e+03  0.00e+00 m   0 1328 1317 1329 0 #N 77, QD2 76, HN 77, 
 465 123.489   7.383  10.445 1 U         -1.245e+03  0.00e+00 m   0 1338 1329 1339 0 #N 78, HN 77, HN 78, 
 466 123.489   4.746  10.445 1 U         -1.645e+04  0.00e+00 m   0 1338 1331 1339 0 #N 78, HA 77, HN 78, 
 467 123.489   3.919  10.445 1 U         -7.408e+03  0.00e+00 m   0 1338 1333 1339 0 #N 78, HB2 77, HN 78, 
 468 123.489   3.281  10.445 1 U         -1.357e+03  0.00e+00 m   0 1338 1334 1339 0 #N 78, HB3 77, HN 78, 
 469 121.905  10.445   7.880 1 U         -1.014e+04  0.00e+00 m   0 1348 1339 1349 0 #N 79, HN 78, HN 79, 
 470 121.905   4.270   7.880 1 U         -4.957e+03  0.00e+00 m   0 1348 1341 1349 0 #N 79, HA 78, HN 79, 
 471 121.905   3.901   7.880 1 U         -5.158e+03  0.00e+00 m   0 1348 1343 1349 0 #N 79, HB2 78, HN 79, 
 472 121.905   4.037   7.880 1 U         -3.245e+03  0.00e+00 m   0 1348 1344 1349 0 #N 79, HB3 78, HN 79, 
 473 127.224   7.880   9.348 1 U         -2.354e+03  0.00e+00 m   0 1359 1349 1360 0 #N 80, HN 79, HN 80, 
 474 127.224   4.752   9.348 1 U         -3.836e+04  0.00e+00 m   0 1359 1351 1360 0 #N 80, HA 79, HN 80, 
 475 127.224   2.468   9.348 1 U         -2.912e+03  0.00e+00 m   0 1359 1353 1360 0 #N 80, HB2 79, HN 80, 
 476 127.224   3.036   9.348 1 U         -3.516e+03  0.00e+00 m   0 1359 1354 1360 0 #N 80, HB3 79, HN 80, 
 477 117.620   9.348   8.684 1 U         -1.059e+04  0.00e+00 m   0 1374 1360 1375 0 #N 81, HN 80, HN 81, 
 478 117.620   3.886   8.684 1 U         -4.311e+03  0.00e+00 m   0 1374 1362 1375 0 #N 81, HA 80, HN 81, 
 479 117.620   2.035   8.684 1 U         -9.873e+03  0.00e+00 m   0 1374 1366 1375 0 #N 81, QB 80, HN 81, 
 481 117.620   2.283   8.684 1 U         -5.286e+03  0.00e+00 m   0 1374 1370 1375 0 #N 81, QG 80, HN 81, 
 483 122.564   8.684   7.643 1 U         -2.423e+04  0.00e+00 m   0 1388 1375 1389 0 #N 82, HN 81, HN 82, 
 484 122.564   4.497   7.643 1 U         -5.391e+03  0.00e+00 m   0 1388 1377 1389 0 #N 82, HA 81, HN 82, 
 485 122.564   2.750   7.643 1 U         -5.833e+03  0.00e+00 m   0 1388 1379 1389 0 #N 82, HB2 81, HN 82, 
 486 122.564   3.047   7.643 1 U         -1.274e+04  0.00e+00 m   0 1388 1380 1389 0 #N 82, HB3 81, HN 82, 
 489 118.230   7.643   7.306 1 U         -1.513e+04  0.00e+00 m   0 1409 1389 1410 0 #N 83, HN 82, HN 83, 
 490 118.230   3.668   7.306 1 U         -2.875e+03  0.00e+00 m   0 1409 1391 1410 0 #N 83, HA 82, HN 83, 
 491 118.230   2.170   7.306 1 U         -1.040e+04  0.00e+00 m   0 1409 1393 1410 0 #N 83, HB 82, HN 83, 
 492 118.230   0.788   7.306 1 U         -8.566e+03  0.00e+00 m   0 1409 1394 1410 0 #N 83, QG2 82, HN 83, 
 493 118.230   1.709   7.306 1 U         -2.735e+03  0.00e+00 m   0 1409 1400 1410 0 #N 83, HG12 82, HN 83, 
 494 118.230   0.952   7.306 1 U         -1.470e+03  0.00e+00 m   0 1409 1401 1410 0 #N 83, HG13 82, HN 83, 
 495 118.230   0.873   7.306 1 U         -6.226e+03  0.00e+00 m   0 1409 1403 1410 0 #N 83, QD1 82, HN 83, 
 496 117.379   7.306   8.160 1 U         -1.165e+04  0.00e+00 m   0 1430 1410 1431 0 #N 84, HN 83, HN 84, 
 497 117.379   3.539   8.160 1 U         -3.305e+03  0.00e+00 m   0 1430 1412 1431 0 #N 84, HA 83, HN 84, 
 498 117.379   2.078   8.160 1 U         -3.445e+04  0.00e+00 m   0 1430 1414 1431 0 #N 84, HB 83, HN 84, 
 499 117.379   0.828   8.160 1 U         -9.725e+03  0.00e+00 m   0 1430 1415 1431 0 #N 84, QG2 83, HN 84, 
 500 117.379   1.534   8.160 1 U         -2.791e+03  0.00e+00 m   0 1430 1421 1431 0 #N 84, HG12 83, HN 84, 
 501 117.379   1.234   8.160 1 U         -1.942e+03  0.00e+00 m   0 1430 1422 1431 0 #N 84, HG13 83, HN 84, 
 502 117.379   0.633   8.160 1 U         -3.237e+03  0.00e+00 m   0 1430 1424 1431 0 #N 84, QD1 83, HN 84, 
 503 114.134   8.160   7.786 1 U         -2.176e+04  0.00e+00 m   0 1445 1431 1446 0 #N 85, HN 84, HN 85, 
 504 114.134   4.025   7.786 1 U         -3.654e+04  0.00e+00 m   0 1445 1433 1446 0 #N 85, HA 84, HN 85, 
 505 114.134   2.115   7.786 1 U         -1.028e+04  0.00e+00 m   0 1445 1435 1446 0 #N 85, HB2 84, HN 85, 
 506 114.134   2.036   7.786 1 U         -1.556e+04  0.00e+00 m   0 1445 1436 1446 0 #N 85, HB3 84, HN 85, 
 507 114.134   2.349   7.786 1 U         -4.266e+03  0.00e+00 m   0 1445 1441 1446 0 #N 85, QG 84, HN 85, 
 509 122.990   7.786   8.247 1 U         -1.003e+04  0.00e+00 m   0 1455 1446 1456 0 #N 86, HN 85, HN 86, 
 510 122.990   4.220   8.247 1 U         -2.952e+03  0.00e+00 m   0 1455 1448 1456 0 #N 86, HA 85, HN 86, 
 511 122.990   4.017   8.247 1 U         -8.430e+03  0.00e+00 m   0 1455 1452 1456 0 #N 86, QB 85, HN 86, 
 513 118.724   8.247   8.153 1 U         -1.488e+04  0.00e+00 m   0 1476 1456 1477 0 #N 87, HN 86, HN 87, 
 514 118.724   3.870   8.153 1 U         -2.241e+03  0.00e+00 m   0 1476 1458 1477 0 #N 87, HA 86, HN 87, 
 515 118.724   2.050   8.153 1 U         -1.187e+04  0.00e+00 m   0 1476 1460 1477 0 #N 87, HB 86, HN 87, 
 516 118.724   0.923   8.153 1 U         -5.696e+03  0.00e+00 m   0 1476 1461 1477 0 #N 87, QG2 86, HN 87, 
 517 118.724   1.300   8.153 1 U         -1.357e+03  0.00e+00 m   0 1476 1467 1477 0 #N 87, HG12 86, HN 87, 
 518 118.724   1.688   8.153 1 U         -1.044e+04  0.00e+00 m   0 1476 1468 1477 0 #N 87, HG13 86, HN 87, 
 519 118.724   0.779   8.153 1 U         -3.902e+03  0.00e+00 m   0 1476 1470 1477 0 #N 87, QD1 86, HN 87, 
 520 114.597   8.153   7.436 1 U         -1.350e+04  0.00e+00 m   0 1502 1477 1503 0 #N 88, HN 87, HN 88, 
 521 114.597   4.114   7.436 1 U         -6.885e+03  0.00e+00 m   0 1502 1479 1503 0 #N 88, HA 87, HN 88, 
 522 114.597   1.808   7.436 1 U         -2.877e+04  0.00e+00 m   0 1502 1481 1503 0 #N 88, HB2 87, HN 88, 
 523 114.597   1.907   7.436 1 U         -2.037e+04  0.00e+00 m   0 1502 1482 1503 0 #N 88, HB3 87, HN 88, 
 524 114.597   1.672   7.436 1 U         -6.058e+03  0.00e+00 m   0 1502 1485 1503 0 #N 88, HG2 87, HN 88, 
 525 114.597   1.842   7.436 1 U         -4.364e+04  0.00e+00 m   0 1502 1486 1503 0 #N 88, HG3 87, HN 88, 
 526 114.597   3.136   7.436 1 U         -1.146e+03  0.00e+00 m   0 1502 1491 1503 0 #N 88, QD 87, HN 88, 
 528 116.894   7.436   7.701 1 U         -2.214e+04  0.00e+00 m   0 1527 1503 1528 0 #N 89, HN 88, HN 89, 
 529 116.894   4.070   7.701 1 U         -7.123e+03  0.00e+00 m   0 1527 1505 1528 0 #N 89, HA 88, HN 89, 
 530 116.894   1.859   7.701 1 U         -2.070e+04  0.00e+00 m   0 1527 1509 1528 0 #N 89, QB 88, HN 89, 
 532 116.894   1.408   7.701 1 U         -1.083e+04  0.00e+00 m   0 1527 1511 1528 0 #N 89, HG2 88, HN 89, 
 533 116.894   1.546   7.701 1 U         -2.221e+03  0.00e+00 m   0 1527 1512 1528 0 #N 89, HG3 88, HN 89, 
 534 116.894   1.665   7.701 1 U         -8.862e+03  0.00e+00 m   0 1527 1517 1528 0 #N 89, QD 88, HN 89, 
 536 116.894   2.950   7.701 1 U         -2.303e+03  0.00e+00 m   0 1527 1521 1528 0 #N 89, QE 88, HN 89, 
 538 116.864   7.701   8.787 1 U         -3.881e+04  0.00e+00 m   0 1545 1528 1546 0 #N 90, HN 89, HN 90, 
 539 116.864   3.942   8.787 1 U         -7.555e+03  0.00e+00 m   0 1545 1530 1546 0 #N 90, HA 89, HN 90, 
 540 116.864   1.373   8.787 1 U         -1.068e+04  0.00e+00 m   0 1545 1532 1546 0 #N 90, HB2 89, HN 90, 
 541 116.864   1.721   8.787 1 U         -1.089e+04  0.00e+00 m   0 1545 1533 1546 0 #N 90, HB3 89, HN 90, 
 542 116.864   1.652   8.787 1 U         -3.794e+03  0.00e+00 m   0 1545 1536 1546 0 #N 90, HG2 89, HN 90, 
 543 116.864   2.064   8.787 1 U         -2.920e+03  0.00e+00 m   0 1545 1537 1546 0 #N 90, HG3 89, HN 90, 
 546 114.684   4.526   8.352 1 U         -7.021e+03  0.00e+00 m   0 1584 1571 1585 0 #N 92, HA 91, HN 92, 
 547 114.684   1.948   8.352 1 U         -1.285e+04  0.00e+00 m   0 1584 1573 1585 0 #N 92, HB2 91, HN 92, 
 548 114.684   2.472   8.352 1 U         -2.875e+03  0.00e+00 m   0 1584 1574 1585 0 #N 92, HB3 91, HN 92, 
 549 114.684   1.963   8.352 1 U         -1.285e+04  0.00e+00 m   0 1584 1577 1585 0 #N 92, HG2 91, HN 92, 
 550 114.684   1.998   8.352 1 U         -1.461e+04  0.00e+00 m   0 1584 1578 1585 0 #N 92, HG3 91, HN 92, 
 551 114.684   3.675   8.352 1 U         -5.776e+03  0.00e+00 m   0 1584 1580 1585 0 #N 92, HD2 91, HN 92, 
 552 114.684   3.331   8.352 1 U         -3.462e+03  0.00e+00 m   0 1584 1581 1585 0 #N 92, HD3 91, HN 92, 
 553 121.254   8.352   7.758 1 U         -2.063e+04  0.00e+00 m   0 1609 1585 1610 0 #N 93, HN 92, HN 93, 
 554 121.254   4.369   7.758 1 U         -6.106e+03  0.00e+00 m   0 1609 1587 1610 0 #N 93, HA 92, HN 93, 
 555 121.254   1.809   7.758 1 U         -3.738e+03  0.00e+00 m   0 1609 1589 1610 0 #N 93, HB2 92, HN 93, 
 556 121.254   2.030   7.758 1 U         -3.289e+03  0.00e+00 m   0 1609 1590 1610 0 #N 93, HB3 92, HN 93, 
 557 121.254   1.516   7.758 1 U         -1.874e+03  0.00e+00 m   0 1609 1593 1610 0 #N 93, HG2 92, HN 93, 
 558 121.254   1.439   7.758 1 U         -1.281e+03  0.00e+00 m   0 1609 1594 1610 0 #N 93, HG3 92, HN 93, 
 563 127.911   7.758   8.243 1 U         -2.354e+03  0.00e+00 m   0 1627 1610 1628 0 #N 94, HN 93, HN 94, 
 564 127.911   3.999   8.243 1 U         -3.849e+04  0.00e+00 m   0 1627 1612 1628 0 #N 94, HA 93, HN 94, 
 565 127.911   2.155   8.243 1 U         -1.075e+04  0.00e+00 m   0 1627 1614 1628 0 #N 94, HB 93, HN 94, 
 566 127.911   0.725   8.243 1 U         -1.550e+04  0.00e+00 m   0 1627 1615 1628 0 #N 94, QG1 93, HN 94, 
 567 127.911   0.791   8.243 1 U         -8.703e+03  0.00e+00 m   0 1627 1616 1628 0 #N 94, QG2 93, HN 94, 
 568 115.873   8.243   8.238 1 U         -1.482e+05  0.00e+00 m   0 1642 1628 1643 0 #N 95, HN 94, HN 95, 
 569 115.873   4.471   8.238 1 U         -4.686e+04  0.00e+00 m   0 1642 1630 1643 0 #N 95, HA 94, HN 95, 
 570 115.873   2.196   8.238 1 U         -4.164e+03  0.00e+00 m   0 1642 1632 1643 0 #N 95, HB2 94, HN 95, 
 571 115.873   2.112   8.238 1 U         -6.451e+03  0.00e+00 m   0 1642 1633 1643 0 #N 95, HB3 94, HN 95, 
 572 115.873   2.422   8.238 1 U         -5.391e+03  0.00e+00 m   0 1642 1636 1643 0 #N 95, HG2 94, HN 95, 
 573 115.873   2.384   8.238 1 U         -5.005e+03  0.00e+00 m   0 1642 1637 1643 0 #N 95, HG3 94, HN 95, 
 574 121.684   8.238   8.370 1 U         -2.570e+03  0.00e+00 m   0 1655 1643 1656 0 #N 96, HN 95, HN 96, 
 575 121.684   5.522   8.370 1 U         -2.436e+04  0.00e+00 m   0 1655 1645 1656 0 #N 96, HA 95, HN 96, 
 576 121.684   3.922   8.370 1 U         -7.419e+03  0.00e+00 m   0 1655 1647 1656 0 #N 96, HB 95, HN 96, 
 577 121.684   1.101   8.370 1 U         -5.431e+03  0.00e+00 m   0 1655 1648 1656 0 #N 96, QG2 95, HN 96, 
 578 125.251   8.370   8.757 1 U         -2.138e+03  0.00e+00 m   0 1681 1656 1682 0 #N 97, HN 96, HN 97, 
 579 125.251   4.392   8.757 1 U         -3.300e+04  0.00e+00 m   0 1681 1658 1682 0 #N 97, HA 96, HN 97, 
 580 125.251   1.605   8.757 1 U         -1.256e+04  0.00e+00 m   0 1681 1660 1682 0 #N 97, HB2 96, HN 97, 
 581 125.251   1.717   8.757 1 U         -8.430e+03  0.00e+00 m   0 1681 1661 1682 0 #N 97, HB3 96, HN 97, 
 582 125.251   1.564   8.757 1 U         -1.391e+04  0.00e+00 m   0 1681 1666 1682 0 #N 97, HG2 96, HN 97, 
 584 125.251   3.242   8.757 1 U         -1.942e+03  0.00e+00 m   0 1681 1668 1682 0 #N 97, HD2 96, HN 97, 
 585 125.251   3.059   8.757 1 U         -1.283e+03  0.00e+00 m   0 1681 1669 1682 0 #N 97, HD3 96, HN 97, 
 586 129.536   8.757   7.921 1 U         -2.084e+03  0.00e+00 m   0 1707 1682 1708 0 #N 98, HN 97, HN 98, 
 587 129.536   4.875   7.921 1 U         -2.102e+04  0.00e+00 m   0 1707 1684 1708 0 #N 98, HA 97, HN 98, 
 588 129.536   1.880   7.921 1 U         -2.317e+03  0.00e+00 m   0 1707 1686 1708 0 #N 98, HB2 97, HN 98, 
 589 129.536   1.650   7.921 1 U         -3.165e+03  0.00e+00 m   0 1707 1687 1708 0 #N 98, HB3 97, HN 98, 
 590 129.536   1.562   7.921 1 U         -9.157e+03  0.00e+00 m   0 1707 1692 1708 0 #N 98, QG 97, HN 98, 
 592 129.536   3.143   7.921 1 U         -1.381e+03  0.00e+00 m   0 1707 1696 1708 0 #N 98, QD 97, HN 98, 
 594 120.610   7.921   9.535 1 U         -2.900e+03  0.00e+00 m   0 1717 1708 1718 0 #N 99, HN 98, HN 99, 
 595 120.610   4.760   9.535 1 U         -3.181e+04  0.00e+00 m   0 1717 1710 1718 0 #N 99, HA 98, HN 99, 
 596 120.610   1.032   9.535 1 U         -9.913e+03  0.00e+00 m   0 1717 1711 1718 0 #N 99, QB 98, HN 99, 
 597 115.767   9.535   7.594 1 U         -2.487e+04  0.00e+00 m   0 1735 1718 1736 0 #N 100, HN 99, HN 100, 
 598 115.767   4.260   7.594 1 U         -6.556e+03  0.00e+00 m   0 1735 1720 1736 0 #N 100, HA 99, HN 100, 
 599 115.767   2.100   7.594 1 U         -2.513e+04  0.00e+00 m   0 1735 1722 1736 0 #N 100, HB2 99, HN 100, 
 600 115.767   2.018   7.594 1 U         -8.964e+03  0.00e+00 m   0 1735 1723 1736 0 #N 100, HB3 99, HN 100, 
 601 115.767   2.355   7.594 1 U         -5.278e+03  0.00e+00 m   0 1735 1726 1736 0 #N 100, HG2 99, HN 100, 
 602 115.767   2.279   7.594 1 U         -2.221e+03  0.00e+00 m   0 1735 1727 1736 0 #N 100, HG3 99, HN 100, 
 605 116.693   7.594   8.857 1 U         -1.181e+03  0.00e+00 m   0 1746 1736 1747 0 #N 101, HN 100, HN 101, 
 606 116.693   4.712   8.857 1 U         -8.771e+03  0.00e+00 m   0 1746 1738 1747 0 #N 101, HA 100, HN 101, 
 607 116.693   2.774   8.857 1 U         -5.495e+03  0.00e+00 m   0 1746 1740 1747 0 #N 101, HB2 100, HN 101, 
 608 116.693   3.025   8.857 1 U         -8.532e+03  0.00e+00 m   0 1746 1741 1747 0 #N 101, HB3 100, HN 101, 
 609 121.254   8.857   8.110 1 U         -4.989e+03  0.00e+00 m   0 1771 1747 1772 0 #N 102, HN 101, HN 102, 
 610 121.254   3.805   8.110 1 U         -4.243e+03  0.00e+00 m   0 1771 1749 1772 0 #N 102, HA 101, HN 102, 
 611 121.254   1.766   8.110 1 U         -3.942e+03  0.00e+00 m   0 1771 1751 1772 0 #N 102, HB2 101, HN 102, 
 612 121.254   1.705   8.110 1 U         -4.550e+03  0.00e+00 m   0 1771 1752 1772 0 #N 102, HB3 101, HN 102, 
 613 121.254   1.483   8.110 1 U         -8.453e+03  0.00e+00 m   0 1771 1755 1772 0 #N 102, HG2 101, HN 102, 
 614 121.254   1.389   8.110 1 U         -6.700e+03  0.00e+00 m   0 1771 1756 1772 0 #N 102, HG3 101, HN 102, 
 615 121.254   1.610   8.110 1 U         -2.204e+03  0.00e+00 m   0 1771 1761 1772 0 #N 102, HD2 101, HN 102, 
 617 121.254   2.978   8.110 1 U         -2.445e+03  0.00e+00 m   0 1771 1765 1772 0 #N 102, QE 101, HN 102, 
 619 118.801   8.110   8.274 1 U         -2.227e+04  0.00e+00 m   0 1786 1772 1787 0 #N 103, HN 102, HN 103, 
 620 118.801   4.009   8.274 1 U         -3.999e+03  0.00e+00 m   0 1786 1774 1787 0 #N 103, HA 102, HN 103, 
 621 118.801   2.119   8.274 1 U         -3.190e+04  0.00e+00 m   0 1786 1778 1787 0 #N 103, QB 102, HN 103, 
 623 118.801   2.355   8.274 1 U         -1.221e+04  0.00e+00 m   0 1786 1780 1787 0 #N 103, HG2 102, HN 103, 
 624 118.801   2.282   8.274 1 U         -3.681e+03  0.00e+00 m   0 1786 1781 1787 0 #N 103, HG3 102, HN 103, 
 625 117.960   8.274   7.933 1 U         -1.343e+04  0.00e+00 m   0 1801 1787 1802 0 #N 104, HN 103, HN 104, 
 626 117.960   4.166   7.933 1 U         -3.556e+03  0.00e+00 m   0 1801 1789 1802 0 #N 104, HA 103, HN 104, 
 627 117.960   2.093   7.933 1 U         -4.255e+04  0.00e+00 m   0 1801 1791 1802 0 #N 104, HB2 103, HN 104, 
 628 117.960   2.137   7.933 1 U         -2.561e+04  0.00e+00 m   0 1801 1792 1802 0 #N 104, HB3 103, HN 104, 
 629 117.960   2.778   7.933 1 U         -1.628e+03  0.00e+00 m   0 1801 1795 1802 0 #N 104, HG2 103, HN 104, 
 630 117.960   2.361   7.933 1 U         -3.823e+03  0.00e+00 m   0 1801 1796 1802 0 #N 104, HG3 103, HN 104, 
 631 118.790   7.933   7.963 1 U         -1.160e+05  0.00e+00 m   0 1819 1802 1820 0 #N 105, HN 104, HN 105, 
 632 118.790   3.377   7.963 1 U         -4.391e+03  0.00e+00 m   0 1819 1804 1820 0 #N 105, HA 104, HN 105, 
 633 118.790   2.084   7.963 1 U         -1.934e+04  0.00e+00 m   0 1819 1806 1820 0 #N 105, HB 104, HN 105, 
 634 118.790   0.883   7.963 1 U         -7.680e+03  0.00e+00 m   0 1819 1807 1820 0 #N 105, QG1 104, HN 105, 
 635 118.790   0.691   7.963 1 U         -7.896e+03  0.00e+00 m   0 1819 1808 1820 0 #N 105, QG2 104, HN 105, 
 636 118.293   7.963   8.200 1 U         -1.784e+04  0.00e+00 m   0 1844 1820 1845 0 #N 106, HN 105, HN 106, 
 637 118.293   3.478   8.200 1 U         -4.686e+03  0.00e+00 m   0 1844 1822 1845 0 #N 106, HA 105, HN 106, 
 638 118.293   1.943   8.200 1 U         -1.107e+04  0.00e+00 m   0 1844 1824 1845 0 #N 106, HB2 105, HN 106, 
 639 118.293   1.809   8.200 1 U         -7.930e+03  0.00e+00 m   0 1844 1825 1845 0 #N 106, HB3 105, HN 106, 
 640 118.293   1.224   8.200 1 U         -1.792e+03  0.00e+00 m   0 1844 1828 1845 0 #N 106, HG2 105, HN 106, 
 641 118.293   1.629   8.200 1 U         -3.760e+03  0.00e+00 m   0 1844 1829 1845 0 #N 106, HG3 105, HN 106, 
 642 118.293   1.663   8.200 1 U         -3.522e+03  0.00e+00 m   0 1844 1832 1845 0 #N 106, HD2 105, HN 106, 
 643 118.293   1.763   8.200 1 U         -3.959e+03  0.00e+00 m   0 1844 1833 1845 0 #N 106, HD3 105, HN 106, 
 645 118.293   2.998   8.200 1 U         -1.399e+03  0.00e+00 m   0 1844 1837 1845 0 #N 106, HE3 105, HN 106, 
 646 122.064   8.200   7.751 1 U         -1.475e+04  0.00e+00 m   0 1855 1845 1856 0 #N 107, HN 106, HN 107, 
 647 122.064   4.370   7.751 1 U         -4.726e+03  0.00e+00 m   0 1855 1847 1856 0 #N 107, HA 106, HN 107, 
 648 122.064   2.685   7.751 1 U         -1.968e+04  0.00e+00 m   0 1855 1851 1856 0 #N 107, QB 106, HN 107, 
 650 117.788   7.751   8.310 1 U         -1.977e+04  0.00e+00 m   0 1865 1856 1866 0 #N 108, HN 107, HN 108, 
 651 117.788   4.090   8.310 1 U         -4.056e+03  0.00e+00 m   0 1865 1858 1866 0 #N 108, HA 107, HN 108, 
 652 117.788   1.445   8.310 1 U         -1.763e+04  0.00e+00 m   0 1865 1859 1866 0 #N 108, QB 107, HN 108, 
 653 117.849   8.310   8.039 1 U         -1.586e+04  0.00e+00 m   0 1883 1866 1884 0 #N 109, HN 108, HN 109, 
 654 117.849   3.298   8.039 1 U         -3.060e+03  0.00e+00 m   0 1883 1868 1884 0 #N 109, HA 108, HN 109, 
 655 117.849   2.075   8.039 1 U         -3.277e+04  0.00e+00 m   0 1883 1870 1884 0 #N 109, HB 108, HN 109, 
 656 117.849   0.869   8.039 1 U         -7.260e+03  0.00e+00 m   0 1883 1871 1884 0 #N 109, QG1 108, HN 109, 
 657 117.849   0.643   8.039 1 U         -9.135e+03  0.00e+00 m   0 1883 1872 1884 0 #N 109, QG2 108, HN 109, 
 658 117.728   8.039   7.939 1 U         -1.427e+04  0.00e+00 m   0 1898 1884 1899 0 #N 110, HN 109, HN 110, 
 659 117.728   3.660   7.939 1 U         -2.980e+03  0.00e+00 m   0 1898 1886 1899 0 #N 110, HA 109, HN 110, 
 660 117.728   2.070   7.939 1 U         -4.885e+04  0.00e+00 m   0 1898 1888 1899 0 #N 110, HB2 109, HN 110, 
 661 117.728   2.149   7.939 1 U         -6.935e+04  0.00e+00 m   0 1898 1889 1899 0 #N 110, HB3 109, HN 110, 
 662 117.728   2.156   7.939 1 U         -6.935e+04  0.00e+00 m   0 1898 1892 1899 0 #N 110, HG2 109, HN 110, 
 663 117.728   2.380   7.939 1 U         -9.305e+03  0.00e+00 m   0 1898 1893 1899 0 #N 110, HG3 109, HN 110, 
 664 119.474   7.939   8.077 1 U         -1.436e+04  0.00e+00 m   0 1913 1899 1914 0 #N 111, HN 110, HN 111, 
 665 119.474   3.929   8.077 1 U         -3.749e+03  0.00e+00 m   0 1913 1901 1914 0 #N 111, HA 110, HN 111, 
 666 119.474   2.230   8.077 1 U         -2.851e+03  0.00e+00 m   0 1913 1903 1914 0 #N 111, HB2 110, HN 111, 
 667 119.474   2.107   8.077 1 U         -9.282e+03  0.00e+00 m   0 1913 1904 1914 0 #N 111, HB3 110, HN 111, 
 668 119.474   2.425   8.077 1 U         -1.713e+03  0.00e+00 m   0 1913 1909 1914 0 #N 111, QG 110, HN 111, 
 670 116.972   8.077   8.144 1 U         -1.952e+04  0.00e+00 m   0 1936 1914 1937 0 #N 112, HN 111, HN 112, 
 671 116.972   4.346   8.144 1 U         -2.928e+03  0.00e+00 m   0 1936 1916 1937 0 #N 112, HA 111, HN 112, 
 672 116.972   3.164   8.144 1 U         -4.862e+03  0.00e+00 m   0 1936 1918 1937 0 #N 112, HB2 111, HN 112, 
 673 116.972   2.919   8.144 1 U         -7.521e+03  0.00e+00 m   0 1936 1919 1937 0 #N 112, HB3 111, HN 112, 
 675 116.972   7.039   8.144 1 U         -3.692e+03  0.00e+00 m   0 1936 1934 1937 0 #N 112, QD 111, HN 112, 
 676 120.009   8.144   8.047 1 U         -1.364e+04  0.00e+00 m   0 1958 1937 1959 0 #N 113, HN 112, HN 113, 
 677 120.009   3.821   8.047 1 U         -3.386e+03  0.00e+00 m   0 1958 1939 1959 0 #N 113, HA 112, HN 113, 
 678 120.009   1.075   8.047 1 U         -4.033e+03  0.00e+00 m   0 1958 1941 1959 0 #N 113, HB2 112, HN 113, 
 679 120.009   1.462   8.047 1 U         -9.237e+03  0.00e+00 m   0 1958 1942 1959 0 #N 113, HB3 112, HN 113, 
 680 120.009   1.736   8.047 1 U         -1.940e+03  0.00e+00 m   0 1958 1945 1959 0 #N 113, HG 112, HN 113, 
 681 120.009   0.349   8.047 1 U         -1.610e+03  0.00e+00 m   0 1958 1946 1959 0 #N 113, QD1 112, HN 113, 
 682 120.009   0.630   8.047 1 U         -1.536e+03  0.00e+00 m   0 1958 1947 1959 0 #N 113, QD2 112, HN 113, 
 683 118.059   8.047   7.949 1 U         -2.307e+04  0.00e+00 m   0 1983 1959 1984 0 #N 114, HN 113, HN 114, 
 684 118.059   4.054   7.949 1 U         -1.191e+04  0.00e+00 m   0 1983 1961 1984 0 #N 114, HA 113, HN 114, 
 685 118.059   1.884   7.949 1 U         -6.853e+03  0.00e+00 m   0 1983 1963 1984 0 #N 114, HB2 113, HN 114, 
 686 118.059   1.944   7.949 1 U         -8.498e+03  0.00e+00 m   0 1983 1964 1984 0 #N 114, HB3 113, HN 114, 
 687 118.059   1.563   7.949 1 U         -4.442e+03  0.00e+00 m   0 1983 1967 1984 0 #N 114, HG2 113, HN 114, 
 688 118.059   1.431   7.949 1 U         -4.652e+03  0.00e+00 m   0 1983 1968 1984 0 #N 114, HG3 113, HN 114, 
 689 118.059   1.677   7.949 1 U         -2.783e+03  0.00e+00 m   0 1983 1973 1984 0 #N 114, QD 113, HN 114, 
 693 107.774   7.949   7.926 1 U         -1.013e+05  0.00e+00 m   0 1998 1984 1999 0 #N 115, HN 114, HN 115, 
 694 107.774   4.242   7.926 1 U         -8.782e+03  0.00e+00 m   0 1998 1986 1999 0 #N 115, HA 114, HN 115, 
 695 107.774   2.035   7.926 1 U         -3.573e+03  0.00e+00 m   0 1998 1988 1999 0 #N 115, HB2 114, HN 115, 
 696 107.774   2.083   7.926 1 U         -2.948e+03  0.00e+00 m   0 1998 1989 1999 0 #N 115, HB3 114, HN 115, 
 697 107.774   2.264   7.926 1 U         -1.733e+03  0.00e+00 m   0 1998 1992 1999 0 #N 115, HG2 114, HN 115, 
 698 107.774   2.295   7.926 1 U         -1.920e+03  0.00e+00 m   0 1998 1993 1999 0 #N 115, HG3 114, HN 115, 
 699 107.849   7.926   8.146 1 U         -6.877e+03  0.00e+00 m   0 2005 1999 2006 0 #N 116, HN 115, HN 116, 
 700 107.849   3.781   8.146 1 U         -2.034e+04  0.00e+00 m   0 2005 2003 2006 0 #N 116, QA 115, HN 116, 
 702 114.221   8.146   7.706 1 U         -3.104e+03  0.00e+00 m   0 2012 2006 2013 0 #N 117, HN 116, HN 117, 
 703 114.221   3.783   7.706 1 U         -5.238e+03  0.00e+00 m   0 2012 2008 2013 0 #N 117, HA1 116, HN 117, 
 704 114.221   3.167   7.706 1 U         -1.940e+03  0.00e+00 m   0 2012 2009 2013 0 #N 117, HA2 116, HN 117, 
 705 122.599   7.706   8.453 1 U         -1.733e+03  0.00e+00 m   0 2022 2013 2023 0 #N 118, HN 117, HN 118, 
 706 122.599   4.465   8.453 1 U         -1.999e+04  0.00e+00 m   0 2022 2015 2023 0 #N 118, HA 117, HN 118, 
 707 122.599   3.816   8.453 1 U         -3.743e+03  0.00e+00 m   0 2022 2017 2023 0 #N 118, HB2 117, HN 118, 
 708 122.599   3.741   8.453 1 U         -2.815e+03  0.00e+00 m   0 2022 2018 2023 0 #N 118, HB3 117, HN 118, 
 710 120.724   4.409   8.487 1 U         -1.861e+04  0.00e+00 m   0 2044 2025 2045 0 #N 119, HA 118, HN 119, 
 711 120.724   1.601   8.487 1 U         -8.032e+03  0.00e+00 m   0 2044 2027 2045 0 #N 119, HB2 118, HN 119, 
 712 120.724   1.571   8.487 1 U         -9.669e+03  0.00e+00 m   0 2044 2028 2045 0 #N 119, HB3 118, HN 119, 
 713 120.724   1.581   8.487 1 U         -9.669e+03  0.00e+00 m   0 2044 2031 2045 0 #N 119, HG 118, HN 119, 
 714 120.724   0.849   8.487 1 U         -3.446e+03  0.00e+00 m   0 2044 2032 2045 0 #N 119, QD1 118, HN 119, 
 715 120.724   0.833   8.487 1 U         -4.703e+03  0.00e+00 m   0 2044 2033 2045 0 #N 119, QD2 118, HN 119, 
 722 110.225   8.132   7.685 1 U         -1.466e+03  0.00e+00 m   0  514  506  515 0 #ND2 32, HN 32, HD21 32, 
 723 110.225   5.490   7.685 1 U         -1.965e+03  0.00e+00 m   0  514  508  515 0 #ND2 32, HA 32, HD21 32, 
 724 110.225   3.285   7.685 1 U         -8.669e+03  0.00e+00 m   0  514  510  515 0 #ND2 32, HB2 32, HD21 32, 
 725 110.225   2.658   7.685 1 U         -8.487e+03  0.00e+00 m   0  514  511  515 0 #ND2 32, HB3 32, HD21 32, 
 726 110.225   7.685   7.685 1 U         -9.255e+04  0.00e+00 m   0  514  515  515 0 #ND2 32, HD21 32, HD21 32, 
 727 110.225   6.787   7.685 1 U         -1.052e+05  0.00e+00 m   0  514  516  515 0 #ND2 32, HD22 32, HD21 32, 
 728 110.225   8.132   6.787 1 U         -1.104e+03  0.00e+00 m   0  514  506  516 0 #ND2 32, HN 32, HD22 32, 
 729 110.225   5.490   6.787 1 U         -1.871e+03  0.00e+00 m   0  514  508  516 0 #ND2 32, HA 32, HD22 32, 
 730 110.225   3.285   6.787 1 U         -6.331e+03  0.00e+00 m   0  514  510  516 0 #ND2 32, HB2 32, HD22 32, 
 731 110.225   2.658   6.787 1 U         -6.050e+03  0.00e+00 m   0  514  511  516 0 #ND2 32, HB3 32, HD22 32, 
 732 110.225   7.685   6.787 1 U         -8.613e+04  0.00e+00 m   0  514  515  516 0 #ND2 32, HD21 32, HD22 32, 
 733 110.225   6.787   6.787 1 U         -1.238e+05  0.00e+00 m   0  514  516  516 0 #ND2 32, HD22 32, HD22 32, 
 734 110.017   8.024   7.588 1 U         -1.355e+03  0.00e+00 m   0  782  774  783 0 #ND2 45, HN 45, HD21 45, 
 735 110.017   4.953   7.588 1 U         -8.816e+03  0.00e+00 m   0  782  776  783 0 #ND2 45, HA 45, HD21 45, 
 736 110.017   2.810   7.588 1 U         -6.347e+03  0.00e+00 m   0  782  778  783 0 #ND2 45, HB2 45, HD21 45, 
 737 110.017   2.585   7.588 1 U         -5.166e+03  0.00e+00 m   0  782  779  783 0 #ND2 45, HB3 45, HD21 45, 
 738 110.017   7.588   7.588 1 U         -1.062e+05  0.00e+00 m   0  782  783  783 0 #ND2 45, HD21 45, HD21 45, 
 739 110.017   6.926   7.588 1 U         -8.291e+04  0.00e+00 m   0  782  784  783 0 #ND2 45, HD22 45, HD21 45, 
 740 110.017   8.024   6.926 1 U         -1.309e+03  0.00e+00 m   0  782  774  784 0 #ND2 45, HN 45, HD22 45, 
 741 110.017   4.953   6.926 1 U         -5.198e+03  0.00e+00 m   0  782  776  784 0 #ND2 45, HA 45, HD22 45, 
 742 110.017   2.810   6.926 1 U         -3.897e+03  0.00e+00 m   0  782  778  784 0 #ND2 45, HB2 45, HD22 45, 
 743 110.017   2.585   6.926 1 U         -3.390e+03  0.00e+00 m   0  782  779  784 0 #ND2 45, HB3 45, HD22 45, 
 744 110.017   7.588   6.926 1 U         -8.690e+04  0.00e+00 m   0  782  783  784 0 #ND2 45, HD21 45, HD22 45, 
 745 110.017   6.926   6.926 1 U         -1.314e+05  0.00e+00 m   0  782  784  784 0 #ND2 45, HD22 45, HD22 45, 
 746 115.148   8.684   7.072 1 U         -3.692e+03  0.00e+00 m   0 1383 1375 1384 0 #ND2 81, HN 81, HD21 81, 
 747 115.148   4.497   7.072 1 U         -1.829e+03  0.00e+00 m   0 1383 1377 1384 0 #ND2 81, HA 81, HD21 81, 
 748 115.148   2.750   7.072 1 U         -4.380e+03  0.00e+00 m   0 1383 1379 1384 0 #ND2 81, HB2 81, HD21 81, 
 749 115.148   3.047   7.072 1 U         -8.135e+03  0.00e+00 m   0 1383 1380 1384 0 #ND2 81, HB3 81, HD21 81, 
 750 115.148   7.072   7.072 1 U         -2.785e+05  0.00e+00 m   0 1383 1384 1384 0 #ND2 81, HD21 81, HD21 81, 
 751 115.148   8.035   7.072 1 U         -1.443e+05  0.00e+00 m   0 1383 1385 1384 0 #ND2 81, HD22 81, HD21 81, 
 752 115.148   8.684   8.035 1 U         -5.455e+03  0.00e+00 m   0 1383 1375 1385 0 #ND2 81, HN 81, HD22 81, 
 753 115.148   4.497   8.035 1 U         -1.940e+03  0.00e+00 m   0 1383 1377 1385 0 #ND2 81, HA 81, HD22 81, 
 754 115.148   2.750   8.035 1 U         -6.459e+03  0.00e+00 m   0 1383 1379 1385 0 #ND2 81, HB2 81, HD22 81, 
 755 115.148   3.047   8.035 1 U         -1.362e+04  0.00e+00 m   0 1383 1380 1385 0 #ND2 81, HB3 81, HD22 81, 
 756 115.148   7.072   8.035 1 U         -1.494e+05  0.00e+00 m   0 1383 1384 1385 0 #ND2 81, HD21 81, HD22 81, 
 757 115.148   8.035   8.035 1 U         -1.830e+05  0.00e+00 m   0 1383 1385 1385 0 #ND2 81, HD22 81, HD22 81, 
 759 111.752   3.994   7.796 1 U         -1.928e+03  0.00e+00 m   0  177  167  178 0 #NE2 11, HA 11, HE21 11, 
 760 111.752   2.115   7.796 1 U         -3.177e+03  0.00e+00 m   0  177  169  178 0 #NE2 11, HB2 11, HE21 11, 
 761 111.752   2.218   7.796 1 U         -2.101e+03  0.00e+00 m   0  177  170  178 0 #NE2 11, HB3 11, HE21 11, 
 762 111.752   2.477   7.796 1 U         -1.659e+04  0.00e+00 m   0  177  173  178 0 #NE2 11, HG2 11, HE21 11, 
 763 111.752   2.519   7.796 1 U         -2.446e+04  0.00e+00 m   0  177  174  178 0 #NE2 11, HG3 11, HE21 11, 
 764 111.752   7.796   7.796 1 U         -4.432e+05  0.00e+00 m   0  177  178  178 0 #NE2 11, HE21 11, HE21 11, 
 765 111.752   6.843   7.796 1 U         -2.170e+05  0.00e+00 m   0  177  179  178 0 #NE2 11, HE22 11, HE21 11, 
 767 111.752   3.994   6.843 1 U         -1.721e+03  0.00e+00 m   0  177  167  179 0 #NE2 11, HA 11, HE22 11, 
 768 111.752   2.115   6.843 1 U         -1.846e+03  0.00e+00 m   0  177  169  179 0 #NE2 11, HB2 11, HE22 11, 
 769 111.752   2.218   6.843 1 U         -1.093e+03  0.00e+00 m   0  177  170  179 0 #NE2 11, HB3 11, HE22 11, 
 770 111.752   2.477   6.843 1 U         -8.748e+03  0.00e+00 m   0  177  173  179 0 #NE2 11, HG2 11, HE22 11, 
 771 111.752   2.519   6.843 1 U         -1.152e+04  0.00e+00 m   0  177  174  179 0 #NE2 11, HG3 11, HE22 11, 
 772 111.752   7.796   6.843 1 U         -2.443e+05  0.00e+00 m   0  177  178  179 0 #NE2 11, HE21 11, HE22 11, 
 773 111.752   6.843   6.843 1 U         -4.843e+05  0.00e+00 m   0  177  179  179 0 #NE2 11, HE22 11, HE22 11, 
 775 111.687   4.806   7.637 1 U         -4.789e+03  0.00e+00 m   0  477  467  478 0 #NE2 29, HA 29, HE21 29, 
 776 111.687   2.124   7.637 1 U         -7.020e+02  0.00e+00 m   0  477  469  478 0 #NE2 29, HB2 29, HE21 29, 
 777 111.687   1.993   7.637 1 U         -1.014e+03  0.00e+00 m   0  477  470  478 0 #NE2 29, HB3 29, HE21 29, 
 778 111.687   2.521   7.637 1 U         -6.267e+03  0.00e+00 m   0  477  473  478 0 #NE2 29, HG2 29, HE21 29, 
 779 111.687   2.267   7.637 1 U         -6.042e+03  0.00e+00 m   0  477  474  478 0 #NE2 29, HG3 29, HE21 29, 
 780 111.687   7.637   7.637 1 U         -1.498e+05  0.00e+00 m   0  477  478  478 0 #NE2 29, HE21 29, HE21 29, 
 781 111.687   6.930   7.637 1 U         -9.615e+04  0.00e+00 m   0  477  479  478 0 #NE2 29, HE22 29, HE21 29, 
 783 111.687   4.806   6.930 1 U         -6.162e+03  0.00e+00 m   0  477  467  479 0 #NE2 29, HA 29, HE22 29, 
 786 111.687   2.521   6.930 1 U         -4.931e+03  0.00e+00 m   0  477  473  479 0 #NE2 29, HG2 29, HE22 29, 
 787 111.687   2.267   6.930 1 U         -4.669e+03  0.00e+00 m   0  477  474  479 0 #NE2 29, HG3 29, HE22 29, 
 788 111.687   7.637   6.930 1 U         -1.327e+05  0.00e+00 m   0  477  478  479 0 #NE2 29, HE21 29, HE22 29, 
 789 111.687   6.930   6.930 1 U         -1.661e+05  0.00e+00 m   0  477  479  479 0 #NE2 29, HE22 29, HE22 29, 
 790 114.091   7.404   7.675 1 U         -1.668e+03  0.00e+00 m   0 1137 1125 1138 0 #NE2 65, HN 65, HE21 65, 
 791 114.091   4.215   7.675 1 U         -3.112e+03  0.00e+00 m   0 1137 1127 1138 0 #NE2 65, HA 65, HE21 65, 
 792 114.091   2.092   7.675 1 U         -2.574e+03  0.00e+00 m   0 1137 1129 1138 0 #NE2 65, HB2 65, HE21 65, 
 793 114.091   2.004   7.675 1 U         -2.377e+03  0.00e+00 m   0 1137 1130 1138 0 #NE2 65, HB3 65, HE21 65, 
 794 114.091   2.266   7.675 1 U         -9.373e+03  0.00e+00 m   0 1137 1133 1138 0 #NE2 65, HG2 65, HE21 65, 
 795 114.091   2.627   7.675 1 U         -9.044e+03  0.00e+00 m   0 1137 1134 1138 0 #NE2 65, HG3 65, HE21 65, 
 796 114.091   7.675   7.675 1 U         -1.182e+05  0.00e+00 m   0 1137 1138 1138 0 #NE2 65, HE21 65, HE21 65, 
 797 114.091   7.070   7.675 1 U         -1.003e+05  0.00e+00 m   0 1137 1139 1138 0 #NE2 65, HE22 65, HE21 65, 
 798 114.091   7.404   7.070 1 U         -7.740e+02  0.00e+00 m   0 1137 1125 1139 0 #NE2 65, HN 65, HE22 65, 
 799 114.091   4.215   7.070 1 U         -2.368e+03  0.00e+00 m   0 1137 1127 1139 0 #NE2 65, HA 65, HE22 65, 
 800 114.091   2.092   7.070 1 U         -1.484e+03  0.00e+00 m   0 1137 1129 1139 0 #NE2 65, HB2 65, HE22 65, 
 801 114.091   2.004   7.070 1 U         -2.246e+03  0.00e+00 m   0 1137 1130 1139 0 #NE2 65, HB3 65, HE22 65, 
 802 114.091   2.266   7.070 1 U         -6.564e+03  0.00e+00 m   0 1137 1133 1139 0 #NE2 65, HG2 65, HE22 65, 
 803 114.091   2.627   7.070 1 U         -6.580e+03  0.00e+00 m   0 1137 1134 1139 0 #NE2 65, HG3 65, HE22 65, 
 804 114.091   7.675   7.070 1 U         -1.072e+05  0.00e+00 m   0 1137 1138 1139 0 #NE2 65, HE21 65, HE22 65, 
 805 114.091   7.070   7.070 1 U         -1.467e+05  0.00e+00 m   0 1137 1139 1139 0 #NE2 65, HE22 65, HE22 65, 
 807 110.363   3.942   7.095 1 U         -8.400e+02  0.00e+00 m   0 1540 1530 1541 0 #NE2 89, HA 89, HE21 89, 
 809 110.363   1.721   7.095 1 U         -1.626e+03  0.00e+00 m   0 1540 1533 1541 0 #NE2 89, HB3 89, HE21 89, 
 810 110.363   1.652   7.095 1 U         -6.909e+03  0.00e+00 m   0 1540 1536 1541 0 #NE2 89, HG2 89, HE21 89, 
 811 110.363   2.064   7.095 1 U         -9.135e+03  0.00e+00 m   0 1540 1537 1541 0 #NE2 89, HG3 89, HE21 89, 
 812 110.363   7.095   7.095 1 U         -3.630e+05  0.00e+00 m   0 1540 1541 1541 0 #NE2 89, HE21 89, HE21 89, 
 813 110.363   6.701   7.095 1 U         -2.323e+05  0.00e+00 m   0 1540 1542 1541 0 #NE2 89, HE22 89, HE21 89, 
 816 110.363   1.373   6.701 1 U         -8.830e+02  0.00e+00 m   0 1540 1532 1542 0 #NE2 89, HB2 89, HE22 89, 
 817 110.363   1.721   6.701 1 U         -1.594e+03  0.00e+00 m   0 1540 1533 1542 0 #NE2 89, HB3 89, HE22 89, 
 818 110.363   1.652   6.701 1 U         -4.442e+03  0.00e+00 m   0 1540 1536 1542 0 #NE2 89, HG2 89, HE22 89, 
 819 110.363   2.064   6.701 1 U         -6.090e+03  0.00e+00 m   0 1540 1537 1542 0 #NE2 89, HG3 89, HE22 89, 
 820 110.363   7.095   6.701 1 U         -2.600e+05  0.00e+00 m   0 1540 1541 1542 0 #NE2 89, HE21 89, HE22 89, 
 821 110.363   6.701   6.701 1 U         -3.388e+05  0.00e+00 m   0 1540 1542 1542 0 #NE2 89, HE22 89, HE22 89, 
 824 112.292   2.100   6.869 1 U         -9.080e+02  0.00e+00 m   0 1730 1722 1731 0 #NE2 99, HB2 99, HE21 99, 
 825 112.292   2.018   6.869 1 U         -1.211e+03  0.00e+00 m   0 1730 1723 1731 0 #NE2 99, HB3 99, HE21 99, 
 826 112.292   2.355   6.869 1 U         -4.323e+03  0.00e+00 m   0 1730 1726 1731 0 #NE2 99, HG2 99, HE21 99, 
 827 112.292   2.279   6.869 1 U         -3.486e+03  0.00e+00 m   0 1730 1727 1731 0 #NE2 99, HG3 99, HE21 99, 
 828 112.292   6.869   6.869 1 U         -4.252e+05  0.00e+00 m   0 1730 1731 1731 0 #NE2 99, HE21 99, HE21 99, 
 829 112.292   7.875   6.869 1 U         -1.656e+05  0.00e+00 m   0 1730 1732 1731 0 #NE2 99, HE22 99, HE21 99, 
 832 112.292   2.100   7.875 1 U         -8.670e+02  0.00e+00 m   0 1730 1722 1732 0 #NE2 99, HB2 99, HE22 99, 
 833 112.292   2.018   7.875 1 U         -1.897e+03  0.00e+00 m   0 1730 1723 1732 0 #NE2 99, HB3 99, HE22 99, 
 834 112.292   2.355   7.875 1 U         -8.612e+03  0.00e+00 m   0 1730 1726 1732 0 #NE2 99, HG2 99, HE22 99, 
 835 112.292   2.279   7.875 1 U         -5.294e+03  0.00e+00 m   0 1730 1727 1732 0 #NE2 99, HG3 99, HE22 99, 
 836 112.292   6.869   7.875 1 U         -2.026e+05  0.00e+00 m   0 1730 1731 1732 0 #NE2 99, HE21 99, HE22 99, 
 837 112.292   7.875   7.875 1 U         -3.188e+05  0.00e+00 m   0 1730 1732 1732 0 #NE2 99, HE22 99, HE22 99, 
 838 123.774   8.477   8.477 1 U         -1.122e+05  0.00e+00 m   0   51   52   52 0 #N 4, HN 4, HN 4, 
 839 123.774   4.939   8.477 1 U         -5.865e+03  0.00e+00 m   0   51   54   52 0 #N 4, HA 4, HN 4, 
 840 123.774   2.165   8.477 1 U         -1.427e+04  0.00e+00 m   0   51   56   52 0 #N 4, HB 4, HN 4, 
 841 123.774   0.856   8.477 1 U         -8.351e+03  0.00e+00 m   0   51   57   52 0 #N 4, QG1 4, HN 4, 
 842 123.774   0.996   8.477 1 U         -1.518e+04  0.00e+00 m   0   51   58   52 0 #N 4, QG2 4, HN 4, 
 843 126.474   8.393   8.393 1 U         -8.677e+04  0.00e+00 m   0   69   70   70 0 #N 5, HN 5, HN 5, 
 844 126.474   5.157   8.393 1 U         -6.347e+03  0.00e+00 m   0   69   72   70 0 #N 5, HA 5, HN 5, 
 845 126.474   1.727   8.393 1 U         -1.429e+04  0.00e+00 m   0   69   74   70 0 #N 5, HB 5, HN 5, 
 846 126.474   0.887   8.393 1 U         -1.911e+04  0.00e+00 m   0   69   75   70 0 #N 5, QG1 5, HN 5, 
 847 126.474   0.754   8.393 1 U         -9.475e+03  0.00e+00 m   0   69   76   70 0 #N 5, QG2 5, HN 5, 
 848 126.797   8.883   8.883 1 U         -8.741e+04  0.00e+00 m   0   87   88   88 0 #N 6, HN 6, HN 6, 
 849 126.797   5.461   8.883 1 U         -1.290e+04  0.00e+00 m   0   87   90   88 0 #N 6, HA 6, HN 6, 
 850 126.797   2.866   8.883 1 U         -8.623e+03  0.00e+00 m   0   87   92   88 0 #N 6, HB2 6, HN 6, 
 851 126.797   2.548   8.883 1 U         -6.877e+03  0.00e+00 m   0   87   93   88 0 #N 6, HB3 6, HN 6, 
 853 126.797   6.920   8.883 1 U         -3.028e+03  0.00e+00 m   0   87  108   88 0 #N 6, QD 6, HN 6, 
 854 130.099   8.725   8.725 1 U         -6.990e+04  0.00e+00 m   0  110  111  111 0 #N 7, HN 7, HN 7, 
 855 130.099   5.365   8.725 1 U         -6.532e+03  0.00e+00 m   0  110  113  111 0 #N 7, HA 7, HN 7, 
 856 130.099   1.485   8.725 1 U         -1.048e+04  0.00e+00 m   0  110  115  111 0 #N 7, HB2 7, HN 7, 
 857 130.099   0.945   8.725 1 U         -7.703e+03  0.00e+00 m   0  110  116  111 0 #N 7, HB3 7, HN 7, 
 858 130.099   1.211   8.725 1 U         -2.053e+03  0.00e+00 m   0  110  119  111 0 #N 7, HG 7, HN 7, 
 859 130.099   0.574   8.725 1 U         -2.823e+03  0.00e+00 m   0  110  120  111 0 #N 7, QD1 7, HN 7, 
 860 130.099   0.647   8.725 1 U         -7.498e+03  0.00e+00 m   0  110  121  111 0 #N 7, QD2 7, HN 7, 
 861 115.631   8.116   8.116 1 U         -1.064e+05  0.00e+00 m   0  132  133  133 0 #N 8, HN 8, HN 8, 
 862 115.631   4.577   8.116 1 U         -6.275e+03  0.00e+00 m   0  132  135  133 0 #N 8, HA 8, HN 8, 
 863 115.631   3.286   8.116 1 U         -5.230e+03  0.00e+00 m   0  132  137  133 0 #N 8, HB2 8, HN 8, 
 864 115.631   3.799   8.116 1 U         -3.561e+03  0.00e+00 m   0  132  138  133 0 #N 8, HB3 8, HN 8, 
 865 118.290   8.318   8.318 1 U         -9.448e+04  0.00e+00 m   0  142  143  143 0 #N 9, HN 9, HN 9, 
 866 118.290   4.871   8.318 1 U         -6.451e+03  0.00e+00 m   0  142  145  143 0 #N 9, HA 9, HN 9, 
 867 118.290   2.787   8.318 1 U         -4.647e+03  0.00e+00 m   0  142  147  143 0 #N 9, HB2 9, HN 9, 
 868 118.290   3.070   8.318 1 U         -6.443e+03  0.00e+00 m   0  142  148  143 0 #N 9, HB3 9, HN 9, 
 869 121.660   8.287   8.287 1 U         -1.371e+05  0.00e+00 m   0  153  154  154 0 #N 10, HN 10, HN 10, 
 870 121.660   4.858   8.287 1 U         -9.169e+03  0.00e+00 m   0  153  156  154 0 #N 10, HA 10, HN 10, 
 871 121.660   3.057   8.287 1 U         -1.495e+04  0.00e+00 m   0  153  158  154 0 #N 10, HB2 10, HN 10, 
 872 121.660   2.549   8.287 1 U         -1.556e+04  0.00e+00 m   0  153  159  154 0 #N 10, HB3 10, HN 10, 
 873 126.131   9.026   9.026 1 U         -6.363e+04  0.00e+00 m   0  164  165  165 0 #N 11, HN 11, HN 11, 
 874 126.131   3.994   9.026 1 U         -6.700e+03  0.00e+00 m   0  164  167  165 0 #N 11, HA 11, HN 11, 
 875 126.131   2.115   9.026 1 U         -1.208e+04  0.00e+00 m   0  164  169  165 0 #N 11, HB2 11, HN 11, 
 876 126.131   2.218   9.026 1 U         -1.432e+04  0.00e+00 m   0  164  170  165 0 #N 11, HB3 11, HN 11, 
 877 126.131   2.477   9.026 1 U         -4.726e+03  0.00e+00 m   0  164  173  165 0 #N 11, HG2 11, HN 11, 
 878 126.131   2.519   9.026 1 U         -5.310e+03  0.00e+00 m   0  164  174  165 0 #N 11, HG3 11, HN 11, 
 881 119.136   8.306   8.306 1 U         -1.992e+05  0.00e+00 m   0  182  183  183 0 #N 12, HN 12, HN 12, 
 882 119.136   4.147   8.306 1 U         -2.021e+04  0.00e+00 m   0  182  185  183 0 #N 12, HA 12, HN 12, 
 883 119.136   2.185   8.306 1 U         -4.820e+04  0.00e+00 m   0  182  187  183 0 #N 12, HB2 12, HN 12, 
 884 119.136   2.212   8.306 1 U         -5.322e+04  0.00e+00 m   0  182  188  183 0 #N 12, HB3 12, HN 12, 
 885 119.136   2.195   8.306 1 U         -5.322e+04  0.00e+00 m   0  182  191  183 0 #N 12, HG2 12, HN 12, 
 886 119.136   2.421   8.306 1 U         -1.096e+04  0.00e+00 m   0  182  192  183 0 #N 12, HG3 12, HN 12, 
 887 119.899   7.727   7.727 1 U         -1.542e+05  0.00e+00 m   0  197  198  198 0 #N 13, HN 13, HN 13, 
 888 119.899   3.734   7.727 1 U         -1.189e+04  0.00e+00 m   0  197  200  198 0 #N 13, HA 13, HN 13, 
 889 119.899   2.144   7.727 1 U         -4.242e+04  0.00e+00 m   0  197  202  198 0 #N 13, HB 13, HN 13, 
 890 119.899   1.113   7.727 1 U         -1.004e+04  0.00e+00 m   0  197  203  198 0 #N 13, QG2 13, HN 13, 
 891 119.899   1.727   7.727 1 U         -1.436e+04  0.00e+00 m   0  197  209  198 0 #N 13, HG12 13, HN 13, 
 892 119.899   1.053   7.727 1 U         -8.578e+03  0.00e+00 m   0  197  210  198 0 #N 13, HG13 13, HN 13, 
 893 119.899   0.848   7.727 1 U         -5.222e+03  0.00e+00 m   0  197  212  198 0 #N 13, QD1 13, HN 13, 
 894 120.959   8.086   8.086 1 U         -9.255e+04  0.00e+00 m   0  218  219  219 0 #N 14, HN 14, HN 14, 
 895 120.959   3.504   8.086 1 U         -8.498e+03  0.00e+00 m   0  218  221  219 0 #N 14, HA 14, HN 14, 
 896 120.959   2.070   8.086 1 U         -1.950e+04  0.00e+00 m   0  218  223  219 0 #N 14, HB 14, HN 14, 
 897 120.959   0.945   8.086 1 U         -9.180e+03  0.00e+00 m   0  218  224  219 0 #N 14, QG2 14, HN 14, 
 898 120.959   1.910   8.086 1 U         -1.154e+04  0.00e+00 m   0  218  230  219 0 #N 14, HG12 14, HN 14, 
 899 120.959   1.024   8.086 1 U         -6.837e+03  0.00e+00 m   0  218  231  219 0 #N 14, HG13 14, HN 14, 
 900 120.959   0.897   8.086 1 U         -7.794e+03  0.00e+00 m   0  218  233  219 0 #N 14, QD1 14, HN 14, 
 901 119.194   8.121   8.121 1 U         -1.258e+05  0.00e+00 m   0  239  240  240 0 #N 15, HN 15, HN 15, 
 902 119.194   4.032   8.121 1 U         -1.913e+04  0.00e+00 m   0  239  242  240 0 #N 15, HA 15, HN 15, 
 903 119.194   2.097   8.121 1 U         -2.954e+04  0.00e+00 m   0  239  244  240 0 #N 15, HB2 15, HN 15, 
 904 119.194   2.193   8.121 1 U         -2.333e+04  0.00e+00 m   0  239  245  240 0 #N 15, HB3 15, HN 15, 
 905 119.194   2.362   8.121 1 U         -8.975e+03  0.00e+00 m   0  239  248  240 0 #N 15, HG2 15, HN 15, 
 906 119.194   2.502   8.121 1 U         -1.391e+04  0.00e+00 m   0  239  249  240 0 #N 15, HG3 15, HN 15, 
 907 119.136   7.792   7.792 1 U         -1.374e+05  0.00e+00 m   0  254  255  255 0 #N 16, HN 16, HN 16, 
 908 119.136   4.031   7.792 1 U         -1.983e+04  0.00e+00 m   0  254  257  255 0 #N 16, HA 16, HN 16, 
 909 119.136   2.113   7.792 1 U         -3.250e+04  0.00e+00 m   0  254  259  255 0 #N 16, HB2 16, HN 16, 
 910 119.136   1.967   7.792 1 U         -1.370e+04  0.00e+00 m   0  254  260  255 0 #N 16, HB3 16, HN 16, 
 911 119.136   2.159   7.792 1 U         -2.600e+04  0.00e+00 m   0  254  263  255 0 #N 16, HG2 16, HN 16, 
 912 119.136   2.318   7.792 1 U         -9.737e+03  0.00e+00 m   0  254  264  255 0 #N 16, HG3 16, HN 16, 
 913 120.411   8.392   8.392 1 U         -1.048e+05  0.00e+00 m   0  269  270  270 0 #N 17, HN 17, HN 17, 
 914 120.411   3.259   8.392 1 U         -1.024e+04  0.00e+00 m   0  269  272  270 0 #N 17, HA 17, HN 17, 
 915 120.411   1.540   8.392 1 U         -2.455e+04  0.00e+00 m   0  269  274  270 0 #N 17, HB 17, HN 17, 
 916 120.411   0.095   8.392 1 U         -2.507e+04  0.00e+00 m   0  269  275  270 0 #N 17, QG1 17, HN 17, 
 917 120.411   0.208   8.392 1 U         -8.078e+03  0.00e+00 m   0  269  276  270 0 #N 17, QG2 17, HN 17, 
 918 115.233   8.534   8.534 1 U         -1.411e+05  0.00e+00 m   0  287  288  288 0 #N 18, HN 18, HN 18, 
 919 115.233   4.061   8.534 1 U         -2.089e+04  0.00e+00 m   0  287  290  288 0 #N 18, HA 18, HN 18, 
 920 115.233   3.994   8.534 1 U         -3.186e+04  0.00e+00 m   0  287  294  288 0 #N 18, QB 18, HN 18, 
 922 121.809   7.987   7.987 1 U         -1.580e+05  0.00e+00 m   0  297  298  298 0 #N 19, HN 19, HN 19, 
 923 121.809   4.114   7.987 1 U         -1.777e+04  0.00e+00 m   0  297  300  298 0 #N 19, HA 19, HN 19, 
 924 121.809   1.889   7.987 1 U         -4.300e+04  0.00e+00 m   0  297  304  298 0 #N 19, QB 19, HN 19, 
 926 121.809   1.568   7.987 1 U         -9.884e+03  0.00e+00 m   0  297  306  298 0 #N 19, HG2 19, HN 19, 
 927 121.809   1.407   7.987 1 U         -4.607e+03  0.00e+00 m   0  297  307  298 0 #N 19, HG3 19, HN 19, 
 928 121.809   1.668   7.987 1 U         -2.747e+03  0.00e+00 m   0  297  312  298 0 #N 19, QD 19, HN 19, 
 930 121.809   2.948   7.987 1 U         -1.004e+03  0.00e+00 m   0  297  316  298 0 #N 19, QE 19, HN 19, 
 932 120.493   7.794   7.794 1 U         -2.272e+05  0.00e+00 m   0  322  323  323 0 #N 20, HN 20, HN 20, 
 933 120.493   4.194   7.794 1 U         -1.509e+04  0.00e+00 m   0  322  325  323 0 #N 20, HA 20, HN 20, 
 934 120.493   1.990   7.794 1 U         -2.950e+04  0.00e+00 m   0  322  327  323 0 #N 20, HB2 20, HN 20, 
 935 120.493   1.853   7.794 1 U         -2.895e+04  0.00e+00 m   0  322  328  323 0 #N 20, HB3 20, HN 20, 
 936 120.493   1.437   7.794 1 U         -5.535e+03  0.00e+00 m   0  322  331  323 0 #N 20, HG2 20, HN 20, 
 937 120.493   1.328   7.794 1 U         -4.203e+03  0.00e+00 m   0  322  332  323 0 #N 20, HG3 20, HN 20, 
 938 120.493   1.638   7.794 1 U         -5.286e+03  0.00e+00 m   0  322  337  323 0 #N 20, QD 20, HN 20, 
 942 119.770   8.511   8.511 1 U         -1.717e+05  0.00e+00 m   0  347  348  348 0 #N 21, HN 21, HN 21, 
 943 119.770   3.870   8.511 1 U         -1.218e+04  0.00e+00 m   0  347  350  348 0 #N 21, HA 21, HN 21, 
 944 119.770   1.535   8.511 1 U         -4.268e+04  0.00e+00 m   0  347  351  348 0 #N 21, QB 21, HN 21, 
 945 117.677   7.934   7.934 1 U         -4.719e+05  0.00e+00 m   0  357  358  358 0 #N 22, HN 22, HN 22, 
 946 117.677   4.094   7.934 1 U         -3.318e+04  0.00e+00 m   0  357  360  358 0 #N 22, HA 22, HN 22, 
 947 117.677   2.187   7.934 1 U         -7.272e+04  0.00e+00 m   0  357  362  358 0 #N 22, HB2 22, HN 22, 
 948 117.677   2.107   7.934 1 U         -5.425e+04  0.00e+00 m   0  357  363  358 0 #N 22, HB3 22, HN 22, 
 949 117.677   2.267   7.934 1 U         -1.956e+04  0.00e+00 m   0  357  366  358 0 #N 22, HG2 22, HN 22, 
 950 117.677   2.397   7.934 1 U         -1.554e+04  0.00e+00 m   0  357  367  358 0 #N 22, HG3 22, HN 22, 
 951 119.558   8.185   8.185 1 U         -2.095e+05  0.00e+00 m   0  372  373  373 0 #N 23, HN 23, HN 23, 
 952 119.558   3.989   8.185 1 U         -1.877e+04  0.00e+00 m   0  372  375  373 0 #N 23, HA 23, HN 23, 
 953 119.558   2.058   8.185 1 U         -1.611e+04  0.00e+00 m   0  372  377  373 0 #N 23, HB2 23, HN 23, 
 954 119.558   2.235   8.185 1 U         -4.499e+04  0.00e+00 m   0  372  378  373 0 #N 23, HB3 23, HN 23, 
 955 119.558   2.461   8.185 1 U         -1.691e+04  0.00e+00 m   0  372  381  373 0 #N 23, HG2 23, HN 23, 
 956 119.558   2.239   8.185 1 U         -4.499e+04  0.00e+00 m   0  372  382  373 0 #N 23, HG3 23, HN 23, 
 957 113.767   7.868   7.868 1 U         -1.014e+05  0.00e+00 m   0  387  388  388 0 #N 24, HN 24, HN 24, 
 958 113.767   4.298   7.868 1 U         -9.180e+03  0.00e+00 m   0  387  390  388 0 #N 24, HA 24, HN 24, 
 959 113.767   1.170   7.868 1 U         -8.623e+03  0.00e+00 m   0  387  392  388 0 #N 24, HB2 24, HN 24, 
 960 113.767   1.896   7.868 1 U         -6.909e+03  0.00e+00 m   0  387  393  388 0 #N 24, HB3 24, HN 24, 
 961 113.767   2.228   7.868 1 U         -1.989e+04  0.00e+00 m   0  387  396  388 0 #N 24, HG2 24, HN 24, 
 962 113.767   2.263   7.868 1 U         -2.288e+04  0.00e+00 m   0  387  397  388 0 #N 24, HG3 24, HN 24, 
 963 108.123   7.692   7.692 1 U         -1.507e+05  0.00e+00 m   0  402  403  403 0 #N 25, HN 25, HN 25, 
 964 108.123   3.813   7.692 1 U         -2.571e+04  0.00e+00 m   0  402  405  403 0 #N 25, HA1 25, HN 25, 
 965 108.123   3.951   7.692 1 U         -1.841e+04  0.00e+00 m   0  402  406  403 0 #N 25, HA2 25, HN 25, 
 966 118.211   8.076   8.076 1 U         -3.036e+05  0.00e+00 m   0  409  410  410 0 #N 26, HN 26, HN 26, 
 967 118.211   4.832   8.076 1 U         -7.578e+03  0.00e+00 m   0  409  412  410 0 #N 26, HA 26, HN 26, 
 968 118.211   2.620   8.076 1 U         -1.575e+04  0.00e+00 m   0  409  414  410 0 #N 26, HB2 26, HN 26, 
 969 118.211   2.901   8.076 1 U         -1.093e+04  0.00e+00 m   0  409  415  410 0 #N 26, HB3 26, HN 26, 
 970 118.211   6.645   8.076 1 U         -1.343e+03  0.00e+00 m   0  409  427  410 0 #N 26, QE 26, HN 26, 
 971 118.211   6.798   8.076 1 U         -9.441e+03  0.00e+00 m   0  409  429  410 0 #N 26, QD 26, HN 26, 
 972 123.599   8.819   8.819 1 U         -6.763e+04  0.00e+00 m   0  432  433  433 0 #N 27, HN 27, HN 27, 
 973 123.599   4.762   8.819 1 U         -2.021e+04  0.00e+00 m   0  432  435  433 0 #N 27, HA 27, HN 27, 
 974 123.599   2.884   8.819 1 U         -1.943e+04  0.00e+00 m   0  432  437  433 0 #N 27, HB2 27, HN 27, 
 975 123.599   2.547   8.819 1 U         -1.281e+04  0.00e+00 m   0  432  438  433 0 #N 27, HB3 27, HN 27, 
 976 120.849   7.765   7.765 1 U         -1.413e+05  0.00e+00 m   0  443  444  444 0 #N 28, HN 28, HN 28, 
 977 120.849   4.573   7.765 1 U         -8.214e+03  0.00e+00 m   0  443  446  444 0 #N 28, HA 28, HN 28, 
 978 120.849   1.510   7.765 1 U         -1.504e+04  0.00e+00 m   0  443  448  444 0 #N 28, HB 28, HN 28, 
 979 120.849   0.658   7.765 1 U         -9.089e+03  0.00e+00 m   0  443  449  444 0 #N 28, QG2 28, HN 28, 
 980 120.849   1.377   7.765 1 U         -4.777e+03  0.00e+00 m   0  443  455  444 0 #N 28, HG12 28, HN 28, 
 981 120.849   0.859   7.765 1 U         -5.093e+03  0.00e+00 m   0  443  456  444 0 #N 28, HG13 28, HN 28, 
 982 120.849   0.610   7.765 1 U         -5.704e+03  0.00e+00 m   0  443  458  444 0 #N 28, QD1 28, HN 28, 
 983 126.901   8.577   8.577 1 U         -8.471e+04  0.00e+00 m   0  464  465  465 0 #N 29, HN 29, HN 29, 
 984 126.901   4.806   8.577 1 U         -6.242e+03  0.00e+00 m   0  464  467  465 0 #N 29, HA 29, HN 29, 
 985 126.901   2.124   8.577 1 U         -9.771e+03  0.00e+00 m   0  464  469  465 0 #N 29, HB2 29, HN 29, 
 986 126.901   1.993   8.577 1 U         -8.737e+03  0.00e+00 m   0  464  470  465 0 #N 29, HB3 29, HN 29, 
 987 126.901   2.521   8.577 1 U         -2.871e+03  0.00e+00 m   0  464  473  465 0 #N 29, HG2 29, HN 29, 
 988 126.901   2.267   8.577 1 U         -1.411e+03  0.00e+00 m   0  464  474  465 0 #N 29, HG3 29, HN 29, 
 991 115.255   8.750   8.750 1 U         -1.167e+05  0.00e+00 m   0  482  483  483 0 #N 30, HN 30, HN 30, 
 992 115.255   5.665   8.750 1 U         -6.379e+03  0.00e+00 m   0  482  485  483 0 #N 30, HA 30, HN 30, 
 993 115.255   4.324   8.750 1 U         -2.246e+03  0.00e+00 m   0  482  487  483 0 #N 30, HB 30, HN 30, 
 994 115.255   1.251   8.750 1 U         -1.220e+04  0.00e+00 m   0  482  488  483 0 #N 30, QG2 30, HN 30, 
 995 114.044   8.822   8.822 1 U         -8.844e+04  0.00e+00 m   0  495  496  496 0 #N 31, HN 31, HN 31, 
 996 114.044   4.677   8.822 1 U         -4.897e+03  0.00e+00 m   0  495  498  496 0 #N 31, HA 31, HN 31, 
 997 114.044   3.076   8.822 1 U         -6.411e+03  0.00e+00 m   0  495  500  496 0 #N 31, HB2 31, HN 31, 
 998 114.044   3.785   8.822 1 U         -4.181e+03  0.00e+00 m   0  495  501  496 0 #N 31, HB3 31, HN 31, 
 999 122.434   8.132   8.132 1 U         -1.127e+05  0.00e+00 m   0  505  506  506 0 #N 32, HN 32, HN 32, 
1000 122.434   5.490   8.132 1 U         -7.498e+03  0.00e+00 m   0  505  508  506 0 #N 32, HA 32, HN 32, 
1001 122.434   3.285   8.132 1 U         -3.999e+03  0.00e+00 m   0  505  510  506 0 #N 32, HB2 32, HN 32, 
1002 122.434   2.658   8.132 1 U         -4.919e+03  0.00e+00 m   0  505  511  506 0 #N 32, HB3 32, HN 32, 
1005 122.762   8.672   8.672 1 U         -5.890e+04  0.00e+00 m   0  519  520  520 0 #N 33, HN 33, HN 33, 
1006 122.762   4.778   8.672 1 U         -6.267e+03  0.00e+00 m   0  519  522  520 0 #N 33, HA 33, HN 33, 
1007 122.762   3.024   8.672 1 U         -8.237e+03  0.00e+00 m   0  519  524  520 0 #N 33, HB2 33, HN 33, 
1008 122.762   2.384   8.672 1 U         -6.612e+03  0.00e+00 m   0  519  525  520 0 #N 33, HB3 33, HN 33, 
1009 123.428   8.406   8.406 1 U         -1.052e+05  0.00e+00 m   0  530  531  531 0 #N 34, HN 34, HN 34, 
1010 123.428   3.706   8.406 1 U         -1.004e+04  0.00e+00 m   0  530  533  531 0 #N 34, HA 34, HN 34, 
1011 123.428   1.781   8.406 1 U         -2.339e+04  0.00e+00 m   0  530  537  531 0 #N 34, QB 34, HN 34, 
1013 123.428   1.365   8.406 1 U         -1.027e+04  0.00e+00 m   0  530  541  531 0 #N 34, QG 34, HN 34, 
1015 123.428   1.622   8.406 1 U         -2.723e+03  0.00e+00 m   0  530  545  531 0 #N 34, QD 34, HN 34, 
1019 118.569   8.009   8.009 1 U         -2.021e+05  0.00e+00 m   0  555  556  556 0 #N 35, HN 35, HN 35, 
1020 118.569   3.861   8.009 1 U         -1.956e+04  0.00e+00 m   0  555  558  556 0 #N 35, HA 35, HN 35, 
1021 118.569   1.911   8.009 1 U         -5.470e+04  0.00e+00 m   0  555  562  556 0 #N 35, QB 35, HN 35, 
1023 118.569   1.498   8.009 1 U         -1.160e+04  0.00e+00 m   0  555  564  556 0 #N 35, HG2 35, HN 35, 
1024 118.569   1.388   8.009 1 U         -1.390e+04  0.00e+00 m   0  555  565  556 0 #N 35, HG3 35, HN 35, 
1025 118.569   1.677   8.009 1 U         -5.913e+03  0.00e+00 m   0  555  570  556 0 #N 35, QD 35, HN 35, 
1027 118.569   3.010   8.009 1 U         -2.005e+03  0.00e+00 m   0  555  574  556 0 #N 35, QE 35, HN 35, 
1029 120.475   7.554   7.554 1 U         -1.905e+05  0.00e+00 m   0  580  581  581 0 #N 36, HN 36, HN 36, 
1030 120.475   4.042   7.554 1 U         -1.568e+04  0.00e+00 m   0  580  583  581 0 #N 36, HA 36, HN 36, 
1031 120.475   2.021   7.554 1 U         -4.878e+04  0.00e+00 m   0  580  587  581 0 #N 36, QB 36, HN 36, 
1033 120.475   2.183   7.554 1 U         -6.668e+03  0.00e+00 m   0  580  589  581 0 #N 36, HG2 36, HN 36, 
1034 120.475   2.274   7.554 1 U         -3.971e+03  0.00e+00 m   0  580  590  581 0 #N 36, HG3 36, HN 36, 
1035 118.349   7.501   7.501 1 U         -1.225e+05  0.00e+00 m   0  595  596  596 0 #N 37, HN 37, HN 37, 
1036 118.349   3.657   7.501 1 U         -9.225e+03  0.00e+00 m   0  595  598  596 0 #N 37, HA 37, HN 37, 
1037 118.349   2.017   7.501 1 U         -4.120e+04  0.00e+00 m   0  595  600  596 0 #N 37, HB 37, HN 37, 
1038 118.349   0.691   7.501 1 U         -2.217e+04  0.00e+00 m   0  595  601  596 0 #N 37, QG2 37, HN 37, 
1039 118.349   1.055   7.501 1 U         -7.305e+03  0.00e+00 m   0  595  607  596 0 #N 37, HG12 37, HN 37, 
1040 118.349   1.928   7.501 1 U         -1.954e+04  0.00e+00 m   0  595  608  596 0 #N 37, HG13 37, HN 37, 
1041 118.349   0.693   7.501 1 U         -2.217e+04  0.00e+00 m   0  595  610  596 0 #N 37, QD1 37, HN 37, 
1042 121.911   8.591   8.591 1 U         -9.949e+04  0.00e+00 m   0  616  617  617 0 #N 38, HN 38, HN 38, 
1043 121.911   3.514   8.591 1 U         -9.010e+03  0.00e+00 m   0  616  619  617 0 #N 38, HA 38, HN 38, 
1044 121.911   1.980   8.591 1 U         -3.145e+04  0.00e+00 m   0  616  621  617 0 #N 38, HB 38, HN 38, 
1045 121.911   0.891   8.591 1 U         -9.646e+03  0.00e+00 m   0  616  622  617 0 #N 38, QG2 38, HN 38, 
1046 121.911   1.679   8.591 1 U         -1.427e+04  0.00e+00 m   0  616  628  617 0 #N 38, HG12 38, HN 38, 
1047 121.911   0.956   8.591 1 U         -9.100e+03  0.00e+00 m   0  616  629  617 0 #N 38, HG13 38, HN 38, 
1048 121.911   0.704   8.591 1 U         -1.716e+04  0.00e+00 m   0  616  631  617 0 #N 38, QD1 38, HN 38, 
1049 119.599   7.849   7.849 1 U         -1.313e+05  0.00e+00 m   0  637  638  638 0 #N 39, HN 39, HN 39, 
1050 119.599   4.340   7.849 1 U         -8.839e+03  0.00e+00 m   0  637  640  638 0 #N 39, HA 39, HN 39, 
1051 119.599   2.753   7.849 1 U         -1.634e+04  0.00e+00 m   0  637  642  638 0 #N 39, HB2 39, HN 39, 
1052 119.599   2.679   7.849 1 U         -1.033e+04  0.00e+00 m   0  637  643  638 0 #N 39, HB3 39, HN 39, 
1053 118.381   8.068   8.068 1 U         -1.333e+05  0.00e+00 m   0  648  649  649 0 #N 40, HN 40, HN 40, 
1054 118.381   3.887   8.068 1 U         -8.919e+03  0.00e+00 m   0  648  651  649 0 #N 40, HA 40, HN 40, 
1055 118.381   1.937   8.068 1 U         -1.040e+04  0.00e+00 m   0  648  653  649 0 #N 40, HB2 40, HN 40, 
1056 118.381   1.987   8.068 1 U         -1.422e+04  0.00e+00 m   0  648  654  649 0 #N 40, HB3 40, HN 40, 
1057 118.381   2.177   8.068 1 U         -9.913e+03  0.00e+00 m   0  648  657  649 0 #N 40, HG2 40, HN 40, 
1058 118.381   1.662   8.068 1 U         -6.524e+03  0.00e+00 m   0  648  658  649 0 #N 40, HG3 40, HN 40, 
1059 118.381   2.914   8.068 1 U         -3.028e+03  0.00e+00 m   0  648  661  649 0 #N 40, HD2 40, HN 40, 
1060 118.381   3.297   8.068 1 U         -1.636e+03  0.00e+00 m   0  648  662  649 0 #N 40, HD3 40, HN 40, 
1061 121.053   8.575   8.575 1 U         -9.140e+04  0.00e+00 m   0  674  675  675 0 #N 41, HN 41, HN 41, 
1062 121.053   4.144   8.575 1 U         -8.192e+03  0.00e+00 m   0  674  677  675 0 #N 41, HA 41, HN 41, 
1063 121.053   2.112   8.575 1 U         -1.218e+04  0.00e+00 m   0  674  679  675 0 #N 41, HB2 41, HN 41, 
1064 121.053   1.271   8.575 1 U         -6.612e+03  0.00e+00 m   0  674  680  675 0 #N 41, HB3 41, HN 41, 
1065 121.053   1.779   8.575 1 U         -1.176e+04  0.00e+00 m   0  674  683  675 0 #N 41, HG 41, HN 41, 
1066 121.053   0.681   8.575 1 U         -1.083e+04  0.00e+00 m   0  674  684  675 0 #N 41, QD1 41, HN 41, 
1067 121.053   0.726   8.575 1 U         -1.511e+04  0.00e+00 m   0  674  685  675 0 #N 41, QD2 41, HN 41, 
1068 121.487   8.340   8.340 1 U         -1.200e+05  0.00e+00 m   0  696  697  697 0 #N 42, HN 42, HN 42, 
1069 121.487   4.036   8.340 1 U         -1.038e+04  0.00e+00 m   0  696  699  697 0 #N 42, HA 42, HN 42, 
1070 121.487   1.936   8.340 1 U         -1.142e+04  0.00e+00 m   0  696  701  697 0 #N 42, HB2 42, HN 42, 
1071 121.487   1.996   8.340 1 U         -1.734e+04  0.00e+00 m   0  696  702  697 0 #N 42, HB3 42, HN 42, 
1072 121.487   1.394   8.340 1 U         -5.471e+03  0.00e+00 m   0  696  705  697 0 #N 42, HG2 42, HN 42, 
1073 121.487   1.625   8.340 1 U         -1.443e+04  0.00e+00 m   0  696  706  697 0 #N 42, HG3 42, HN 42, 
1074 121.487   1.677   8.340 1 U         -8.782e+03  0.00e+00 m   0  696  711  697 0 #N 42, QD 42, HN 42, 
1078 115.916   7.482   7.482 1 U         -1.256e+05  0.00e+00 m   0  721  722  722 0 #N 43, HN 43, HN 43, 
1079 115.916   4.265   7.482 1 U         -1.345e+04  0.00e+00 m   0  721  724  722 0 #N 43, HA 43, HN 43, 
1080 115.916   1.723   7.482 1 U         -2.375e+04  0.00e+00 m   0  721  726  722 0 #N 43, HB2 43, HN 43, 
1081 115.916   2.014   7.482 1 U         -1.684e+04  0.00e+00 m   0  721  727  722 0 #N 43, HB3 43, HN 43, 
1082 115.916   1.754   7.482 1 U         -1.602e+04  0.00e+00 m   0  721  730  722 0 #N 43, HG2 43, HN 43, 
1083 115.916   1.676   7.482 1 U         -1.996e+04  0.00e+00 m   0  721  731  722 0 #N 43, HG3 43, HN 43, 
1084 115.916   3.100   7.482 1 U         -1.468e+03  0.00e+00 m   0  721  734  722 0 #N 43, HD2 43, HN 43, 
1085 115.916   3.172   7.482 1 U         -1.158e+03  0.00e+00 m   0  721  735  722 0 #N 43, HD3 43, HN 43, 
1086 115.504   8.069   8.069 1 U         -1.016e+05  0.00e+00 m   0  747  748  748 0 #N 44, HN 44, HN 44, 
1087 115.504   4.269   8.069 1 U         -3.218e+04  0.00e+00 m   0  747  750  748 0 #N 44, HA 44, HN 44, 
1088 115.504   2.094   8.069 1 U         -6.949e+03  0.00e+00 m   0  747  754  748 0 #N 44, QB 44, HN 44, 
1090 115.504   1.653   8.069 1 U         -1.174e+04  0.00e+00 m   0  747  758  748 0 #N 44, QG 44, HN 44, 
1092 115.504   3.265   8.069 1 U         -4.487e+03  0.00e+00 m   0  747  762  748 0 #N 44, QD 44, HN 44, 
1094 113.910   8.024   8.024 1 U         -1.454e+05  0.00e+00 m   0  773  774  774 0 #N 45, HN 45, HN 45, 
1095 113.910   4.953   8.024 1 U         -1.236e+04  0.00e+00 m   0  773  776  774 0 #N 45, HA 45, HN 45, 
1096 113.910   2.810   8.024 1 U         -1.171e+04  0.00e+00 m   0  773  778  774 0 #N 45, HB2 45, HN 45, 
1097 113.910   2.585   8.024 1 U         -1.112e+04  0.00e+00 m   0  773  779  774 0 #N 45, HB3 45, HN 45, 
1098 113.910   7.588   8.024 1 U         -1.124e+03  0.00e+00 m   0  773  783  774 0 #N 45, HD21 45, HN 45, 
1100 116.556   7.204   7.204 1 U         -1.712e+05  0.00e+00 m   0  787  788  788 0 #N 46, HN 46, HN 46, 
1101 116.556   4.105   7.204 1 U         -1.093e+04  0.00e+00 m   0  787  790  788 0 #N 46, HA 46, HN 46, 
1102 116.556   1.440   7.204 1 U         -2.227e+04  0.00e+00 m   0  787  792  788 0 #N 46, HB 46, HN 46, 
1103 116.556   0.699   7.204 1 U         -1.183e+04  0.00e+00 m   0  787  793  788 0 #N 46, QG2 46, HN 46, 
1104 116.556   0.853   7.204 1 U         -4.465e+03  0.00e+00 m   0  787  799  788 0 #N 46, HG12 46, HN 46, 
1105 116.556   1.401   7.204 1 U         -1.641e+04  0.00e+00 m   0  787  800  788 0 #N 46, HG13 46, HN 46, 
1106 116.556   0.739   7.204 1 U         -1.402e+04  0.00e+00 m   0  787  802  788 0 #N 46, QD1 46, HN 46, 
1107 125.470   8.972   8.972 1 U         -4.917e+04  0.00e+00 m   0  808  809  809 0 #N 47, HN 47, HN 47, 
1108 125.470   4.842   8.972 1 U         -4.914e+03  0.00e+00 m   0  808  811  809 0 #N 47, HA 47, HN 47, 
1109 125.470   2.574   8.972 1 U         -7.260e+03  0.00e+00 m   0  808  813  809 0 #N 47, HB2 47, HN 47, 
1110 125.470   2.716   8.972 1 U         -3.760e+03  0.00e+00 m   0  808  814  809 0 #N 47, HB3 47, HN 47, 
1111 119.295   7.817   7.817 1 U         -1.531e+05  0.00e+00 m   0  819  820  820 0 #N 48, HN 48, HN 48, 
1112 119.295   5.430   7.817 1 U         -8.112e+03  0.00e+00 m   0  819  822  820 0 #N 48, HA 48, HN 48, 
1113 119.295   2.126   7.817 1 U         -1.313e+04  0.00e+00 m   0  819  824  820 0 #N 48, HB2 48, HN 48, 
1114 119.295   1.982   7.817 1 U         -8.646e+03  0.00e+00 m   0  819  825  820 0 #N 48, HB3 48, HN 48, 
1115 119.295   2.375   7.817 1 U         -5.969e+03  0.00e+00 m   0  819  830  820 0 #N 48, QG 48, HN 48, 
1117 119.295   1.730   7.817 1 U         -2.150e+03  0.00e+00 m   0  819  831  820 0 #N 48, QE 48, HN 48, 
1118 122.213   9.092   9.092 1 U         -9.062e+04  0.00e+00 m   0  837  838  838 0 #N 49, HN 49, HN 49, 
1119 122.213   5.419   9.092 1 U         -3.286e+04  0.00e+00 m   0  837  840  838 0 #N 49, HA 49, HN 49, 
1120 122.213   1.526   9.092 1 U         -4.573e+03  0.00e+00 m   0  837  842  838 0 #N 49, HB 49, HN 49, 
1121 122.213   0.760   9.092 1 U         -2.503e+04  0.00e+00 m   0  837  843  838 0 #N 49, QG2 49, HN 49, 
1122 122.213   1.344   9.092 1 U         -1.709e+03  0.00e+00 m   0  837  849  838 0 #N 49, HG12 49, HN 49, 
1123 122.213   0.783   9.092 1 U         -2.063e+04  0.00e+00 m   0  837  850  838 0 #N 49, HG13 49, HN 49, 
1124 122.213   0.628   9.092 1 U         -1.769e+03  0.00e+00 m   0  837  852  838 0 #N 49, QD1 49, HN 49, 
1125 126.911   8.894   8.894 1 U         -9.821e+04  0.00e+00 m   0  858  859  859 0 #N 50, HN 50, HN 50, 
1126 126.911   4.895   8.894 1 U         -3.664e+03  0.00e+00 m   0  858  861  859 0 #N 50, HA 50, HN 50, 
1127 126.911   1.719   8.894 1 U         -1.133e+04  0.00e+00 m   0  858  863  859 0 #N 50, HB 50, HN 50, 
1128 126.911   0.744   8.894 1 U         -2.224e+04  0.00e+00 m   0  858  864  859 0 #N 50, QG2 50, HN 50, 
1129 126.911   1.406   8.894 1 U         -5.246e+03  0.00e+00 m   0  858  870  859 0 #N 50, HG12 50, HN 50, 
1130 126.911   0.720   8.894 1 U         -1.522e+04  0.00e+00 m   0  858  871  859 0 #N 50, HG13 50, HN 50, 
1131 126.911   0.881   8.894 1 U         -1.112e+04  0.00e+00 m   0  858  873  859 0 #N 50, QD1 50, HN 50, 
1132 125.411   8.574   8.574 1 U         -7.172e+04  0.00e+00 m   0  879  880  880 0 #N 51, HN 51, HN 51, 
1133 125.411   4.937   8.574 1 U         -9.748e+03  0.00e+00 m   0  879  882  880 0 #N 51, HA 51, HN 51, 
1134 125.411   1.790   8.574 1 U         -9.123e+03  0.00e+00 m   0  879  884  880 0 #N 51, HB 51, HN 51, 
1135 125.411   0.708   8.574 1 U         -1.909e+04  0.00e+00 m   0  879  885  880 0 #N 51, QG1 51, HN 51, 
1136 125.411   0.688   8.574 1 U         -1.909e+04  0.00e+00 m   0  879  886  880 0 #N 51, QG2 51, HN 51, 
1137 126.411   8.252   8.252 1 U         -6.417e+04  0.00e+00 m   0  897  898  898 0 #N 52, HN 52, HN 52, 
1138 126.411   5.742   8.252 1 U         -3.321e+03  0.00e+00 m   0  897  900  898 0 #N 52, HA 52, HN 52, 
1139 126.411   1.957   8.252 1 U         -5.881e+03  0.00e+00 m   0  897  902  898 0 #N 52, HB2 52, HN 52, 
1140 126.411   1.545   8.252 1 U         -4.130e+03  0.00e+00 m   0  897  903  898 0 #N 52, HB3 52, HN 52, 
1141 126.411   1.642   8.252 1 U         -2.025e+03  0.00e+00 m   0  897  906  898 0 #N 52, HG2 52, HN 52, 
1142 126.411   1.377   8.252 1 U         -1.107e+03  0.00e+00 m   0  897  907  898 0 #N 52, HG3 52, HN 52, 
1143 126.411   1.619   8.252 1 U         -2.025e+03  0.00e+00 m   0  897  910  898 0 #N 52, HD2 52, HN 52, 
1144 126.411   1.424   8.252 1 U         -1.381e+03  0.00e+00 m   0  897  911  898 0 #N 52, HD3 52, HN 52, 
1147 120.527   8.434   8.434 1 U         -1.214e+05  0.00e+00 m   0  922  923  923 0 #N 53, HN 53, HN 53, 
1148 120.527   4.795   8.434 1 U         -8.998e+03  0.00e+00 m   0  922  925  923 0 #N 53, HA 53, HN 53, 
1149 120.527   4.299   8.434 1 U         -2.518e+03  0.00e+00 m   0  922  927  923 0 #N 53, HB 53, HN 53, 
1150 120.527   0.886   8.434 1 U         -1.579e+04  0.00e+00 m   0  922  928  923 0 #N 53, QG2 53, HN 53, 
1151 124.060   8.445   8.445 1 U         -7.154e+04  0.00e+00 m   0  935  936  936 0 #N 54, HN 54, HN 54, 
1152 124.060   4.402   8.445 1 U         -5.431e+03  0.00e+00 m   0  935  938  936 0 #N 54, HA 54, HN 54, 
1153 124.060   1.978   8.445 1 U         -8.498e+03  0.00e+00 m   0  935  940  936 0 #N 54, HB2 54, HN 54, 
1154 124.060   2.451   8.445 1 U         -5.600e+03  0.00e+00 m   0  935  941  936 0 #N 54, HB3 54, HN 54, 
1155 124.060   2.563   8.445 1 U         -4.005e+03  0.00e+00 m   0  935  944  936 0 #N 54, HG2 54, HN 54, 
1156 124.060   2.195   8.445 1 U         -1.737e+03  0.00e+00 m   0  935  945  936 0 #N 54, HG3 54, HN 54, 
1157 121.687   8.268   8.268 1 U         -1.142e+05  0.00e+00 m   0  950  951  951 0 #N 55, HN 55, HN 55, 
1158 121.687   4.698   8.268 1 U         -7.169e+03  0.00e+00 m   0  950  953  951 0 #N 55, HA 55, HN 55, 
1159 121.687   2.974   8.268 1 U         -1.250e+04  0.00e+00 m   0  950  955  951 0 #N 55, HB2 55, HN 55, 
1160 121.687   2.599   8.268 1 U         -1.398e+04  0.00e+00 m   0  950  956  951 0 #N 55, HB3 55, HN 55, 
1161 127.275   8.639   8.639 1 U         -1.193e+05  0.00e+00 m   0  961  962  962 0 #N 56, HN 56, HN 56, 
1162 127.275   3.737   8.639 1 U         -1.264e+04  0.00e+00 m   0  961  964  962 0 #N 56, HA 56, HN 56, 
1163 127.275   1.855   8.639 1 U         -3.590e+04  0.00e+00 m   0  961  968  962 0 #N 56, QB 56, HN 56, 
1165 127.275   1.460   8.639 1 U         -1.518e+04  0.00e+00 m   0  961  972  962 0 #N 56, QG 56, HN 56, 
1167 127.275   1.710   8.639 1 U         -4.175e+03  0.00e+00 m   0  961  976  962 0 #N 56, QD 56, HN 56, 
1171 119.516   8.378   8.378 1 U         -1.936e+05  0.00e+00 m   0  986  987  987 0 #N 57, HN 57, HN 57, 
1172 119.516   4.107   8.378 1 U         -1.650e+04  0.00e+00 m   0  986  989  987 0 #N 57, HA 57, HN 57, 
1173 119.516   2.132   8.378 1 U         -3.122e+04  0.00e+00 m   0  986  991  987 0 #N 57, HB2 57, HN 57, 
1174 119.516   2.084   8.378 1 U         -2.391e+04  0.00e+00 m   0  986  992  987 0 #N 57, HB3 57, HN 57, 
1175 119.516   2.324   8.378 1 U         -1.832e+04  0.00e+00 m   0  986  997  987 0 #N 57, QG 57, HN 57, 
1177 115.830   7.777   7.777 1 U         -1.895e+05  0.00e+00 m   0 1001 1002 1002 0 #N 58, HN 58, HN 58, 
1178 115.830   4.240   7.777 1 U         -1.122e+04  0.00e+00 m   0 1001 1004 1002 0 #N 58, HA 58, HN 58, 
1179 115.830   3.608   7.777 1 U         -8.816e+03  0.00e+00 m   0 1001 1006 1002 0 #N 58, HB2 58, HN 58, 
1180 115.830   3.825   7.777 1 U         -1.370e+04  0.00e+00 m   0 1001 1007 1002 0 #N 58, HB3 58, HN 58, 
1181 120.077   7.654   7.654 1 U         -7.453e+04  0.00e+00 m   0 1011 1012 1012 0 #N 59, HN 59, HN 59, 
1182 120.077   3.324   7.654 1 U         -8.260e+03  0.00e+00 m   0 1011 1014 1012 0 #N 59, HA 59, HN 59, 
1183 120.077   1.827   7.654 1 U         -1.847e+04  0.00e+00 m   0 1011 1016 1012 0 #N 59, HB 59, HN 59, 
1184 120.077   0.792   7.654 1 U         -8.010e+03  0.00e+00 m   0 1011 1017 1012 0 #N 59, QG2 59, HN 59, 
1185 120.077   1.596   7.654 1 U         -1.210e+04  0.00e+00 m   0 1011 1023 1012 0 #N 59, HG12 59, HN 59, 
1186 120.077   0.597   7.654 1 U         -6.805e+03  0.00e+00 m   0 1011 1024 1012 0 #N 59, HG13 59, HN 59, 
1187 120.077   0.686   7.654 1 U         -7.589e+03  0.00e+00 m   0 1011 1026 1012 0 #N 59, QD1 59, HN 59, 
1188 114.178   7.933   7.933 1 U         -1.926e+05  0.00e+00 m   0 1032 1033 1033 0 #N 60, HN 60, HN 60, 
1189 114.178   3.948   7.933 1 U         -2.356e+04  0.00e+00 m   0 1032 1035 1033 0 #N 60, HA 60, HN 60, 
1190 114.178   3.986   7.933 1 U         -3.463e+04  0.00e+00 m   0 1032 1037 1033 0 #N 60, HB2 60, HN 60, 
1191 114.178   4.024   7.933 1 U         -3.109e+04  0.00e+00 m   0 1032 1038 1033 0 #N 60, HB3 60, HN 60, 
1192 120.392   7.772   7.772 1 U         -2.291e+05  0.00e+00 m   0 1042 1043 1043 0 #N 61, HN 61, HN 61, 
1193 120.392   3.971   7.772 1 U         -3.040e+04  0.00e+00 m   0 1042 1045 1043 0 #N 61, HA 61, HN 61, 
1194 120.392   2.153   7.772 1 U         -2.381e+04  0.00e+00 m   0 1042 1047 1043 0 #N 61, HB2 61, HN 61, 
1195 120.392   2.002   7.772 1 U         -2.166e+04  0.00e+00 m   0 1042 1048 1043 0 #N 61, HB3 61, HN 61, 
1196 120.392   2.356   7.772 1 U         -1.261e+04  0.00e+00 m   0 1042 1051 1043 0 #N 61, HG2 61, HN 61, 
1197 120.392   2.194   7.772 1 U         -1.277e+04  0.00e+00 m   0 1042 1052 1043 0 #N 61, HG3 61, HN 61, 
1198 118.610   8.117   8.117 1 U         -8.278e+04  0.00e+00 m   0 1057 1058 1058 0 #N 62, HN 62, HN 62, 
1199 118.610   3.421   8.117 1 U         -7.680e+03  0.00e+00 m   0 1057 1060 1058 0 #N 62, HA 62, HN 62, 
1200 118.610   1.810   8.117 1 U         -1.996e+04  0.00e+00 m   0 1057 1062 1058 0 #N 62, HB 62, HN 62, 
1201 118.610   0.559   8.117 1 U         -1.212e+04  0.00e+00 m   0 1057 1063 1058 0 #N 62, QG2 62, HN 62, 
1202 118.610   1.616   8.117 1 U         -1.263e+04  0.00e+00 m   0 1057 1069 1058 0 #N 62, HG12 62, HN 62, 
1203 118.610   0.823   8.117 1 U         -7.339e+03  0.00e+00 m   0 1057 1070 1058 0 #N 62, HG13 62, HN 62, 
1204 118.610   0.557   8.117 1 U         -1.212e+04  0.00e+00 m   0 1057 1072 1058 0 #N 62, QD1 62, HN 62, 
1205 119.241   8.575   8.575 1 U         -9.975e+04  0.00e+00 m   0 1078 1079 1079 0 #N 63, HN 63, HN 63, 
1206 119.241   3.199   8.575 1 U         -7.953e+03  0.00e+00 m   0 1078 1081 1079 0 #N 63, HA 63, HN 63, 
1207 119.241   1.454   8.575 1 U         -2.102e+04  0.00e+00 m   0 1078 1083 1079 0 #N 63, HB 63, HN 63, 
1208 119.241   0.047   8.575 1 U         -7.623e+03  0.00e+00 m   0 1078 1084 1079 0 #N 63, QG2 63, HN 63, 
1209 119.241   0.527   8.575 1 U         -2.204e+04  0.00e+00 m   0 1078 1090 1079 0 #N 63, HG12 63, HN 63, 
1210 119.241   1.609   8.575 1 U         -1.682e+04  0.00e+00 m   0 1078 1091 1079 0 #N 63, HG13 63, HN 63, 
1211 119.241   0.513   8.575 1 U         -1.766e+04  0.00e+00 m   0 1078 1093 1079 0 #N 63, QD1 63, HN 63, 
1212 117.220   7.673   7.673 1 U         -2.041e+05  0.00e+00 m   0 1099 1100 1100 0 #N 64, HN 64, HN 64, 
1213 117.220   3.804   7.673 1 U         -1.800e+04  0.00e+00 m   0 1099 1102 1100 0 #N 64, HA 64, HN 64, 
1214 117.220   1.864   7.673 1 U         -5.174e+04  0.00e+00 m   0 1099 1106 1100 0 #N 64, QB 64, HN 64, 
1216 117.220   1.386   7.673 1 U         -5.809e+03  0.00e+00 m   0 1099 1108 1100 0 #N 64, HG2 64, HN 64, 
1217 117.220   1.578   7.673 1 U         -1.575e+04  0.00e+00 m   0 1099 1109 1100 0 #N 64, HG3 64, HN 64, 
1218 117.220   1.670   7.673 1 U         -4.499e+03  0.00e+00 m   0 1099 1114 1100 0 #N 64, QD 64, HN 64, 
1222 114.597   7.404   7.404 1 U         -1.597e+05  0.00e+00 m   0 1124 1125 1125 0 #N 65, HN 65, HN 65, 
1223 114.597   4.215   7.404 1 U         -1.335e+04  0.00e+00 m   0 1124 1127 1125 0 #N 65, HA 65, HN 65, 
1224 114.597   2.092   7.404 1 U         -1.276e+04  0.00e+00 m   0 1124 1129 1125 0 #N 65, HB2 65, HN 65, 
1225 114.597   2.004   7.404 1 U         -1.588e+04  0.00e+00 m   0 1124 1130 1125 0 #N 65, HB3 65, HN 65, 
1226 114.597   2.266   7.404 1 U         -5.953e+03  0.00e+00 m   0 1124 1133 1125 0 #N 65, HG2 65, HN 65, 
1227 114.597   2.627   7.404 1 U         -1.072e+04  0.00e+00 m   0 1124 1134 1125 0 #N 65, HG3 65, HN 65, 
1228 114.597   7.675   7.404 1 U         -2.018e+04  0.00e+00 m   0 1124 1138 1125 0 #N 65, HE21 65, HN 65, 
1230 120.063   8.655   8.655 1 U         -7.072e+04  0.00e+00 m   0 1142 1143 1143 0 #N 66, HN 66, HN 66, 
1231 120.063   3.687   8.655 1 U         -5.487e+03  0.00e+00 m   0 1142 1145 1143 0 #N 66, HA 66, HN 66, 
1232 120.063   2.196   8.655 1 U         -1.372e+04  0.00e+00 m   0 1142 1147 1143 0 #N 66, HB 66, HN 66, 
1233 120.063   0.824   8.655 1 U         -1.520e+04  0.00e+00 m   0 1142 1148 1143 0 #N 66, QG1 66, HN 66, 
1234 120.063   0.760   8.655 1 U         -7.567e+03  0.00e+00 m   0 1142 1149 1143 0 #N 66, QG2 66, HN 66, 
1235 121.130   8.316   8.316 1 U         -1.112e+05  0.00e+00 m   0 1160 1161 1161 0 #N 67, HN 67, HN 67, 
1236 121.130   4.089   8.316 1 U         -1.221e+04  0.00e+00 m   0 1160 1163 1161 0 #N 67, HA 67, HN 67, 
1237 121.130   1.825   8.316 1 U         -2.900e+04  0.00e+00 m   0 1160 1165 1161 0 #N 67, HB2 67, HN 67, 
1238 121.130   1.508   8.316 1 U         -9.225e+03  0.00e+00 m   0 1160 1166 1161 0 #N 67, HB3 67, HN 67, 
1239 121.130   1.785   8.316 1 U         -2.954e+04  0.00e+00 m   0 1160 1169 1161 0 #N 67, HG 67, HN 67, 
1240 121.130   0.813   8.316 1 U         -2.134e+04  0.00e+00 m   0 1160 1170 1161 0 #N 67, QD1 67, HN 67, 
1241 121.130   0.799   8.316 1 U         -2.134e+04  0.00e+00 m   0 1160 1171 1161 0 #N 67, QD2 67, HN 67, 
1242 118.349   7.809   7.809 1 U         -1.307e+05  0.00e+00 m   0 1182 1183 1183 0 #N 68, HN 68, HN 68, 
1243 118.349   4.626   7.809 1 U         -1.636e+04  0.00e+00 m   0 1182 1185 1183 0 #N 68, HA 68, HN 68, 
1244 118.349   2.740   7.809 1 U         -1.463e+04  0.00e+00 m   0 1182 1187 1183 0 #N 68, HB2 68, HN 68, 
1245 118.349   2.692   7.809 1 U         -2.240e+04  0.00e+00 m   0 1182 1188 1183 0 #N 68, HB3 68, HN 68, 
1246 112.915   7.932   7.932 1 U         -1.549e+05  0.00e+00 m   0 1193 1194 1194 0 #N 69, HN 69, HN 69, 
1247 112.915   4.423   7.932 1 U         -1.305e+04  0.00e+00 m   0 1193 1196 1194 0 #N 69, HA 69, HN 69, 
1248 112.915   4.067   7.932 1 U         -1.886e+04  0.00e+00 m   0 1193 1198 1194 0 #N 69, HB2 69, HN 69, 
1249 112.915   4.039   7.932 1 U         -1.438e+04  0.00e+00 m   0 1193 1199 1194 0 #N 69, HB3 69, HN 69, 
1250 110.368   8.171   8.171 1 U         -5.065e+04  0.00e+00 m   0 1203 1204 1204 0 #N 70, HN 70, HN 70, 
1251 110.368   3.880   8.171 1 U         -1.131e+04  0.00e+00 m   0 1203 1206 1204 0 #N 70, HA1 70, HN 70, 
1252 110.368   4.197   8.171 1 U         -9.260e+03  0.00e+00 m   0 1203 1207 1204 0 #N 70, HA2 70, HN 70, 
1253 122.165   7.564   7.564 1 U         -2.028e+05  0.00e+00 m   0 1210 1211 1211 0 #N 71, HN 71, HN 71, 
1254 122.165   4.436   7.564 1 U         -1.618e+04  0.00e+00 m   0 1210 1213 1211 0 #N 71, HA 71, HN 71, 
1255 122.165   1.154   7.564 1 U         -4.223e+04  0.00e+00 m   0 1210 1214 1211 0 #N 71, QB 71, HN 71, 
1256 119.550   7.831   7.831 1 U         -2.023e+05  0.00e+00 m   0 1220 1221 1221 0 #N 72, HN 72, HN 72, 
1257 119.550   4.670   7.831 1 U         -5.447e+03  0.00e+00 m   0 1220 1223 1221 0 #N 72, HA 72, HN 72, 
1258 119.550   1.821   7.831 1 U         -1.221e+04  0.00e+00 m   0 1220 1225 1221 0 #N 72, HB2 72, HN 72, 
1259 119.550   1.990   7.831 1 U         -1.859e+04  0.00e+00 m   0 1220 1226 1221 0 #N 72, HB3 72, HN 72, 
1260 119.550   1.572   7.831 1 U         -3.897e+03  0.00e+00 m   0 1220 1229 1221 0 #N 72, HG2 72, HN 72, 
1261 119.550   1.648   7.831 1 U         -8.305e+03  0.00e+00 m   0 1220 1230 1221 0 #N 72, HG3 72, HN 72, 
1262 119.550   1.679   7.831 1 U         -8.726e+03  0.00e+00 m   0 1220 1235 1221 0 #N 72, QD 72, HN 72, 
1266 121.224   8.403   8.403 1 U         -1.582e+05  0.00e+00 m   0 1245 1246 1246 0 #N 73, HN 73, HN 73, 
1267 121.224   5.722   8.403 1 U         -7.817e+03  0.00e+00 m   0 1245 1248 1246 0 #N 73, HA 73, HN 73, 
1268 121.224   1.800   8.403 1 U         -1.078e+04  0.00e+00 m   0 1245 1250 1246 0 #N 73, HB 73, HN 73, 
1269 121.224   0.897   8.403 1 U         -2.786e+04  0.00e+00 m   0 1245 1251 1246 0 #N 73, QG1 73, HN 73, 
1270 121.224   0.721   8.403 1 U         -1.131e+04  0.00e+00 m   0 1245 1252 1246 0 #N 73, QG2 73, HN 73, 
1271 127.786   7.934   7.934 1 U         -7.208e+04  0.00e+00 m   0 1263 1264 1264 0 #N 74, HN 74, HN 74, 
1272 127.786   4.657   7.934 1 U         -4.294e+03  0.00e+00 m   0 1263 1266 1264 0 #N 74, HA 74, HN 74, 
1273 127.786   0.880   7.934 1 U         -1.316e+04  0.00e+00 m   0 1263 1268 1264 0 #N 74, HB2 74, HN 74, 
1274 127.786  -0.002   7.934 1 U         -3.936e+03  0.00e+00 m   0 1263 1269 1264 0 #N 74, HB3 74, HN 74, 
1275 127.786   0.900   7.934 1 U         -1.316e+04  0.00e+00 m   0 1263 1272 1264 0 #N 74, HG 74, HN 74, 
1276 127.786   0.359   7.934 1 U         -1.852e+03  0.00e+00 m   0 1263 1273 1264 0 #N 74, QD1 74, HN 74, 
1277 127.786   0.494   7.934 1 U         -3.811e+03  0.00e+00 m   0 1263 1274 1264 0 #N 74, QD2 74, HN 74, 
1278 125.496   8.688   8.688 1 U         -6.835e+04  0.00e+00 m   0 1285 1286 1286 0 #N 75, HN 75, HN 75, 
1279 125.496   4.447   8.688 1 U         -5.037e+03  0.00e+00 m   0 1285 1288 1286 0 #N 75, HA 75, HN 75, 
1280 125.496   1.990   8.688 1 U         -1.051e+04  0.00e+00 m   0 1285 1290 1286 0 #N 75, HB 75, HN 75, 
1281 125.496   0.645   8.688 1 U         -4.272e+03  0.00e+00 m   0 1285 1291 1286 0 #N 75, QG2 75, HN 75, 
1282 125.496   1.352   8.688 1 U         -5.873e+03  0.00e+00 m   0 1285 1297 1286 0 #N 75, HG12 75, HN 75, 
1283 125.496   1.140   8.688 1 U         -5.351e+03  0.00e+00 m   0 1285 1298 1286 0 #N 75, HG13 75, HN 75, 
1284 125.496   0.509   8.688 1 U         -1.918e+04  0.00e+00 m   0 1285 1300 1286 0 #N 75, QD1 75, HN 75, 
1285 126.349   9.303   9.303 1 U         -4.814e+04  0.00e+00 m   0 1306 1307 1307 0 #N 76, HN 76, HN 76, 
1286 126.349   5.562   9.303 1 U         -3.516e+03  0.00e+00 m   0 1306 1309 1307 0 #N 76, HA 76, HN 76, 
1287 126.349   1.960   9.303 1 U         -5.367e+03  0.00e+00 m   0 1306 1311 1307 0 #N 76, HB2 76, HN 76, 
1288 126.349   1.102   9.303 1 U         -3.664e+03  0.00e+00 m   0 1306 1312 1307 0 #N 76, HB3 76, HN 76, 
1289 126.349   1.470   9.303 1 U         -5.656e+03  0.00e+00 m   0 1306 1315 1307 0 #N 76, HG 76, HN 76, 
1290 126.349   0.753   9.303 1 U         -6.821e+03  0.00e+00 m   0 1306 1316 1307 0 #N 76, QD1 76, HN 76, 
1291 126.349   0.779   9.303 1 U         -5.865e+03  0.00e+00 m   0 1306 1317 1307 0 #N 76, QD2 76, HN 76, 
1292 110.744   7.383   7.383 1 U         -9.602e+04  0.00e+00 m   0 1328 1329 1329 0 #N 77, HN 77, HN 77, 
1293 110.744   4.746   7.383 1 U         -6.194e+03  0.00e+00 m   0 1328 1331 1329 0 #N 77, HA 77, HN 77, 
1294 110.744   3.919   7.383 1 U         -5.005e+03  0.00e+00 m   0 1328 1333 1329 0 #N 77, HB2 77, HN 77, 
1295 110.744   3.281   7.383 1 U         -4.357e+03  0.00e+00 m   0 1328 1334 1329 0 #N 77, HB3 77, HN 77, 
1296 123.489  10.445  10.445 1 U         -4.158e+04  0.00e+00 m   0 1338 1339 1339 0 #N 78, HN 78, HN 78, 
1297 123.489   4.270  10.445 1 U         -6.821e+03  0.00e+00 m   0 1338 1341 1339 0 #N 78, HA 78, HN 78, 
1298 123.489   3.901  10.445 1 U         -7.760e+03  0.00e+00 m   0 1338 1343 1339 0 #N 78, HB2 78, HN 78, 
1299 123.489   4.037  10.445 1 U         -5.045e+03  0.00e+00 m   0 1338 1344 1339 0 #N 78, HB3 78, HN 78, 
1300 121.905   7.880   7.880 1 U         -8.780e+04  0.00e+00 m   0 1348 1349 1349 0 #N 79, HN 79, HN 79, 
1301 121.905   4.752   7.880 1 U         -1.059e+04  0.00e+00 m   0 1348 1351 1349 0 #N 79, HA 79, HN 79, 
1302 121.905   2.468   7.880 1 U         -1.356e+04  0.00e+00 m   0 1348 1353 1349 0 #N 79, HB2 79, HN 79, 
1303 121.905   3.036   7.880 1 U         -1.205e+04  0.00e+00 m   0 1348 1354 1349 0 #N 79, HB3 79, HN 79, 
1304 127.224   9.348   9.348 1 U         -1.050e+05  0.00e+00 m   0 1359 1360 1360 0 #N 80, HN 80, HN 80, 
1305 127.224   3.886   9.348 1 U         -1.184e+04  0.00e+00 m   0 1359 1362 1360 0 #N 80, HA 80, HN 80, 
1306 127.224   2.035   9.348 1 U         -3.250e+04  0.00e+00 m   0 1359 1366 1360 0 #N 80, QB 80, HN 80, 
1308 127.224   2.283   9.348 1 U         -1.281e+04  0.00e+00 m   0 1359 1370 1360 0 #N 80, QG 80, HN 80, 
1310 117.620   8.684   8.684 1 U         -1.494e+05  0.00e+00 m   0 1374 1375 1375 0 #N 81, HN 81, HN 81, 
1311 117.620   4.497   8.684 1 U         -1.326e+04  0.00e+00 m   0 1374 1377 1375 0 #N 81, HA 81, HN 81, 
1312 117.620   2.750   8.684 1 U         -1.303e+04  0.00e+00 m   0 1374 1379 1375 0 #N 81, HB2 81, HN 81, 
1313 117.620   3.047   8.684 1 U         -2.384e+04  0.00e+00 m   0 1374 1380 1375 0 #N 81, HB3 81, HN 81, 
1314 117.620   7.072   8.684 1 U         -1.747e+03  0.00e+00 m   0 1374 1384 1375 0 #N 81, HD21 81, HN 81, 
1315 117.620   8.035   8.684 1 U         -3.365e+03  0.00e+00 m   0 1374 1385 1375 0 #N 81, HD22 81, HN 81, 
1316 122.564   7.643   7.643 1 U         -1.127e+05  0.00e+00 m   0 1388 1389 1389 0 #N 82, HN 82, HN 82, 
1317 122.564   3.668   7.643 1 U         -8.180e+03  0.00e+00 m   0 1388 1391 1389 0 #N 82, HA 82, HN 82, 
1318 122.564   2.170   7.643 1 U         -2.166e+04  0.00e+00 m   0 1388 1393 1389 0 #N 82, HB 82, HN 82, 
1319 122.564   0.788   7.643 1 U         -8.623e+03  0.00e+00 m   0 1388 1394 1389 0 #N 82, QG2 82, HN 82, 
1320 122.564   1.709   7.643 1 U         -1.470e+04  0.00e+00 m   0 1388 1400 1389 0 #N 82, HG12 82, HN 82, 
1321 122.564   0.952   7.643 1 U         -6.773e+03  0.00e+00 m   0 1388 1401 1389 0 #N 82, HG13 82, HN 82, 
1322 122.564   0.873   7.643 1 U         -7.283e+03  0.00e+00 m   0 1388 1403 1389 0 #N 82, QD1 82, HN 82, 
1323 118.230   7.306   7.306 1 U         -8.754e+04  0.00e+00 m   0 1409 1410 1410 0 #N 83, HN 83, HN 83, 
1324 118.230   3.539   7.306 1 U         -9.146e+03  0.00e+00 m   0 1409 1412 1410 0 #N 83, HA 83, HN 83, 
1325 118.230   2.078   7.306 1 U         -1.875e+04  0.00e+00 m   0 1409 1414 1410 0 #N 83, HB 83, HN 83, 
1326 118.230   0.828   7.306 1 U         -1.033e+04  0.00e+00 m   0 1409 1415 1410 0 #N 83, QG2 83, HN 83, 
1327 118.230   1.534   7.306 1 U         -1.327e+04  0.00e+00 m   0 1409 1421 1410 0 #N 83, HG12 83, HN 83, 
1328 118.230   1.234   7.306 1 U         -9.191e+03  0.00e+00 m   0 1409 1422 1410 0 #N 83, HG13 83, HN 83, 
1329 118.230   0.633   7.306 1 U         -7.998e+03  0.00e+00 m   0 1409 1424 1410 0 #N 83, QD1 83, HN 83, 
1330 117.379   8.160   8.160 1 U         -1.578e+05  0.00e+00 m   0 1430 1431 1431 0 #N 84, HN 84, HN 84, 
1331 117.379   4.025   8.160 1 U         -1.509e+04  0.00e+00 m   0 1430 1433 1431 0 #N 84, HA 84, HN 84, 
1332 117.379   2.115   8.160 1 U         -3.063e+04  0.00e+00 m   0 1430 1435 1431 0 #N 84, HB2 84, HN 84, 
1333 117.379   2.036   8.160 1 U         -2.712e+04  0.00e+00 m   0 1430 1436 1431 0 #N 84, HB3 84, HN 84, 
1334 117.379   2.349   8.160 1 U         -1.507e+04  0.00e+00 m   0 1430 1441 1431 0 #N 84, QG 84, HN 84, 
1336 114.134   7.786   7.786 1 U         -1.918e+05  0.00e+00 m   0 1445 1446 1446 0 #N 85, HN 85, HN 85, 
1337 114.134   4.220   7.786 1 U         -1.859e+04  0.00e+00 m   0 1445 1448 1446 0 #N 85, HA 85, HN 85, 
1338 114.134   4.017   7.786 1 U         -3.563e+04  0.00e+00 m   0 1445 1452 1446 0 #N 85, QB 85, HN 85, 
1340 122.990   8.247   8.247 1 U         -9.911e+04  0.00e+00 m   0 1455 1456 1456 0 #N 86, HN 86, HN 86, 
1341 122.990   3.870   8.247 1 U         -7.078e+03  0.00e+00 m   0 1455 1458 1456 0 #N 86, HA 86, HN 86, 
1342 122.990   2.050   8.247 1 U         -1.504e+04  0.00e+00 m   0 1455 1460 1456 0 #N 86, HB 86, HN 86, 
1343 122.990   0.923   8.247 1 U         -6.604e+03  0.00e+00 m   0 1455 1461 1456 0 #N 86, QG2 86, HN 86, 
1344 122.990   1.300   8.247 1 U         -7.919e+03  0.00e+00 m   0 1455 1467 1456 0 #N 86, HG12 86, HN 86, 
1345 122.990   1.688   8.247 1 U         -1.125e+04  0.00e+00 m   0 1455 1468 1456 0 #N 86, HG13 86, HN 86, 
1346 122.990   0.779   8.247 1 U         -7.805e+03  0.00e+00 m   0 1455 1470 1456 0 #N 86, QD1 86, HN 86, 
1347 118.724   8.153   8.153 1 U         -1.298e+05  0.00e+00 m   0 1476 1477 1477 0 #N 87, HN 87, HN 87, 
1348 118.724   4.114   8.153 1 U         -1.154e+04  0.00e+00 m   0 1476 1479 1477 0 #N 87, HA 87, HN 87, 
1349 118.724   1.808   8.153 1 U         -2.288e+04  0.00e+00 m   0 1476 1481 1477 0 #N 87, HB2 87, HN 87, 
1350 118.724   1.907   8.153 1 U         -1.638e+04  0.00e+00 m   0 1476 1482 1477 0 #N 87, HB3 87, HN 87, 
1351 118.724   1.672   8.153 1 U         -1.044e+04  0.00e+00 m   0 1476 1485 1477 0 #N 87, HG2 87, HN 87, 
1352 118.724   1.842   8.153 1 U         -2.140e+04  0.00e+00 m   0 1476 1486 1477 0 #N 87, HG3 87, HN 87, 
1353 118.724   3.136   8.153 1 U         -3.124e+03  0.00e+00 m   0 1476 1491 1477 0 #N 87, QD 87, HN 87, 
1355 114.597   7.436   7.436 1 U         -1.746e+05  0.00e+00 m   0 1502 1503 1503 0 #N 88, HN 88, HN 88, 
1356 114.597   4.070   7.436 1 U         -1.738e+04  0.00e+00 m   0 1502 1505 1503 0 #N 88, HA 88, HN 88, 
1357 114.597   1.859   7.436 1 U         -4.364e+04  0.00e+00 m   0 1502 1509 1503 0 #N 88, QB 88, HN 88, 
1359 114.597   1.408   7.436 1 U         -5.648e+03  0.00e+00 m   0 1502 1511 1503 0 #N 88, HG2 88, HN 88, 
1360 114.597   1.546   7.436 1 U         -9.509e+03  0.00e+00 m   0 1502 1512 1503 0 #N 88, HG3 88, HN 88, 
1361 114.597   1.665   7.436 1 U         -5.865e+03  0.00e+00 m   0 1502 1517 1503 0 #N 88, QD 88, HN 88, 
1365 116.894   7.701   7.701 1 U         -1.787e+05  0.00e+00 m   0 1527 1528 1528 0 #N 89, HN 89, HN 89, 
1366 116.894   3.942   7.701 1 U         -1.661e+04  0.00e+00 m   0 1527 1530 1528 0 #N 89, HA 89, HN 89, 
1367 116.894   1.373   7.701 1 U         -1.734e+04  0.00e+00 m   0 1527 1532 1528 0 #N 89, HB2 89, HN 89, 
1368 116.894   1.721   7.701 1 U         -2.220e+04  0.00e+00 m   0 1527 1533 1528 0 #N 89, HB3 89, HN 89, 
1369 116.894   1.652   7.701 1 U         -8.862e+03  0.00e+00 m   0 1527 1536 1528 0 #N 89, HG2 89, HN 89, 
1370 116.894   2.064   7.701 1 U         -9.884e+03  0.00e+00 m   0 1527 1537 1528 0 #N 89, HG3 89, HN 89, 
1371 116.894   7.095   7.701 1 U         -3.108e+03  0.00e+00 m   0 1527 1541 1528 0 #N 89, HE21 89, HN 89, 
1373 116.864   8.787   8.787 1 U         -2.082e+05  0.00e+00 m   0 1545 1546 1546 0 #N 90, HN 90, HN 90, 
1374 116.864   5.124   8.787 1 U         -1.226e+04  0.00e+00 m   0 1545 1548 1546 0 #N 90, HA 90, HN 90, 
1375 116.864   2.923   8.787 1 U         -1.752e+04  0.00e+00 m   0 1545 1552 1546 0 #N 90, QB 90, HN 90, 
1379 114.684   8.352   8.352 1 U         -1.910e+05  0.00e+00 m   0 1584 1585 1585 0 #N 92, HN 92, HN 92, 
1380 114.684   4.369   8.352 1 U         -1.854e+04  0.00e+00 m   0 1584 1587 1585 0 #N 92, HA 92, HN 92, 
1381 114.684   1.809   8.352 1 U         -2.314e+04  0.00e+00 m   0 1584 1589 1585 0 #N 92, HB2 92, HN 92, 
1382 114.684   2.030   8.352 1 U         -1.369e+04  0.00e+00 m   0 1584 1590 1585 0 #N 92, HB3 92, HN 92, 
1383 114.684   1.516   8.352 1 U         -1.125e+04  0.00e+00 m   0 1584 1593 1585 0 #N 92, HG2 92, HN 92, 
1384 114.684   1.439   8.352 1 U         -8.135e+03  0.00e+00 m   0 1584 1594 1585 0 #N 92, HG3 92, HN 92, 
1385 114.684   1.703   8.352 1 U         -5.254e+03  0.00e+00 m   0 1584 1599 1585 0 #N 92, QD 92, HN 92, 
1387 114.684   2.998   8.352 1 U         -1.028e+03  0.00e+00 m   0 1584 1603 1585 0 #N 92, QE 92, HN 92, 
1389 121.254   7.758   7.758 1 U         -1.578e+05  0.00e+00 m   0 1609 1610 1610 0 #N 93, HN 93, HN 93, 
1390 121.254   3.999   7.758 1 U         -8.112e+03  0.00e+00 m   0 1609 1612 1610 0 #N 93, HA 93, HN 93, 
1391 121.254   2.155   7.758 1 U         -2.333e+04  0.00e+00 m   0 1609 1614 1610 0 #N 93, HB 93, HN 93, 
1392 121.254   0.725   7.758 1 U         -9.566e+03  0.00e+00 m   0 1609 1615 1610 0 #N 93, QG1 93, HN 93, 
1393 121.254   0.791   7.758 1 U         -2.201e+04  0.00e+00 m   0 1609 1616 1610 0 #N 93, QG2 93, HN 93, 
1394 127.911   8.243   8.243 1 U         -1.222e+05  0.00e+00 m   0 1627 1628 1628 0 #N 94, HN 94, HN 94, 
1395 127.911   4.471   8.243 1 U         -8.055e+03  0.00e+00 m   0 1627 1630 1628 0 #N 94, HA 94, HN 94, 
1396 127.911   2.196   8.243 1 U         -1.570e+04  0.00e+00 m   0 1627 1632 1628 0 #N 94, HB2 94, HN 94, 
1397 127.911   2.112   8.243 1 U         -1.168e+04  0.00e+00 m   0 1627 1633 1628 0 #N 94, HB3 94, HN 94, 
1398 127.911   2.422   8.243 1 U         -9.339e+03  0.00e+00 m   0 1627 1636 1628 0 #N 94, HG2 94, HN 94, 
1399 127.911   2.384   8.243 1 U         -9.634e+03  0.00e+00 m   0 1627 1637 1628 0 #N 94, HG3 94, HN 94, 
1400 115.873   8.238   8.238 1 U         -1.482e+05  0.00e+00 m   0 1642 1643 1643 0 #N 95, HN 95, HN 95, 
1401 115.873   5.522   8.238 1 U         -6.050e+03  0.00e+00 m   0 1642 1645 1643 0 #N 95, HA 95, HN 95, 
1402 115.873   3.922   8.238 1 U         -4.442e+03  0.00e+00 m   0 1642 1647 1643 0 #N 95, HB 95, HN 95, 
1403 115.873   1.101   8.238 1 U         -1.237e+04  0.00e+00 m   0 1642 1648 1643 0 #N 95, QG2 95, HN 95, 
1404 121.684   8.370   8.370 1 U         -1.077e+05  0.00e+00 m   0 1655 1656 1656 0 #N 96, HN 96, HN 96, 
1405 121.684   4.392   8.370 1 U         -6.773e+03  0.00e+00 m   0 1655 1658 1656 0 #N 96, HA 96, HN 96, 
1406 121.684   1.605   8.370 1 U         -7.896e+03  0.00e+00 m   0 1655 1660 1656 0 #N 96, HB2 96, HN 96, 
1407 121.684   1.717   8.370 1 U         -5.889e+03  0.00e+00 m   0 1655 1661 1656 0 #N 96, HB3 96, HN 96, 
1408 121.684   1.564   8.370 1 U         -5.238e+03  0.00e+00 m   0 1655 1666 1656 0 #N 96, HG2 96, HN 96, 
1412 125.251   8.757   8.757 1 U         -1.093e+05  0.00e+00 m   0 1681 1682 1682 0 #N 97, HN 97, HN 97, 
1413 125.251   4.875   8.757 1 U         -5.037e+03  0.00e+00 m   0 1681 1684 1682 0 #N 97, HA 97, HN 97, 
1414 125.251   1.880   8.757 1 U         -1.380e+04  0.00e+00 m   0 1681 1686 1682 0 #N 97, HB2 97, HN 97, 
1415 125.251   1.650   8.757 1 U         -1.866e+04  0.00e+00 m   0 1681 1687 1682 0 #N 97, HB3 97, HN 97, 
1416 125.251   1.562   8.757 1 U         -1.391e+04  0.00e+00 m   0 1681 1692 1682 0 #N 97, QG 97, HN 97, 
1418 125.251   3.143   8.757 1 U         -2.562e+03  0.00e+00 m   0 1681 1696 1682 0 #N 97, QD 97, HN 97, 
1420 129.536   7.921   7.921 1 U         -8.484e+04  0.00e+00 m   0 1707 1708 1708 0 #N 98, HN 98, HN 98, 
1421 129.536   4.760   7.921 1 U         -7.010e+03  0.00e+00 m   0 1707 1710 1708 0 #N 98, HA 98, HN 98, 
1422 129.536   1.032   7.921 1 U         -1.157e+04  0.00e+00 m   0 1707 1711 1708 0 #N 98, QB 98, HN 98, 
1423 120.610   9.535   9.535 1 U         -9.564e+04  0.00e+00 m   0 1717 1718 1718 0 #N 99, HN 99, HN 99, 
1424 120.610   4.260   9.535 1 U         -8.714e+03  0.00e+00 m   0 1717 1720 1718 0 #N 99, HA 99, HN 99, 
1425 120.610   2.100   9.535 1 U         -1.725e+04  0.00e+00 m   0 1717 1722 1718 0 #N 99, HB2 99, HN 99, 
1426 120.610   2.018   9.535 1 U         -1.343e+04  0.00e+00 m   0 1717 1723 1718 0 #N 99, HB3 99, HN 99, 
1427 120.610   2.355   9.535 1 U         -7.623e+03  0.00e+00 m   0 1717 1726 1718 0 #N 99, HG2 99, HN 99, 
1428 120.610   2.279   9.535 1 U         -4.164e+03  0.00e+00 m   0 1717 1727 1718 0 #N 99, HG3 99, HN 99, 
1431 115.767   7.594   7.594 1 U         -2.098e+05  0.00e+00 m   0 1735 1736 1736 0 #N 100, HN 100, HN 100, 
1432 115.767   4.712   7.594 1 U         -1.279e+04  0.00e+00 m   0 1735 1738 1736 0 #N 100, HA 100, HN 100, 
1433 115.767   2.774   7.594 1 U         -9.913e+03  0.00e+00 m   0 1735 1740 1736 0 #N 100, HB2 100, HN 100, 
1434 115.767   3.025   7.594 1 U         -4.789e+03  0.00e+00 m   0 1735 1741 1736 0 #N 100, HB3 100, HN 100, 
1435 116.693   8.857   8.857 1 U         -2.063e+04  0.00e+00 m   0 1746 1747 1747 0 #N 101, HN 101, HN 101, 
1436 116.693   3.805   8.857 1 U         -5.093e+03  0.00e+00 m   0 1746 1749 1747 0 #N 101, HA 101, HN 101, 
1437 116.693   1.766   8.857 1 U         -5.238e+03  0.00e+00 m   0 1746 1751 1747 0 #N 101, HB2 101, HN 101, 
1438 116.693   1.705   8.857 1 U         -4.737e+03  0.00e+00 m   0 1746 1752 1747 0 #N 101, HB3 101, HN 101, 
1439 116.693   1.483   8.857 1 U         -6.524e+03  0.00e+00 m   0 1746 1755 1747 0 #N 101, HG2 101, HN 101, 
1440 116.693   1.389   8.857 1 U         -3.257e+03  0.00e+00 m   0 1746 1756 1747 0 #N 101, HG3 101, HN 101, 
1441 116.693   1.610   8.857 1 U         -2.005e+03  0.00e+00 m   0 1746 1761 1747 0 #N 101, HD2 101, HN 101, 
1443 116.693   2.978   8.857 1 U         -2.400e+03  0.00e+00 m   0 1746 1765 1747 0 #N 101, QE 101, HN 101, 
1445 121.254   8.110   8.110 1 U         -1.890e+05  0.00e+00 m   0 1771 1772 1772 0 #N 102, HN 102, HN 102, 
1446 121.254   4.009   8.110 1 U         -1.495e+04  0.00e+00 m   0 1771 1774 1772 0 #N 102, HA 102, HN 102, 
1447 121.254   2.119   8.110 1 U         -3.440e+04  0.00e+00 m   0 1771 1778 1772 0 #N 102, QB 102, HN 102, 
1449 121.254   2.355   8.110 1 U         -8.850e+03  0.00e+00 m   0 1771 1780 1772 0 #N 102, HG2 102, HN 102, 
1450 121.254   2.282   8.110 1 U         -1.438e+04  0.00e+00 m   0 1771 1781 1772 0 #N 102, HG3 102, HN 102, 
1451 118.801   8.274   8.274 1 U         -1.262e+05  0.00e+00 m   0 1786 1787 1787 0 #N 103, HN 103, HN 103, 
1452 118.801   4.166   8.274 1 U         -1.210e+04  0.00e+00 m   0 1786 1789 1787 0 #N 103, HA 103, HN 103, 
1453 118.801   2.093   8.274 1 U         -3.090e+04  0.00e+00 m   0 1786 1791 1787 0 #N 103, HB2 103, HN 103, 
1454 118.801   2.137   8.274 1 U         -2.359e+04  0.00e+00 m   0 1786 1792 1787 0 #N 103, HB3 103, HN 103, 
1455 118.801   2.778   8.274 1 U         -2.057e+04  0.00e+00 m   0 1786 1795 1787 0 #N 103, HG2 103, HN 103, 
1456 118.801   2.361   8.274 1 U         -1.221e+04  0.00e+00 m   0 1786 1796 1787 0 #N 103, HG3 103, HN 103, 
1457 117.960   7.933   7.933 1 U         -2.752e+05  0.00e+00 m   0 1801 1802 1802 0 #N 104, HN 104, HN 104, 
1458 117.960   3.377   7.933 1 U         -9.044e+03  0.00e+00 m   0 1801 1804 1802 0 #N 104, HA 104, HN 104, 
1459 117.960   2.084   7.933 1 U         -4.255e+04  0.00e+00 m   0 1801 1806 1802 0 #N 104, HB 104, HN 104, 
1460 117.960   0.883   7.933 1 U         -2.658e+04  0.00e+00 m   0 1801 1807 1802 0 #N 104, QG1 104, HN 104, 
1461 117.960   0.691   7.933 1 U         -6.708e+03  0.00e+00 m   0 1801 1808 1802 0 #N 104, QG2 104, HN 104, 
1462 118.790   7.963   7.963 1 U         -1.376e+05  0.00e+00 m   0 1819 1820 1820 0 #N 105, HN 105, HN 105, 
1463 118.790   3.478   7.963 1 U         -1.115e+04  0.00e+00 m   0 1819 1822 1820 0 #N 105, HA 105, HN 105, 
1464 118.790   1.943   7.963 1 U         -1.711e+04  0.00e+00 m   0 1819 1824 1820 0 #N 105, HB2 105, HN 105, 
1465 118.790   1.809   7.963 1 U         -1.200e+04  0.00e+00 m   0 1819 1825 1820 0 #N 105, HB3 105, HN 105, 
1466 118.790   1.224   7.963 1 U         -5.873e+03  0.00e+00 m   0 1819 1828 1820 0 #N 105, HG2 105, HN 105, 
1467 118.790   1.629   7.963 1 U         -1.411e+04  0.00e+00 m   0 1819 1829 1820 0 #N 105, HG3 105, HN 105, 
1468 118.790   1.663   7.963 1 U         -1.036e+04  0.00e+00 m   0 1819 1832 1820 0 #N 105, HD2 105, HN 105, 
1469 118.790   1.763   7.963 1 U         -7.283e+03  0.00e+00 m   0 1819 1833 1820 0 #N 105, HD3 105, HN 105, 
1470 118.790   2.668   7.963 1 U         -3.556e+03  0.00e+00 m   0 1819 1836 1820 0 #N 105, HE2 105, HN 105, 
1471 118.790   2.998   7.963 1 U         -2.719e+03  0.00e+00 m   0 1819 1837 1820 0 #N 105, HE3 105, HN 105, 
1472 118.293   8.200   8.200 1 U         -1.676e+05  0.00e+00 m   0 1844 1845 1845 0 #N 106, HN 106, HN 106, 
1473 118.293   4.370   8.200 1 U         -1.759e+04  0.00e+00 m   0 1844 1847 1845 0 #N 106, HA 106, HN 106, 
1474 118.293   2.685   8.200 1 U         -3.972e+04  0.00e+00 m   0 1844 1851 1845 0 #N 106, QB 106, HN 106, 
1476 122.064   7.751   7.751 1 U         -1.962e+05  0.00e+00 m   0 1855 1856 1856 0 #N 107, HN 107, HN 107, 
1477 122.064   4.090   7.751 1 U         -1.509e+04  0.00e+00 m   0 1855 1858 1856 0 #N 107, HA 107, HN 107, 
1478 122.064   1.445   7.751 1 U         -4.216e+04  0.00e+00 m   0 1855 1859 1856 0 #N 107, QB 107, HN 107, 
1479 117.788   8.310   8.310 1 U         -1.117e+05  0.00e+00 m   0 1865 1866 1866 0 #N 108, HN 108, HN 108, 
1480 117.788   3.298   8.310 1 U         -1.076e+04  0.00e+00 m   0 1865 1868 1866 0 #N 108, HA 108, HN 108, 
1481 117.788   2.075   8.310 1 U         -2.728e+04  0.00e+00 m   0 1865 1870 1866 0 #N 108, HB 108, HN 108, 
1482 117.788   0.869   8.310 1 U         -3.300e+04  0.00e+00 m   0 1865 1871 1866 0 #N 108, QG1 108, HN 108, 
1483 117.788   0.643   8.310 1 U         -1.115e+04  0.00e+00 m   0 1865 1872 1866 0 #N 108, QG2 108, HN 108, 
1484 117.849   8.039   8.039 1 U         -8.574e+04  0.00e+00 m   0 1883 1884 1884 0 #N 109, HN 109, HN 109, 
1485 117.849   3.660   8.039 1 U         -1.160e+04  0.00e+00 m   0 1883 1886 1884 0 #N 109, HA 109, HN 109, 
1486 117.849   2.070   8.039 1 U         -3.277e+04  0.00e+00 m   0 1883 1888 1884 0 #N 109, HB2 109, HN 109, 
1487 117.849   2.149   8.039 1 U         -2.683e+04  0.00e+00 m   0 1883 1889 1884 0 #N 109, HB3 109, HN 109, 
1488 117.849   2.156   8.039 1 U         -2.683e+04  0.00e+00 m   0 1883 1892 1884 0 #N 109, HG2 109, HN 109, 
1489 117.849   2.380   8.039 1 U         -5.809e+03  0.00e+00 m   0 1883 1893 1884 0 #N 109, HG3 109, HN 109, 
1490 117.728   7.939   7.939 1 U         -4.887e+05  0.00e+00 m   0 1898 1899 1899 0 #N 110, HN 110, HN 110, 
1491 117.728   3.929   7.939 1 U         -1.666e+04  0.00e+00 m   0 1898 1901 1899 0 #N 110, HA 110, HN 110, 
1492 117.728   2.230   7.939 1 U         -3.022e+04  0.00e+00 m   0 1898 1903 1899 0 #N 110, HB2 110, HN 110, 
1493 117.728   2.107   7.939 1 U         -5.681e+04  0.00e+00 m   0 1898 1904 1899 0 #N 110, HB3 110, HN 110, 
1494 117.728   2.425   7.939 1 U         -1.361e+04  0.00e+00 m   0 1898 1909 1899 0 #N 110, QG 110, HN 110, 
1496 119.474   8.077   8.077 1 U         -1.104e+05  0.00e+00 m   0 1913 1914 1914 0 #N 111, HN 111, HN 111, 
1497 119.474   4.346   8.077 1 U         -9.839e+03  0.00e+00 m   0 1913 1916 1914 0 #N 111, HA 111, HN 111, 
1498 119.474   3.164   8.077 1 U         -1.845e+04  0.00e+00 m   0 1913 1918 1914 0 #N 111, HB2 111, HN 111, 
1499 119.474   2.919   8.077 1 U         -1.545e+04  0.00e+00 m   0 1913 1919 1914 0 #N 111, HB3 111, HN 111, 
1501 119.474   7.039   8.077 1 U         -5.351e+03  0.00e+00 m   0 1913 1934 1914 0 #N 111, QD 111, HN 111, 
1502 116.972   8.144   8.144 1 U         -1.054e+05  0.00e+00 m   0 1936 1937 1937 0 #N 112, HN 112, HN 112, 
1503 116.972   3.821   8.144 1 U         -1.038e+04  0.00e+00 m   0 1936 1939 1937 0 #N 112, HA 112, HN 112, 
1504 116.972   1.075   8.144 1 U         -9.464e+03  0.00e+00 m   0 1936 1941 1937 0 #N 112, HB2 112, HN 112, 
1505 116.972   1.462   8.144 1 U         -1.734e+04  0.00e+00 m   0 1936 1942 1937 0 #N 112, HB3 112, HN 112, 
1506 116.972   1.736   8.144 1 U         -1.859e+04  0.00e+00 m   0 1936 1945 1937 0 #N 112, HG 112, HN 112, 
1507 116.972   0.349   8.144 1 U         -7.760e+03  0.00e+00 m   0 1936 1946 1937 0 #N 112, QD1 112, HN 112, 
1508 116.972   0.630   8.144 1 U         -8.589e+03  0.00e+00 m   0 1936 1947 1937 0 #N 112, QD2 112, HN 112, 
1509 120.009   8.047   8.047 1 U         -1.256e+05  0.00e+00 m   0 1958 1959 1959 0 #N 113, HN 113, HN 113, 
1510 120.009   4.054   8.047 1 U         -1.081e+04  0.00e+00 m   0 1958 1961 1959 0 #N 113, HA 113, HN 113, 
1511 120.009   1.884   8.047 1 U         -1.115e+04  0.00e+00 m   0 1958 1963 1959 0 #N 113, HB2 113, HN 113, 
1512 120.009   1.944   8.047 1 U         -1.491e+04  0.00e+00 m   0 1958 1964 1959 0 #N 113, HB3 113, HN 113, 
1513 120.009   1.563   8.047 1 U         -7.283e+03  0.00e+00 m   0 1958 1967 1959 0 #N 113, HG2 113, HN 113, 
1514 120.009   1.431   8.047 1 U         -7.930e+03  0.00e+00 m   0 1958 1968 1959 0 #N 113, HG3 113, HN 113, 
1515 120.009   1.677   8.047 1 U         -3.048e+03  0.00e+00 m   0 1958 1973 1959 0 #N 113, QD 113, HN 113, 
1519 118.059   7.949   7.949 1 U         -3.615e+05  0.00e+00 m   0 1983 1984 1984 0 #N 114, HN 114, HN 114, 
1520 118.059   4.242   7.949 1 U         -1.017e+04  0.00e+00 m   0 1983 1986 1984 0 #N 114, HA 114, HN 114, 
1521 118.059   2.035   7.949 1 U         -3.336e+04  0.00e+00 m   0 1983 1988 1984 0 #N 114, HB2 114, HN 114, 
1522 118.059   2.083   7.949 1 U         -5.148e+04  0.00e+00 m   0 1983 1989 1984 0 #N 114, HB3 114, HN 114, 
1523 118.059   2.264   7.949 1 U         -1.477e+04  0.00e+00 m   0 1983 1992 1984 0 #N 114, HG2 114, HN 114, 
1524 118.059   2.295   7.949 1 U         -1.432e+04  0.00e+00 m   0 1983 1993 1984 0 #N 114, HG3 114, HN 114, 
1525 107.774   7.926   7.926 1 U         -9.384e+04  0.00e+00 m   0 1998 1999 1999 0 #N 115, HN 115, HN 115, 
1526 107.774   3.781   7.926 1 U         -3.354e+04  0.00e+00 m   0 1998 2003 1999 0 #N 115, QA 115, HN 115, 
1528 107.849   8.146   8.146 1 U         -6.508e+04  0.00e+00 m   0 2005 2006 2006 0 #N 116, HN 116, HN 116, 
1529 107.849   3.783   8.146 1 U         -2.034e+04  0.00e+00 m   0 2005 2008 2006 0 #N 116, HA1 116, HN 116, 
1530 107.849   3.167   8.146 1 U         -8.373e+03  0.00e+00 m   0 2005 2009 2006 0 #N 116, HA2 116, HN 116, 
1531 114.221   7.706   7.706 1 U         -3.431e+04  0.00e+00 m   0 2012 2013 2013 0 #N 117, HN 117, HN 117, 
1532 114.221   4.465   7.706 1 U         -4.050e+03  0.00e+00 m   0 2012 2015 2013 0 #N 117, HA 117, HN 117, 
1533 114.221   3.816   7.706 1 U         -4.891e+03  0.00e+00 m   0 2012 2017 2013 0 #N 117, HB2 117, HN 117, 
1534 114.221   3.741   7.706 1 U         -3.237e+03  0.00e+00 m   0 2012 2018 2013 0 #N 117, HB3 117, HN 117, 
1535 122.599   8.453   8.453 1 U         -9.500e+04  0.00e+00 m   0 2022 2023 2023 0 #N 118, HN 118, HN 118, 
1536 122.599   4.409   8.453 1 U         -9.044e+03  0.00e+00 m   0 2022 2025 2023 0 #N 118, HA 118, HN 118, 
1537 122.599   1.601   8.453 1 U         -1.884e+04  0.00e+00 m   0 2022 2027 2023 0 #N 118, HB2 118, HN 118, 
1538 122.599   1.571   8.453 1 U         -1.918e+04  0.00e+00 m   0 2022 2028 2023 0 #N 118, HB3 118, HN 118, 
1539 122.599   1.581   8.453 1 U         -1.918e+04  0.00e+00 m   0 2022 2031 2023 0 #N 118, HG 118, HN 118, 
1540 122.599   0.849   8.453 1 U         -4.090e+03  0.00e+00 m   0 2022 2032 2023 0 #N 118, QD1 118, HN 118, 
1541 122.599   0.833   8.453 1 U         -5.182e+03  0.00e+00 m   0 2022 2033 2023 0 #N 118, QD2 118, HN 118, 
1542 120.724   8.487   8.487 1 U         -1.545e+05  0.00e+00 m   0 2044 2045 2045 0 #N 119, HN 119, HN 119, 
1543 120.724   4.130   8.487 1 U         -8.544e+03  0.00e+00 m   0 2044 2047 2045 0 #N 119, HA 119, HN 119, 
1544 120.724   1.860   8.487 1 U         -2.021e+04  0.00e+00 m   0 2044 2049 2045 0 #N 119, HB2 119, HN 119, 
1545 120.724   1.837   8.487 1 U         -2.021e+04  0.00e+00 m   0 2044 2050 2045 0 #N 119, HB3 119, HN 119, 
1546 120.724   2.107   8.487 1 U         -3.309e+03  0.00e+00 m   0 2044 2053 2045 0 #N 119, HG2 119, HN 119, 
1547 120.724   2.190   8.487 1 U         -4.300e+03  0.00e+00 m   0 2044 2054 2045 0 #N 119, HG3 119, HN 119, 
1548 119.270   8.342   8.342 1 U         -1.075e+04  0.00e+00 m   0 2059 2060 2060 0 #N 120, HN 120, HN 120, 
1549 119.270   4.576   8.342 1 U         -1.080e+03  0.00e+00 m   0 2059 2062 2060 0 #N 120, HA 120, HN 120, 
1550 119.270   3.003   8.342 1 U         -1.347e+03  0.00e+00 m   0 2059 2064 2060 0 #N 120, HB2 120, HN 120, 
1551 119.270   3.062   8.342 1 U         -1.225e+03  0.00e+00 m   0 2059 2065 2060 0 #N 120, HB3 120, HN 120, 
1553 123.774   8.393   8.477 1 U         -3.068e+03  0.00e+00 m   0   51   70   52 0 #N 4, HN 5, HN 4, 
1554 126.474   8.883   8.393 1 U         -3.522e+03  0.00e+00 m   0   69   88   70 0 #N 5, HN 6, HN 5, 
1555 126.797   8.725   8.883 1 U         -3.965e+03  0.00e+00 m   0   87  111   88 0 #N 6, HN 7, HN 6, 
1556 130.099   8.116   8.725 1 U         -1.462e+03  0.00e+00 m   0  110  133  111 0 #N 7, HN 8, HN 7, 
1557 115.631   8.318   8.116 1 U         -2.807e+03  0.00e+00 m   0  132  143  133 0 #N 8, HN 9, HN 8, 
1558 118.290   8.287   8.318 1 U         -8.741e+04  0.00e+00 m   0  142  154  143 0 #N 9, HN 10, HN 9, 
1559 121.660   9.026   8.287 1 U         -2.226e+03  0.00e+00 m   0  153  165  154 0 #N 10, HN 11, HN 10, 
1560 126.131   8.306   9.026 1 U         -1.093e+04  0.00e+00 m   0  164  183  165 0 #N 11, HN 12, HN 11, 
1561 119.136   7.727   8.306 1 U         -3.136e+04  0.00e+00 m   0  182  198  183 0 #N 12, HN 13, HN 12, 
1562 119.899   8.086   7.727 1 U         -1.741e+04  0.00e+00 m   0  197  219  198 0 #N 13, HN 14, HN 13, 
1563 120.959   8.121   8.086 1 U         -8.240e+04  0.00e+00 m   0  218  240  219 0 #N 14, HN 15, HN 14, 
1564 119.194   7.792   8.121 1 U         -1.477e+04  0.00e+00 m   0  239  255  240 0 #N 15, HN 16, HN 15, 
1565 119.136   8.392   7.792 1 U         -1.482e+04  0.00e+00 m   0  254  270  255 0 #N 16, HN 17, HN 16, 
1566 120.411   8.534   8.392 1 U         -1.491e+04  0.00e+00 m   0  269  288  270 0 #N 17, HN 18, HN 17, 
1567 115.233   7.987   8.534 1 U         -1.595e+04  0.00e+00 m   0  287  298  288 0 #N 18, HN 19, HN 18, 
1568 121.809   7.794   7.987 1 U         -1.369e+04  0.00e+00 m   0  297  323  298 0 #N 19, HN 20, HN 19, 
1569 120.493   8.511   7.794 1 U         -2.137e+04  0.00e+00 m   0  322  348  323 0 #N 20, HN 21, HN 20, 
1570 119.770   7.934   8.511 1 U         -1.820e+04  0.00e+00 m   0  347  358  348 0 #N 21, HN 22, HN 21, 
1571 117.677   8.185   7.934 1 U         -2.732e+04  0.00e+00 m   0  357  373  358 0 #N 22, HN 23, HN 22, 
1572 119.558   7.868   8.185 1 U         -1.761e+04  0.00e+00 m   0  372  388  373 0 #N 23, HN 24, HN 23, 
1573 113.767   7.692   7.868 1 U         -1.418e+04  0.00e+00 m   0  387  403  388 0 #N 24, HN 25, HN 24, 
1574 108.123   8.076   7.692 1 U         -2.789e+04  0.00e+00 m   0  402  410  403 0 #N 25, HN 26, HN 25, 
1575 118.211   8.819   8.076 1 U         -2.164e+03  0.00e+00 m   0  409  433  410 0 #N 26, HN 27, HN 26, 
1576 123.599   7.765   8.819 1 U         -2.008e+03  0.00e+00 m   0  432  444  433 0 #N 27, HN 28, HN 27, 
1577 120.849   8.577   7.765 1 U         -2.076e+03  0.00e+00 m   0  443  465  444 0 #N 28, HN 29, HN 28, 
1578 126.901   8.750   8.577 1 U         -1.632e+03  0.00e+00 m   0  464  483  465 0 #N 29, HN 30, HN 29, 
1579 115.255   8.822   8.750 1 U         -2.839e+03  0.00e+00 m   0  482  496  483 0 #N 30, HN 31, HN 30, 
1580 114.044   8.132   8.822 1 U         -4.005e+03  0.00e+00 m   0  495  506  496 0 #N 31, HN 32, HN 31, 
1581 122.434   8.672   8.132 1 U         -2.462e+04  0.00e+00 m   0  505  520  506 0 #N 32, HN 33, HN 32, 
1582 122.762   8.406   8.672 1 U         -1.373e+03  0.00e+00 m   0  519  531  520 0 #N 33, HN 34, HN 33, 
1583 123.428   8.009   8.406 1 U         -1.062e+04  0.00e+00 m   0  530  556  531 0 #N 34, HN 35, HN 34, 
1584 118.569   7.554   8.009 1 U         -2.822e+04  0.00e+00 m   0  555  581  556 0 #N 35, HN 36, HN 35, 
1585 120.475   7.501   7.554 1 U         -5.078e+04  0.00e+00 m   0  580  596  581 0 #N 36, HN 37, HN 36, 
1586 118.349   8.591   7.501 1 U         -1.390e+04  0.00e+00 m   0  595  617  596 0 #N 37, HN 38, HN 37, 
1587 121.911   7.849   8.591 1 U         -8.953e+03  0.00e+00 m   0  616  638  617 0 #N 38, HN 39, HN 38, 
1588 119.599   8.068   7.849 1 U         -9.180e+03  0.00e+00 m   0  637  649  638 0 #N 39, HN 40, HN 39, 
1589 118.381   8.575   8.068 1 U         -1.353e+04  0.00e+00 m   0  648  675  649 0 #N 40, HN 41, HN 40, 
1590 121.053   8.340   8.575 1 U         -1.056e+04  0.00e+00 m   0  674  697  675 0 #N 41, HN 42, HN 41, 
1591 121.487   7.482   8.340 1 U         -1.158e+04  0.00e+00 m   0  696  722  697 0 #N 42, HN 43, HN 42, 
1592 115.916   8.069   7.482 1 U         -1.632e+04  0.00e+00 m   0  721  748  722 0 #N 43, HN 44, HN 43, 
1593 115.504   8.024   8.069 1 U         -2.767e+04  0.00e+00 m   0  747  774  748 0 #N 44, HN 45, HN 44, 
1594 113.910   7.204   8.024 1 U         -2.577e+04  0.00e+00 m   0  773  788  774 0 #N 45, HN 46, HN 45, 
1595 116.556   8.972   7.204 1 U         -2.374e+03  0.00e+00 m   0  787  809  788 0 #N 46, HN 47, HN 46, 
1596 125.470   7.817   8.972 1 U         -1.722e+04  0.00e+00 m   0  808  820  809 0 #N 47, HN 48, HN 47, 
1597 119.295   9.092   7.817 1 U         -3.084e+03  0.00e+00 m   0  819  838  820 0 #N 48, HN 49, HN 48, 
1598 122.213   8.894   9.092 1 U         -1.846e+03  0.00e+00 m   0  837  859  838 0 #N 49, HN 50, HN 49, 
1599 126.911   8.574   8.894 1 U         -2.912e+03  0.00e+00 m   0  858  880  859 0 #N 50, HN 51, HN 50, 
1600 125.411   8.252   8.574 1 U         -1.275e+03  0.00e+00 m   0  879  898  880 0 #N 51, HN 52, HN 51, 
1601 126.411   8.434   8.252 1 U         -1.798e+03  0.00e+00 m   0  897  923  898 0 #N 52, HN 53, HN 52, 
1602 120.527   8.445   8.434 1 U         -1.214e+05  0.00e+00 m   0  922  936  923 0 #N 53, HN 54, HN 53, 
1603 124.060   8.268   8.445 1 U         -2.243e+04  0.00e+00 m   0  935  951  936 0 #N 54, HN 55, HN 54, 
1604 121.687   8.639   8.268 1 U         -2.411e+03  0.00e+00 m   0  950  962  951 0 #N 55, HN 56, HN 55, 
1605 127.275   8.378   8.639 1 U         -1.495e+04  0.00e+00 m   0  961  987  962 0 #N 56, HN 57, HN 56, 
1606 119.516   7.777   8.378 1 U         -2.131e+04  0.00e+00 m   0  986 1002  987 0 #N 57, HN 58, HN 57, 
1607 115.830   7.654   7.777 1 U         -1.541e+04  0.00e+00 m   0 1001 1012 1002 0 #N 58, HN 59, HN 58, 
1608 120.077   7.933   7.654 1 U         -1.054e+04  0.00e+00 m   0 1011 1033 1012 0 #N 59, HN 60, HN 59, 
1609 114.178   7.772   7.933 1 U         -2.015e+04  0.00e+00 m   0 1032 1043 1033 0 #N 60, HN 61, HN 60, 
1610 120.392   8.117   7.772 1 U         -1.734e+04  0.00e+00 m   0 1042 1058 1043 0 #N 61, HN 62, HN 61, 
1611 118.610   8.575   8.117 1 U         -1.059e+04  0.00e+00 m   0 1057 1079 1058 0 #N 62, HN 63, HN 62, 
1612 119.241   7.673   8.575 1 U         -1.297e+04  0.00e+00 m   0 1078 1100 1079 0 #N 63, HN 64, HN 63, 
1613 117.220   7.404   7.673 1 U         -1.568e+04  0.00e+00 m   0 1099 1125 1100 0 #N 64, HN 65, HN 64, 
1614 114.597   8.655   7.404 1 U         -2.044e+04  0.00e+00 m   0 1124 1143 1125 0 #N 65, HN 66, HN 65, 
1615 120.063   8.316   8.655 1 U         -9.055e+03  0.00e+00 m   0 1142 1161 1143 0 #N 66, HN 67, HN 66, 
1616 121.130   7.809   8.316 1 U         -8.657e+03  0.00e+00 m   0 1160 1183 1161 0 #N 67, HN 68, HN 67, 
1617 118.349   7.932   7.809 1 U         -1.432e+04  0.00e+00 m   0 1182 1194 1183 0 #N 68, HN 69, HN 68, 
1618 112.915   8.171   7.932 1 U         -1.346e+04  0.00e+00 m   0 1193 1204 1194 0 #N 69, HN 70, HN 69, 
1619 110.368   7.564   8.171 1 U         -1.107e+04  0.00e+00 m   0 1203 1211 1204 0 #N 70, HN 71, HN 70, 
1620 122.165   7.831   7.564 1 U         -3.601e+03  0.00e+00 m   0 1210 1221 1211 0 #N 71, HN 72, HN 71, 
1621 119.550   8.403   7.831 1 U         -3.141e+03  0.00e+00 m   0 1220 1246 1221 0 #N 72, HN 73, HN 72, 
1622 121.224   7.934   8.403 1 U         -2.119e+03  0.00e+00 m   0 1245 1264 1246 0 #N 73, HN 74, HN 73, 
1623 127.786   8.688   7.934 1 U         -1.680e+03  0.00e+00 m   0 1263 1286 1264 0 #N 74, HN 75, HN 74, 
1624 125.496   9.303   8.688 1 U         -1.405e+03  0.00e+00 m   0 1285 1307 1286 0 #N 75, HN 76, HN 75, 
1625 126.349   7.383   9.303 1 U         -9.880e+02  0.00e+00 m   0 1306 1329 1307 0 #N 76, HN 77, HN 76, 
1626 110.744  10.445   7.383 1 U         -7.830e+02  0.00e+00 m   0 1328 1339 1329 0 #N 77, HN 78, HN 77, 
1627 123.489   7.880  10.445 1 U         -1.258e+04  0.00e+00 m   0 1338 1349 1339 0 #N 78, HN 79, HN 78, 
1628 121.905   9.348   7.880 1 U         -1.994e+03  0.00e+00 m   0 1348 1360 1349 0 #N 79, HN 80, HN 79, 
1629 127.224   8.684   9.348 1 U         -1.500e+04  0.00e+00 m   0 1359 1375 1360 0 #N 80, HN 81, HN 80, 
1630 117.620   7.643   8.684 1 U         -2.384e+04  0.00e+00 m   0 1374 1389 1375 0 #N 81, HN 82, HN 81, 
1631 122.564   7.306   7.643 1 U         -1.788e+04  0.00e+00 m   0 1388 1410 1389 0 #N 82, HN 83, HN 82, 
1632 118.230   8.160   7.306 1 U         -1.093e+04  0.00e+00 m   0 1409 1431 1410 0 #N 83, HN 84, HN 83, 
1633 117.379   7.786   8.160 1 U         -1.588e+04  0.00e+00 m   0 1430 1446 1431 0 #N 84, HN 85, HN 84, 
1634 114.134   8.247   7.786 1 U         -1.736e+04  0.00e+00 m   0 1445 1456 1446 0 #N 85, HN 86, HN 85, 
1635 122.990   8.153   8.247 1 U         -1.292e+04  0.00e+00 m   0 1455 1477 1456 0 #N 86, HN 87, HN 86, 
1636 118.724   7.436   8.153 1 U         -1.330e+04  0.00e+00 m   0 1476 1503 1477 0 #N 87, HN 88, HN 87, 
1637 114.597   7.701   7.436 1 U         -2.208e+04  0.00e+00 m   0 1502 1528 1503 0 #N 88, HN 89, HN 88, 
1638 116.894   8.787   7.701 1 U         -3.140e+04  0.00e+00 m   0 1527 1546 1528 0 #N 89, HN 90, HN 89, 
1639 114.684   7.758   8.352 1 U         -2.744e+04  0.00e+00 m   0 1584 1610 1585 0 #N 92, HN 93, HN 92, 
1640 121.254   8.243   7.758 1 U         -2.207e+03  0.00e+00 m   0 1609 1628 1610 0 #N 93, HN 94, HN 93, 
1641 127.911   8.238   8.243 1 U         -1.222e+05  0.00e+00 m   0 1627 1643 1628 0 #N 94, HN 95, HN 94, 
1642 115.873   8.370   8.238 1 U         -2.357e+03  0.00e+00 m   0 1642 1656 1643 0 #N 95, HN 96, HN 95, 
1643 121.684   8.757   8.370 1 U         -1.815e+03  0.00e+00 m   0 1655 1682 1656 0 #N 96, HN 97, HN 96, 
1644 125.251   7.921   8.757 1 U         -2.246e+03  0.00e+00 m   0 1681 1708 1682 0 #N 97, HN 98, HN 97, 
1645 129.536   9.535   7.921 1 U         -1.959e+03  0.00e+00 m   0 1707 1718 1708 0 #N 98, HN 99, HN 98, 
1646 120.610   7.594   9.535 1 U         -1.986e+04  0.00e+00 m   0 1717 1736 1718 0 #N 99, HN 100, HN 99, 
1647 115.767   8.857   7.594 1 U         -1.261e+03  0.00e+00 m   0 1735 1747 1736 0 #N 100, HN 101, HN 100, 
1648 116.693   8.110   8.857 1 U         -4.249e+03  0.00e+00 m   0 1746 1772 1747 0 #N 101, HN 102, HN 101, 
1649 121.254   8.274   8.110 1 U         -2.474e+04  0.00e+00 m   0 1771 1787 1772 0 #N 102, HN 103, HN 102, 
1650 118.801   7.933   8.274 1 U         -1.911e+04  0.00e+00 m   0 1786 1802 1787 0 #N 103, HN 104, HN 103, 
1651 117.960   7.963   7.933 1 U         -1.625e+05  0.00e+00 m   0 1801 1820 1802 0 #N 104, HN 105, HN 104, 
1652 118.790   8.200   7.963 1 U         -1.310e+04  0.00e+00 m   0 1819 1845 1820 0 #N 105, HN 106, HN 105, 
1653 118.293   7.751   8.200 1 U         -2.198e+04  0.00e+00 m   0 1844 1856 1845 0 #N 106, HN 107, HN 106, 
1654 122.064   8.310   7.751 1 U         -1.784e+04  0.00e+00 m   0 1855 1866 1856 0 #N 107, HN 108, HN 107, 
1655 117.788   8.039   8.310 1 U         -1.264e+04  0.00e+00 m   0 1865 1884 1866 0 #N 108, HN 109, HN 108, 
1656 117.849   7.939   8.039 1 U         -2.024e+04  0.00e+00 m   0 1883 1899 1884 0 #N 109, HN 110, HN 109, 
1657 117.728   8.077   7.939 1 U         -3.363e+04  0.00e+00 m   0 1898 1914 1899 0 #N 110, HN 111, HN 110, 
1658 119.474   8.144   8.077 1 U         -2.845e+04  0.00e+00 m   0 1913 1937 1914 0 #N 111, HN 112, HN 111, 
1659 116.972   8.047   8.144 1 U         -2.118e+04  0.00e+00 m   0 1936 1959 1937 0 #N 112, HN 113, HN 112, 
1660 120.009   7.949   8.047 1 U         -1.099e+04  0.00e+00 m   0 1958 1984 1959 0 #N 113, HN 114, HN 113, 
1661 118.059   7.926   7.949 1 U         -1.931e+05  0.00e+00 m   0 1983 1999 1984 0 #N 114, HN 115, HN 114, 
1662 107.774   8.146   7.926 1 U         -6.532e+03  0.00e+00 m   0 1998 2006 1999 0 #N 115, HN 116, HN 115, 
1663 107.849   7.706   8.146 1 U         -3.349e+03  0.00e+00 m   0 2005 2013 2006 0 #N 116, HN 117, HN 116, 
1664 114.221   8.453   7.706 1 U         -1.371e+03  0.00e+00 m   0 2012 2023 2013 0 #N 117, HN 118, HN 117, 
1667 126.131   7.727   9.026 3 U         -1.409e+03  0.00e+00 m   0  164  198  165 0 #N 11, HN 13, HN 11, 
1668 119.136   8.086   8.306 3 U         -3.450e+03  0.00e+00 m   0  182  219  183 0 #N 12, HN 14, HN 12, 
1669 119.899   3.994   7.727 3 U         -2.843e+03  0.00e+00 m   0  197  167  198 0 #N 13, HA 11, HN 13, 
1670 119.899   9.026   7.727 3 U         -1.747e+03  0.00e+00 m   0  197  165  198 0 #N 13, HN 11, HN 13, 
1671 119.899   8.121   7.727 3 U         -1.720e+04  0.00e+00 m   0  197  240  198 0 #N 13, HN 15, HN 13, 
1672 120.959   4.147   8.086 3 U         -7.960e+02  0.00e+00 m   0  218  185  219 0 #N 14, HA 12, HN 14, 
1673 120.959   8.306   8.086 3 U         -4.601e+03  0.00e+00 m   0  218  183  219 0 #N 14, HN 12, HN 14, 
1674 120.959   3.994   8.086 3 U         -7.362e+03  0.00e+00 m   0  218  167  219 0 #N 14, HA 11, HN 14, 
1675 120.959   7.792   8.086 3 U         -3.828e+03  0.00e+00 m   0  218  255  219 0 #N 14, HN 16, HN 14, 
1676 119.194   3.734   8.121 3 U         -1.234e+03  0.00e+00 m   0  239  200  240 0 #N 15, HA 13, HN 15, 
1677 119.194   7.727   8.121 3 U         -2.280e+03  0.00e+00 m   0  239  198  240 0 #N 15, HN 13, HN 15, 
1678 119.194   4.147   8.121 3 U         -6.395e+03  0.00e+00 m   0  239  185  240 0 #N 15, HA 12, HN 15, 
1679 119.194   3.994   8.121 3 U         -1.502e+04  0.00e+00 m   0  239  167  240 0 #N 15, HA 11, HN 15, 
1680 119.194   8.392   8.121 3 U         -1.891e+03  0.00e+00 m   0  239  270  240 0 #N 15, HN 17, HN 15, 
1682 119.136   8.086   7.792 3 U         -5.190e+03  0.00e+00 m   0  254  219  255 0 #N 16, HN 14, HN 16, 
1683 119.136   3.734   7.792 3 U         -6.347e+03  0.00e+00 m   0  254  200  255 0 #N 16, HA 13, HN 16, 
1684 119.136   4.147   7.792 3 U         -2.952e+03  0.00e+00 m   0  254  185  255 0 #N 16, HA 12, HN 16, 
1685 119.136   8.534   7.792 3 U         -2.368e+03  0.00e+00 m   0  254  288  255 0 #N 16, HN 18, HN 16, 
1686 120.411   4.032   8.392 3 U         -7.317e+03  0.00e+00 m   0  269  242  270 0 #N 17, HA 15, HN 17, 
1687 120.411   8.121   8.392 3 U         -2.207e+03  0.00e+00 m   0  269  240  270 0 #N 17, HN 15, HN 17, 
1688 120.411   3.504   8.392 3 U         -3.499e+03  0.00e+00 m   0  269  221  270 0 #N 17, HA 14, HN 17, 
1689 120.411   3.734   8.392 3 U         -1.792e+03  0.00e+00 m   0  269  200  270 0 #N 17, HA 13, HN 17, 
1690 120.411   7.987   8.392 3 U         -2.445e+03  0.00e+00 m   0  269  298  270 0 #N 17, HN 19, HN 17, 
1691 115.233   4.031   8.534 3 U         -2.840e+04  0.00e+00 m   0  287  257  288 0 #N 18, HA 16, HN 18, 
1692 115.233   7.792   8.534 3 U         -3.482e+03  0.00e+00 m   0  287  255  288 0 #N 18, HN 16, HN 18, 
1693 115.233   4.032   8.534 3 U         -2.840e+04  0.00e+00 m   0  287  242  288 0 #N 18, HA 15, HN 18, 
1694 115.233   3.504   8.534 3 U         -2.158e+03  0.00e+00 m   0  287  221  288 0 #N 18, HA 14, HN 18, 
1695 115.233   7.794   8.534 3 U         -3.482e+03  0.00e+00 m   0  287  323  288 0 #N 18, HN 20, HN 18, 
1696 121.809   3.259   7.987 3 U         -1.437e+03  0.00e+00 m   0  297  272  298 0 #N 19, HA 17, HN 19, 
1697 121.809   8.392   7.987 3 U         -1.863e+03  0.00e+00 m   0  297  270  298 0 #N 19, HN 17, HN 19, 
1698 121.809   4.031   7.987 3 U         -1.770e+04  0.00e+00 m   0  297  257  298 0 #N 19, HA 16, HN 19, 
1699 121.809   4.032   7.987 3 U         -1.770e+04  0.00e+00 m   0  297  242  298 0 #N 19, HA 15, HN 19, 
1700 121.809   8.511   7.987 3 U         -1.321e+04  0.00e+00 m   0  297  348  298 0 #N 19, HN 21, HN 19, 
1701 120.493   4.061   7.794 3 U         -7.487e+03  0.00e+00 m   0  322  290  323 0 #N 20, HA 18, HN 20, 
1702 120.493   8.534   7.794 3 U         -1.207e+04  0.00e+00 m   0  322  288  323 0 #N 20, HN 18, HN 20, 
1703 120.493   3.259   7.794 3 U         -6.676e+03  0.00e+00 m   0  322  272  323 0 #N 20, HA 17, HN 20, 
1704 120.493   4.031   7.794 3 U         -1.134e+04  0.00e+00 m   0  322  257  323 0 #N 20, HA 16, HN 20, 
1705 120.493   7.934   7.794 3 U         -1.550e+04  0.00e+00 m   0  322  358  323 0 #N 20, HN 22, HN 20, 
1706 119.770   4.114   8.511 3 U         -3.743e+03  0.00e+00 m   0  347  300  348 0 #N 21, HA 19, HN 21, 
1707 119.770   7.987   8.511 3 U         -3.868e+03  0.00e+00 m   0  347  298  348 0 #N 21, HN 19, HN 21, 
1708 119.770   4.061   8.511 3 U         -6.580e+03  0.00e+00 m   0  347  290  348 0 #N 21, HA 18, HN 21, 
1709 119.770   3.259   8.511 3 U         -3.410e+03  0.00e+00 m   0  347  272  348 0 #N 21, HA 17, HN 21, 
1710 119.770   8.185   8.511 3 U         -2.811e+03  0.00e+00 m   0  347  373  348 0 #N 21, HN 23, HN 21, 
1711 117.677   4.194   7.934 3 U         -4.101e+03  0.00e+00 m   0  357  325  358 0 #N 22, HA 20, HN 22, 
1712 117.677   7.794   7.934 3 U         -3.092e+03  0.00e+00 m   0  357  323  358 0 #N 22, HN 20, HN 22, 
1713 117.677   4.114   7.934 3 U         -3.050e+04  0.00e+00 m   0  357  300  358 0 #N 22, HA 19, HN 22, 
1714 117.677   4.061   7.934 3 U         -1.772e+04  0.00e+00 m   0  357  290  358 0 #N 22, HA 18, HN 22, 
1715 119.558   3.870   8.185 3 U         -1.699e+03  0.00e+00 m   0  372  350  373 0 #N 23, HA 21, HN 23, 
1716 119.558   8.511   8.185 3 U         -3.141e+03  0.00e+00 m   0  372  348  373 0 #N 23, HN 21, HN 23, 
1717 119.558   4.194   8.185 3 U         -6.259e+03  0.00e+00 m   0  372  325  373 0 #N 23, HA 20, HN 23, 
1718 119.558   4.114   8.185 3 U         -8.805e+03  0.00e+00 m   0  372  300  373 0 #N 23, HA 19, HN 23, 
1719 123.428   7.554   8.406 3 U         -1.942e+03  0.00e+00 m   0  530  581  531 0 #N 34, HN 36, HN 34, 
1720 118.569   7.501   8.009 3 U         -8.987e+03  0.00e+00 m   0  555  596  556 0 #N 35, HN 37, HN 35, 
1721 120.475   3.706   7.554 3 U         -2.121e+03  0.00e+00 m   0  580  533  581 0 #N 36, HA 34, HN 36, 
1722 120.475   8.406   7.554 3 U         -1.578e+03  0.00e+00 m   0  580  531  581 0 #N 36, HN 34, HN 36, 
1723 120.475   8.591   7.554 3 U         -2.594e+03  0.00e+00 m   0  580  617  581 0 #N 36, HN 38, HN 36, 
1724 118.349   3.861   7.501 3 U         -1.460e+03  0.00e+00 m   0  595  558  596 0 #N 37, HA 35, HN 37, 
1725 118.349   8.009   7.501 3 U         -2.138e+03  0.00e+00 m   0  595  556  596 0 #N 37, HN 35, HN 37, 
1726 118.349   3.706   7.501 3 U         -7.964e+03  0.00e+00 m   0  595  533  596 0 #N 37, HA 34, HN 37, 
1727 118.349   7.849   7.501 3 U         -1.121e+03  0.00e+00 m   0  595  638  596 0 #N 37, HN 39, HN 37, 
1728 121.911   4.042   8.591 3 U         -8.930e+02  0.00e+00 m   0  616  583  617 0 #N 38, HA 36, HN 38, 
1729 121.911   7.554   8.591 3 U         -2.940e+03  0.00e+00 m   0  616  581  617 0 #N 38, HN 36, HN 38, 
1730 121.911   3.861   8.591 3 U         -5.825e+03  0.00e+00 m   0  616  558  617 0 #N 38, HA 35, HN 38, 
1731 121.911   3.706   8.591 3 U         -2.699e+03  0.00e+00 m   0  616  533  617 0 #N 38, HA 34, HN 38, 
1732 121.911   8.068   8.591 3 U         -1.210e+03  0.00e+00 m   0  616  649  617 0 #N 38, HN 40, HN 38, 
1733 119.599   3.657   7.849 3 U         -7.100e+02  0.00e+00 m   0  637  598  638 0 #N 39, HA 37, HN 39, 
1734 119.599   7.501   7.849 3 U         -1.755e+03  0.00e+00 m   0  637  596  638 0 #N 39, HN 37, HN 39, 
1735 119.599   4.042   7.849 3 U         -3.257e+03  0.00e+00 m   0  637  583  638 0 #N 39, HA 36, HN 39, 
1736 119.599   3.861   7.849 3 U         -1.971e+03  0.00e+00 m   0  637  558  638 0 #N 39, HA 35, HN 39, 
1737 119.599   8.575   7.849 3 U         -8.532e+03  0.00e+00 m   0  637  675  638 0 #N 39, HN 41, HN 39, 
1738 118.381   3.514   8.068 3 U         -1.337e+03  0.00e+00 m   0  648  619  649 0 #N 40, HA 38, HN 40, 
1739 118.381   8.591   8.068 3 U         -1.049e+04  0.00e+00 m   0  648  617  649 0 #N 40, HN 38, HN 40, 
1740 118.381   3.657   8.068 3 U         -5.174e+03  0.00e+00 m   0  648  598  649 0 #N 40, HA 37, HN 40, 
1741 118.381   4.042   8.068 3 U         -2.417e+03  0.00e+00 m   0  648  583  649 0 #N 40, HA 36, HN 40, 
1742 118.381   8.340   8.068 3 U         -2.360e+03  0.00e+00 m   0  648  697  649 0 #N 40, HN 42, HN 40, 
1743 121.053   4.340   8.575 3 U         -1.134e+03  0.00e+00 m   0  674  640  675 0 #N 41, HA 39, HN 41, 
1744 121.053   7.849   8.575 3 U         -1.160e+03  0.00e+00 m   0  674  638  675 0 #N 41, HN 39, HN 41, 
1745 121.053   3.514   8.575 3 U         -4.482e+03  0.00e+00 m   0  674  619  675 0 #N 41, HA 38, HN 41, 
1746 121.053   3.657   8.575 3 U         -1.820e+03  0.00e+00 m   0  674  598  675 0 #N 41, HA 37, HN 41, 
1747 121.053   7.482   8.575 3 U         -1.925e+03  0.00e+00 m   0  674  722  675 0 #N 41, HN 43, HN 41, 
1749 121.487   8.068   8.340 3 U         -3.181e+03  0.00e+00 m   0  696  649  697 0 #N 42, HN 40, HN 42, 
1750 121.487   4.340   8.340 3 U         -4.652e+03  0.00e+00 m   0  696  640  697 0 #N 42, HA 39, HN 42, 
1751 121.487   3.514   8.340 3 U         -1.620e+03  0.00e+00 m   0  696  619  697 0 #N 42, HA 38, HN 42, 
1752 115.916   4.144   7.482 3 U         -2.033e+03  0.00e+00 m   0  721  677  722 0 #N 43, HA 41, HN 43, 
1753 115.916   8.575   7.482 3 U         -1.948e+03  0.00e+00 m   0  721  675  722 0 #N 43, HN 41, HN 43, 
1754 115.916   3.887   7.482 3 U         -4.527e+03  0.00e+00 m   0  721  651  722 0 #N 43, HA 40, HN 43, 
1755 115.916   4.340   7.482 3 U         -2.119e+03  0.00e+00 m   0  721  640  722 0 #N 43, HA 39, HN 43, 
1756 127.275   7.777   8.639 3 U         -2.048e+03  0.00e+00 m   0  961 1002  962 0 #N 56, HN 58, HN 56, 
1757 119.516   7.654   8.378 3 U         -2.164e+03  0.00e+00 m   0  986 1012  987 0 #N 57, HN 59, HN 57, 
1758 115.830   3.737   7.777 3 U         -2.386e+03  0.00e+00 m   0 1001  964 1002 0 #N 58, HA 56, HN 58, 
1759 115.830   8.639   7.777 3 U         -1.923e+03  0.00e+00 m   0 1001  962 1002 0 #N 58, HN 56, HN 58, 
1760 115.830   7.933   7.777 3 U         -2.337e+03  0.00e+00 m   0 1001 1033 1002 0 #N 58, HN 60, HN 58, 
1761 120.077   4.107   7.654 3 U         -1.089e+03  0.00e+00 m   0 1011  989 1012 0 #N 59, HA 57, HN 59, 
1762 120.077   8.378   7.654 3 U         -2.096e+03  0.00e+00 m   0 1011  987 1012 0 #N 59, HN 57, HN 59, 
1763 120.077   3.737   7.654 3 U         -4.692e+03  0.00e+00 m   0 1011  964 1012 0 #N 59, HA 56, HN 59, 
1764 120.077   7.772   7.654 3 U         -1.226e+04  0.00e+00 m   0 1011 1043 1012 0 #N 59, HN 61, HN 59, 
1765 114.178   4.240   7.933 3 U         -1.357e+03  0.00e+00 m   0 1032 1004 1033 0 #N 60, HA 58, HN 60, 
1766 114.178   7.777   7.933 3 U         -2.015e+04  0.00e+00 m   0 1032 1002 1033 0 #N 60, HN 58, HN 60, 
1767 114.178   4.107   7.933 3 U         -7.385e+03  0.00e+00 m   0 1032  989 1033 0 #N 60, HA 57, HN 60, 
1768 114.178   3.737   7.933 3 U         -2.386e+03  0.00e+00 m   0 1032  964 1033 0 #N 60, HA 56, HN 60, 
1769 114.178   8.117   7.933 3 U         -1.920e+03  0.00e+00 m   0 1032 1058 1033 0 #N 60, HN 62, HN 60, 
1770 120.392   3.324   7.772 3 U         -1.161e+03  0.00e+00 m   0 1042 1014 1043 0 #N 61, HA 59, HN 61, 
1771 120.392   7.654   7.772 3 U         -2.167e+03  0.00e+00 m   0 1042 1012 1043 0 #N 61, HN 59, HN 61, 
1772 120.392   4.240   7.772 3 U         -4.879e+03  0.00e+00 m   0 1042 1004 1043 0 #N 61, HA 58, HN 61, 
1773 120.392   4.107   7.772 3 U         -3.544e+03  0.00e+00 m   0 1042  989 1043 0 #N 61, HA 57, HN 61, 
1774 120.392   8.575   7.772 3 U         -2.351e+03  0.00e+00 m   0 1042 1079 1043 0 #N 61, HN 63, HN 61, 
1775 118.610   3.948   8.117 3 U         -3.261e+03  0.00e+00 m   0 1057 1035 1058 0 #N 62, HA 60, HN 62, 
1776 118.610   7.933   8.117 3 U         -1.490e+02  0.00e+00 m   0 1057 1033 1058 0 #N 62, HN 60, HN 62, 
1777 118.610   3.324   8.117 3 U         -3.261e+03  0.00e+00 m   0 1057 1014 1058 0 #N 62, HA 59, HN 62, 
1778 118.610   4.240   8.117 3 U         -8.600e+02  0.00e+00 m   0 1057 1004 1058 0 #N 62, HA 58, HN 62, 
1779 118.610   7.673   8.117 3 U         -2.317e+03  0.00e+00 m   0 1057 1100 1058 0 #N 62, HN 64, HN 62, 
1780 119.241   3.971   8.575 3 U         -4.238e+03  0.00e+00 m   0 1078 1045 1079 0 #N 63, HA 61, HN 63, 
1781 119.241   7.772   8.575 3 U         -2.084e+03  0.00e+00 m   0 1078 1043 1079 0 #N 63, HN 61, HN 63, 
1782 119.241   3.948   8.575 3 U         -4.851e+03  0.00e+00 m   0 1078 1035 1079 0 #N 63, HA 60, HN 63, 
1783 119.241   3.324   8.575 3 U         -2.759e+03  0.00e+00 m   0 1078 1014 1079 0 #N 63, HA 59, HN 63, 
1784 119.241   7.404   8.575 3 U         -1.263e+03  0.00e+00 m   0 1078 1125 1079 0 #N 63, HN 65, HN 63, 
1785 117.220   3.421   7.673 3 U         -1.311e+03  0.00e+00 m   0 1099 1060 1100 0 #N 64, HA 62, HN 64, 
1786 117.220   8.117   7.673 3 U         -1.897e+03  0.00e+00 m   0 1099 1058 1100 0 #N 64, HN 62, HN 64, 
1787 117.220   3.971   7.673 3 U         -7.067e+03  0.00e+00 m   0 1099 1045 1100 0 #N 64, HA 61, HN 64, 
1788 117.220   3.948   7.673 3 U         -6.725e+03  0.00e+00 m   0 1099 1035 1100 0 #N 64, HA 60, HN 64, 
1789 117.220   8.655   7.673 3 U         -2.691e+03  0.00e+00 m   0 1099 1143 1100 0 #N 64, HN 66, HN 64, 
1790 114.597   3.199   7.404 3 U         -1.443e+03  0.00e+00 m   0 1124 1081 1125 0 #N 65, HA 63, HN 65, 
1791 114.597   8.575   7.404 3 U         -1.860e+03  0.00e+00 m   0 1124 1079 1125 0 #N 65, HN 63, HN 65, 
1792 114.597   3.421   7.404 3 U         -4.306e+03  0.00e+00 m   0 1124 1060 1125 0 #N 65, HA 62, HN 65, 
1793 114.597   3.971   7.404 3 U         -2.286e+03  0.00e+00 m   0 1124 1045 1125 0 #N 65, HA 61, HN 65, 
1794 114.597   8.316   7.404 3 U         -2.445e+03  0.00e+00 m   0 1124 1161 1125 0 #N 65, HN 67, HN 65, 
1795 120.063   3.804   8.655 3 U         -1.022e+03  0.00e+00 m   0 1142 1102 1143 0 #N 66, HA 64, HN 66, 
1796 120.063   7.673   8.655 3 U         -1.443e+03  0.00e+00 m   0 1142 1100 1143 0 #N 66, HN 64, HN 66, 
1797 120.063   3.199   8.655 3 U         -3.225e+03  0.00e+00 m   0 1142 1081 1143 0 #N 66, HA 63, HN 66, 
1798 120.063   3.421   8.655 3 U         -5.450e+02  0.00e+00 m   0 1142 1060 1143 0 #N 66, HA 62, HN 66, 
1799 120.063   7.809   8.655 3 U         -9.400e+02  0.00e+00 m   0 1142 1183 1143 0 #N 66, HN 68, HN 66, 
1800 121.130   4.215   8.316 3 U         -1.311e+03  0.00e+00 m   0 1160 1127 1161 0 #N 67, HA 65, HN 67, 
1801 121.130   7.404   8.316 3 U         -1.443e+03  0.00e+00 m   0 1160 1125 1161 0 #N 67, HN 65, HN 67, 
1802 121.130   3.804   8.316 3 U         -2.703e+03  0.00e+00 m   0 1160 1102 1161 0 #N 67, HA 64, HN 67, 
1803 121.130   3.199   8.316 3 U         -2.218e+03  0.00e+00 m   0 1160 1081 1161 0 #N 67, HA 63, HN 67, 
1804 121.130   7.932   8.316 3 U         -8.990e+02  0.00e+00 m   0 1160 1194 1161 0 #N 67, HN 69, HN 67, 
1805 118.349   3.687   7.809 3 U         -1.072e+03  0.00e+00 m   0 1182 1145 1183 0 #N 68, HA 66, HN 68, 
1806 118.349   8.655   7.809 3 U         -1.666e+03  0.00e+00 m   0 1182 1143 1183 0 #N 68, HN 66, HN 68, 
1807 118.349   4.215   7.809 3 U         -4.266e+03  0.00e+00 m   0 1182 1127 1183 0 #N 68, HA 65, HN 68, 
1808 118.349   3.804   7.809 3 U         -1.670e+03  0.00e+00 m   0 1182 1102 1183 0 #N 68, HA 64, HN 68, 
1809 112.915   4.089   7.932 3 U         -1.488e+04  0.00e+00 m   0 1193 1163 1194 0 #N 69, HA 67, HN 69, 
1810 112.915   8.316   7.932 3 U         -2.008e+03  0.00e+00 m   0 1193 1161 1194 0 #N 69, HN 67, HN 69, 
1811 112.915   3.687   7.932 3 U         -4.533e+03  0.00e+00 m   0 1193 1145 1194 0 #N 69, HA 66, HN 69, 
1812 112.915   4.215   7.932 3 U         -4.027e+03  0.00e+00 m   0 1193 1127 1194 0 #N 69, HA 65, HN 69, 
1813 127.224   7.643   9.348 3 U         -1.775e+03  0.00e+00 m   0 1359 1389 1360 0 #N 80, HN 82, HN 80, 
1814 117.620   7.306   8.684 3 U         -2.952e+03  0.00e+00 m   0 1374 1410 1375 0 #N 81, HN 83, HN 81, 
1815 122.564   3.886   7.643 3 U         -2.751e+03  0.00e+00 m   0 1388 1362 1389 0 #N 82, HA 80, HN 82, 
1816 122.564   9.348   7.643 3 U         -1.766e+03  0.00e+00 m   0 1388 1360 1389 0 #N 82, HN 80, HN 82, 
1817 122.564   8.160   7.643 3 U         -2.343e+03  0.00e+00 m   0 1388 1431 1389 0 #N 82, HN 84, HN 82, 
1818 118.230   4.497   7.306 3 U         -1.323e+03  0.00e+00 m   0 1409 1377 1410 0 #N 83, HA 81, HN 83, 
1819 118.230   8.684   7.306 3 U         -2.719e+03  0.00e+00 m   0 1409 1375 1410 0 #N 83, HN 81, HN 83, 
1821 118.230   7.786   7.306 3 U         -1.548e+03  0.00e+00 m   0 1409 1446 1410 0 #N 83, HN 85, HN 83, 
1822 117.379   3.668   8.160 3 U         -1.367e+03  0.00e+00 m   0 1430 1391 1431 0 #N 84, HA 82, HN 84, 
1823 117.379   7.643   8.160 3 U         -1.817e+03  0.00e+00 m   0 1430 1389 1431 0 #N 84, HN 82, HN 84, 
1824 117.379   4.497   8.160 3 U         -6.066e+03  0.00e+00 m   0 1430 1377 1431 0 #N 84, HA 81, HN 84, 
1825 117.379   3.886   8.160 3 U         -3.088e+03  0.00e+00 m   0 1430 1362 1431 0 #N 84, HA 80, HN 84, 
1826 117.379   8.247   8.160 3 U         -2.896e+03  0.00e+00 m   0 1430 1456 1431 0 #N 84, HN 86, HN 84, 
1827 114.134   3.539   7.786 3 U         -1.874e+03  0.00e+00 m   0 1445 1412 1446 0 #N 85, HA 83, HN 85, 
1828 114.134   7.306   7.786 3 U         -1.854e+03  0.00e+00 m   0 1445 1410 1446 0 #N 85, HN 83, HN 85, 
1829 114.134   3.668   7.786 3 U         -5.439e+03  0.00e+00 m   0 1445 1391 1446 0 #N 85, HA 82, HN 85, 
1830 114.134   4.497   7.786 3 U         -4.908e+03  0.00e+00 m   0 1445 1377 1446 0 #N 85, HA 81, HN 85, 
1831 114.134   8.153   7.786 3 U         -2.176e+04  0.00e+00 m   0 1445 1477 1446 0 #N 85, HN 87, HN 85, 
1832 122.990   4.025   8.247 3 U         -7.828e+03  0.00e+00 m   0 1455 1433 1456 0 #N 86, HA 84, HN 86, 
1833 122.990   8.160   8.247 3 U         -1.292e+04  0.00e+00 m   0 1455 1431 1456 0 #N 86, HN 84, HN 86, 
1834 122.990   3.539   8.247 3 U         -2.655e+03  0.00e+00 m   0 1455 1412 1456 0 #N 86, HA 83, HN 86, 
1835 122.990   3.668   8.247 3 U         -1.279e+03  0.00e+00 m   0 1455 1391 1456 0 #N 86, HA 82, HN 86, 
1836 122.990   7.436   8.247 3 U         -1.212e+03  0.00e+00 m   0 1455 1503 1456 0 #N 86, HN 88, HN 86, 
1837 118.724   4.220   8.153 3 U         -1.151e+03  0.00e+00 m   0 1476 1448 1477 0 #N 87, HA 85, HN 87, 
1838 118.724   7.786   8.153 3 U         -4.158e+03  0.00e+00 m   0 1476 1446 1477 0 #N 87, HN 85, HN 87, 
1839 118.724   4.025   8.153 3 U         -6.475e+03  0.00e+00 m   0 1476 1433 1477 0 #N 87, HA 84, HN 87, 
1840 118.724   3.539   8.153 3 U         -1.674e+03  0.00e+00 m   0 1476 1412 1477 0 #N 87, HA 83, HN 87, 
1841 118.724   7.701   8.153 3 U         -1.725e+03  0.00e+00 m   0 1476 1528 1477 0 #N 87, HN 89, HN 87, 
1842 114.597   3.870   7.436 3 U         -1.335e+03  0.00e+00 m   0 1502 1458 1503 0 #N 88, HA 86, HN 88, 
1843 114.597   8.247   7.436 3 U         -1.207e+03  0.00e+00 m   0 1502 1456 1503 0 #N 88, HN 86, HN 88, 
1844 114.597   4.220   7.436 3 U         -5.817e+03  0.00e+00 m   0 1502 1448 1503 0 #N 88, HA 85, HN 88, 
1845 114.597   4.025   7.436 3 U         -1.258e+04  0.00e+00 m   0 1502 1433 1503 0 #N 88, HA 84, HN 88, 
1846 116.894   4.114   7.701 3 U         -2.417e+03  0.00e+00 m   0 1527 1479 1528 0 #N 89, HA 87, HN 89, 
1847 116.894   8.153   7.701 3 U         -1.886e+03  0.00e+00 m   0 1527 1477 1528 0 #N 89, HN 87, HN 89, 
1848 116.894   3.870   7.701 3 U         -5.254e+03  0.00e+00 m   0 1527 1458 1528 0 #N 89, HA 86, HN 89, 
1849 116.894   4.220   7.701 3 U         -1.654e+03  0.00e+00 m   0 1527 1448 1528 0 #N 89, HA 85, HN 89, 
1851 121.254   7.933   8.110 3 U         -4.931e+03  0.00e+00 m   0 1771 1802 1772 0 #N 102, HN 104, HN 102, 
1852 118.801   3.805   8.274 3 U         -9.890e+02  0.00e+00 m   0 1786 1749 1787 0 #N 103, HA 101, HN 103, 
1854 118.801   7.963   8.274 3 U         -1.310e+04  0.00e+00 m   0 1786 1820 1787 0 #N 103, HN 105, HN 103, 
1855 117.960   4.009   7.933 3 U         -1.837e+03  0.00e+00 m   0 1801 1774 1802 0 #N 104, HA 102, HN 104, 
1856 117.960   8.110   7.933 3 U         -1.179e+04  0.00e+00 m   0 1801 1772 1802 0 #N 104, HN 102, HN 104, 
1857 117.960   3.805   7.933 3 U         -6.194e+03  0.00e+00 m   0 1801 1749 1802 0 #N 104, HA 101, HN 104, 
1858 117.960   8.200   7.933 3 U         -5.849e+03  0.00e+00 m   0 1801 1845 1802 0 #N 104, HN 106, HN 104, 
1859 118.790   4.166   7.963 3 U         -1.321e+03  0.00e+00 m   0 1819 1789 1820 0 #N 105, HA 103, HN 105, 
1860 118.790   8.274   7.963 3 U         -3.040e+03  0.00e+00 m   0 1819 1787 1820 0 #N 105, HN 103, HN 105, 
1861 118.790   4.009   7.963 3 U         -5.102e+03  0.00e+00 m   0 1819 1774 1820 0 #N 105, HA 102, HN 105, 
1862 118.790   3.805   7.963 3 U         -2.879e+03  0.00e+00 m   0 1819 1749 1820 0 #N 105, HA 101, HN 105, 
1863 118.790   7.751   7.963 3 U         -2.823e+03  0.00e+00 m   0 1819 1856 1820 0 #N 105, HN 107, HN 105, 
1865 118.293   7.933   8.200 3 U         -1.575e+04  0.00e+00 m   0 1844 1802 1845 0 #N 106, HN 104, HN 106, 
1866 118.293   4.166   8.200 3 U         -6.275e+03  0.00e+00 m   0 1844 1789 1845 0 #N 106, HA 103, HN 106, 
1867 118.293   4.009   8.200 3 U         -2.357e+03  0.00e+00 m   0 1844 1774 1845 0 #N 106, HA 102, HN 106, 
1868 118.293   8.310   8.200 3 U         -6.427e+03  0.00e+00 m   0 1844 1866 1845 0 #N 106, HN 108, HN 106, 
1870 122.064   7.963   7.751 3 U         -3.104e+03  0.00e+00 m   0 1855 1820 1856 0 #N 107, HN 105, HN 107, 
1871 122.064   3.377   7.751 3 U         -4.249e+03  0.00e+00 m   0 1855 1804 1856 0 #N 107, HA 104, HN 107, 
1872 122.064   4.166   7.751 3 U         -2.831e+03  0.00e+00 m   0 1855 1789 1856 0 #N 107, HA 103, HN 107, 
1873 122.064   8.039   7.751 3 U         -1.792e+03  0.00e+00 m   0 1855 1884 1856 0 #N 107, HN 109, HN 107, 
1874 117.788   4.370   8.310 3 U         -1.423e+03  0.00e+00 m   0 1865 1847 1866 0 #N 108, HA 106, HN 108, 
1875 117.788   8.200   8.310 3 U         -4.016e+03  0.00e+00 m   0 1865 1845 1866 0 #N 108, HN 106, HN 108, 
1876 117.788   3.478   8.310 3 U         -4.874e+03  0.00e+00 m   0 1865 1822 1866 0 #N 108, HA 105, HN 108, 
1877 117.788   3.377   8.310 3 U         -2.062e+03  0.00e+00 m   0 1865 1804 1866 0 #N 108, HA 104, HN 108, 
1878 117.788   7.939   8.310 3 U         -3.732e+03  0.00e+00 m   0 1865 1899 1866 0 #N 108, HN 110, HN 108, 
1879 117.849   4.090   8.039 3 U         -1.092e+03  0.00e+00 m   0 1883 1858 1884 0 #N 109, HA 107, HN 109, 
1880 117.849   7.751   8.039 3 U         -2.916e+03  0.00e+00 m   0 1883 1856 1884 0 #N 109, HN 107, HN 109, 
1881 117.849   4.370   8.039 3 U         -4.010e+03  0.00e+00 m   0 1883 1847 1884 0 #N 109, HA 106, HN 109, 
1882 117.849   3.478   8.039 3 U         -1.996e+03  0.00e+00 m   0 1883 1822 1884 0 #N 109, HA 105, HN 109, 
1883 117.849   8.077   8.039 3 U         -5.790e+04  0.00e+00 m   0 1883 1914 1884 0 #N 109, HN 111, HN 109, 
1885 117.728   8.310   7.939 3 U         -1.284e+04  0.00e+00 m   0 1898 1866 1899 0 #N 110, HN 108, HN 110, 
1886 117.728   4.090   7.939 3 U         -3.168e+04  0.00e+00 m   0 1898 1858 1899 0 #N 110, HA 107, HN 110, 
1887 117.728   4.370   7.939 3 U         -3.390e+03  0.00e+00 m   0 1898 1847 1899 0 #N 110, HA 106, HN 110, 
1888 117.728   8.144   7.939 3 U         -1.134e+04  0.00e+00 m   0 1898 1937 1899 0 #N 110, HN 112, HN 110, 
1890 119.474   8.039   8.077 3 U         -6.958e+03  0.00e+00 m   0 1913 1884 1914 0 #N 111, HN 109, HN 111, 
1891 119.474   3.298   8.077 3 U         -3.993e+03  0.00e+00 m   0 1913 1868 1914 0 #N 111, HA 108, HN 111, 
1892 119.474   4.090   8.077 3 U         -2.067e+03  0.00e+00 m   0 1913 1858 1914 0 #N 111, HA 107, HN 111, 
1893 119.474   8.047   8.077 3 U         -5.626e+04  0.00e+00 m   0 1913 1959 1914 0 #N 111, HN 113, HN 111, 
1894 116.972   3.929   8.144 3 U         -1.445e+03  0.00e+00 m   0 1936 1901 1937 0 #N 112, HA 110, HN 112, 
1895 116.972   7.939   8.144 3 U         -4.533e+03  0.00e+00 m   0 1936 1899 1937 0 #N 112, HN 110, HN 112, 
1896 116.972   3.660   8.144 3 U         -3.357e+03  0.00e+00 m   0 1936 1886 1937 0 #N 112, HA 109, HN 112, 
1897 116.972   3.298   8.144 3 U         -1.857e+03  0.00e+00 m   0 1936 1868 1937 0 #N 112, HA 108, HN 112, 
1899 120.009   8.077   8.047 3 U         -5.736e+04  0.00e+00 m   0 1958 1914 1959 0 #N 113, HN 111, HN 113, 
1900 120.009   3.929   8.047 3 U         -3.301e+03  0.00e+00 m   0 1958 1901 1959 0 #N 113, HA 110, HN 113, 
1901 120.009   3.660   8.047 3 U         -9.280e+02  0.00e+00 m   0 1958 1886 1959 0 #N 113, HA 109, HN 113, 
6961 123.774   3.861   8.477 1 U         -1.093e+03  0.00e+00 m   0   51    0   52 0 #N 4,  0, HN 4, 
6962 123.774   0.646   8.477 1 U         -2.187e+03  0.00e+00 m   0   51    0   52 0 #N 4,  0, HN 4, 
6967 126.474   7.812   8.393 1 U         -2.272e+03  0.00e+00 m   0   69    0   70 0 #N 5,  0, HN 5, 
6968 126.474   5.419   8.393 1 U         -1.017e+04  0.00e+00 m   0   69    0   70 0 #N 5,  0, HN 5, 
6990 126.474   1.527   8.393 1 U         -2.506e+03  0.00e+00 m   0   69    0   70 0 #N 5,  0, HN 5, 
6991 126.474   1.358   8.393 1 U         -1.815e+03  0.00e+00 m   0   69    0   70 0 #N 5,  0, HN 5, 
6992 126.474   1.976   8.393 1 U         -2.090e+03  0.00e+00 m   0   69    0   70 0 #N 5,  0, HN 5, 
6993 126.474   0.661   8.393 1 U         -5.993e+03  0.00e+00 m   0   69    0   70 0 #N 5,  0, HN 5, 
7021 126.797   1.522   8.883 1 U         -3.499e+03  0.00e+00 m   0   87    0   88 0 #N 6,  0, HN 6, 
7022 126.797   1.269   8.883 1 U         -3.846e+03  0.00e+00 m   0   87    0   88 0 #N 6,  0, HN 6, 
7045 130.099   8.261   8.725 1 U         -2.207e+03  0.00e+00 m   0  110    0  111 0 #N 7,  0, HN 7, 
7051 130.099   4.950   8.725 1 U         -7.623e+03  0.00e+00 m   0  110    0  111 0 #N 7,  0, HN 7, 
7062 130.099   1.712   8.725 1 U         -2.883e+03  0.00e+00 m   0  110    0  111 0 #N 7,  0, HN 7, 
7076 118.290   5.230   8.318 1 U         -9.873e+03  0.00e+00 m   0  142    0  143 0 #N 9,  0, HN 9, 
7088 115.631   0.900   8.116 1 U         -1.022e+04  0.00e+00 m   0  132    0  133 0 #N 8,  0, HN 8, 
7089 118.290   2.548   8.318 1 U         -1.670e+03  0.00e+00 m   0  142    0  143 0 #N 9,  0, HN 9, 
7090 118.290   1.945   8.318 1 U         -1.190e+03  0.00e+00 m   0  142    0  143 0 #N 9,  0, HN 9, 
7091 118.290   0.884   8.318 1 U         -2.471e+03  0.00e+00 m   0  142    0  143 0 #N 9,  0, HN 9, 
7092 118.290   0.688   8.318 1 U         -1.466e+03  0.00e+00 m   0  142    0  143 0 #N 9,  0, HN 9, 
7096 121.660   7.712   8.287 1 U         -8.630e+02  0.00e+00 m   0  153    0  154 0 #N 10,  0, HN 10, 
7099 121.660   5.209   8.287 1 U         -8.703e+03  0.00e+00 m   0  153    0  154 0 #N 10,  0, HN 10, 
7102 121.660   4.586   8.287 1 U         -4.641e+03  0.00e+00 m   0  153    0  154 0 #N 10,  0, HN 10, 
7103 121.660   3.815   8.287 1 U         -3.369e+03  0.00e+00 m   0  153    0  154 0 #N 10,  0, HN 10, 
7104 121.660   3.287   8.287 1 U         -4.124e+03  0.00e+00 m   0  153    0  154 0 #N 10,  0, HN 10, 
7105 121.660   2.157   8.287 1 U         -2.944e+03  0.00e+00 m   0  153    0  154 0 #N 10,  0, HN 10, 
7106 121.660   1.116   8.287 1 U         -1.852e+03  0.00e+00 m   0  153    0  154 0 #N 10,  0, HN 10, 
7107 126.131   0.910   9.026 1 U         -1.279e+03  0.00e+00 m   0  164    0  165 0 #N 11,  0, HN 11, 
7113 111.752   0.931   7.796 1 U         -3.766e+03  0.00e+00 m   0  177    0  178 0 #NE2 11,  0, HE21 11, 
7114 111.752   0.942   6.843 1 U         -7.135e+03  0.00e+00 m   0  177    0  179 0 #NE2 11,  0, HE22 11, 
7115 111.752   2.362   7.796 1 U         -3.418e+03  0.00e+00 m   0  177    0  178 0 #NE2 11,  0, HE21 11, 
7116 111.752   2.356   6.843 1 U         -2.266e+03  0.00e+00 m   0  177    0  179 0 #NE2 11,  0, HE22 11, 
7121 126.131   8.119   9.026 1 U         -9.310e+02  0.00e+00 m   0  164    0  165 0 #N 11,  0, HN 11, 
7124 111.752   8.124   7.796 1 U         -1.680e+03  0.00e+00 m   0  177    0  178 0 #NE2 11,  0, HE21 11, 
7125 119.136   3.746   8.306 1 U         -1.423e+03  0.00e+00 m   0  182    0  183 0 #N 12,  0, HN 12, 
7126 119.136   3.055   8.306 1 U         -1.582e+03  0.00e+00 m   0  182    0  183 0 #N 12,  0, HN 12, 
7127 119.136   4.881   8.306 1 U         -3.863e+03  0.00e+00 m   0  182    0  183 0 #N 12,  0, HN 12, 
7128 119.136   1.723   8.306 1 U         -2.079e+03  0.00e+00 m   0  182    0  183 0 #N 12,  0, HN 12, 
7129 119.136   1.077   8.306 1 U         -1.743e+03  0.00e+00 m   0  182    0  183 0 #N 12,  0, HN 12, 
7130 119.136   0.879   8.306 1 U         -1.672e+03  0.00e+00 m   0  182    0  183 0 #N 12,  0, HN 12, 
7145 119.899   3.051   7.727 1 U         -3.584e+03  0.00e+00 m   0  197    0  198 0 #N 13,  0, HN 13, 
7146 119.899   2.554   7.727 1 U         -2.252e+03  0.00e+00 m   0  197    0  198 0 #N 13,  0, HN 13, 
7166 119.899   1.935   7.727 1 U         -1.886e+03  0.00e+00 m   0  197    0  198 0 #N 13,  0, HN 13, 
7180 120.959   6.863   8.086 1 U         -2.610e+03  0.00e+00 m   0  218    0  219 0 #N 14,  0, HN 14, 
7205 120.959   3.293   8.086 1 U         -1.363e+03  0.00e+00 m   0  218    0  219 0 #N 14,  0, HN 14, 
7206 120.959   3.056   8.086 1 U         -9.300e+02  0.00e+00 m   0  218    0  219 0 #N 14,  0, HN 14, 
7207 120.959   2.512   8.086 1 U         -1.620e+03  0.00e+00 m   0  218    0  219 0 #N 14,  0, HN 14, 
7231 120.959   1.534   8.086 1 U         -6.010e+02  0.00e+00 m   0  218    0  219 0 #N 14,  0, HN 14, 
7232 120.959   0.109   8.086 1 U         -9.480e+02  0.00e+00 m   0  218    0  219 0 #N 14,  0, HN 14, 
7240 119.194   8.516   8.121 1 U         -1.508e+03  0.00e+00 m   0  239    0  240 0 #N 15,  0, HN 15, 
7241 119.194   6.858   8.121 1 U         -1.028e+03  0.00e+00 m   0  239    0  240 0 #N 15,  0, HN 15, 
7242 119.136   1.544   7.792 1 U         -2.510e+03  0.00e+00 m   0  254    0  255 0 #N 16,  0, HN 16, 
7243 119.136   0.103   7.792 1 U         -2.428e+03  0.00e+00 m   0  254    0  255 0 #N 16,  0, HN 16, 
7244 120.411   1.123   8.392 1 U         -1.311e+03  0.00e+00 m   0  269    0  270 0 #N 17,  0, HN 17, 
7245 120.411   1.239   8.392 1 U         -1.281e+03  0.00e+00 m   0  269    0  270 0 #N 17,  0, HN 17, 
7282 115.233   0.944   8.534 1 U         -2.022e+03  0.00e+00 m   0  287    0  288 0 #N 18,  0, HN 18, 
7283 115.233   1.249   8.534 1 U         -5.423e+03  0.00e+00 m   0  287    0  288 0 #N 18,  0, HN 18, 
7284 115.233   1.899   8.534 1 U         -3.008e+03  0.00e+00 m   0  287    0  288 0 #N 18,  0, HN 18, 
7285 115.233   2.121   8.534 1 U         -1.602e+03  0.00e+00 m   0  287    0  288 0 #N 18,  0, HN 18, 
7290 121.809   0.220   7.987 1 U         -1.151e+03  0.00e+00 m   0  297    0  298 0 #N 19,  0, HN 19, 
7292 121.809   2.178   7.987 1 U         -1.837e+03  0.00e+00 m   0  297    0  298 0 #N 19,  0, HN 19, 
7293 119.770   0.638   8.511 1 U         -2.590e+03  0.00e+00 m   0  347    0  348 0 #N 21,  0, HN 21, 
7294 119.770   0.210   8.511 1 U         -2.747e+03  0.00e+00 m   0  347    0  348 0 #N 21,  0, HN 21, 
7308 119.770   2.200   8.511 1 U         -3.024e+03  0.00e+00 m   0  347    0  348 0 #N 21,  0, HN 21, 
7319 117.677   7.054   7.934 1 U         -1.313e+03  0.00e+00 m   0  357    0  358 0 #N 22,  0, HN 22, 
7320 119.770   6.801   8.511 1 U         -1.114e+03  0.00e+00 m   0  347    0  348 0 #N 21,  0, HN 21, 
7321 119.558   1.868   8.185 1 U         -3.197e+03  0.00e+00 m   0  372    0  373 0 #N 23,  0, HN 23, 
7322 119.558   1.536   8.185 1 U         -3.658e+03  0.00e+00 m   0  372    0  373 0 #N 23,  0, HN 23, 
7332 113.767   6.658   7.868 1 U         -1.173e+03  0.00e+00 m   0  387    0  388 0 #N 24,  0, HN 24, 
7334 113.767   3.844   7.868 1 U         -3.072e+03  0.00e+00 m   0  387    0  388 0 #N 24,  0, HN 24, 
7335 113.767   2.032   7.868 1 U         -5.857e+03  0.00e+00 m   0  387    0  388 0 #N 24,  0, HN 24, 
7336 108.123   1.541   7.692 1 U         -1.812e+03  0.00e+00 m   0  402    0  403 0 #N 25,  0, HN 25, 
7337 108.123   2.618   7.692 1 U         -1.329e+03  0.00e+00 m   0  402    0  403 0 #N 25,  0, HN 25, 
7338 108.123   4.098   7.692 1 U         -6.122e+03  0.00e+00 m   0  402    0  403 0 #N 25,  0, HN 25, 
7339 108.123   6.807   7.692 1 U         -1.676e+03  0.00e+00 m   0  402    0  403 0 #N 25,  0, HN 25, 
7340 108.123   8.175   7.692 1 U         -2.847e+03  0.00e+00 m   0  402    0  403 0 #N 25,  0, HN 25, 
7346 118.211   3.871   8.076 1 U         -1.996e+04  0.00e+00 m   0  409    0  410 0 #N 26,  0, HN 26, 
7347 118.211   2.196   8.076 1 U         -6.781e+03  0.00e+00 m   0  409    0  410 0 #N 26,  0, HN 26, 
7348 118.211   1.926   8.076 1 U         -7.578e+03  0.00e+00 m   0  409    0  410 0 #N 26,  0, HN 26, 
7349 118.211   1.520   8.076 1 U         -8.498e+03  0.00e+00 m   0  409    0  410 0 #N 26,  0, HN 26, 
7350 118.211   1.404   8.076 1 U         -1.153e+03  0.00e+00 m   0  409    0  410 0 #N 26,  0, HN 26, 
7351 118.211   0.871   8.076 1 U         -1.676e+03  0.00e+00 m   0  409    0  410 0 #N 26,  0, HN 26, 
7352 118.211   0.633   8.076 1 U         -3.458e+03  0.00e+00 m   0  409    0  410 0 #N 26,  0, HN 26, 
7375 123.599   1.532   8.819 1 U         -1.041e+03  0.00e+00 m   0  432    0  433 0 #N 27,  0, HN 27, 
7376 123.599   0.634   8.819 1 U         -2.079e+03  0.00e+00 m   0  432    0  433 0 #N 27,  0, HN 27, 
7377 123.599   0.354   8.819 1 U         -8.470e+02  0.00e+00 m   0  432    0  433 0 #N 27,  0, HN 27, 
7378 123.599   0.872   8.819 1 U         -8.910e+02  0.00e+00 m   0  432    0  433 0 #N 27,  0, HN 27, 
7428 126.901   8.868   8.577 1 U         -3.173e+03  0.00e+00 m   0  464    0  465 0 #N 29,  0, HN 29, 
7429 111.687   0.709   6.930 1 U         -1.117e+03  0.00e+00 m   0  477    0  479 0 #NE2 29,  0, HE22 29, 
7431 115.255   0.888   8.750 1 U         -1.526e+03  0.00e+00 m   0  482    0  483 0 #N 30,  0, HN 30, 
7432 115.255   0.661   8.750 1 U         -1.758e+03  0.00e+00 m   0  482    0  483 0 #N 30,  0, HN 30, 
7466 114.044   6.915   8.822 1 U         -1.849e+03  0.00e+00 m   0  495    0  496 0 #N 31,  0, HN 31, 
7471 114.044   5.361   8.822 1 U         -6.122e+03  0.00e+00 m   0  495    0  496 0 #N 31,  0, HN 31, 
7474 114.044   2.870   8.822 1 U         -1.337e+03  0.00e+00 m   0  495    0  496 0 #N 31,  0, HN 31, 
7475 114.044   2.553   8.822 1 U         -8.810e+02  0.00e+00 m   0  495    0  496 0 #N 31,  0, HN 31, 
7476 114.044   0.925   8.822 1 U         -4.681e+03  0.00e+00 m   0  495    0  496 0 #N 31,  0, HN 31, 
7477 114.044   0.762   8.822 1 U         -3.823e+03  0.00e+00 m   0  495    0  496 0 #N 31,  0, HN 31, 
7478 114.044   0.688   8.822 1 U         -2.598e+03  0.00e+00 m   0  495    0  496 0 #N 31,  0, HN 31, 
7479 114.044   0.582   8.822 1 U         -2.807e+03  0.00e+00 m   0  495    0  496 0 #N 31,  0, HN 31, 
7489 122.434   2.398   8.132 1 U         -2.351e+03  0.00e+00 m   0  505    0  506 0 #N 32,  0, HN 32, 
7490 122.434   0.910   8.132 1 U         -2.972e+03  0.00e+00 m   0  505    0  506 0 #N 32,  0, HN 32, 
7491 122.434   0.566   8.132 1 U         -4.078e+03  0.00e+00 m   0  505    0  506 0 #N 32,  0, HN 32, 
7498 110.225   0.899   7.685 1 U         -3.474e+03  0.00e+00 m   0  514    0  515 0 #ND2 32,  0, HD21 32, 
7499 110.225   0.899   6.787 1 U         -2.787e+03  0.00e+00 m   0  514    0  516 0 #ND2 32,  0, HD22 32, 
7502 110.225   4.870   7.685 1 U         -9.100e+02  0.00e+00 m   0  514    0  515 0 #ND2 32,  0, HD21 32, 
7503 110.225   4.881   6.787 1 U         -8.030e+02  0.00e+00 m   0  514    0  516 0 #ND2 32,  0, HD22 32, 
7504 122.434   6.391   8.132 1 U         -1.719e+03  0.00e+00 m   0  505    0  506 0 #N 32,  0, HN 32, 
7505 122.762   6.393   8.672 1 U         -2.141e+03  0.00e+00 m   0  519    0  520 0 #N 33,  0, HN 33, 
7508 122.762   3.793   8.672 1 U         -1.846e+03  0.00e+00 m   0  519    0  520 0 #N 33,  0, HN 33, 
7509 122.762   4.661   8.672 1 U         -3.132e+03  0.00e+00 m   0  519    0  520 0 #N 33,  0, HN 33, 
7510 122.762   2.014   8.672 1 U         -1.650e+03  0.00e+00 m   0  519    0  520 0 #N 33,  0, HN 33, 
7511 122.762   0.694   8.672 1 U         -1.658e+03  0.00e+00 m   0  519    0  520 0 #N 33,  0, HN 33, 
7512 122.762   0.562   8.672 1 U         -6.853e+03  0.00e+00 m   0  519    0  520 0 #N 33,  0, HN 33, 
7515 123.428   0.668   8.406 1 U         -2.831e+03  0.00e+00 m   0  530    0  531 0 #N 34,  0, HN 34, 
7516 123.428   0.567   8.406 1 U         -5.600e+03  0.00e+00 m   0  530    0  531 0 #N 34,  0, HN 34, 
7527 118.569   0.699   8.009 1 U         -3.527e+03  0.00e+00 m   0  555    0  556 0 #N 35,  0, HN 35, 
7528 120.475   0.699   7.554 1 U         -4.345e+03  0.00e+00 m   0  580    0  581 0 #N 36,  0, HN 36, 
7544 118.349   3.035   7.501 1 U         -9.940e+02  0.00e+00 m   0  595    0  596 0 #N 37,  0, HN 37, 
7545 118.349   0.578   7.501 1 U         -3.863e+03  0.00e+00 m   0  595    0  596 0 #N 37,  0, HN 37, 
7546 118.349   0.903   7.501 1 U         -1.476e+03  0.00e+00 m   0  595    0  596 0 #N 37,  0, HN 37, 
7556 121.911   0.579   8.591 1 U         -2.400e+03  0.00e+00 m   0  616    0  617 0 #N 38,  0, HN 38, 
7557 121.911   1.381   8.591 1 U         -1.812e+03  0.00e+00 m   0  616    0  617 0 #N 38,  0, HN 38, 
7569 121.911   2.749   8.591 1 U         -1.063e+03  0.00e+00 m   0  616    0  617 0 #N 38,  0, HN 38, 
7616 121.053   0.874   8.575 1 U         -2.269e+03  0.00e+00 m   0  674    0  675 0 #N 41,  0, HN 41, 
7617 121.053   1.402   8.575 1 U         -1.806e+03  0.00e+00 m   0  674    0  675 0 #N 41,  0, HN 41, 
7628 113.910   7.477   8.024 1 U         -3.068e+03  0.00e+00 m   0  773    0  774 0 #N 45,  0, HN 45, 
7629 113.910   4.124   8.024 1 U         -3.398e+03  0.00e+00 m   0  773    0  774 0 #N 45,  0, HN 45, 
7630 113.910   3.891   8.024 1 U         -1.789e+03  0.00e+00 m   0  773    0  774 0 #N 45,  0, HN 45, 
7633 110.017   3.875   6.926 1 U         -1.058e+03  0.00e+00 m   0  782    0  784 0 #ND2 45,  0, HD22 45, 
7634 110.017   3.189   6.926 1 U         -1.335e+03  0.00e+00 m   0  782    0  784 0 #ND2 45,  0, HD22 45, 
7635 110.017   3.105   6.926 1 U         -1.232e+03  0.00e+00 m   0  782    0  784 0 #ND2 45,  0, HD22 45, 
7636 110.017   2.924   6.926 1 U         -9.350e+02  0.00e+00 m   0  782    0  784 0 #ND2 45,  0, HD22 45, 
7637 110.017   2.016   6.926 1 U         -1.800e+03  0.00e+00 m   0  782    0  784 0 #ND2 45,  0, HD22 45, 
7638 110.017   1.694   6.926 1 U         -3.020e+03  0.00e+00 m   0  782    0  784 0 #ND2 45,  0, HD22 45, 
7639 110.017   2.005   7.588 1 U         -1.741e+03  0.00e+00 m   0  782    0  783 0 #ND2 45,  0, HD21 45, 
7640 110.017   1.704   7.588 1 U         -1.951e+03  0.00e+00 m   0  782    0  783 0 #ND2 45,  0, HD21 45, 
7652 113.910   1.435   8.024 1 U         -3.840e+03  0.00e+00 m   0  773    0  774 0 #N 45,  0, HN 45, 
7653 113.910   0.733   8.024 1 U         -4.186e+03  0.00e+00 m   0  773    0  774 0 #N 45,  0, HN 45, 
7654 113.910   1.746   8.024 1 U         -3.325e+03  0.00e+00 m   0  773    0  774 0 #N 45,  0, HN 45, 
7655 113.910   2.000   8.024 1 U         -3.233e+03  0.00e+00 m   0  773    0  774 0 #N 45,  0, HN 45, 
7671 116.556   4.285   7.204 1 U         -5.648e+03  0.00e+00 m   0  787    0  788 0 #N 46,  0, HN 46, 
7684 125.470   1.831   8.972 1 U         -4.476e+03  0.00e+00 m   0  808    0  809 0 #N 47,  0, HN 47, 
7685 125.470   4.536   8.972 1 U         -2.209e+03  0.00e+00 m   0  808    0  809 0 #N 47,  0, HN 47, 
7704 119.295   4.948   7.817 1 U         -7.317e+03  0.00e+00 m   0  819    0  820 0 #N 48,  0, HN 48, 
7725 119.295   1.153   7.817 1 U         -2.428e+03  0.00e+00 m   0  819    0  820 0 #N 48,  0, HN 48, 
7726 119.295   0.715   7.817 1 U         -1.457e+04  0.00e+00 m   0  819    0  820 0 #N 48,  0, HN 48, 
7732 122.213   1.819   9.092 1 U         -3.630e+03  0.00e+00 m   0  837    0  838 0 #N 49,  0, HN 49, 
7733 122.213   1.158   9.092 1 U         -2.490e+03  0.00e+00 m   0  837    0  838 0 #N 49,  0, HN 49, 
7740 122.213   0.876   9.092 1 U         -2.940e+03  0.00e+00 m   0  837    0  838 0 #N 49,  0, HN 49, 
7747 122.213   8.393   9.092 1 U         -1.431e+03  0.00e+00 m   0  837    0  838 0 #N 49,  0, HN 49, 
7748 122.213   6.894   9.092 1 U         -1.187e+03  0.00e+00 m   0  837    0  838 0 #N 49,  0, HN 49, 
7749 122.213   7.040   9.092 1 U         -1.141e+03  0.00e+00 m   0  837    0  838 0 #N 49,  0, HN 49, 
7750 122.213   7.933   9.092 1 U         -2.386e+03  0.00e+00 m   0  837    0  838 0 #N 49,  0, HN 49, 
7763 122.213   5.721   9.092 1 U         -7.510e+03  0.00e+00 m   0  837    0  838 0 #N 49,  0, HN 49, 
7764 126.797   5.678   8.883 1 U         -7.976e+03  0.00e+00 m   0   87    0   88 0 #N 6,  0, HN 6, 
7792 125.411   0.517   8.574 1 U         -4.590e+03  0.00e+00 m   0  879    0  880 0 #N 51,  0, HN 51, 
7801 125.411   4.460   8.574 1 U         -3.789e+03  0.00e+00 m   0  879    0  880 0 #N 51,  0, HN 51, 
7807 125.411   7.943   8.574 1 U         -2.340e+03  0.00e+00 m   0  879    0  880 0 #N 51,  0, HN 51, 
7808 125.411   9.296   8.574 1 U         -1.888e+03  0.00e+00 m   0  879    0  880 0 #N 51,  0, HN 51, 
7816 126.411   8.726   8.252 1 U         -2.022e+03  0.00e+00 m   0  897    0  898 0 #N 52,  0, HN 52, 
7817 126.411   6.882   8.252 1 U         -2.439e+03  0.00e+00 m   0  897    0  898 0 #N 52,  0, HN 52, 
7822 126.411   5.219   8.252 1 U         -1.942e+03  0.00e+00 m   0  897    0  898 0 #N 52,  0, HN 52, 
7823 126.411   4.584   8.252 1 U         -3.777e+03  0.00e+00 m   0  897    0  898 0 #N 52,  0, HN 52, 
7824 126.411   3.797   8.252 1 U         -2.626e+03  0.00e+00 m   0  897    0  898 0 #N 52,  0, HN 52, 
7825 126.411   3.282   8.252 1 U         -1.488e+03  0.00e+00 m   0  897    0  898 0 #N 52,  0, HN 52, 
7837 126.411   0.885   8.252 1 U         -2.280e+03  0.00e+00 m   0  897    0  898 0 #N 52,  0, HN 52, 
7854 120.527   0.691   8.434 1 U         -9.169e+03  0.00e+00 m   0  922    0  923 0 #N 53,  0, HN 53, 
7861 120.527   1.099   8.434 1 U         -2.033e+03  0.00e+00 m   0  922    0  923 0 #N 53,  0, HN 53, 
7872 120.527   9.300   8.434 1 U         -2.403e+03  0.00e+00 m   0  922    0  923 0 #N 53,  0, HN 53, 
7873 110.368   7.810   8.171 1 U         -1.626e+03  0.00e+00 m   0 1203    0 1204 0 #N 70,  0, HN 70, 
7876 110.368   4.640   8.171 1 U         -2.138e+03  0.00e+00 m   0 1203    0 1204 0 #N 70,  0, HN 70, 
7877 110.368   3.699   8.171 1 U         -1.163e+03  0.00e+00 m   0 1203    0 1204 0 #N 70,  0, HN 70, 
7878 122.165   4.067   7.564 1 U         -5.407e+03  0.00e+00 m   0 1210    0 1211 0 #N 71,  0, HN 71, 
7879 122.165   3.699   7.564 1 U         -3.100e+03  0.00e+00 m   0 1210    0 1211 0 #N 71,  0, HN 71, 
7882 110.368   1.156   8.171 1 U         -1.772e+03  0.00e+00 m   0 1203    0 1204 0 #N 70,  0, HN 70, 
7883 110.368   0.767   8.171 1 U         -1.297e+03  0.00e+00 m   0 1203    0 1204 0 #N 70,  0, HN 70, 
7884 122.165   0.765   7.564 1 U         -1.086e+04  0.00e+00 m   0 1210    0 1211 0 #N 71,  0, HN 71, 
7897 122.165   7.935   7.564 1 U         -3.450e+03  0.00e+00 m   0 1210    0 1211 0 #N 71,  0, HN 71, 
7903 119.550   5.433   7.831 1 U         -1.168e+04  0.00e+00 m   0 1220    0 1221 0 #N 72,  0, HN 72, 
7912 121.224   0.786   8.403 1 U         -7.976e+03  0.00e+00 m   0 1245    0 1246 0 #N 73,  0, HN 73, 
7922 121.224   7.037   8.403 1 U         -1.129e+03  0.00e+00 m   0 1245    0 1246 0 #N 73,  0, HN 73, 
7923 121.224   6.892   8.403 1 U         -2.099e+03  0.00e+00 m   0 1245    0 1246 0 #N 73,  0, HN 73, 
7924 121.224   9.081   8.403 1 U         -1.086e+03  0.00e+00 m   0 1245    0 1246 0 #N 73,  0, HN 73, 
7932 127.786   8.590   7.934 1 U         -2.232e+03  0.00e+00 m   0 1263    0 1264 0 #N 74,  0, HN 74, 
7933 127.786   9.089   7.934 1 U         -2.771e+03  0.00e+00 m   0 1263    0 1264 0 #N 74,  0, HN 74, 
7934 127.786   7.039   7.934 1 U         -1.925e+03  0.00e+00 m   0 1263    0 1264 0 #N 74,  0, HN 74, 
7935 127.786   6.907   7.934 1 U         -1.261e+03  0.00e+00 m   0 1263    0 1264 0 #N 74,  0, HN 74, 
7944 127.786   4.889   7.934 1 U         -6.580e+03  0.00e+00 m   0 1263    0 1264 0 #N 74,  0, HN 74, 
7945 127.786   5.454   7.934 1 U         -1.249e+03  0.00e+00 m   0 1263    0 1264 0 #N 74,  0, HN 74, 
7952 127.786   1.396   7.934 1 U         -1.488e+03  0.00e+00 m   0 1263    0 1264 0 #N 74,  0, HN 74, 
7973 125.496   2.103   8.688 1 U         -1.660e+03  0.00e+00 m   0 1285    0 1286 0 #N 75,  0, HN 75, 
7974 125.496   2.189   8.688 1 U         -1.399e+03  0.00e+00 m   0 1285    0 1286 0 #N 75,  0, HN 75, 
7975 125.496   3.904   8.688 1 U         -1.596e+03  0.00e+00 m   0 1285    0 1286 0 #N 75,  0, HN 75, 
7981 125.496   5.534   8.688 1 U         -8.419e+03  0.00e+00 m   0 1285    0 1286 0 #N 75,  0, HN 75, 
7987 125.496   8.250   8.688 1 U         -2.320e+03  0.00e+00 m   0 1285    0 1286 0 #N 75,  0, HN 75, 
7988 125.496   8.385   8.688 1 U         -2.258e+03  0.00e+00 m   0 1285    0 1286 0 #N 75,  0, HN 75, 
7999 126.349   8.574   9.303 1 U         -2.258e+03  0.00e+00 m   0 1306    0 1307 0 #N 76,  0, HN 76, 
8000 126.349   8.454   9.303 1 U         -8.080e+02  0.00e+00 m   0 1306    0 1307 0 #N 76,  0, HN 76, 
8005 110.744   8.359   7.383 1 U         -1.612e+03  0.00e+00 m   0 1328    0 1329 0 #N 77,  0, HN 77, 
8006 126.349   1.800   9.303 1 U         -2.334e+03  0.00e+00 m   0 1306    0 1307 0 #N 76,  0, HN 76, 
8022 126.349   5.724   9.303 1 U         -3.112e+03  0.00e+00 m   0 1306    0 1307 0 #N 76,  0, HN 76, 
8025 110.744   7.926   7.383 1 U         -9.532e+03  0.00e+00 m   0 1328    0 1329 0 #N 77,  0, HN 77, 
8029 110.744   4.897   7.383 1 U         -5.696e+03  0.00e+00 m   0 1328    0 1329 0 #N 77,  0, HN 77, 
8030 110.744   5.247   7.383 1 U         -2.073e+03  0.00e+00 m   0 1328    0 1329 0 #N 77,  0, HN 77, 
8031 110.744   4.439   7.383 1 U         -2.011e+03  0.00e+00 m   0 1328    0 1329 0 #N 77,  0, HN 77, 
8032 110.744   4.282   7.383 1 U         -1.755e+03  0.00e+00 m   0 1328    0 1329 0 #N 77,  0, HN 77, 
8034 123.489   5.247  10.445 1 U         -5.760e+03  0.00e+00 m   0 1338    0 1339 0 #N 78,  0, HN 78, 
8039 110.744   1.051   7.383 1 U         -5.238e+03  0.00e+00 m   0 1328    0 1329 0 #N 77,  0, HN 77, 
8040 110.744   0.637   7.383 1 U         -1.666e+04  0.00e+00 m   0 1328    0 1329 0 #N 77,  0, HN 77, 
8041 110.744   1.558   7.383 1 U         -2.590e+03  0.00e+00 m   0 1328    0 1329 0 #N 77,  0, HN 77, 
8042 123.489   2.555  10.445 1 U         -2.735e+03  0.00e+00 m   0 1338    0 1339 0 #N 78,  0, HN 78, 
8043 123.489   2.461  10.445 1 U         -1.840e+03  0.00e+00 m   0 1338    0 1339 0 #N 78,  0, HN 78, 
8044 123.489   2.186  10.445 1 U         -3.470e+03  0.00e+00 m   0 1338    0 1339 0 #N 78,  0, HN 78, 
8045 123.489   0.886  10.445 1 U         -1.407e+03  0.00e+00 m   0 1338    0 1339 0 #N 78,  0, HN 78, 
8046 123.489   0.647  10.445 1 U         -1.041e+03  0.00e+00 m   0 1338    0 1339 0 #N 78,  0, HN 78, 
8055 116.864   7.431   8.787 1 U         -4.181e+03  0.00e+00 m   0 1545    0 1546 0 #N 90,  0, HN 90, 
8056 116.864   7.089   8.787 1 U         -1.014e+04  0.00e+00 m   0 1545    0 1546 0 #N 90,  0, HN 90, 
8057 116.864   6.683   8.787 1 U         -1.680e+03  0.00e+00 m   0 1545    0 1546 0 #N 90,  0, HN 90, 
8059 116.864   3.323   8.787 1 U         -5.736e+03  0.00e+00 m   0 1545    0 1546 0 #N 90,  0, HN 90, 
8060 116.864   3.685   8.787 1 U         -4.073e+03  0.00e+00 m   0 1545    0 1546 0 #N 90,  0, HN 90, 
8061 116.864   3.856   8.787 1 U         -3.874e+03  0.00e+00 m   0 1545    0 1546 0 #N 90,  0, HN 90, 
8062 116.864   4.111   8.787 1 U         -3.076e+03  0.00e+00 m   0 1545    0 1546 0 #N 90,  0, HN 90, 
8080 116.864   0.927   8.787 1 U         -5.029e+03  0.00e+00 m   0 1545    0 1546 0 #N 90,  0, HN 90, 
8081 116.864   0.790   8.787 1 U         -4.465e+03  0.00e+00 m   0 1545    0 1546 0 #N 90,  0, HN 90, 
8082 116.864   1.860   8.787 1 U         -3.567e+03  0.00e+00 m   0 1545    0 1546 0 #N 90,  0, HN 90, 
8092 114.684   5.087   8.352 1 U         -1.095e+03  0.00e+00 m   0 1584    0 1585 0 #N 92,  0, HN 92, 
8093 114.684   2.173   8.352 1 U         -2.727e+03  0.00e+00 m   0 1584    0 1585 0 #N 92,  0, HN 92, 
8094 114.684   0.790   8.352 1 U         -6.347e+03  0.00e+00 m   0 1584    0 1585 0 #N 92,  0, HN 92, 
8095 121.254   0.920   7.758 1 U         -3.817e+03  0.00e+00 m   0 1609    0 1610 0 #N 93,  0, HN 93, 
8109 121.254   4.520   7.758 1 U         -2.562e+03  0.00e+00 m   0 1609    0 1610 0 #N 93,  0, HN 93, 
8112 121.254   5.107   7.758 1 U         -1.170e+03  0.00e+00 m   0 1609    0 1610 0 #N 93,  0, HN 93, 
8115 121.254   7.072   7.758 1 U         -8.630e+02  0.00e+00 m   0 1609    0 1610 0 #N 93,  0, HN 93, 
8120 127.911   0.494   8.243 1 U         -2.618e+03  0.00e+00 m   0 1627    0 1628 0 #N 94,  0, HN 94, 
8121 127.911   0.915   8.243 1 U         -5.551e+03  0.00e+00 m   0 1627    0 1628 0 #N 94,  0, HN 94, 
8152 115.873   0.849   8.238 1 U         -2.916e+03  0.00e+00 m   0 1642    0 1643 0 #N 95,  0, HN 95, 
8153 115.873   0.741   8.238 1 U         -1.584e+03  0.00e+00 m   0 1642    0 1643 0 #N 95,  0, HN 95, 
8155 115.873   0.501   8.238 1 U         -3.863e+03  0.00e+00 m   0 1642    0 1643 0 #N 95,  0, HN 95, 
8170 115.873   4.664   8.238 1 U         -9.910e+02  0.00e+00 m   0 1642    0 1643 0 #N 95,  0, HN 95, 
8172 121.684   0.751   8.370 1 U         -1.128e+04  0.00e+00 m   0 1655    0 1656 0 #N 96,  0, HN 96, 
8173 121.684   0.643   8.370 1 U         -8.203e+03  0.00e+00 m   0 1655    0 1656 0 #N 96,  0, HN 96, 
8174 121.684   0.492   8.370 1 U         -4.897e+03  0.00e+00 m   0 1655    0 1656 0 #N 96,  0, HN 96, 
8182 121.684   7.378   8.370 1 U         -1.739e+03  0.00e+00 m   0 1655    0 1656 0 #N 96,  0, HN 96, 
8185 125.251   1.229   8.757 1 U         -1.843e+03  0.00e+00 m   0 1681    0 1682 0 #N 97,  0, HN 97, 
8186 125.251   0.824   8.757 1 U         -4.601e+03  0.00e+00 m   0 1681    0 1682 0 #N 97,  0, HN 97, 
8187 125.251   0.638   8.757 1 U         -4.374e+03  0.00e+00 m   0 1681    0 1682 0 #N 97,  0, HN 97, 
8188 129.536   0.761   7.921 1 U         -1.880e+03  0.00e+00 m   0 1707    0 1708 0 #N 98,  0, HN 98, 
8189 129.536   0.633   7.921 1 U         -3.749e+03  0.00e+00 m   0 1707    0 1708 0 #N 98,  0, HN 98, 
8190 129.536   1.230   7.921 1 U         -1.363e+03  0.00e+00 m   0 1707    0 1708 0 #N 98,  0, HN 98, 
8203 129.536   2.325   7.921 1 U         -7.960e+02  0.00e+00 m   0 1707    0 1708 0 #N 98,  0, HN 98, 
8204 129.536   2.090   7.921 1 U         -1.033e+03  0.00e+00 m   0 1707    0 1708 0 #N 98,  0, HN 98, 
8205 129.536   3.910   7.921 1 U         -1.062e+03  0.00e+00 m   0 1707    0 1708 0 #N 98,  0, HN 98, 
8206 129.536   4.277   7.921 1 U         -5.744e+03  0.00e+00 m   0 1707    0 1708 0 #N 98,  0, HN 98, 
8207 129.536   7.387   7.921 1 U         -6.074e+03  0.00e+00 m   0 1707    0 1708 0 #N 98,  0, HN 98, 
8208 129.536   5.567   7.921 1 U         -1.464e+03  0.00e+00 m   0 1707    0 1708 0 #N 98,  0, HN 98, 
8214 120.610   8.277   9.535 1 U         -1.772e+03  0.00e+00 m   0 1717    0 1718 0 #N 99,  0, HN 99, 
8215 112.292   3.157   6.869 1 U         -9.740e+02  0.00e+00 m   0 1730    0 1731 0 #NE2 99,  0, HE21 99, 
8216 112.292   3.137   7.875 1 U         -1.540e+03  0.00e+00 m   0 1730    0 1732 0 #NE2 99,  0, HE22 99, 
8217 120.610   2.777   9.535 1 U         -2.590e+03  0.00e+00 m   0 1717    0 1718 0 #N 99,  0, HN 99, 
8218 120.610   1.566   9.535 1 U         -1.349e+03  0.00e+00 m   0 1717    0 1718 0 #N 99,  0, HN 99, 
8222 120.610   0.888   9.535 1 U         -1.243e+03  0.00e+00 m   0 1717    0 1718 0 #N 99,  0, HN 99, 
8223 115.767   1.030   7.594 1 U         -6.644e+03  0.00e+00 m   0 1735    0 1736 0 #N 100,  0, HN 100, 
8224 115.767   0.878   7.594 1 U         -4.363e+03  0.00e+00 m   0 1735    0 1736 0 #N 100,  0, HN 100, 
8227 115.767   7.932   7.594 1 U         -4.431e+03  0.00e+00 m   0 1735    0 1736 0 #N 100,  0, HN 100, 
8228 115.767   8.278   7.594 1 U         -5.704e+03  0.00e+00 m   0 1735    0 1736 0 #N 100,  0, HN 100, 
8235 121.254   2.774   8.110 1 U         -4.942e+03  0.00e+00 m   0 1771    0 1772 0 #N 102,  0, HN 102, 
8236 121.254   3.042   8.110 1 U         -2.803e+03  0.00e+00 m   0 1771    0 1772 0 #N 102,  0, HN 102, 
8237 121.254   4.725   8.110 1 U         -2.172e+03  0.00e+00 m   0 1771    0 1772 0 #N 102,  0, HN 102, 
8241 118.801   9.539   8.274 1 U         -1.982e+03  0.00e+00 m   0 1786    0 1787 0 #N 103,  0, HN 103, 
8243 118.801   7.591   8.274 1 U         -5.077e+03  0.00e+00 m   0 1786    0 1787 0 #N 103,  0, HN 103, 
8244 118.801   1.030   8.274 1 U         -2.679e+03  0.00e+00 m   0 1786    0 1787 0 #N 103,  0, HN 103, 
8245 118.801   0.873   8.274 1 U         -2.819e+03  0.00e+00 m   0 1786    0 1787 0 #N 103,  0, HN 103, 
8247 117.960   1.045   7.933 1 U         -5.085e+03  0.00e+00 m   0 1801    0 1802 0 #N 104,  0, HN 104, 
8266 118.293   0.869   8.200 1 U         -1.769e+03  0.00e+00 m   0 1844    0 1845 0 #N 106,  0, HN 106, 
8267 118.293   0.682   8.200 1 U         -1.173e+03  0.00e+00 m   0 1844    0 1845 0 #N 106,  0, HN 106, 
8268 118.293   1.456   8.200 1 U         -3.486e+03  0.00e+00 m   0 1844    0 1845 0 #N 106,  0, HN 106, 
8269 118.293   2.121   8.200 1 U         -3.993e+03  0.00e+00 m   0 1844    0 1845 0 #N 106,  0, HN 106, 
8270 122.064   0.873   7.751 1 U         -4.902e+03  0.00e+00 m   0 1855    0 1856 0 #N 107,  0, HN 107, 
8271 122.064   0.766   7.751 1 U         -3.965e+03  0.00e+00 m   0 1855    0 1856 0 #N 107,  0, HN 107, 
8272 122.064   0.673   7.751 1 U         -2.079e+03  0.00e+00 m   0 1855    0 1856 0 #N 107,  0, HN 107, 
8273 122.064   2.082   7.751 1 U         -4.527e+03  0.00e+00 m   0 1855    0 1856 0 #N 107,  0, HN 107, 
8295 117.788   0.355   8.310 1 U         -1.684e+03  0.00e+00 m   0 1865    0 1866 0 #N 108,  0, HN 108, 
8296 117.788   0.100   8.310 1 U         -1.096e+03  0.00e+00 m   0 1865    0 1866 0 #N 108,  0, HN 108, 
8297 117.788   0.746   8.310 1 U         -5.576e+03  0.00e+00 m   0 1865    0 1866 0 #N 108,  0, HN 108, 
8317 117.849   1.449   8.039 1 U         -2.082e+03  0.00e+00 m   0 1883    0 1884 0 #N 109,  0, HN 109, 
8320 117.849   0.364   8.039 1 U         -1.039e+03  0.00e+00 m   0 1883    0 1884 0 #N 109,  0, HN 109, 
8323 119.474   1.737   8.077 1 U         -1.636e+03  0.00e+00 m   0 1913    0 1914 0 #N 111,  0, HN 111, 
8324 119.474   1.454   8.077 1 U         -1.911e+03  0.00e+00 m   0 1913    0 1914 0 #N 111,  0, HN 111, 
8329 119.474   0.849   8.077 1 U         -5.150e+03  0.00e+00 m   0 1913    0 1914 0 #N 111,  0, HN 111, 
8330 119.474   0.643   8.077 1 U         -2.723e+03  0.00e+00 m   0 1913    0 1914 0 #N 111,  0, HN 111, 
8331 119.474   0.369   8.077 1 U         -4.414e+03  0.00e+00 m   0 1913    0 1914 0 #N 111,  0, HN 111, 
8358 116.972   0.872   8.144 1 U         -3.394e+03  0.00e+00 m   0 1936    0 1937 0 #N 112,  0, HN 112, 
8360 116.972   1.921   8.144 1 U         -1.472e+03  0.00e+00 m   0 1936    0 1937 0 #N 112,  0, HN 112, 
8368 107.849   1.737   8.146 1 U         -1.492e+03  0.00e+00 m   0 2005    0 2006 0 #N 116,  0, HN 116, 
8370 107.849   7.048   8.146 1 U         -7.410e+02  0.00e+00 m   0 2005    0 2006 0 #N 116,  0, HN 116, 
8371 122.990   0.653   8.247 1 U         -1.500e+03  0.00e+00 m   0 1455    0 1456 0 #N 86,  0, HN 86, 
8372 122.990   1.110   8.247 1 U         -2.498e+03  0.00e+00 m   0 1455    0 1456 0 #N 86,  0, HN 86, 
8410 114.134   1.853   7.786 1 U         -1.431e+03  0.00e+00 m   0 1445    0 1446 0 #N 85,  0, HN 85, 
8411 114.134   1.674   7.786 1 U         -2.349e+03  0.00e+00 m   0 1445    0 1446 0 #N 85,  0, HN 85, 
8412 114.134   0.794   7.786 1 U         -2.679e+03  0.00e+00 m   0 1445    0 1446 0 #N 85,  0, HN 85, 
8430 118.230   3.896   7.306 1 U         -7.226e+03  0.00e+00 m   0 1409    0 1410 0 #N 83,  0, HN 83, 
8431 118.230   4.023   7.306 1 U         -1.568e+03  0.00e+00 m   0 1409    0 1410 0 #N 83,  0, HN 83, 
8432 118.230   3.287   7.306 1 U         -8.520e+02  0.00e+00 m   0 1409    0 1410 0 #N 83,  0, HN 83, 
8433 118.230   3.045   7.306 1 U         -1.534e+03  0.00e+00 m   0 1409    0 1410 0 #N 83,  0, HN 83, 
8440 122.564   1.532   7.643 1 U         -2.025e+03  0.00e+00 m   0 1388    0 1389 0 #N 82,  0, HN 82, 
8449 115.148   2.292   7.072 1 U         -1.570e+03  0.00e+00 m   0 1383    0 1384 0 #ND2 81,  0, HD21 81, 
8456 117.620   1.707   8.684 1 U         -1.705e+03  0.00e+00 m   0 1374    0 1375 0 #N 81,  0, HN 81, 
8457 117.620   2.167   8.684 1 U         -2.900e+03  0.00e+00 m   0 1374    0 1375 0 #N 81,  0, HN 81, 
8458 117.620   3.685   8.684 1 U         -1.798e+03  0.00e+00 m   0 1374    0 1375 0 #N 81,  0, HN 81, 
8460 127.224   3.156   9.348 1 U         -1.954e+03  0.00e+00 m   0 1359    0 1360 0 #N 80,  0, HN 80, 
8462 127.224   1.557   9.348 1 U         -1.454e+03  0.00e+00 m   0 1359    0 1360 0 #N 80,  0, HN 80, 
8466 121.905   2.181   7.880 1 U         -6.218e+03  0.00e+00 m   0 1348    0 1349 0 #N 79,  0, HN 79, 
8468 121.905   3.290   7.880 1 U         -3.624e+03  0.00e+00 m   0 1348    0 1349 0 #N 79,  0, HN 79, 
8469 121.905   5.241   7.880 1 U         -5.294e+03  0.00e+00 m   0 1348    0 1349 0 #N 79,  0, HN 79, 
8488 117.220   0.719   7.673 1 U         -1.880e+03  0.00e+00 m   0 1099    0 1100 0 #N 64,  0, HN 64, 
8489 117.220   0.817   7.673 1 U         -4.374e+03  0.00e+00 m   0 1099    0 1100 0 #N 64,  0, HN 64, 
8505 114.091   1.668   7.675 1 U         -3.418e+03  0.00e+00 m   0 1137    0 1138 0 #NE2 65,  0, HE21 65, 
8506 114.091   1.391   7.675 1 U         -2.383e+03  0.00e+00 m   0 1137    0 1138 0 #NE2 65,  0, HE21 65, 
8507 114.091   0.883   7.675 1 U         -2.346e+03  0.00e+00 m   0 1137    0 1138 0 #NE2 65,  0, HE21 65, 
8508 114.091   0.714   7.675 1 U         -1.682e+03  0.00e+00 m   0 1137    0 1138 0 #NE2 65,  0, HE21 65, 
8509 114.091   1.661   7.070 1 U         -3.647e+03  0.00e+00 m   0 1137    0 1139 0 #NE2 65,  0, HE22 65, 
8510 114.091   1.400   7.070 1 U         -3.369e+03  0.00e+00 m   0 1137    0 1139 0 #NE2 65,  0, HE22 65, 
8511 114.091   0.907   7.070 1 U         -1.327e+03  0.00e+00 m   0 1137    0 1139 0 #NE2 65,  0, HE22 65, 
8512 114.091   0.709   7.070 1 U         -1.443e+03  0.00e+00 m   0 1137    0 1139 0 #NE2 65,  0, HE22 65, 
8513 114.597   0.835   7.404 1 U         -4.635e+03  0.00e+00 m   0 1124    0 1125 0 #N 65,  0, HN 65, 
8514 114.597   0.709   7.404 1 U         -5.134e+03  0.00e+00 m   0 1124    0 1125 0 #N 65,  0, HN 65, 
8515 114.597   0.550   7.404 1 U         -2.309e+03  0.00e+00 m   0 1124    0 1125 0 #N 65,  0, HN 65, 
8516 114.597   0.047   7.404 1 U         -1.423e+03  0.00e+00 m   0 1124    0 1125 0 #N 65,  0, HN 65, 
8517 114.091   4.044   7.675 1 U         -2.618e+03  0.00e+00 m   0 1137    0 1138 0 #NE2 65,  0, HE21 65, 
8518 114.091   4.049   7.070 1 U         -2.448e+03  0.00e+00 m   0 1137    0 1139 0 #NE2 65,  0, HE22 65, 
8519 114.091   2.896   7.070 1 U         -1.931e+03  0.00e+00 m   0 1137    0 1139 0 #NE2 65,  0, HE22 65, 
8522 120.063   0.550   8.655 1 U         -2.144e+03  0.00e+00 m   0 1142    0 1143 0 #N 66,  0, HN 66, 
8523 120.063   1.819   8.655 1 U         -2.246e+03  0.00e+00 m   0 1142    0 1143 0 #N 66,  0, HN 66, 
8541 124.060   0.685   8.445 1 U         -1.823e+03  0.00e+00 m   0  935    0  936 0 #N 54,  0, HN 54, 
8542 124.060   2.967   8.445 1 U         -2.554e+03  0.00e+00 m   0  935    0  936 0 #N 54,  0, HN 54, 
8549 121.687   0.877   8.268 1 U         -1.879e+04  0.00e+00 m   0  950    0  951 0 #N 55,  0, HN 55, 
8550 121.687   0.692   8.268 1 U         -3.084e+03  0.00e+00 m   0  950    0  951 0 #N 55,  0, HN 55, 
8557 124.060   5.228   8.445 1 U         -1.265e+03  0.00e+00 m   0  935    0  936 0 #N 54,  0, HN 54, 
8558 124.060   6.147   8.445 1 U         -1.267e+03  0.00e+00 m   0  935    0  936 0 #N 54,  0, HN 54, 
8565 127.275   0.883   8.639 1 U         -6.628e+03  0.00e+00 m   0  961    0  962 0 #N 56,  0, HN 56, 
8566 127.275   0.774   8.639 1 U         -1.829e+03  0.00e+00 m   0  961    0  962 0 #N 56,  0, HN 56, 
8567 127.275   0.666   8.639 1 U         -1.783e+03  0.00e+00 m   0  961    0  962 0 #N 56,  0, HN 56, 
8568 127.275   2.121   8.639 1 U         -1.610e+03  0.00e+00 m   0  961    0  962 0 #N 56,  0, HN 56, 
8569 127.275   2.312   8.639 1 U         -1.198e+03  0.00e+00 m   0  961    0  962 0 #N 56,  0, HN 56, 
8572 115.830   2.983   7.777 1 U         -2.420e+03  0.00e+00 m   0 1001    0 1002 0 #N 58,  0, HN 58, 
8587 115.830   1.851   7.777 1 U         -4.311e+03  0.00e+00 m   0 1001    0 1002 0 #N 58,  0, HN 58, 
8588 115.830   1.614   7.777 1 U         -2.707e+03  0.00e+00 m   0 1001    0 1002 0 #N 58,  0, HN 58, 
8589 115.830   0.877   7.777 1 U         -1.988e+03  0.00e+00 m   0 1001    0 1002 0 #N 58,  0, HN 58, 
8590 115.830   0.787   7.777 1 U         -1.267e+03  0.00e+00 m   0 1001    0 1002 0 #N 58,  0, HN 58, 
8591 115.830   0.678   7.777 1 U         -1.580e+03  0.00e+00 m   0 1001    0 1002 0 #N 58,  0, HN 58, 
8592 115.830   0.574   7.777 1 U         -1.279e+03  0.00e+00 m   0 1001    0 1002 0 #N 58,  0, HN 58, 
8610 120.077   2.134   7.654 1 U         -1.295e+03  0.00e+00 m   0 1011    0 1012 0 #N 59,  0, HN 59, 
8646 126.901   5.160   8.577 1 U         -8.544e+03  0.00e+00 m   0  464    0  465 0 #N 29,  0, HN 29, 
8650 125.496   0.738   8.688 1 U         -8.351e+03  0.00e+00 m   0 1285    0 1286 0 #N 75,  0, HN 75, 
8651 126.349   0.898   9.303 1 U         -2.300e+03  0.00e+00 m   0 1306    0 1307 0 #N 76,  0, HN 76, 
8652 121.905   0.857   7.880 1 U         -4.113e+03  0.00e+00 m   0 1348    0 1349 0 #N 79,  0, HN 79, 
8653 121.905   0.783   7.880 1 U         -1.526e+03  0.00e+00 m   0 1348    0 1349 0 #N 79,  0, HN 79, 
8654 121.905   0.642   7.880 1 U         -1.723e+03  0.00e+00 m   0 1348    0 1349 0 #N 79,  0, HN 79, 
8657 121.905   4.401   7.880 1 U         -3.128e+03  0.00e+00 m   0 1348    0 1349 0 #N 79,  0, HN 79, 
8669 116.693   1.038   8.857 1 U         -7.150e+02  0.00e+00 m   0 1746    0 1747 0 #N 101,  0, HN 101, 
8670 116.693   0.842   8.857 1 U         -1.381e+03  0.00e+00 m   0 1746    0 1747 0 #N 101,  0, HN 101, 
8671 116.693   2.119   8.857 1 U         -1.445e+03  0.00e+00 m   0 1746    0 1747 0 #N 101,  0, HN 101, 
8681 118.801   4.748   8.274 1 U         -1.988e+03  0.00e+00 m   0 1786    0 1787 0 #N 103,  0, HN 103, 
8704 117.960   9.544   7.933 1 U         -9.820e+02  0.00e+00 m   0 1801    0 1802 0 #N 104,  0, HN 104, 
8728 120.475   2.382   7.554 1 U         -1.654e+03  0.00e+00 m   0  580    0  581 0 #N 36,  0, HN 36, 
8729 120.475   1.798   7.554 1 U         -2.538e+03  0.00e+00 m   0  580    0  581 0 #N 36,  0, HN 36, 
8731 120.475   3.016   7.554 1 U         -3.692e+03  0.00e+00 m   0  580    0  581 0 #N 36,  0, HN 36, 
8732 118.349   1.804   7.501 1 U         -1.660e+03  0.00e+00 m   0  595    0  596 0 #N 37,  0, HN 37, 
8733 118.349   1.675   7.501 1 U         -2.048e+03  0.00e+00 m   0  595    0  596 0 #N 37,  0, HN 37, 
8754 121.911   2.670   8.591 1 U         -1.004e+03  0.00e+00 m   0  616    0  617 0 #N 38,  0, HN 38, 
8763 118.381   0.718   8.068 1 U         -6.259e+03  0.00e+00 m   0  648    0  649 0 #N 40,  0, HN 40, 
8807 115.504   7.211   8.069 1 U         -1.832e+03  0.00e+00 m   0  747    0  748 0 #N 44,  0, HN 44, 
8809 115.504   4.040   8.069 1 U         -3.305e+03  0.00e+00 m   0  747    0  748 0 #N 44,  0, HN 44, 
8810 115.504   4.149   8.069 1 U         -4.368e+03  0.00e+00 m   0  747    0  748 0 #N 44,  0, HN 44, 
8811 115.504   0.727   8.069 1 U         -1.701e+03  0.00e+00 m   0  747    0  748 0 #N 44,  0, HN 44, 
8820 116.556   1.661   7.204 1 U         -1.185e+03  0.00e+00 m   0  787    0  788 0 #N 46,  0, HN 46, 
8822 116.556   1.974   7.204 1 U         -1.035e+03  0.00e+00 m   0  787    0  788 0 #N 46,  0, HN 46, 
8823 116.556   2.090   7.204 1 U         -1.363e+03  0.00e+00 m   0  787    0  788 0 #N 46,  0, HN 46, 
8837 126.474   8.574   8.393 1 U         -1.319e+03  0.00e+00 m   0   69    0   70 0 #N 5,  0, HN 5, 
8852 120.077   0.893   7.654 1 U         -5.110e+03  0.00e+00 m   0 1011    0 1012 0 #N 59,  0, HN 59, 
8865 126.797   2.130   8.883 1 U         -1.783e+03  0.00e+00 m   0   87    0   88 0 #N 6,  0, HN 6, 
8866 126.797   1.989   8.883 1 U         -1.448e+03  0.00e+00 m   0   87    0   88 0 #N 6,  0, HN 6, 
8874 120.392   0.802   7.772 1 U         -2.386e+03  0.00e+00 m   0 1042    0 1043 0 #N 61,  0, HN 61, 
8875 120.392   0.671   7.772 1 U         -3.377e+03  0.00e+00 m   0 1042    0 1043 0 #N 61,  0, HN 61, 
8876 120.392   0.541   7.772 1 U         -2.116e+03  0.00e+00 m   0 1042    0 1043 0 #N 61,  0, HN 61, 
8882 118.610   0.711   8.117 1 U         -4.965e+03  0.00e+00 m   0 1057    0 1058 0 #N 62,  0, HN 62, 
8930 119.241   2.178   8.575 1 U         -1.183e+03  0.00e+00 m   0 1078    0 1079 0 #N 63,  0, HN 63, 
8933 119.241   0.690   8.575 1 U         -2.859e+03  0.00e+00 m   0 1078    0 1079 0 #N 63,  0, HN 63, 
8934 119.241   0.770   8.575 1 U         -5.849e+03  0.00e+00 m   0 1078    0 1079 0 #N 63,  0, HN 63, 
8945 114.091   2.737   7.675 1 U         -1.562e+03  0.00e+00 m   0 1137    0 1138 0 #NE2 65,  0, HE21 65, 
8946 114.091   2.737   7.070 1 U         -2.101e+03  0.00e+00 m   0 1137    0 1139 0 #NE2 65,  0, HE22 65, 
8947 114.091   1.866   7.070 1 U         -1.662e+03  0.00e+00 m   0 1137    0 1139 0 #NE2 65,  0, HE22 65, 
8948 114.091   1.884   7.675 1 U         -1.470e+03  0.00e+00 m   0 1137    0 1138 0 #NE2 65,  0, HE21 65, 
8949 120.063   0.046   8.655 1 U         -9.180e+02  0.00e+00 m   0 1142    0 1143 0 #N 66,  0, HN 66, 
8950 121.130   0.039   8.316 1 U         -2.522e+03  0.00e+00 m   0 1160    0 1161 0 #N 67,  0, HN 67, 
8973 121.130   2.699   8.316 1 U         -1.140e+03  0.00e+00 m   0 1160    0 1161 0 #N 67,  0, HN 67, 
8996 112.915   0.721   7.932 1 U         -2.351e+03  0.00e+00 m   0 1193    0 1194 0 #N 69,  0, HN 69, 
8997 112.915   1.817   7.932 1 U         -1.363e+03  0.00e+00 m   0 1193    0 1194 0 #N 69,  0, HN 69, 
8998 112.915   1.142   7.932 1 U         -1.041e+03  0.00e+00 m   0 1193    0 1194 0 #N 69,  0, HN 69, 
8999 112.915   0.815   7.932 1 U         -2.650e+03  0.00e+00 m   0 1193    0 1194 0 #N 69,  0, HN 69, 
9000 112.915   3.892   7.932 1 U         -1.931e+03  0.00e+00 m   0 1193    0 1194 0 #N 69,  0, HN 69, 
9001 112.915   7.695   7.932 1 U         -1.674e+03  0.00e+00 m   0 1193    0 1194 0 #N 69,  0, HN 69, 
9002 112.915   7.571   7.932 1 U         -3.337e+03  0.00e+00 m   0 1193    0 1194 0 #N 69,  0, HN 69, 
9010 130.099   0.743   8.725 1 U         -7.044e+03  0.00e+00 m   0  110    0  111 0 #N 7,  0, HN 7, 
9015 115.631   0.729   8.116 1 U         -2.011e+03  0.00e+00 m   0  132    0  133 0 #N 8,  0, HN 8, 
9049 123.489   2.891  10.445 1 U         -1.399e+03  0.00e+00 m   0 1338    0 1339 0 #N 78,  0, HN 78, 
9055 121.905   7.654   7.880 1 U         -1.275e+03  0.00e+00 m   0 1348    0 1349 0 #N 79,  0, HN 79, 
9057 121.905   2.564   7.880 1 U         -3.550e+03  0.00e+00 m   0 1348    0 1349 0 #N 79,  0, HN 79, 
9063 115.148   4.798   8.035 1 U         -8.214e+03  0.00e+00 m   0 1383    0 1385 0 #ND2 81,  0, HD22 81, 
9072 122.564   2.065   7.643 1 U         -3.902e+03  0.00e+00 m   0 1388    0 1389 0 #N 82,  0, HN 82, 
9073 122.564   2.461   7.643 1 U         -2.130e+03  0.00e+00 m   0 1388    0 1389 0 #N 82,  0, HN 82, 
9074 122.564   0.639   7.643 1 U         -1.766e+03  0.00e+00 m   0 1388    0 1389 0 #N 82,  0, HN 82, 
9102 117.620   4.749   8.684 1 U         -4.425e+03  0.00e+00 m   0 1374    0 1375 0 #N 81,  0, HN 81, 
9121 122.990   1.835   8.247 1 U         -1.666e+03  0.00e+00 m   0 1455    0 1456 0 #N 86,  0, HN 86, 
9134  83.361   7.167   7.167 1 U         -3.636e+04  0.00e+00 m   0 1492 1493 1493 0 #NE 87, HE 87, HE 87, 
9135  83.361   4.268   7.167 1 U         -1.359e+03  0.00e+00 m   0 1492    0 1493 0 #NE 87,  0, HE 87, 
9136  83.361   3.143   7.167 1 U         -7.248e+03  0.00e+00 m   0 1492    0 1493 0 #NE 87,  0, HE 87, 
9137  83.361   2.291   7.167 1 U         -1.894e+03  0.00e+00 m   0 1492    0 1493 0 #NE 87,  0, HE 87, 
9138  83.361   2.029   7.167 1 U         -1.381e+03  0.00e+00 m   0 1492    0 1493 0 #NE 87,  0, HE 87, 
9139  83.361   1.888   7.167 1 U         -1.191e+03  0.00e+00 m   0 1492    0 1493 0 #NE 87,  0, HE 87, 
9140  83.361   1.554   7.167 1 U         -5.142e+03  0.00e+00 m   0 1492    0 1493 0 #NE 87,  0, HE 87, 
9144 118.724   1.108   8.153 1 U         -4.760e+03  0.00e+00 m   0 1476    0 1477 0 #N 87,  0, HN 87, 
9156 121.254   2.933   7.758 1 U         -6.210e+03  0.00e+00 m   0 1609    0 1610 0 #N 93,  0, HN 93, 
9157 127.911   4.682   8.243 1 U         -2.005e+03  0.00e+00 m   0 1627    0 1628 0 #N 94,  0, HN 94, 
9170  84.070   7.416   7.416 1 U         -2.166e+04  0.00e+00 m   0 1671 1672 1672 0 #NE 96, HE 96, HE 96, 
9171  84.070   3.232   7.416 1 U         -3.313e+03  0.00e+00 m   0 1671    0 1672 0 #NE 96,  0, HE 96, 
9172  84.070   3.072   7.416 1 U         -3.217e+03  0.00e+00 m   0 1671    0 1672 0 #NE 96,  0, HE 96, 
9173  84.070   1.585   7.416 1 U         -3.817e+03  0.00e+00 m   0 1671    0 1672 0 #NE 96,  0, HE 96, 
9174  84.070   1.705   7.416 1 U         -1.979e+03  0.00e+00 m   0 1671    0 1672 0 #NE 96,  0, HE 96, 
9175  84.070   1.458   7.416 1 U         -1.104e+03  0.00e+00 m   0 1671    0 1672 0 #NE 96,  0, HE 96, 
9176  84.070   0.841   7.416 1 U         -1.470e+03  0.00e+00 m   0 1671    0 1672 0 #NE 96,  0, HE 96, 
9194 130.099   1.343   8.725 1 U         -1.518e+03  0.00e+00 m   0  110    0  111 0 #N 7,  0, HN 7, 
9200 115.631   8.835   8.116 1 U         -2.431e+03  0.00e+00 m   0  132    0  133 0 #N 8,  0, HN 8, 
9201 115.631   6.875   8.116 1 U         -1.914e+03  0.00e+00 m   0  132    0  133 0 #N 8,  0, HN 8, 
9205 115.631   5.497   8.116 1 U         -8.601e+03  0.00e+00 m   0  132    0  133 0 #N 8,  0, HN 8, 
9206 115.631   5.225   8.116 1 U         -1.703e+03  0.00e+00 m   0  132    0  133 0 #N 8,  0, HN 8, 
9209 115.631   1.931   8.116 1 U         -1.355e+03  0.00e+00 m   0  132    0  133 0 #N 8,  0, HN 8, 
9211 121.660   0.893   8.287 1 U         -1.443e+04  0.00e+00 m   0  153    0  154 0 #N 10,  0, HN 10, 
9212 118.290   4.303   8.318 1 U         -2.900e+03  0.00e+00 m   0  142    0  143 0 #N 9,  0, HN 9, 
9213 121.687   4.298   8.268 1 U         -2.767e+03  0.00e+00 m   0  950    0  951 0 #N 55,  0, HN 55, 
9237 119.194   8.307   8.121 1 U         -2.241e+03  0.00e+00 m   0  239    0  240 0 #N 15,  0, HN 15, 
9238 119.136   1.114   7.792 1 U         -1.582e+03  0.00e+00 m   0  254    0  255 0 #N 16,  0, HN 16, 
9239 119.295   0.995   7.817 1 U         -3.732e+03  0.00e+00 m   0  819    0  820 0 #N 48,  0, HN 48, 
9240 119.295   0.854   7.817 1 U         -3.840e+03  0.00e+00 m   0  819    0  820 0 #N 48,  0, HN 48, 
9248 115.233   8.100   8.534 1 U         -1.741e+03  0.00e+00 m   0  287    0  288 0 #N 18,  0, HN 18, 
9263 120.493   0.202   7.794 1 U         -1.204e+03  0.00e+00 m   0  322    0  323 0 #N 20,  0, HN 20, 
9264 120.493   0.105   7.794 1 U         -1.086e+03  0.00e+00 m   0  322    0  323 0 #N 20,  0, HN 20, 
9273 117.677   1.887   7.934 1 U         -2.992e+03  0.00e+00 m   0  357    0  358 0 #N 22,  0, HN 22, 
9275 117.677   0.654   7.934 1 U         -3.823e+03  0.00e+00 m   0  357    0  358 0 #N 22,  0, HN 22, 
9276 119.558   1.174   8.185 1 U         -1.417e+03  0.00e+00 m   0  372    0  373 0 #N 23,  0, HN 23, 
9277 113.767   1.545   7.868 1 U         -1.458e+03  0.00e+00 m   0  387    0  388 0 #N 24,  0, HN 24, 
9283 113.767   4.204   7.868 1 U         -2.130e+03  0.00e+00 m   0  387    0  388 0 #N 24,  0, HN 24, 
9284 113.767   4.108   7.868 1 U         -1.610e+03  0.00e+00 m   0  387    0  388 0 #N 24,  0, HN 24, 
9285 119.558   7.694   8.185 1 U         -2.490e+03  0.00e+00 m   0  372    0  373 0 #N 23,  0, HN 23, 
9289 113.767   8.070   7.868 1 U         -4.215e+03  0.00e+00 m   0  387    0  388 0 #N 24,  0, HN 24, 
9295 118.211   1.177   8.076 1 U         -2.235e+03  0.00e+00 m   0  409    0  410 0 #N 26,  0, HN 26, 
9296 118.211   4.095   8.076 1 U         -4.152e+03  0.00e+00 m   0  409    0  410 0 #N 26,  0, HN 26, 
9304 126.901   0.756   8.577 1 U         -2.351e+03  0.00e+00 m   0  464    0  465 0 #N 29,  0, HN 29, 
9310 122.434   0.683   8.132 1 U         -1.048e+03  0.00e+00 m   0  505    0  506 0 #N 32,  0, HN 32, 
9311 123.428   1.907   8.406 1 U         -2.667e+03  0.00e+00 m   0  530    0  531 0 #N 34,  0, HN 34, 
9334 123.428   2.859   8.406 1 U         -8.400e+02  0.00e+00 m   0  530    0  531 0 #N 34,  0, HN 34, 
9370 115.504   8.328   8.069 1 U         -2.394e+03  0.00e+00 m   0  747    0  748 0 #N 44,  0, HN 44, 
9381 125.470   1.762   8.972 1 U         -2.719e+03  0.00e+00 m   0  808    0  809 0 #N 47,  0, HN 47, 
9382 119.295   4.108   7.817 1 U         -4.931e+03  0.00e+00 m   0  819    0  820 0 #N 48,  0, HN 48, 
9396 119.295   1.420   7.817 1 U         -1.241e+03  0.00e+00 m   0  819    0  820 0 #N 48,  0, HN 48, 
9408 125.411   1.458   8.574 1 U         -1.405e+03  0.00e+00 m   0  879    0  880 0 #N 51,  0, HN 51, 
9421 120.527   5.232   8.434 1 U         -1.725e+03  0.00e+00 m   0  922    0  923 0 #N 53,  0, HN 53, 
9430 124.060   4.710   8.445 1 U         -4.090e+03  0.00e+00 m   0  935    0  936 0 #N 54,  0, HN 54, 
9436 127.275   7.665   8.639 1 U         -1.018e+03  0.00e+00 m   0  961    0  962 0 #N 56,  0, HN 56, 
9455 119.516   3.845   8.378 1 U         -1.357e+03  0.00e+00 m   0  986    0  987 0 #N 57,  0, HN 57, 
9456 119.516   4.724   8.378 1 U         -3.394e+03  0.00e+00 m   0  986    0  987 0 #N 57,  0, HN 57, 
9458 115.830   4.721   7.777 1 U         -1.011e+03  0.00e+00 m   0 1001    0 1002 0 #N 58,  0, HN 58, 
9459 119.516   7.935   8.378 1 U         -1.279e+03  0.00e+00 m   0  986    0  987 0 #N 57,  0, HN 57, 
9467 120.077   3.989   7.654 1 U         -1.612e+03  0.00e+00 m   0 1011    0 1012 0 #N 59,  0, HN 59, 
9477 114.178   8.374   7.933 1 U         -1.494e+03  0.00e+00 m   0 1032    0 1033 0 #N 60,  0, HN 60, 
9478 114.178   8.604   7.933 1 U         -1.144e+03  0.00e+00 m   0 1032    0 1033 0 #N 60,  0, HN 60, 
9481 114.178   2.152   7.933 1 U         -2.246e+03  0.00e+00 m   0 1032    0 1033 0 #N 60,  0, HN 60, 
9482 114.178   1.474   7.933 1 U         -2.471e+03  0.00e+00 m   0 1032    0 1033 0 #N 60,  0, HN 60, 
9483 114.178   0.527   7.933 1 U         -2.751e+03  0.00e+00 m   0 1032    0 1033 0 #N 60,  0, HN 60, 
9490 118.610   1.472   8.117 1 U         -1.161e+03  0.00e+00 m   0 1057    0 1058 0 #N 62,  0, HN 62, 
9496 117.220   2.186   7.673 1 U         -1.275e+03  0.00e+00 m   0 1099    0 1100 0 #N 64,  0, HN 64, 
9504 114.597   7.070   7.404 1 U         -1.568e+03  0.00e+00 m   0 1124    0 1125 0 #N 65,  0, HN 65, 
9511 120.063   0.690   8.655 1 U         -4.266e+03  0.00e+00 m   0 1142    0 1143 0 #N 66,  0, HN 66, 
9525 122.165   0.696   7.564 1 U         -3.766e+03  0.00e+00 m   0 1210    0 1211 0 #N 71,  0, HN 71, 
9526 122.165   0.857   7.564 1 U         -1.792e+03  0.00e+00 m   0 1210    0 1211 0 #N 71,  0, HN 71, 
9530 119.550   9.104   7.831 1 U         -3.993e+03  0.00e+00 m   0 1220    0 1221 0 #N 72,  0, HN 72, 
9531 119.550   2.373   7.831 1 U         -4.255e+03  0.00e+00 m   0 1220    0 1221 0 #N 72,  0, HN 72, 
9544 121.224   4.881   8.403 1 U         -1.626e+03  0.00e+00 m   0 1245    0 1246 0 #N 73,  0, HN 73, 
9564 110.744   1.240   7.383 1 U         -1.325e+03  0.00e+00 m   0 1328    0 1329 0 #N 77,  0, HN 77, 
9565 110.744   1.644   7.383 1 U         -1.369e+03  0.00e+00 m   0 1328    0 1329 0 #N 77,  0, HN 77, 
9566 123.489   4.408  10.445 1 U         -2.218e+03  0.00e+00 m   0 1338    0 1339 0 #N 78,  0, HN 78, 
9576 123.489   3.033  10.445 1 U         -9.450e+02  0.00e+00 m   0 1338    0 1339 0 #N 78,  0, HN 78, 
9589 117.620   0.805   8.684 1 U         -1.045e+03  0.00e+00 m   0 1374    0 1375 0 #N 81,  0, HN 81, 
9591 115.148   2.300   8.035 1 U         -1.117e+03  0.00e+00 m   0 1383    0 1385 0 #ND2 81,  0, HD22 81, 
9611 117.379   1.696   8.160 1 U         -1.087e+03  0.00e+00 m   0 1430    0 1431 0 #N 84,  0, HN 84, 
9621 118.724   8.784   8.153 1 U         -1.301e+03  0.00e+00 m   0 1476    0 1477 0 #N 87,  0, HN 87, 
9623 114.597   8.793   7.436 1 U         -3.024e+03  0.00e+00 m   0 1502    0 1503 0 #N 88,  0, HN 88, 
9628 116.894   5.110   7.701 1 U         -1.680e+03  0.00e+00 m   0 1527    0 1528 0 #N 89,  0, HN 89, 
9632 110.363   4.017   7.095 1 U         -1.363e+03  0.00e+00 m   0 1540    0 1541 0 #NE2 89,  0, HE21 89, 
9633 110.363   4.021   6.701 1 U         -1.536e+03  0.00e+00 m   0 1540    0 1542 0 #NE2 89,  0, HE22 89, 
9636 116.894   0.915   7.701 1 U         -1.772e+03  0.00e+00 m   0 1527    0 1528 0 #N 89,  0, HN 89, 
9637 116.894   0.786   7.701 1 U         -1.484e+03  0.00e+00 m   0 1527    0 1528 0 #N 89,  0, HN 89, 
9647 116.864   1.968   8.787 1 U         -1.512e+03  0.00e+00 m   0 1545    0 1546 0 #N 90,  0, HN 90, 
9649 116.864   4.531   8.787 1 U         -1.383e+03  0.00e+00 m   0 1545    0 1546 0 #N 90,  0, HN 90, 
9654 114.684   2.930   8.352 1 U         -2.530e+03  0.00e+00 m   0 1584    0 1585 0 #N 92,  0, HN 92, 
9655 114.684   3.993   8.352 1 U         -1.147e+03  0.00e+00 m   0 1584    0 1585 0 #N 92,  0, HN 92, 
9656 114.684   0.736   8.352 1 U         -2.042e+03  0.00e+00 m   0 1584    0 1585 0 #N 92,  0, HN 92, 
9663 127.911   8.691   8.243 1 U         -1.066e+03  0.00e+00 m   0 1627    0 1628 0 #N 94,  0, HN 94, 
9667 115.873   8.691   8.238 1 U         -1.285e+03  0.00e+00 m   0 1642    0 1643 0 #N 95,  0, HN 95, 
9668 121.684   8.699   8.370 1 U         -2.839e+03  0.00e+00 m   0 1655    0 1656 0 #N 96,  0, HN 96, 
9671 125.251   0.760   8.757 1 U         -1.347e+03  0.00e+00 m   0 1681    0 1682 0 #N 97,  0, HN 97, 
9672 125.251   1.082   8.757 1 U         -1.029e+03  0.00e+00 m   0 1681    0 1682 0 #N 97,  0, HN 97, 
9678 129.536   0.832   7.921 1 U         -1.506e+03  0.00e+00 m   0 1707    0 1708 0 #N 98,  0, HN 98, 
9688 115.767   8.114   7.594 1 U         -1.351e+03  0.00e+00 m   0 1735    0 1736 0 #N 100,  0, HN 100, 
9689 121.254   0.869   8.110 1 U         -2.775e+03  0.00e+00 m   0 1771    0 1772 0 #N 102,  0, HN 102, 
9695 118.790   0.106   7.963 1 U         -1.707e+03  0.00e+00 m   0 1819    0 1820 0 #N 105,  0, HN 105, 
9696 118.790   1.024   7.963 1 U         -1.405e+03  0.00e+00 m   0 1819    0 1820 0 #N 105,  0, HN 105, 
9697 118.790   1.439   7.963 1 U         -1.809e+03  0.00e+00 m   0 1819    0 1820 0 #N 105,  0, HN 105, 
9716 120.009   2.955   8.047 1 U         -9.180e+02  0.00e+00 m   0 1958    0 1959 0 #N 113,  0, HN 113, 
9720 107.774   4.050   7.926 1 U         -1.727e+03  0.00e+00 m   0 1998    0 1999 0 #N 115,  0, HN 115, 
9721 107.774   1.724   7.926 1 U         -1.275e+03  0.00e+00 m   0 1998    0 1999 0 #N 115,  0, HN 115, 
9727 122.599   7.035   8.453 1 U         -1.287e+03  0.00e+00 m   0 2022    0 2023 0 #N 118,  0, HN 118, 
9733 122.599   2.416   8.453 1 U         -1.488e+03  0.00e+00 m   0 2022    0 2023 0 #N 118,  0, HN 118, 
9734 126.349   0.697   9.303 1 U         -5.206e+03  0.00e+00 m   0 1306    0 1307 0 #N 76,  0, HN 76, 
9735 119.270   5.784   8.342 1 U         -1.100e+02  0.00e+00 m   0 2059    0 2060 0 #N 120,  0, HN 120, 
9736 119.270   4.128   8.342 1 U         -3.851e+03  0.00e+00 m   0 2059    0 2060 0 #N 120,  0, HN 120, 
9737 119.270   1.841   8.342 1 U         -1.087e+03  0.00e+00 m   0 2059    0 2060 0 #N 120,  0, HN 120, 
9738 119.270   2.148   8.342 1 U         -5.359e+03  0.00e+00 m   0 2059    0 2060 0 #N 120,  0, HN 120, 
9740 125.500   8.130   8.130 1 U         -2.224e+04  0.00e+00 m   0 2076 2077 2077 0 #N 121, HN 121, HN 121, 
9741 125.500   4.426   8.130 1 U         -1.883e+03  0.00e+00 m   0 2076    0 2077 0 #N 121,  0, HN 121, 
9742 125.500   4.601   8.130 1 U         -5.061e+03  0.00e+00 m   0 2076    0 2077 0 #N 121,  0, HN 121, 
9743 125.500   3.178   8.130 1 U         -9.850e+02  0.00e+00 m   0 2076    0 2077 0 #N 121,  0, HN 121, 
9744 125.500   3.086   8.130 1 U         -2.510e+03  0.00e+00 m   0 2076    0 2077 0 #N 121,  0, HN 121, 
9886 118.059   7.605   7.949 1 U         -2.510e+03  0.00e+00 m   0 1983    0 1984 0 #N 114,  0, HN 114, 
9889 119.516   1.466   8.378 1 U         -4.997e+03  0.00e+00 m   0  986    0  987 0 #N 57,  0, HN 57, 
9903  83.361   1.675   7.167 1 U         -7.530e+02  0.00e+00 m   0 1492    0 1493 0 #NE 87,  0, HE 87,
;

   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   .   .   N   15   15N   .   .   31        ppm   .   .   .   118     .   .   30763   1
      2   .   .   H   1    H     .   .   11202.7   Hz    .   .   .   4.804   .   .   30763   1
      3   .   .   H   1    HN    .   .   11160.7   Hz    .   .   .   4.804   .   .   30763   1
   stop_
save_