* LIGAND DATABASE FILE (OPLS2005)
*
001      74    77    131    222     394
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02079    93.36207    34.65381
    3     1 S   H    _H1_     3     1.02167    33.25329   154.32740
    4     1 S   H    _H2_     4     1.02102    86.94377   -73.91947
    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   _C12    36     1.83839    97.44851   161.83430
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CO4  _C13    37     1.52743   109.51853   -80.01470
   38    37 S   O    _O34    38     1.22909   123.32941    27.11739
   39    33 S   CM   _C14    57     1.50274   107.22557    35.68822
   40    37 S   CA   _C8_    39     1.48696   117.51723  -157.31722
   41    39 S   CO4  _C23    58     1.49250   113.58289    62.59087
   42    41 S   O    _O36    59     1.22652   120.27542    -0.07913
   43    40 S   CA   _C9_    40     1.39965   121.14665     8.95791
   44    41 S   CA   _C22    60     1.46553   118.26265   179.82196
   45    43 S   CA   _C4_    41     1.39960   120.04638  -177.55551
   46    45 S   HA   _H4_    42     1.08725   120.93524   178.76141
   47    43 S   CO4  _C10    51     1.47924   120.74830     3.69565
   48    47 S   O    _O33    52     1.22700   120.75112  -170.03257
   49    44 S   CA   _C17    61     1.38768   120.13826     0.27052
   50    45 S   CA   _C5_    43     1.39499   120.03035    -0.55778
   51    33 S   CT   _C11    53     1.53342   109.26760   157.50029
   52    51 S   HC   _H3_    54     1.07151   112.98132   -66.58233
   53    49 S   CA   _C18    62     1.40195   119.62309   179.93439
   54    53 S   HA   _H6_    63     1.09036   119.90824   179.97202
   55    49 S   CO4  _C16    71     1.47446   120.74618    -0.07133
   56    55 S   O    _O35    72     1.23030   118.50604   179.84174
   57    50 S   CA   _C6_    44     1.39381   120.02702     0.03426
   58    57 S   HA   _H5_    45     1.08700   119.76403  -179.37255
   59    50 S   OH   _O42    49     1.36030   120.01327   179.78330
   60    59 S   HO   _H11    50     0.97099   110.27640     0.02798
   61    51 S   OH   _O40    55     1.42480   112.50552    56.14166
   62    61 S   HO   _H9_    56     0.97146   106.86642  -178.77795
   63    53 S   CA   _C19    64     1.39473   120.25723    -0.00000
   64    63 S   OM   _O38    65     1.28151   120.01657   179.97202
   65    39 S   CMA  _C15    73     1.35452   122.71689  -117.34543
   66    65 S   OM   _O39    74     1.26454   129.53292    -0.01978
   67    40 S   CA   _C7_    46     1.40066   119.23901  -169.33592
   68    63 S   CA   _C20    66     1.39199   120.00016     0.01978
   69    68 S   HA   _H7_    67     1.09009   121.05908   180.00000
   70    67 S   OH   _O41    47     1.36326   122.97168    -2.76017
   71    70 S   HO   _H10    48     0.96989   110.17592     0.59215
   72    44 S   CA   _C21    68     1.40173   119.70706  -179.82754
   73    72 S   OH   _O37    69     1.36341   122.84766     0.07913
   74    73 S   HO   _H8_    70     0.96957   110.11128     0.03426
  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  11   5   4   3
  18   2   1   1  14   5  14  12  11   4  12  12  10   4   7   3
  11   6   4   2   9   4   5   2   6   3   2   1   1   1   5   3
   1   1   2   4   2   1   1   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    51    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    40    47    51    52    61    39    41    65  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    40    43    67    47    48    51    52    61    62    39    41    42    44    55    65    66  
   35    36  
   36  
    0  
   38    40    43    45    57    67    70    47    51    52    61    39    41    65  
   40    43    67    51    39  
   41    42    44    49    72    55    56    65    66    40    47    51    52    61  
   43    45    46    50    57    58    67    70    71    47    48    51  
   42    44    49    53    68    72    73    55    65    66    51  
   44    49    72    65  
   45    46    50    57    67    70    59    47    48    51    52    61  
   49    53    54    63    68    69    72    73    74    55    56    65  
   46    50    57    58    67    59    60    47    48    51  
   50    57    59    47  
   48    51    52    61    62    50    67  
   51    52    61  
   53    54    63    64    68    72    73    55    56    65    66  
   57    58    67    70    59    60  
   52    61    62    65  
   61    62  
   54    63    64    68    69    72    55    56    65  
   63    64    68    55  
   56    65    66    63    72  
   65    66  
   58    67    70    71    59    60  
   67    70    59  
   60    67  
    0  
   62  
    0  
   64    68    69    72    73  
   68    69    72  
   66  
    0  
   70    71  
   69    72    73    74  
   72    73  
   71  
    0  
   73    74  
   74  
    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   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   39   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   41   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   44   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   48   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   49   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   50   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   51   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   53   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   54   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   55   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   56   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   57   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   60   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   61   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   62   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   63   3.5500   0.0700  -0.170000   2.5000   1.7750   0.001000000  -0.843144165
   64   3.1500   0.2500  -0.830000   1.7825   1.5750   0.001000000  -0.126889456
   65   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   66   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   67   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   68   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   69   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   70   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   71   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   72   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   73   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   74   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
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    34   317.000  1.522
   34    35   656.000  1.250
   34    36   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    37   317.000  1.522
   33    51   268.000  1.529
   33    39   317.000  1.510
   37    38   570.000  1.229
   37    40   310.000  1.470
   40    43   469.000  1.400
   40    67   469.000  1.400
   43    45   469.000  1.400
   43    47   310.000  1.470
   45    46   367.000  1.080
   45    50   469.000  1.400
   50    57   469.000  1.400
   50    59   450.000  1.364
   57    58   367.000  1.080
   57    67   469.000  1.400
   67    70   450.000  1.364
   70    71   553.000  0.945
   59    60   553.000  0.945
   47    48   570.000  1.229
   47    51   317.000  1.522
   51    52   340.000  1.090
   51    61   320.000  1.410
   61    62   553.000  0.945
   39    41   320.000  1.462
   39    65   465.000  1.376
   41    42   570.000  1.229
   41    44   310.000  1.470
   44    49   469.000  1.400
   44    72   469.000  1.400
   49    53   469.000  1.400
   49    55   310.000  1.470
   53    54   367.000  1.080
   53    63   469.000  1.400
   63    64   450.000  1.364
   63    68   469.000  1.400
   68    69   367.000  1.080
   68    72   469.000  1.400
   72    73   450.000  1.364
   73    74   553.000  0.945
   55    56   570.000  1.229
   55    65   270.000  1.476
   65    66   745.000  1.250
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    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    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    37    75.00000  110.18000
   29    33    51    75.00000  111.63000
   29    33    39    75.00000  112.20000
   33    37    38    80.00000  120.40000
   33    37    40    65.00000  115.47100
   33    51    47    63.00000  111.10000
   33    51    52    37.50000  110.70000
   33    51    61    50.00000  109.50000
   33    39    41    65.00000  116.34900
   33    39    65    70.00000  124.00000
   37    40    43    60.00000  119.52600
   37    40    67    60.00000  119.52600
   40    37    38    75.00000  123.78400
   40    43    45    63.00000  120.00000
   40    43    47    60.00000  119.52600
   40    67    57    63.00000  120.00000
   40    67    70    70.00000  120.00000
   43    45    46    35.00000  120.00000
   43    45    50    63.00000  120.00000
   43    47    48    75.00000  123.78400
   43    47    51    65.00000  115.47100
   45    50    57    63.00000  120.00000
   45    50    59    70.00000  120.00000
   50    45    46    35.00000  120.00000
   50    57    58    35.00000  120.00000
   50    57    67    63.00000  120.00000
   50    59    60    35.00000  113.00000
   57    67    70    70.00000  120.00000
   67    40    43    63.00000  120.00000
   67    57    58    35.00000  120.00000
   67    70    71    35.00000  113.00000
   59    50    57    70.00000  120.00000
   47    43    45    60.00000  119.52600
   47    51    52    35.00000  109.50000
   47    51    61    90.00000  109.61100
   51    33    37    63.00000  111.10000
   51    47    48    80.00000  120.40000
   51    61    62    55.00000  108.50000
   61    51    52    35.00000  109.50000
   39    33    37    70.00000  109.06800
   39    33    51    70.00000  112.02700
   39    41    42    80.00000  123.72100
   39    41    44    65.00000  117.02400
   39    65    55    65.00000  114.61000
   39    65    66    65.00000  137.10300
   41    44    49    60.00000  119.52600
   41    44    72    60.00000  119.52600
   44    41    42    75.00000  123.78400
   44    49    53    63.00000  120.00000
   44    49    55    60.00000  119.52600
   44    72    68    63.00000  120.00000
   44    72    73    70.00000  120.00000
   49    53    54    35.00000  120.00000
   49    53    63    63.00000  120.00000
   49    55    56    75.00000  123.78400
   49    55    65    60.00000  117.44000
   53    63    64    70.00000  120.00000
   53    63    68    63.00000  120.00000
   63    53    54    35.00000  120.00000
   63    68    69    35.00000  120.00000
   63    68    72    63.00000  120.00000
   68    63    64    70.00000  120.00000
   68    72    73    70.00000  120.00000
   72    44    49    63.00000  120.00000
   72    68    69    35.00000  120.00000
   72    73    74    35.00000  113.00000
   55    49    53    60.00000  119.52600
   55    65    66    85.00000  116.28000
   65    39    41    60.00000  125.92000
   65    55    56    80.00000  120.81000
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    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -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    34    35   0.00000  1.0 1.0
   27    30    34    36   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    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   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    37   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    51   0.01700  1.0 1.0
   24    29    33    51  -0.23550 -1.0 2.0
   24    29    33    51   0.21350  1.0 3.0
   24    29    33    39  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  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    37    38   0.30150 -1.0 2.0
   29    33    37    40   0.65300  1.0 1.0
   29    33    37    40  -0.03850 -1.0 2.0
   29    33    37    40   0.33900  1.0 3.0
   29    33    51    47   0.56750  1.0 1.0
   29    33    51    47  -0.07550 -1.0 2.0
   29    33    51    47   0.20000  1.0 3.0
   29    33    51    52   0.15000  1.0 3.0
   29    33    51    61   0.56750  1.0 1.0
   29    33    51    61  -0.07550 -1.0 2.0
   29    33    51    61   0.20000  1.0 3.0
   29    33    39    41   0.09700  1.0 1.0
   29    33    39    41   0.15600 -1.0 2.0
   29    33    39    41  -0.50800  1.0 3.0
   29    33    39    65   0.42700  1.0 1.0
   29    33    39    65  -0.70350 -1.0 2.0
   29    33    39    65  -0.43150  1.0 3.0
   33    37    40    43   2.26350  1.0 1.0
   33    37    40    43   0.76750 -1.0 2.0
   33    37    40    43   0.22500  1.0 3.0
   33    37    40    67   2.26350  1.0 1.0
   33    37    40    67   0.76750 -1.0 2.0
   33    37    40    67   0.22500  1.0 3.0
   33    51    61    62  -0.11600  1.0 1.0
   33    51    61    62  -0.09450 -1.0 2.0
   33    51    61    62   0.21250  1.0 3.0
   33    39    41    42  -0.64400  1.0 1.0
   33    39    41    42   0.26850 -1.0 2.0
   33    39    41    44   1.50000 -1.0 2.0
   33    39    65    55   7.00000 -1.0 2.0
   33    39    65    66   7.00000 -1.0 2.0
   37    33    51    47   0.11950  1.0 1.0
   37    33    51    47   0.20300 -1.0 2.0
   37    33    51    47  -0.70800  1.0 3.0
   37    33    51    52  -0.11250  1.0 3.0
   37    33    51    61  -0.09450  1.0 1.0
   37    33    51    61  -1.12950 -1.0 2.0
   37    33    51    61   0.54000  1.0 3.0
   37    33    39    41   0.09700  1.0 1.0
   37    33    39    41   0.15600 -1.0 2.0
   37    33    39    41  -0.50800  1.0 3.0
   37    33    39    65  -0.51250  1.0 1.0
   37    33    39    65  -0.88800 -1.0 2.0
   37    33    39    65   0.08850  1.0 3.0
   37    40    43    45   3.62500 -1.0 2.0
   37    40   -43    47   3.62500 -1.0 2.0
   37    40    67    57   3.62500 -1.0 2.0
   37    40    67    70   3.62500 -1.0 2.0
   38    37    40    43   1.05000 -1.0 2.0
   38    37    40    67   1.05000 -1.0 2.0
   40    43    45    46   3.62500 -1.0 2.0
   40    43    45    50   3.62500 -1.0 2.0
   40    43    47    48   1.05000 -1.0 2.0
   40    43    47    51   2.26350  1.0 1.0
   40    43    47    51   0.76750 -1.0 2.0
   40    43    47    51   0.22500  1.0 3.0
   40    67    70    71   0.84100 -1.0 2.0
   43    40    67    57   3.62500 -1.0 2.0
   43    40    67    70   3.62500 -1.0 2.0
   43    45   -50    57   3.62500 -1.0 2.0
   43    45    50    59   3.62500 -1.0 2.0
   43    47   -51    33   0.05850 -1.0 2.0
   43    47   -51    33   0.17250  1.0 3.0
   43    47    51    52   0.00000  1.0 1.0
   43    47    51    61   0.65300  1.0 1.0
   43    47    51    61  -0.03850 -1.0 2.0
   43    47    51    61   0.33900  1.0 3.0
   45    43    47    48   1.05000 -1.0 2.0
   45    43    47    51   2.26350  1.0 1.0
   45    43    47    51   0.76750 -1.0 2.0
   45    43    47    51   0.22500  1.0 3.0
   45    50    57    58   3.62500 -1.0 2.0
   45    50    57    67   3.62500 -1.0 2.0
   45    50    59    60   0.84100 -1.0 2.0
   46    45    50    57   3.62500 -1.0 2.0
   46    45    50    59   3.62500 -1.0 2.0
   50    57   -67    40   3.62500 -1.0 2.0
   50    57    67    70   3.62500 -1.0 2.0
   57    50    59    60   0.84100 -1.0 2.0
   57    67    70    71   0.84100 -1.0 2.0
   58    57    67    40   3.62500 -1.0 2.0
   58    57    67    70   3.62500 -1.0 2.0
   67    40   -43    45   3.62500 -1.0 2.0
   67    40    43    47   3.62500 -1.0 2.0
   59    50    57    58   3.62500 -1.0 2.0
   59    50    57    67   3.62500 -1.0 2.0
   47    43    45    46   3.62500 -1.0 2.0
   47    43    45    50   3.62500 -1.0 2.0
   47    51    61    62   0.91850  1.0 1.0
   47    51    61    62   0.57950  1.0 3.0
   48    47    51    33   0.30150 -1.0 2.0
   48    47    51    52   0.00000  1.0 1.0
   48    47    51    61   0.30150 -1.0 2.0
   51    33    37    38   0.30150 -1.0 2.0
   51    33   -37    40   0.05850 -1.0 2.0
   51    33   -37    40   0.17250  1.0 3.0
   51    33    39    41   0.09700  1.0 1.0
   51    33    39    41   0.15600 -1.0 2.0
   51    33    39    41  -0.50800  1.0 3.0
   51    33    39    65   0.09850  1.0 1.0
   51    33    39    65   0.15250 -1.0 2.0
   51    33    39    65  -0.50650  1.0 3.0
   52    51    61    62   0.19450  1.0 3.0
   39    33    37    38   0.30150 -1.0 2.0
   39    33    37    40   0.65300  1.0 1.0
   39    33    37    40  -0.03850 -1.0 2.0
   39    33    37    40   0.33900  1.0 3.0
   39    33    51    47  -0.98800  1.0 1.0
   39    33    51    47   0.48800 -1.0 2.0
   39    33    51    47   0.76800  1.0 3.0
   39    33    51    52   0.15000  1.0 3.0
   39    33    51    61   1.05650  1.0 1.0
   39    33    51    61   0.15600 -1.0 2.0
   39    33    51    61   0.53150  1.0 3.0
   39    41    44    49  -0.11500  1.0 1.0
   39    41    44    49   1.10450 -1.0 2.0
   39    41    44    49  -0.48050  1.0 3.0
   39    41    44    72  -0.11500  1.0 1.0
   39    41    44    72   1.10450 -1.0 2.0
   39    41    44    72  -0.48050  1.0 3.0
   41    39    65    55   7.00000 -1.0 2.0
   41    39    65    66   7.00000 -1.0 2.0
   41    44    49    53   3.62500 -1.0 2.0
   41    44   -49    55   3.62500 -1.0 2.0
   41    44    72    68   3.62500 -1.0 2.0
   41    44    72    73   3.62500 -1.0 2.0
   42    41    44    49   1.05000 -1.0 2.0
   42    41    44    72   1.05000 -1.0 2.0
   44    49    53    54   3.62500 -1.0 2.0
   44    49    53    63   3.62500 -1.0 2.0
   44    49    55    56   1.05000 -1.0 2.0
   44    49    55    65  -0.11500  1.0 1.0
   44    49    55    65   1.10450 -1.0 2.0
   44    49    55    65  -0.48050  1.0 3.0
   44    72    73    74   0.84100 -1.0 2.0
   49    44    72    68   3.62500 -1.0 2.0
   49    44    72    73   3.62500 -1.0 2.0
   49    53    63    64   3.62500 -1.0 2.0
   49    53   -63    68   3.62500 -1.0 2.0
   49    55   -65    39  -1.65800  1.0 1.0
   49    55   -65    39   0.77650 -1.0 2.0
   49    55    65    66   1.50000 -1.0 2.0
   53    49    55    56   1.05000 -1.0 2.0
   53    49    55    65  -0.11500  1.0 1.0
   53    49    55    65   1.10450 -1.0 2.0
   53    49    55    65  -0.48050  1.0 3.0
   53    63    68    69   3.62500 -1.0 2.0
   53    63    68    72   3.62500 -1.0 2.0
   54    53    63    64   3.62500 -1.0 2.0
   54    53    63    68   3.62500 -1.0 2.0
   63    68   -72    44   3.62500 -1.0 2.0
   63    68    72    73   3.62500 -1.0 2.0
   64    63    68    69   3.62500 -1.0 2.0
   64    63    68    72   3.62500 -1.0 2.0
   68    72    73    74   0.84100 -1.0 2.0
   69    68    72    44   3.62500 -1.0 2.0
   69    68    72    73   3.62500 -1.0 2.0
   72    44   -49    53   3.62500 -1.0 2.0
   72    44    49    55   3.62500 -1.0 2.0
   55    49    53    54   3.62500 -1.0 2.0
   55    49    53    63   3.62500 -1.0 2.0
   56    55    65    39   1.00000 -1.0 2.0
   56    55    65    66  -0.11900  1.0 1.0
   56    55    65    66   0.76850 -1.0 2.0
   56    55    65    66   0.14100  1.0 3.0
   65    39    41    42   1.00000 -1.0 2.0
   65    39   -41    44  -1.65800  1.0 1.0
   65    39   -41    44   0.77650 -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
   35    30    34    36  10.50000 -1.0 2.0
   33    40    37    38  10.50000 -1.0 2.0
   43    67    40    37   4.00000 -1.0 2.0
   45    47    43    40   4.00000 -1.0 2.0
   50    46    45    43   1.10000 -1.0 2.0
   57    59    50    45   4.00000 -1.0 2.0
   67    58    57    50   1.10000 -1.0 2.0
   57    70    67    40   4.00000 -1.0 2.0
   43    51    47    48  10.50000 -1.0 2.0
   33    41    39    65   1.10000 -1.0 2.0
   39    44    41    42  10.50000 -1.0 2.0
   49    72    44    41   4.00000 -1.0 2.0
   53    55    49    44   4.00000 -1.0 2.0
   63    54    53    49   1.10000 -1.0 2.0
   68    64    63    53   4.00000 -1.0 2.0
   72    69    68    63   1.10000 -1.0 2.0
   68    73    72    44   4.00000 -1.0 2.0
   49    65    55    56  10.50000 -1.0 2.0
   55    66    65    39   1.10000 -1.0 2.0
END
