* LIGAND DATABASE FILE (OPLS2005)
*
001     117   123    226    373     675
    1     0 S   NP   _N1_     1    28.47210    96.28864   -23.80066
    2     1 S   H    _HN1     2     1.02838    25.06189   142.46315
    3     1 S   H    _H1_     3     1.02777   106.10652  -119.67096
    4     1 S   H    _H2_     4     1.02959    84.45386   -12.16957
    5     1 S   CT   _CA1     5     1.50131   130.74904   100.08692
    6     5 S   HC   _HA1     6     1.09575   105.22000    76.97927
    7     5 S   CO3  _C1_     7     1.53785   112.29531   -43.21264
    8     7 S   O2Z  _O11     8     1.26364   115.00015   -45.41950
    9     7 S   O2Z  _O12     9     1.26229   114.92704   133.61488
   10     5 S   CT   _CB1    10     1.53093   107.41556  -165.14162
   11    10 S   HC   HB11    11     1.09828   109.34097   -50.56600
   12    10 S   HC   HB12    12     1.09816   110.43479    65.98449
   13    10 S   CT   _CG1    13     1.53018   112.66773  -171.62877
   14    13 S   HC   HG11    14     1.09600   110.50281   -64.03725
   15    13 S   HC   HG12    15     1.09655   109.93175    55.16571
   16    13 S   C    _CD1    16     1.51840   112.27302   175.53007
   17    16 S   O    _OE1    17     1.22752   123.30154     0.15066
   18    16 S   N    _N2_    18     1.38512   111.71482  -179.94405
   19    18 S   H    _HN2    19     1.01570   119.06702     4.89405
   20    18 S   CT1  _CA2    20     1.45930   122.97820   178.08582
   21    20 S   HC   _HA2    21     1.09639   109.16129    21.12881
   22    20 S   C    _C2_    22     1.52795   105.15900   -96.65182
   23    22 S   O    _O2_    23     1.23071   122.46512   -42.96156
   24    20 S   CT   _CB2    32     1.53253   112.25169   144.31843
   25    24 S   HC   HB21    33     1.09402   109.63225    59.80550
   26    24 S   HC   HB22    34     1.09504   109.60585   177.90072
   27    22 S   N    _N3_    24     1.38303   113.34127   138.02023
   28    27 S   H    _HN3    25     1.01561   120.61267     0.17017
   29    24 S   S    _SG2    35     1.83599   110.73634   -62.07822
   30    27 S   CT   _CA3    26     1.45414   122.14033  -177.42580
   31    30 S   HC   HA31    27     1.09482   107.89261   -58.79009
   32    30 S   HC   HA32    28     1.09589   107.53412    57.28169
   33    29 S   CT   _C12    36     1.83742   102.10345   158.44787
   34    33 S   HC   _H7_    37     1.08993   107.53304  -172.23843
   35    30 S   CO3  _C3_    29     1.52811   114.52336   178.87031
   36    35 S   O2Z  _O31    30     1.26306   116.03148     2.84476
   37    35 S   O2Z  _O32    31     1.26423   114.41110  -176.98020
   38    33 S   CM   _C13    38     1.50386   113.30681   -56.32442
   39    38 S   CMA  _C14    39     1.34609   112.71242   135.51295
   40    39 S   OM   _O37    40     1.26057   133.92814   175.28233
   41    38 S   CT   _C28   114     1.49815   121.17960   -50.88699
   42    41 S   HC   _H26   115     1.09491   110.20944   -48.10577
   43    41 S   HC   _H27   116     1.09471   112.26099  -167.59277
   44    41 S   HC   _H28   117     1.09324   111.06779    72.26665
   45    39 S   CT   _C15    41     1.53794   110.38742    -0.69605
   46    45 S   CT   _C16    42     1.55347   112.91477  -130.00408
   47    46 S   HC   _H13    43     1.09956   107.44566    35.19921
   48    46 S   HC   _H14    44     1.09861   109.53258   -80.36097
   49    33 S   CT   _C11    59     1.54657   113.56519    63.10306
   50    49 S   HC   _H6_    60     1.09916   105.31001   -28.79600
   51    45 S   OH   _O36   112     1.42796   107.67928   109.12353
   52    51 S   HO   _H25   113     0.97397   106.56884    46.55070
   53    46 S   CM   _C17    45     1.51674   119.16201   156.08999
   54    53 S   CM   _C18    46     1.34535   126.93827    16.15340
   55    54 S   HC   _H15    47     1.09032   116.41615  -179.50228
   56    53 S   CT   _C19    91     1.51315   114.16364  -161.67046
   57    56 S   HC   _H16    92     1.09596   110.32785   -45.49954
   58    56 S   HC   _H17    93     1.09675   111.53430  -165.90523
   59    54 S   CT   _C9_    48     1.51495   128.39432     1.72454
   60    59 S   HC   _H5_    49     1.09626   106.06301    62.84933
   61    56 S   OS   _O33    94     1.43758   107.38305    73.47543
   62    59 S   CT   _C8_    50     1.54606   109.17495   177.65181
   63    62 S   HC   _H4_    51     1.09499   111.20479   -58.79020
   64    61 S   CO4  _C20    95     1.36388   116.46140   164.47045
   65    64 S   O    _O34    96     1.22294   125.68702     3.27668
   66    62 S   CT   _C7_    52     1.54974   112.60697   171.35076
   67    62 S   OS   _O39    63     1.43490   105.91287    59.90417
   68    64 S   CT   _C21    97     1.50992   108.47586  -176.98422
   69    68 S   HC   _H18    98     1.09688   108.81913    52.64343
   70    68 S   HC   _H19    99     1.09633   108.25814   -63.96919
   71    66 S   CT   _C6_    53     1.54037   111.34967    19.54821
   72    71 S   HC   _H11    54     1.09811   110.64214   175.99171
   73    71 S   HC   _H12    55     1.09773   110.12609    59.27666
   74    66 S   OS   _O40    64     1.45039   103.66501   -93.66456
   75    66 S   CM   _C37    83     1.52609   112.32658   147.30557
   76    68 S   CA   _C22   100     1.50643   113.25520   173.92669
   77    71 S   CT   _C5_    56     1.55617   111.33324   -61.86410
   78    77 S   HC   _H3_    57     1.09645   106.20679   152.41763
   79    75 S   CM   _C38    84     1.34460   123.41728   107.85163
   80    79 S   HC   _H36    85     1.08543   121.35210   179.93147
   81    79 S   HC   _H37    86     1.08447   122.19994    -0.20558
   82    75 S   CT   _C39    87     1.50775   117.07579   -72.13567
   83    82 S   HC   _H38    88     1.09438   110.59081   -66.35882
   84    82 S   HC   _H39    89     1.09394   111.00010    54.20985
   85    82 S   HC   _H40    90     1.09559   112.06553   173.98204
   86    76 S   CA   _C23   101     1.40240   120.32654   -82.78963
   87    86 S   HA   _H20   102     1.08681   120.32952    -0.54068
   88    59 S   CT   _C10    58     1.57473   116.78131   -60.72479
   89    77 S   CT   _C4_    79     1.54583   108.23655   -93.45469
   90    89 S   HC   _H8_    80     1.09382   113.05982    31.56535
   91    89 S   HC   _H9_    81     1.09611   109.41406   -86.63450
   92    89 S   HC   _H10    82     1.08937   113.72067   152.83676
   93    86 S   CA   _C24   103     1.39502   120.47373   179.70459
   94    93 S   HA   _H21   104     1.08603   119.87124   179.61539
   95    88 S   OS   _O38    61     1.45548   108.70526   -75.57419
   96    93 S   CA   _C25   105     1.39141   119.58843    -0.21489
   97    95 S   CO   _C29    62     1.44331   115.23396   -42.78903
   98    96 S   CA   _C26   106     1.39284   120.77848    -0.17017
   99    98 S   HA   _H22   107     1.08585   120.99110  -179.95154
  100    96 S   OH   _O35   110     1.36649   118.19554   179.93147
  101   100 S   HO   _H24   111     0.97225   108.43337  -178.00747
  102    97 S   CT   _C30    65     1.53076   108.97839   179.98022
  103   102 S   HC   _H29    66     1.09811   110.07781  -179.67918
  104   102 S   HC   _H30    67     1.09810   109.49578    64.73566
  105    76 S   CA   _C27   108     1.40192   120.51779    96.25356
  106   105 S   HA   _H23   109     1.08715   120.34790     0.54965
  107   102 S   CA   _C31    68     1.51105   113.45809   -57.47543
  108   107 S   CA   _C32    69     1.40171   120.62208   -81.09501
  109   108 S   HA   _H31    70     1.08717   120.34443    -0.92132
  110   108 S   CA   _C33    71     1.39540   120.48207   178.83081
  111   110 S   HA   _H32    72     1.08614   119.99343  -179.88131
  112   110 S   CA   _C34    73     1.39310   120.03084     0.20077
  113   112 S   HA   _H33    74     1.08606   120.01427   179.71196
  114   112 S   CA   _C35    75     1.39323   119.99047    -0.17471
  115   114 S   HA   _H34    76     1.08581   119.95568   179.76510
  116   107 S   CA   _C36    77     1.40167   120.39242    97.66943
  117   116 S   HA   _H35    78     1.08717   120.38668     0.75121
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   9   5   4   3
  17   7   2   1   1  12  15   5   5   2   1   1  14  15   6   5
  15   5   3   1  11  14   5   7   3   2  14   7   6  15   7   7
   4  20  10   9   4   3  15   7   6  11   9   9   8   6   6   2
   1   3   2   1   1   8   4   7   4   2   1   1   7   3   5   6
   6   5   3   2   1   9   4   3   1   1   9   8   4   6   3   5
   3   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    49    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    45    88    49    50    41  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    45    46    59    77    88    49    50    95    51    41    42    43    44  
   38    39    45    88    49    50    41  
   36    37  
   37  
    0  
   39    40    45    46    88    49    50    51    41    42    43    44  
   40    45    46    47    48    53    88    49    50    51    52    41    42    43    44  
   45    46    49    51    41  
   42    43    44    45    49  
   43    44  
   44  
    0  
   46    47    48    53    54    59    77    88    49    50    95    56    51    52  
   47    48    53    54    55    59    88    49    50    56    57    58    61    51    52  
   48    53    54    49    56    51  
   53    54    49    56    51  
   50    95    97    89    51    52    53    54    59    60    62    71    77    78    88  
   95    51    59    77    88  
   52    53    88  
    0  
   54    55    59    60    62    88    56    57    58    61    64  
   55    59    60    62    63    66    77    88    95    67    56    57    58    61  
   59    60    62    88    56  
   57    58    61    64    65    68    59  
   58    61    64  
   61    64  
   60    62    63    66    71    77    78    88    95    97    67    74    89    75  
   62    63    66    77    88    95    67  
   64    65    68    69    70    76  
   63    66    71    72    73    77    88    95    97    67    74   102    75    79    82  
   66    71    88    97    67    74    75  
   65    68    69    70    76    86   105  
   68    69    70    76  
   71    72    73    77    78    88    95    97    67    74   102    89    75    79    80    81    82    83    84    85  
   74   102   103   104   107    75    71    88    95    97  
   69    70    76    86    87    93    98   105   106  
   70    76    86   105  
   76    86   105  
   72    73    77    78    88    95    97    74    89    90    91    92    75    79    82  
   73    77    78    88    74    89    75  
   77    78    88    74    89    75  
  102   103   104   107    75    79    82    77    88    95    97  
   79    80    81    82    83    84    85    77    97  
   86    87    93    94    96    98    99   105   106  
   78    88    95    97    89    90    91    92  
   88    95    89    90    91    92  
   80    81    82    83    84    85  
   81    82  
   82  
   83    84    85  
   84    85  
   85  
    0  
   87    93    94    96    98   105   106   100  
   93    94    96   105  
   95    97   102    89    90    91    92  
   90    91    92    95  
   91    92  
   92  
    0  
   94    96    98    99   105   100   101  
   96    98   100  
   97   102   103   104   107  
   98    99   105   106   100   101  
  102   103   104   107   108   116  
   99   105   106   100   101  
  105   106   100  
  101   105  
    0  
  103   104   107   108   109   110   114   116   117  
  104   107   108   116  
  107   108   116  
  106  
    0  
  108   109   110   111   112   114   115   116   117  
  109   110   111   112   113   114   116   117  
  110   111   112   116  
  111   112   113   114   115   116  
  112   113   114  
  113   114   115   116   117  
  114   115   116  
  115   116   117  
  116   117  
  117  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   40   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   41   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   46   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   52   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   53   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   54   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   55   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660   0.259000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   58   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   59   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   62   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   64   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   65   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   66   3.5000   0.0660   0.269000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   68   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   70   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   71   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   75   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   76   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   77   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   80   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   81   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   82   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   87   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   88   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   89   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   94   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   95   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   96   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   97   3.5000   0.0660   0.600000   1.9750   1.7500   0.005000000  -0.741685710
   98   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   99   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
  100   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
  101   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
  102   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
  103   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  104   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
  106   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
  107   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
  108   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
  109   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
  110   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
  111   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
  112   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
  113   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
  114   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
  115   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
  116   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
  117   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    49   268.000  1.529
   38    39   465.000  1.376
   38    41   317.000  1.510
   39    40   745.000  1.250
   39    45   270.000  1.512
   45    46   268.000  1.529
   45    49   268.000  1.529
   45    51   320.000  1.410
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    53   317.000  1.510
   53    54   549.000  1.340
   53    56   317.000  1.510
   54    55   340.000  1.080
   54    59   317.000  1.510
   59    60   340.000  1.090
   59    62   268.000  1.529
   59    88   268.000  1.529
   62    63   340.000  1.090
   62    66   268.000  1.529
   62    67   320.000  1.410
   66    71   268.000  1.529
   66    74   320.000  1.410
   66    75   317.000  1.510
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    77   268.000  1.529
   77    78   340.000  1.090
   77    88   268.000  1.529
   77    89   268.000  1.529
   88    49   268.000  1.529
   88    95   320.000  1.410
   49    50   340.000  1.090
   95    97   320.000  1.380
   97    67   320.000  1.380
   97    74   320.000  1.380
   97   102   250.000  1.527
  102   103   340.000  1.090
  102   104   340.000  1.090
  102   107   317.000  1.510
  107   108   469.000  1.400
  107   116   469.000  1.400
  108   109   367.000  1.080
  108   110   469.000  1.400
  110   111   367.000  1.080
  110   112   469.000  1.400
  112   113   367.000  1.080
  112   114   469.000  1.400
  114   115   367.000  1.080
  114   116   469.000  1.400
  116   117   367.000  1.080
   89    90   340.000  1.090
   89    91   340.000  1.090
   89    92   340.000  1.090
   75    79   549.000  1.340
   75    82   317.000  1.510
   79    80   340.000  1.080
   79    81   340.000  1.080
   82    83   340.000  1.090
   82    84   340.000  1.090
   82    85   340.000  1.090
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    61   320.000  1.410
   61    64   214.000  1.327
   64    65   570.000  1.229
   64    68   317.000  1.522
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    76   317.000  1.510
   76    86   469.000  1.400
   76   105   469.000  1.400
   86    87   367.000  1.080
   86    93   469.000  1.400
   93    94   367.000  1.080
   93    96   469.000  1.400
   96    98   469.000  1.400
   96   100   450.000  1.364
   98    99   367.000  1.080
   98   105   469.000  1.400
  105   106   367.000  1.080
  100   101   553.000  0.945
   51    52   553.000  0.945
   41    42   340.000  1.090
   41    43   340.000  1.090
   41    44   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    49    75.00000  111.63000
   33    38    39    70.00000  124.00000
   33    38    41    65.00000  117.92700
   33    49    45    58.35000  112.70000
   33    49    88    58.35000  112.70000
   33    49    50    37.50000  110.70000
   38    33    34    35.00000  109.50000
   38    39    40    65.00000  137.10300
   38    39    45    65.00000  122.18000
   38    41    42    35.00000  109.50000
   38    41    43    35.00000  109.50000
   38    41    44    35.00000  109.50000
   39    45    46    70.00000  112.02700
   39    45    49    70.00000  112.02700
   39    45    51    90.00000  110.39200
   45    39    40    85.00000  112.85300
   45    46    47    37.50000  110.70000
   45    46    48    37.50000  110.70000
   45    46    53    70.00000  112.02700
   45    49    88    58.35000  112.70000
   45    49    50    37.50000  110.70000
   45    51    52    55.00000  108.50000
   46    53    54    70.00000  124.00000
   46    53    56    65.00000  117.92700
   48    46    47    33.00000  107.80000
   53    46    47    35.00000  109.50000
   53    46    48    35.00000  109.50000
   53    54    55    35.00000  120.00000
   53    54    59    70.00000  124.00000
   53    56    57    35.00000  109.50000
   53    56    58    35.00000  109.50000
   53    56    61    85.00000  110.90400
   54    59    60    35.00000  109.50000
   54    59    62    70.00000  112.02700
   54    59    88    70.00000  112.02700
   59    54    55    35.00000  117.00000
   59    62    63    37.50000  110.70000
   59    62    66    58.35000  112.70000
   59    62    67    50.00000  109.50000
   59    88    77    58.35000  112.70000
   59    88    49    58.35000  112.70000
   59    88    95    50.00000  109.50000
   62    59    60    37.50000  110.70000
   62    66    71    58.35000  112.70000
   62    66    74    50.00000  109.50000
   62    66    75    70.00000  112.02700
   62    67    97    60.00000  109.50000
   66    62    63    37.50000  110.70000
   66    71    72    37.50000  110.70000
   66    71    73    37.50000  110.70000
   66    71    77    58.35000  112.70000
   66    74    97    60.00000  109.50000
   66    75    79    70.00000  124.00000
   66    75    82    65.00000  117.92700
   71    77    78    37.50000  110.70000
   71    77    88    58.35000  112.70000
   71    77    89    58.35000  112.70000
   73    71    72    33.00000  107.80000
   77    71    72    37.50000  110.70000
   77    71    73    37.50000  110.70000
   77    88    49    58.35000  112.70000
   77    88    95    50.00000  109.50000
   77    89    90    37.50000  110.70000
   77    89    91    37.50000  110.70000
   77    89    92    37.50000  110.70000
   88    59    60    37.50000  110.70000
   88    59    62    58.35000  112.70000
   88    77    78    37.50000  110.70000
   88    49    50    37.50000  110.70000
   88    95    97    60.00000  109.50000
   49    33    34    37.50000  110.70000
   49    33    38    70.00000  112.02700
   49    45    46    58.35000  112.70000
   95    88    49    50.00000  109.50000
   95    97    67    92.60000  111.55000
   95    97    74    92.60000  111.55000
   95    97   102    90.00000  108.56700
   97   102   103    45.00000  108.72000
   97   102   104    45.00000  108.72000
   97   102   107    70.00000  112.17500
   67    62    63    35.00000  109.50000
   67    62    66    50.00000  109.50000
   74    66    71    50.00000  109.50000
   74    97    67    92.60000  111.55000
  102    97    67    90.00000  108.56700
  102    97    74    90.00000  108.56700
  102   107   108    70.00000  120.00000
  102   107   116    70.00000  120.00000
  104   102   103    33.00000  107.80000
  107   102   103    35.00000  109.50000
  107   102   104    35.00000  109.50000
  107   108   109    35.00000  120.00000
  107   108   110    63.00000  120.00000
  107   116   114    63.00000  120.00000
  107   116   117    35.00000  120.00000
  108   110   111    35.00000  120.00000
  108   110   112    63.00000  120.00000
  110   108   109    35.00000  120.00000
  110   112   113    35.00000  120.00000
  110   112   114    63.00000  120.00000
  112   110   111    35.00000  120.00000
  112   114   115    35.00000  120.00000
  112   114   116    63.00000  120.00000
  114   112   113    35.00000  120.00000
  114   116   117    35.00000  120.00000
  116   107   108    63.00000  120.00000
  116   114   115    35.00000  120.00000
   89    77    78    37.50000  110.70000
   89    77    88    58.35000  112.70000
   91    89    90    33.00000  107.80000
   92    89    90    33.00000  107.80000
   92    89    91    33.00000  107.80000
   75    66    71    70.00000  112.02700
   75    66    74    85.00000  110.90400
   75    79    80    35.00000  120.00000
   75    79    81    35.00000  120.00000
   75    82    83    35.00000  109.50000
   75    82    84    35.00000  109.50000
   75    82    85    35.00000  109.50000
   81    79    80    35.00000  117.00000
   82    75    79    70.00000  124.00000
   84    82    83    33.00000  107.80000
   85    82    83    33.00000  107.80000
   85    82    84    33.00000  107.80000
   56    53    54    70.00000  124.00000
   56    61    64    83.00000  116.90000
   58    56    57    33.00000  107.80000
   61    56    57    35.00000  109.50000
   61    56    58    35.00000  109.50000
   61    64    65    83.00000  123.40000
   61    64    68    81.00000  111.40000
   64    68    69    35.00000  109.50000
   64    68    70    35.00000  109.50000
   64    68    76    70.00000  110.93000
   68    64    65    80.00000  120.40000
   68    76    86    70.00000  120.00000
   68    76   105    70.00000  120.00000
   70    68    69    33.00000  107.80000
   76    68    69    35.00000  109.50000
   76    68    70    35.00000  109.50000
   76    86    87    35.00000  120.00000
   76    86    93    63.00000  120.00000
   76   105    98    63.00000  120.00000
   76   105   106    35.00000  120.00000
   86    93    94    35.00000  120.00000
   86    93    96    63.00000  120.00000
   93    86    87    35.00000  120.00000
   93    96    98    63.00000  120.00000
   93    96   100    70.00000  120.00000
   96    93    94    35.00000  120.00000
   96    98    99    35.00000  120.00000
   96    98   105    63.00000  120.00000
   96   100   101    35.00000  113.00000
   98   105   106    35.00000  120.00000
  105    76    86    63.00000  120.00000
  105    98    99    35.00000  120.00000
  100    96    98    70.00000  120.00000
   51    45    46    50.00000  109.50000
   51    45    49    50.00000  109.50000
   41    38    39    70.00000  124.00000
   43    41    42    33.00000  107.80000
   44    41    42    33.00000  107.80000
   44    41    43    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
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   49    33   -38    39   0.09850  1.0 1.0
   49    33   -38    39   0.15250 -1.0 2.0
   49    33   -38    39  -0.50650  1.0 3.0
   49    33    38    41   0.46850  1.0 1.0
   49    33    38    41   0.08550 -1.0 2.0
   49    33    38    41   0.09800  1.0 3.0
   49    45    46    47   0.15000  1.0 3.0
   49    45    46    48   0.15000  1.0 3.0
   49    45    46    53   0.34400  1.0 1.0
   49    45    46    53   0.09450 -1.0 2.0
   49    45    46    53   0.11100  1.0 3.0
   49    45    51    52  -0.11600  1.0 1.0
   49    45    51    52  -0.09450 -1.0 2.0
   49    45    51    52   0.21250  1.0 3.0
   49    88    95    97   0.06250  1.0 1.0
   49    88    95    97  -0.01100 -1.0 2.0
   49    88    95    97   0.28050  1.0 3.0
   95    88    49    33   0.62750  1.0 1.0
   95    88    49    33  -0.30950 -1.0 2.0
   95    88    49    33   0.27300  1.0 3.0
   95    88    49    45   0.62750  1.0 1.0
   95    88    49    45  -0.30950 -1.0 2.0
   95    88    49    45   0.27300  1.0 3.0
   95    88    49    50   0.23400  1.0 3.0
   95    97   -67    62  -0.53350  1.0 1.0
   95    97   -67    62  -0.78350 -1.0 2.0
   95    97   -67    62   0.33750  1.0 3.0
   95    97    74    66  -0.53350  1.0 1.0
   95    97    74    66  -0.78350 -1.0 2.0
   95    97    74    66   0.33750  1.0 3.0
   95    97   102   103   0.23400  1.0 3.0
   95    97   102   104   0.23400  1.0 3.0
   95    97   102   107  -0.64350  1.0 1.0
   95    97   102   107  -0.04200 -1.0 2.0
   95    97   102   107   0.19800  1.0 3.0
   97   102   107   108   0.04150 -1.0 2.0
   97   102   107   116   0.04150 -1.0 2.0
   67    62    66    71   0.62750  1.0 1.0
   67    62    66    71  -0.30950 -1.0 2.0
   67    62    66    71   0.27300  1.0 3.0
   67    62   -66    74   1.11900  1.0 1.0
   67    62   -66    74  -1.16350 -1.0 2.0
   67    62   -66    74  -0.34150  1.0 3.0
   67    62    66    75   0.61850  1.0 1.0
   67    62    66    75  -0.22750 -1.0 2.0
   67    62    66    75   0.15300  1.0 3.0
   67    97   -74    66  -0.53350  1.0 1.0
   67    97   -74    66  -0.78350 -1.0 2.0
   67    97   -74    66   0.33750  1.0 3.0
   67    97   102   103   0.23400  1.0 3.0
   67    97   102   104   0.23400  1.0 3.0
   67    97   102   107  -0.64350  1.0 1.0
   67    97   102   107  -0.04200 -1.0 2.0
   67    97   102   107   0.19800  1.0 3.0
   74    66    71    72   0.23400  1.0 3.0
   74    66    71    73   0.23400  1.0 3.0
   74    66    71    77   0.62750  1.0 1.0
   74    66    71    77  -0.30950 -1.0 2.0
   74    66    71    77   0.27300  1.0 3.0
   74    66    75    79   0.39000  1.0 1.0
   74    66    75    79  -0.05800 -1.0 2.0
   74    66    75    79  -0.55150  1.0 3.0
   74    66    75    82   0.09700  1.0 1.0
   74    66    75    82   0.15600 -1.0 2.0
   74    66    75    82  -0.50800  1.0 3.0
   74    97   -67    62  -0.53350  1.0 1.0
   74    97   -67    62  -0.78350 -1.0 2.0
   74    97   -67    62   0.33750  1.0 3.0
   74    97   102   103   0.23400  1.0 3.0
   74    97   102   104   0.23400  1.0 3.0
   74    97   102   107  -0.64350  1.0 1.0
   74    97   102   107  -0.04200 -1.0 2.0
   74    97   102   107   0.19800  1.0 3.0
  102    97    67    62   0.06250  1.0 1.0
  102    97    67    62  -0.01100 -1.0 2.0
  102    97    67    62   0.28050  1.0 3.0
  102    97    74    66   0.06250  1.0 1.0
  102    97    74    66  -0.01100 -1.0 2.0
  102    97    74    66   0.28050  1.0 3.0
  102   107   108   109   3.62500 -1.0 2.0
  102   107   108   110   3.62500 -1.0 2.0
  102   107   116   114   3.62500 -1.0 2.0
  102   107   116   117   3.62500 -1.0 2.0
  103   102   107   108   0.00000  1.0 1.0
  103   102   107   116   0.00000  1.0 1.0
  104   102   107   108   0.00000  1.0 1.0
  104   102   107   116   0.00000  1.0 1.0
  107   108   110   111   3.62500 -1.0 2.0
  107   108   110   112   3.62500 -1.0 2.0
  108   107   116   114   3.62500 -1.0 2.0
  108   107   116   117   3.62500 -1.0 2.0
  108   110   112   113   3.62500 -1.0 2.0
  108   110  -112   114   3.62500 -1.0 2.0
  109   108   110   111   3.62500 -1.0 2.0
  109   108   110   112   3.62500 -1.0 2.0
  110   112   114   115   3.62500 -1.0 2.0
  110   112   114   116   3.62500 -1.0 2.0
  111   110   112   113   3.62500 -1.0 2.0
  111   110   112   114   3.62500 -1.0 2.0
  112   114  -116   107   3.62500 -1.0 2.0
  112   114   116   117   3.62500 -1.0 2.0
  113   112   114   115   3.62500 -1.0 2.0
  113   112   114   116   3.62500 -1.0 2.0
  115   114   116   107   3.62500 -1.0 2.0
  115   114   116   117   3.62500 -1.0 2.0
  116   107   108   109   3.62500 -1.0 2.0
  116   107  -108   110   3.62500 -1.0 2.0
   89    77    88    59   0.56750  1.0 1.0
   89    77    88    59  -0.07550 -1.0 2.0
   89    77    88    59   0.20000  1.0 3.0
   89    77    88    49   0.56750  1.0 1.0
   89    77    88    49  -0.07550 -1.0 2.0
   89    77    88    49   0.20000  1.0 3.0
   89    77    88    95   0.62750  1.0 1.0
   89    77    88    95  -0.30950 -1.0 2.0
   89    77    88    95   0.27300  1.0 3.0
   75    66    71    72   0.15000  1.0 3.0
   75    66    71    73   0.15000  1.0 3.0
   75    66    71    77   0.34400  1.0 1.0
   75    66    71    77   0.09450 -1.0 2.0
   75    66    71    77   0.11100  1.0 3.0
   75    66    74    97  -0.77900  1.0 1.0
   75    66    74    97  -0.36900 -1.0 2.0
   75    66    74    97   0.40400  1.0 3.0
   79    75    82    83   0.00000  1.0 1.0
   79    75    82    84   0.00000  1.0 1.0
   79    75    82    85   0.00000  1.0 1.0
   82    75    79    80   7.00000 -1.0 2.0
   82    75    79    81   7.00000 -1.0 2.0
   56    53    54    55   7.00000 -1.0 2.0
   56    53    54    59   7.00000 -1.0 2.0
   56    61    64    65   3.00000 -1.0 2.0
   56    61    64    68   1.63150  1.0 1.0
   56    61    64    68   2.92000 -1.0 2.0
   57    56    61    64   0.08050  1.0 3.0
   58    56    61    64   0.08050  1.0 3.0
   61    64    68    69   0.00000  1.0 1.0
   61    64    68    70   0.00000  1.0 1.0
   61    64    68    76   0.40000  1.0 3.0
   64    68    76    86   0.04300 -1.0 2.0
   64    68    76   105   0.04300 -1.0 2.0
   65    64    68    69   0.00000  1.0 1.0
   65    64    68    70   0.00000  1.0 1.0
   65    64    68    76   0.30150 -1.0 2.0
   68    76    86    87   3.62500 -1.0 2.0
   68    76    86    93   3.62500 -1.0 2.0
   68    76   105    98   3.62500 -1.0 2.0
   68    76   105   106   3.62500 -1.0 2.0
   69    68    76    86   0.00000  1.0 1.0
   69    68    76   105   0.00000  1.0 1.0
   70    68    76    86   0.00000  1.0 1.0
   70    68    76   105   0.00000  1.0 1.0
   76    86    93    94   3.62500 -1.0 2.0
   76    86    93    96   3.62500 -1.0 2.0
   86    76   105    98   3.62500 -1.0 2.0
   86    76   105   106   3.62500 -1.0 2.0
   86    93   -96    98   3.62500 -1.0 2.0
   86    93    96   100   3.62500 -1.0 2.0
   87    86    93    94   3.62500 -1.0 2.0
   87    86    93    96   3.62500 -1.0 2.0
   93    96    98    99   3.62500 -1.0 2.0
   93    96    98   105   3.62500 -1.0 2.0
   93    96   100   101   0.84100 -1.0 2.0
   94    93    96    98   3.62500 -1.0 2.0
   94    93    96   100   3.62500 -1.0 2.0
   96    98  -105    76   3.62500 -1.0 2.0
   96    98   105   106   3.62500 -1.0 2.0
   98    96   100   101   0.84100 -1.0 2.0
   99    98   105    76   3.62500 -1.0 2.0
   99    98   105   106   3.62500 -1.0 2.0
  105    76    86    87   3.62500 -1.0 2.0
  105    76   -86    93   3.62500 -1.0 2.0
  100    96    98    99   3.62500 -1.0 2.0
  100    96    98   105   3.62500 -1.0 2.0
   51    45    46    47   0.23400  1.0 3.0
   51    45    46    48   0.23400  1.0 3.0
   51    45    46    53   1.05650  1.0 1.0
   51    45    46    53   0.15600 -1.0 2.0
   51    45    46    53   0.53150  1.0 3.0
   51    45    49    33   0.86500  1.0 1.0
   51    45    49    33  -0.17500 -1.0 2.0
   51    45    49    33   0.20800  1.0 3.0
   51    45    49    88   0.86500  1.0 1.0
   51    45    49    88  -0.17500 -1.0 2.0
   51    45    49    88   0.20800  1.0 3.0
   51    45    49    50   0.23400  1.0 3.0
   41    38    39    40   7.00000 -1.0 2.0
   41    38    39    45   7.00000 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   33    41    38    39   1.10000 -1.0 2.0
   45    40    39    38   1.10000 -1.0 2.0
   46    56    53    54   1.10000 -1.0 2.0
   59    55    54    53   1.10000 -1.0 2.0
  108   116   107   102   4.00000 -1.0 2.0
  110   109   108   107   1.10000 -1.0 2.0
  112   111   110   108   1.10000 -1.0 2.0
  114   113   112   110   1.10000 -1.0 2.0
  116   115   114   112   1.10000 -1.0 2.0
  114   117   116   107   1.10000 -1.0 2.0
   66    82    75    79  15.00000 -1.0 2.0
   80    81    79    75  15.00000 -1.0 2.0
   61    68    64    65  10.50000 -1.0 2.0
   86   105    76    68   4.00000 -1.0 2.0
   93    87    86    76   1.10000 -1.0 2.0
   96    94    93    86   1.10000 -1.0 2.0
   98   100    96    93   4.00000 -1.0 2.0
  105    99    98    96   1.10000 -1.0 2.0
   98   106   105    76   1.10000 -1.0 2.0
END
