* LIGAND DATABASE FILE (OPLS2005)
*
001     109   111    199    300     580
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02087   106.08422    -4.08106
    3     1 S   H    _H1_     3     1.02093    50.03404    97.04893
    4     1 S   H    _H2_     4     1.02103    62.31566  -107.11754
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08610   110.54789    58.78698
   26    24 S   HC   HB22    34     1.08612   109.94660   179.10082
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CT   _C6_    36     1.84422    97.55670  -158.16269
   34    33 S   HC   _H4_    37     1.02294   106.13433    35.40452
   35    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   36    35 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   37    35 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   38    33 S   CT   _C7_    38     1.54295   106.05395   -80.00079
   39    38 S   HC   _H10    39     1.07849   109.89243    27.02250
   40    38 S   HC   _H11    40     1.08339   109.76224   -90.09905
   41    33 S   CT   _C5_    86     1.56656   110.60421   155.58644
   42    41 S   HC   _H3_    87     1.06958   107.44934    57.97991
   43    38 S   CD   _C8_    41     1.51071   113.83766   150.00542
   44    41 S   CT   _C4_    88     1.53799   110.87645   174.73910
   45    44 S   HC   _H7_    89     1.08670   109.49040    63.01491
   46    44 S   HC   _H8_    90     1.08628   109.48971   -56.99215
   47    44 S   HC   _H9_    91     1.08656   109.45789  -176.96901
   48    43 S   NI   _N4_    42     1.28893   122.00242   -50.87313
   49    43 S   OH   _O39   108     1.35227   114.44815   131.82626
   50    49 S   HO   _H38   109     0.97197   111.18157    -0.00000
   51    48 S   CT   _C9_    43     1.46493   116.11367  -177.04031
   52    51 S   HC   _H12    44     1.10065   112.21821    47.99259
   53    51 S   HC   _H13    45     1.10012   107.10949   -66.41701
   54    51 S   CM   _C10    46     1.50226   111.51971   176.03706
   55    54 S   HC   _H14    47     1.10245   115.02205  -147.14564
   56    54 S   CM   _C11    48     1.34271   125.47215    32.75219
   57    56 S   HC   _H15    49     1.07547   118.46154    -0.12667
   58    56 S   CM   _C12    50     1.45699   124.54903  -179.50663
   59    58 S   CM   _C13    51     1.34801   120.89780    55.29250
   60    59 S   HC   _H16    52     1.08635   118.23494    -4.55157
   61    58 S   CT   _C31   104     1.50224   113.40374  -126.05002
   62    61 S   HC   _H35   105     1.08512   109.21423    89.99327
   63    61 S   HC   _H36   106     1.08559   109.19087   -30.22571
   64    61 S   HC   _H37   107     1.08661   109.18493  -149.83167
   65    59 S   CT   _C14    53     1.50714   127.60653   176.71842
   66    65 S   HC   _H5_    54     1.06295   113.45082    -9.83053
   67    65 S   CT   _C15    55     1.53089   112.14055  -133.92122
   68    67 S   HC   _H17    56     1.09407   110.10406   -57.49964
   69    67 S   HC   _H18    57     1.09538   109.16738  -175.86663
   70    65 S   OH   _O38   102     1.42703   108.40839   107.83823
   71    70 S   HO   _H34   103     0.96864   106.38976   179.96574
   72    67 S   CO4  _C16    58     1.51690   113.79814    61.97940
   73    72 S   O    _O33    59     1.23242   120.68301  -111.73035
   74    72 S   CT   _C17    60     1.51393   117.87695    68.76121
   75    74 S   HC   _H19    61     1.09836   108.82398   120.10585
   76    74 S   HC   _H20    62     1.09766   108.94806     3.99008
   77    74 S   CRA  _C18    63     1.47973   110.52125  -118.75987
   78    77 S   N5B  _N5_    64     1.31627   129.81032    -0.83603
   79    78 S   C5B  _C19    65     1.37872   104.24956   177.58840
   80    79 S   C5A  _C20    66     1.37636   108.92404     2.75456
   81    80 S   HA   _H21    67     1.07857   135.95280   176.89008
   82    79 S   C    _C21    69     1.45245   120.56087   179.98022
   83    82 S   O    _O35    70     1.23039   118.08906   -32.94948
   84    77 S   OA   _O34    68     1.36715   115.86213   178.90765
   85    82 S   N    _N6_    71     1.39910   118.13896   143.86850
   86    85 S   CM   _C25    72     1.38264   125.21627   177.71338
   87    86 S   CM   _C24    73     1.33844   112.40204   168.84661
   88    87 S   HC   _H26    74     1.08085   125.67973   178.78147
   89    86 S   CO4  _C26    81     1.47148   125.14531   -14.67674
   90    89 S   O    _O36    82     1.22116   123.50561   -43.34923
   91    87 S   CT   _C23    75     1.49271   110.80802    -1.51414
   92    91 S   HC   _H24    76     1.09337   112.08298   126.47159
   93    91 S   HC   _H25    77     1.09537   110.52445  -111.83864
   94    89 S   OS   _O37    83     1.35848   109.12201   136.86846
   95    85 S   CT   _C22    78     1.48026   126.69742    -9.68192
   96    95 S   HC   _H22    79     1.09507   108.49081    77.42528
   97    95 S   HC   _H23    80     1.09477   110.60499   -42.72131
   98    94 S   CT   _C27    84     1.44520   118.53039   176.95123
   99    98 S   HC   _H6_    85     1.09548   109.03398    -3.97848
  100    98 S   CT   _C28    92     1.52922   106.88052  -121.19797
  101   100 S   HC   _H27    93     1.09647   108.12482   -61.17181
  102   100 S   CT   _C29    94     1.52618   110.46515    57.36283
  103   102 S   HC   _H28    95     1.09476   111.36899    61.62221
  104   102 S   HC   _H29    96     1.09536   110.83277   -58.70022
  105   102 S   HC   _H30    97     1.09500   110.65020  -178.18361
  106   100 S   CT   _C30    98     1.52524   110.49210  -179.76930
  107   106 S   HC   _H31    99     1.09580   111.34540   -61.63363
  108   106 S   HC   _H32   100     1.09494   110.70209   178.19908
  109   106 S   HC   _H33   101     1.09485   110.86843    58.58491
  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  10   5   4   3
  17   8   2   1   1  11   5   4  14   8   7   7   3   2   1   8
   2   1   7   4   3   6   3   9   3  10  13   5   4   2   1   1
   9   6  10   5   4   2   1   7   4   7   4   3   6   7   8   5
   2  10   3   1  12  12  10   5   7   2   5   4   3   6   2   1
   1  11   4   9   8   7   3   2   1   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    41    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    43    98    41    42    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    43    48    94    98    99    41    42    44    45    46    47   100    49  
   38    39    40    43    98    41    42    44  
   36    37  
   37  
    0  
   39    40    43    48    51    98    41    42    44    49    50  
   40    43    48    41    49  
   43    48    41    49  
   42    44    45    46    47   100   101   102   106    43    89    94    98    99  
   44    45    46    47   100    94    98    99  
   48    51    52    53    54    49    50  
   45    46    47   100    94    98    99  
   46    47    98  
   47    98  
   98  
   51    52    53    54    55    56    49    50  
   50    51  
    0  
   52    53    54    55    56    57    58  
   53    54    55    56  
   54    55    56  
   55    56    57    58    59    61  
   56    57    58  
   57    58    59    60    65    61    62    63    64  
   58    59    61  
   59    60    65    66    67    70    61    62    63    64  
   60    65    66    67    68    69    72    70    71    61    62    63    64  
   65    66    67    70    61  
   62    63    64    65  
   63    64  
   64  
    0  
   66    67    68    69    72    73    74    70    71  
   67    68    69    72    70    71  
   68    69    72    73    74    75    76    77    70    71  
   69    72    73    74    70  
   72    73    74    70  
   71    72  
    0  
   73    74    75    76    77    78    84  
   74    75    76    77  
   75    76    77    78    79    80    84  
   76    77    78    84  
   77    78    84  
   78    79    80    81    84    82  
   79    80    81    84    82    83    85  
   80    81    84    82    83    85    86    95  
   81    84    82    83    85  
   84    82  
   83    85    86    87    91    95    96    97    89    84  
   85    86    95  
    0  
   86    87    88    91    92    93    95    96    97    89    90    94  
   87    88    91    92    93    95    96    97    89    90    94    98  
   88    91    92    93    95    96    97    89    90    94  
   91    92    93    95    89  
   90    94    98    99   100    91    95  
   94    98  
   92    93    95    96    97  
   93    95    96    97  
   95    96    97  
   98    99   100   101   102   106  
   96    97  
   97  
    0  
   99   100   101   102   103   104   105   106   107   108   109  
  100   101   102   106  
  101   102   103   104   105   106   107   108   109  
  102   103   104   105   106   107   108   109  
  103   104   105   106   107   108   109  
  104   105   106  
  105   106  
  106  
  107   108   109  
  108   109  
  109  
    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   3.5000   0.0660  -0.083900   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.7500   0.1050   0.438600   2.0020   1.7750   0.023028004  -0.852763146
   44   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.2800   0.1700  -0.609900   1.8540   1.6400   0.005000000   0.000000000
   49   3.1200   0.1700  -0.503000   1.7660   1.5600   0.021068034  -0.322181743
   50   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   51   3.5000   0.0660   0.100200   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   57   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   59   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   60   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   71   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   72   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   73   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   74   3.5000   0.0660  -0.005000   2.4950   1.7500   0.005000000  -0.741685710
   75   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   76   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   77   3.5500   0.0700   0.439000   2.5000   1.7750   0.001000000  -0.843144165
   78   3.2500   0.1700  -0.590000   1.8650   1.6500   0.001000000  -0.511443539
   79   3.5500   0.0700   0.145000   2.5000   1.7750   0.001000000  -0.843144165
   80   3.5500   0.0700  -0.148000   2.0020   1.7750   0.001000000  -0.843144165
   81   2.4200   0.0300   0.181000   1.3810   1.2100   0.030040813   0.268726247
   82   3.7500   0.1050   0.615000   1.9250   1.7000   0.001000000  -0.126889456
   83   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   84   2.9000   0.1400  -0.257000   1.6450   1.4500   0.001000000  -0.126889456
   85   3.2500   0.1700   0.003200   1.8100   1.6000   0.054801302  -1.445846770
   86   3.5500   0.0760  -0.073200   2.0020   1.7750   0.023028004  -0.852763146
   87   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   88   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   89   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   90   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   91   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   95   3.5000   0.0660  -0.050000   1.9750   1.7500   0.005000000  -0.741685710
   96   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   97   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   98   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   99   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
  100   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
  101   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  102   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  107   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  108   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  109   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   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   268.000  1.529
   33    41   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    43   270.000  1.508
   43    48   500.000  1.261
   43    49   440.000  1.374
   48    51   315.000  1.435
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    54   317.000  1.510
   54    55   340.000  1.080
   54    56   549.000  1.340
   56    57   340.000  1.080
   56    58   380.000  1.444
   58    59   549.000  1.340
   58    61   317.000  1.510
   59    60   340.000  1.080
   59    65   317.000  1.510
   65    66   340.000  1.090
   65    67   268.000  1.529
   65    70   320.000  1.410
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    72   317.000  1.522
   72    73   570.000  1.229
   72    74   317.000  1.522
   74    75   340.000  1.090
   74    76   340.000  1.090
   74    77   295.000  1.488
   77    78   488.000  1.335
   77    84   462.000  1.357
   78    79   410.000  1.394
   79    80   520.000  1.370
   79    82   310.000  1.477
   80    81   367.000  1.080
   80    84   340.000  1.360
   82    83   570.000  1.229
   82    85   490.000  1.335
   85    86   400.000  1.384
   85    95   337.000  1.449
   86    87   549.000  1.340
   86    89   320.000  1.462
   87    88   340.000  1.080
   87    91   317.000  1.510
   91    92   340.000  1.090
   91    93   340.000  1.090
   91    95   268.000  1.529
   95    96   340.000  1.090
   95    97   340.000  1.090
   89    90   570.000  1.229
   89    94   214.000  1.327
   94    98   320.000  1.410
   98    99   340.000  1.090
   98    41   268.000  1.529
   98   100   268.000  1.529
   41    42   340.000  1.090
   41    44   268.000  1.529
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   340.000  1.090
  100   101   340.000  1.090
  100   102   268.000  1.529
  100   106   268.000  1.529
  102   103   340.000  1.090
  102   104   340.000  1.090
  102   105   340.000  1.090
  106   107   340.000  1.090
  106   108   340.000  1.090
  106   109   340.000  1.090
   70    71   553.000  0.945
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   340.000  1.090
   49    50   553.000  0.945
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  111.63000
   29    33    41    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    43    70.00000  111.76100
   33    41    98    58.35000  112.70000
   33    41    42    37.50000  110.70000
   33    41    44    58.35000  112.70000
   38    33    34    37.50000  110.70000
   38    43    48    65.00000  122.10100
   38    43    49    85.00000  110.80600
   40    38    39    33.00000  107.80000
   43    38    39    45.00000  109.49600
   43    38    40    45.00000  109.49600
   43    48    51    70.00000  113.48600
   43    49    50    70.00000  105.55000
   48    51    52    50.00000  110.29200
   48    51    53    50.00000  110.29200
   48    51    54    75.00000  110.00000
   51    54    55    35.00000  117.00000
   51    54    56    70.00000  124.00000
   53    51    52    33.00000  107.80000
   54    51    52    35.00000  109.50000
   54    51    53    35.00000  109.50000
   54    56    57    35.00000  120.00000
   54    56    58    70.00000  123.01800
   56    54    55    35.00000  120.00000
   56    58    59    70.00000  123.01800
   56    58    61    70.00000  124.00000
   58    56    57    35.00000  120.00000
   58    59    60    35.00000  120.00000
   58    59    65    70.00000  124.00000
   58    61    62    35.00000  109.50000
   58    61    63    35.00000  109.50000
   58    61    64    35.00000  109.50000
   59    65    66    35.00000  109.50000
   59    65    67    70.00000  112.02700
   59    65    70    90.00000  110.39200
   65    59    60    35.00000  117.00000
   65    67    68    37.50000  110.70000
   65    67    69    37.50000  110.70000
   65    67    72    63.00000  111.10000
   65    70    71    55.00000  108.50000
   67    65    66    37.50000  110.70000
   67    72    73    80.00000  120.40000
   67    72    74    70.00000  116.00000
   69    67    68    33.00000  107.80000
   72    67    68    35.00000  109.50000
   72    67    69    35.00000  109.50000
   72    74    75    35.00000  109.50000
   72    74    76    35.00000  109.50000
   72    74    77    75.00000  105.85400
   74    72    73    80.00000  120.40000
   74    77    78    65.00000  125.57700
   74    77    84    80.00000  117.62500
   76    74    75    33.00000  107.80000
   77    74    75    45.00000  109.19200
   77    74    76    45.00000  109.19200
   77    78    79    70.00000  110.00000
   77    84    80    70.00000  104.00000
   78    79    80    70.00000  111.00000
   78    79    82    65.00000  122.69000
   79    80    81    35.00000  130.70000
   79    80    84    70.00000  108.00000
   79    82    83    80.00000  122.33200
   79    82    85    75.00000  113.48100
   84    77    78    70.00000  115.00000
   84    80    81    35.00000  113.40000
   82    79    80    60.00000  124.35000
   82    85    86    70.00000  120.89900
   82    85    95    50.00000  121.90000
   85    82    83    80.00000  122.90000
   85    86    87    75.00000  120.83300
   85    86    89    70.00000  117.92000
   85    95    91    70.00000  110.72300
   85    95    96    35.00000  109.50000
   85    95    97    35.00000  109.50000
   86    87    88    35.00000  120.00000
   86    87    91    70.00000  124.00000
   86    89    90    80.00000  123.72100
   86    89    94    90.00000  111.29400
   87    91    92    35.00000  109.50000
   87    91    93    35.00000  109.50000
   87    91    95    70.00000  112.02700
   91    87    88    35.00000  117.00000
   91    95    96    37.50000  110.70000
   91    95    97    37.50000  110.70000
   93    91    92    33.00000  107.80000
   95    85    86    70.00000  119.94800
   95    91    92    37.50000  110.70000
   95    91    93    37.50000  110.70000
   97    95    96    33.00000  107.80000
   89    86    87    65.00000  118.96000
   89    94    98    83.00000  116.90000
   94    89    90    83.00000  123.40000
   94    98    99    35.00000  109.50000
   94    98    41    50.00000  109.50000
   94    98   100    50.00000  109.50000
   98    41    42    37.50000  110.70000
   98    41    44    58.35000  112.70000
   98   100   101    37.50000  110.70000
   98   100   102    58.35000  112.70000
   98   100   106    58.35000  112.70000
   41    33    34    37.50000  110.70000
   41    33    38    58.35000  112.70000
   41    98    99    37.50000  110.70000
   41    44    45    37.50000  110.70000
   41    44    46    37.50000  110.70000
   41    44    47    37.50000  110.70000
   44    41    42    37.50000  110.70000
   46    44    45    33.00000  107.80000
   47    44    45    33.00000  107.80000
   47    44    46    33.00000  107.80000
  100    98    99    37.50000  110.70000
  100    98    41    58.35000  112.70000
  100   102   103    37.50000  110.70000
  100   102   104    37.50000  110.70000
  100   102   105    37.50000  110.70000
  100   106   107    37.50000  110.70000
  100   106   108    37.50000  110.70000
  100   106   109    37.50000  110.70000
  102   100   101    37.50000  110.70000
  104   102   103    33.00000  107.80000
  105   102   103    33.00000  107.80000
  105   102   104    33.00000  107.80000
  106   100   101    37.50000  110.70000
  106   100   102    58.35000  112.70000
  108   106   107    33.00000  107.80000
  109   106   107    33.00000  107.80000
  109   106   108    33.00000  107.80000
   70    65    66    35.00000  109.50000
   70    65    67    50.00000  109.50000
   61    58    59    70.00000  124.00000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
   49    43    48    90.00000  118.59000
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
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    41   0.01700  1.0 1.0
   24    29    33    41  -0.23550 -1.0 2.0
   24    29    33    41   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    43   0.56750  1.0 1.0
   29    33    38    43  -0.07550 -1.0 2.0
   29    33    38    43   0.20000  1.0 3.0
   29    33    41    98   0.44750  1.0 1.0
   29    33    41    98  -0.17800 -1.0 2.0
   29    33    41    98   0.20200  1.0 3.0
   29    33    41    42   0.15000  1.0 3.0
   29    33    41    44   0.44750  1.0 1.0
   29    33    41    44  -0.17800 -1.0 2.0
   29    33    41    44   0.20200  1.0 3.0
   33    38    43    48   0.00000  1.0 1.0
   33    38    43    49   0.00000  1.0 1.0
   33    41    44    45   0.15000  1.0 3.0
   33    41    44    46   0.15000  1.0 3.0
   33    41    44    47   0.15000  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    43   0.15000  1.0 3.0
   34    33    41    98   0.15000  1.0 3.0
   34    33    41    42   0.15000  1.0 3.0
   34    33    41    44   0.15000  1.0 3.0
   38    33    41    98   0.56750  1.0 1.0
   38    33    41    98  -0.07550 -1.0 2.0
   38    33    41    98   0.20000  1.0 3.0
   38    33    41    42   0.15000  1.0 3.0
   38    33    41    44   0.56750  1.0 1.0
   38    33    41    44  -0.07550 -1.0 2.0
   38    33    41    44   0.20000  1.0 3.0
   38    43    48    51   6.00000 -1.0 2.0
   38    43    49    50   1.50000 -1.0 2.0
   39    38    43    48   0.00000  1.0 1.0
   39    38    43    49   0.00000  1.0 1.0
   40    38    43    48   0.00000  1.0 1.0
   40    38    43    49   0.00000  1.0 1.0
   43    48    51    52  -0.15000  1.0 3.0
   43    48    51    53  -0.15000  1.0 3.0
   43    48    51    54  -0.12500  1.0 1.0
   43    48    51    54  -0.12500 -1.0 2.0
   43    48    51    54   0.25000  1.0 3.0
   48    43    49    50   1.50000 -1.0 2.0
   48    51    54    55   0.00000  1.0 1.0
   48    51    54    56   0.09700  1.0 1.0
   48    51    54    56   0.15600 -1.0 2.0
   48    51    54    56  -0.50800  1.0 3.0
   51    54    56    57   7.00000 -1.0 2.0
   51    54    56    58   7.00000 -1.0 2.0
   52    51    54    55   0.33100  1.0 3.0
   52    51    54    56   0.00000  1.0 1.0
   53    51    54    55   0.33100  1.0 3.0
   53    51    54    56   0.00000  1.0 1.0
   54    56    58    59   0.28850  1.0 1.0
   54    56    58    59   2.61350 -1.0 2.0
   54    56    58    59   0.78400  1.0 3.0
   54    56    58    61  -0.18600  1.0 3.0
   55    54    56    57   7.00000 -1.0 2.0
   55    54    56    58   7.00000 -1.0 2.0
   56    58    59    60   7.00000 -1.0 2.0
   56    58    59    65   7.00000 -1.0 2.0
   56    58    61    62   0.00000  1.0 1.0
   56    58    61    63   0.00000  1.0 1.0
   56    58    61    64   0.00000  1.0 1.0
   57    56    58    59  -0.18600  1.0 3.0
   57    56    58    61   0.00000  1.0 1.0
   58    59    65    66   0.00000  1.0 1.0
   58    59    65    67   0.09850  1.0 1.0
   58    59    65    67   0.15250 -1.0 2.0
   58    59    65    67  -0.50650  1.0 3.0
   58    59    65    70   0.67800  1.0 1.0
   58    59    65    70   0.47050 -1.0 2.0
   58    59    65    70  -0.62500  1.0 3.0
   59    58    61    62   0.00000  1.0 1.0
   59    58    61    63   0.00000  1.0 1.0
   59    58    61    64   0.00000  1.0 1.0
   59    65    67    68   0.15000  1.0 3.0
   59    65    67    69   0.15000  1.0 3.0
   59    65    67    72  -0.98800  1.0 1.0
   59    65    67    72   0.48800 -1.0 2.0
   59    65    67    72   0.76800  1.0 3.0
   59    65    70    71  -0.07800  1.0 1.0
   59    65    70    71  -0.21500 -1.0 2.0
   59    65    70    71  -0.03150  1.0 3.0
   60    59    65    66   0.33100  1.0 3.0
   60    59    65    67   0.00000  1.0 1.0
   60    59    65    70   0.00000  1.0 1.0
   65    67    72    73   0.30150 -1.0 2.0
   65    67    72    74   0.60050  1.0 1.0
   65    67    72    74   0.05600 -1.0 2.0
   65    67    72    74   0.26150  1.0 3.0
   66    65    67    68   0.15000  1.0 3.0
   66    65    67    69   0.15000  1.0 3.0
   66    65    67    72  -0.11250  1.0 3.0
   66    65    70    71   0.19450  1.0 3.0
   67    65    70    71  -0.11600  1.0 1.0
   67    65    70    71  -0.09450 -1.0 2.0
   67    65    70    71   0.21250  1.0 3.0
   67    72    74    75   0.00000  1.0 1.0
   67    72    74    76   0.00000  1.0 1.0
   67    72    74    77   0.65300  1.0 1.0
   67    72    74    77  -0.03850 -1.0 2.0
   67    72    74    77   0.33900  1.0 3.0
   68    67    72    73   0.00000  1.0 1.0
   68    67    72    74   0.00000  1.0 1.0
   69    67    72    73   0.00000  1.0 1.0
   69    67    72    74   0.00000  1.0 1.0
   72    74    77    78   0.04300 -1.0 2.0
   72    74    77    84   0.04300 -1.0 2.0
   73    72    74    75   0.00000  1.0 1.0
   73    72    74    76   0.00000  1.0 1.0
   73    72    74    77   0.30150 -1.0 2.0
   74    77    78    79   3.62500 -1.0 2.0
   74    77    84    80   3.62500 -1.0 2.0
   75    74    77    78   0.00000  1.0 1.0
   75    74    77    84   0.00000  1.0 1.0
   76    74    77    78   0.00000  1.0 1.0
   76    74    77    84   0.00000  1.0 1.0
   77    78   -79    80   2.40000 -1.0 2.0
   77    78    79    82   3.62500 -1.0 2.0
   78    77   -84    80   3.62500 -1.0 2.0
   78    79    80    81   3.62500 -1.0 2.0
   78    79   -80    84   3.62500 -1.0 2.0
   78    79    82    83   1.05000 -1.0 2.0
   78    79    82    85   1.61600  1.0 1.0
   78    79    82    85  -0.04750 -1.0 2.0
   78    79    82    85   0.11700  1.0 3.0
   79    80   -84    77   3.62500 -1.0 2.0
   79    82    85    86   2.45000 -1.0 2.0
   79    82    85    95   1.49850  1.0 1.0
   79    82    85    95   1.53950 -1.0 2.0
   80    79    82    83   1.05000 -1.0 2.0
   80    79    82    85   0.75700  1.0 1.0
   80    79    82    85   0.34650 -1.0 2.0
   80    79    82    85   0.33000  1.0 3.0
   80    79    82    85  -0.28100 -1.0 4.0
   81    80    84    77   3.62500 -1.0 2.0
   84    77   -78    79   3.62500 -1.0 2.0
   82    79    80    81   3.62500 -1.0 2.0
   82    79    80    84   3.62500 -1.0 2.0
   82    85    86    87  -0.18900  1.0 1.0
   82    85    86    87   1.70900 -1.0 2.0
   82    85    86    89  -0.56400  1.0 1.0
   82    85    86    89   0.77500 -1.0 2.0
   82    85    86    89   0.18700  1.0 3.0
   82    85    95    91  -0.43950  1.0 1.0
   82    85    95    91  -0.08100 -1.0 2.0
   82    85    95    91   0.03350  1.0 3.0
   82    85    95    96   0.00000  1.0 1.0
   82    85    95    97   0.00000  1.0 1.0
   83    82    85    86   2.67200 -1.0 2.0
   83    82    85    95   3.04450 -1.0 2.0
   85    86    87    88   7.00000 -1.0 2.0
   85    86   -87    91   7.00000 -1.0 2.0
   85    86    89    90  -0.52200  1.0 1.0
   85    86    89    90   0.82950 -1.0 2.0
   85    86    89    94   1.50000 -1.0 2.0
   86    85   -95    91  -0.05900 -1.0 2.0
   86    85    95    96   0.00000  1.0 1.0
   86    85    95    97   0.00000  1.0 1.0
   86    87    91    92   0.00000  1.0 1.0
   86    87    91    93   0.00000  1.0 1.0
   86    87   -91    95   0.09850  1.0 1.0
   86    87   -91    95   0.15250 -1.0 2.0
   86    87   -91    95  -0.50650  1.0 3.0
   86    89    94    98   2.00000 -1.0 2.0
   87    86    89    90   1.00000 -1.0 2.0
   87    86    89    94  -0.56150  1.0 1.0
   87    86    89    94   2.19150 -1.0 2.0
   87    91   -95    85   0.21700  1.0 1.0
   87    91   -95    85   0.68550 -1.0 2.0
   87    91   -95    85  -0.27950  1.0 3.0
   87    91    95    96   0.15000  1.0 3.0
   87    91    95    97   0.15000  1.0 3.0
   88    87    91    92   0.33100  1.0 3.0
   88    87    91    93   0.33100  1.0 3.0
   88    87    91    95   0.00000  1.0 1.0
   92    91    95    85   0.15000  1.0 3.0
   92    91    95    96   0.15000  1.0 3.0
   92    91    95    97   0.15000  1.0 3.0
   93    91    95    85   0.15000  1.0 3.0
   93    91    95    96   0.15000  1.0 3.0
   93    91    95    97   0.15000  1.0 3.0
   95    85   -86    87  -0.88150  1.0 1.0
   95    85   -86    87   2.95600 -1.0 2.0
   95    85    86    89   1.00000 -1.0 2.0
   89    86    87    88   7.00000 -1.0 2.0
   89    86    87    91   7.00000 -1.0 2.0
   89    94    98    99   0.08050  1.0 3.0
   89    94    98    41  -0.25900  1.0 1.0
   89    94    98    41  -0.47000 -1.0 2.0
   89    94    98    41   0.11750  1.0 3.0
   89    94    98   100  -0.25900  1.0 1.0
   89    94    98   100  -0.47000 -1.0 2.0
   89    94    98   100   0.11750  1.0 3.0
   90    89    94    98   3.00000 -1.0 2.0
   94    98    41    33   0.62750  1.0 1.0
   94    98    41    33  -0.30950 -1.0 2.0
   94    98    41    33   0.27300  1.0 3.0
   94    98    41    42   0.23400  1.0 3.0
   94    98    41    44   0.62750  1.0 1.0
   94    98    41    44  -0.30950 -1.0 2.0
   94    98    41    44   0.27300  1.0 3.0
   94    98   100   101   0.23400  1.0 3.0
   94    98   100   102   0.62750  1.0 1.0
   94    98   100   102  -0.30950 -1.0 2.0
   94    98   100   102   0.27300  1.0 3.0
   94    98   100   106   0.62750  1.0 1.0
   94    98   100   106  -0.30950 -1.0 2.0
   94    98   100   106   0.27300  1.0 3.0
   98    41    44    45   0.15000  1.0 3.0
   98    41    44    46   0.15000  1.0 3.0
   98    41    44    47   0.15000  1.0 3.0
   98   100   102   103   0.15000  1.0 3.0
   98   100   102   104   0.15000  1.0 3.0
   98   100   102   105   0.15000  1.0 3.0
   98   100   106   107   0.15000  1.0 3.0
   98   100   106   108   0.15000  1.0 3.0
   98   100   106   109   0.15000  1.0 3.0
   99    98    41    33   0.15000  1.0 3.0
   99    98    41    42   0.15000  1.0 3.0
   99    98    41    44   0.15000  1.0 3.0
   99    98   100   101   0.15000  1.0 3.0
   99    98   100   102   0.15000  1.0 3.0
   99    98   100   106   0.15000  1.0 3.0
   41    33    38    39   0.15000  1.0 3.0
   41    33    38    40   0.15000  1.0 3.0
   41    33    38    43   0.34400  1.0 1.0
   41    33    38    43   0.09450 -1.0 2.0
   41    33    38    43   0.11100  1.0 3.0
   41    98   100   101   0.15000  1.0 3.0
   41    98   100   102   0.56750  1.0 1.0
   41    98   100   102  -0.07550 -1.0 2.0
   41    98   100   102   0.20000  1.0 3.0
   41    98   100   106   0.56750  1.0 1.0
   41    98   100   106  -0.07550 -1.0 2.0
   41    98   100   106   0.20000  1.0 3.0
   42    41    44    45   0.15000  1.0 3.0
   42    41    44    46   0.15000  1.0 3.0
   42    41    44    47   0.15000  1.0 3.0
  100    98    41    33   0.56750  1.0 1.0
  100    98    41    33  -0.07550 -1.0 2.0
  100    98    41    33   0.20000  1.0 3.0
  100    98    41    42   0.15000  1.0 3.0
  100    98    41    44   0.56750  1.0 1.0
  100    98    41    44  -0.07550 -1.0 2.0
  100    98    41    44   0.20000  1.0 3.0
  101   100   102   103   0.15000  1.0 3.0
  101   100   102   104   0.15000  1.0 3.0
  101   100   102   105   0.15000  1.0 3.0
  101   100   106   107   0.15000  1.0 3.0
  101   100   106   108   0.15000  1.0 3.0
  101   100   106   109   0.15000  1.0 3.0
  102   100   106   107   0.15000  1.0 3.0
  102   100   106   108   0.15000  1.0 3.0
  102   100   106   109   0.15000  1.0 3.0
  106   100   102   103   0.15000  1.0 3.0
  106   100   102   104   0.15000  1.0 3.0
  106   100   102   105   0.15000  1.0 3.0
   70    65    67    68   0.23400  1.0 3.0
   70    65    67    69   0.23400  1.0 3.0
   70    65    67    72  -0.09450  1.0 1.0
   70    65    67    72  -1.12950 -1.0 2.0
   70    65    67    72   0.54000  1.0 3.0
   61    58    59    60   7.00000 -1.0 2.0
   61    58    59    65   7.00000 -1.0 2.0
   49    43    48    51   6.00000 -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
   38    49    43    48  10.50000 -1.0 2.0
   51    55    54    56   1.10000 -1.0 2.0
   58    57    56    54   1.10000 -1.0 2.0
   56    61    58    59   1.10000 -1.0 2.0
   65    60    59    58   1.10000 -1.0 2.0
   67    74    72    73  10.50000 -1.0 2.0
   78    84    77    74   4.00000 -1.0 2.0
   80    82    79    78   4.00000 -1.0 2.0
   84    81    80    79   1.10000 -1.0 2.0
   79    85    82    83  10.50000 -1.0 2.0
   95    82    85    86   1.00000 -1.0 2.0
   85    89    86    87   1.10000 -1.0 2.0
   91    88    87    86   1.10000 -1.0 2.0
   86    94    89    90  10.50000 -1.0 2.0
END
