* LIGAND DATABASE FILE (OPLS2005)
*
001      71    74    129    214     382
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02010   106.18552   -23.82001
    3     1 S   H    _H1_     3     1.02077    61.81349    79.07523
    4     1 S   H    _H2_     4     1.02153    50.45905  -124.97121
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.05972   107.41041    47.01581
    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     1.34015   114.76575   162.47883
   19    18 S   H    _HN2    19     1.04748   118.84952     8.59078
   20    18 S   CT1  _CA2    20     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    21     1.08457   106.27517   -11.11459
   22    20 S   C    _C2_    22     1.54037   112.60135  -130.27230
   23    22 S   O    _O2_    23     1.23085   119.01196  -169.64989
   24    20 S   CT   _CB2    32     1.54652   109.46586   105.32505
   25    24 S   HC   HB21    33     1.08519   110.61667    58.77943
   26    24 S   HC   HB22    34     1.08547   109.95733   179.17291
   27    22 S   N    _N3_    24     1.34263   118.97450    10.45203
   28    27 S   H    _HN3    25     1.03492   120.05970     5.06895
   29    24 S   S    _SG2    35     1.81647   112.43692   -61.22030
   30    27 S   CT   _CA3    26     1.46098   124.53040  -172.10347
   31    30 S   HC   HA31    27     1.12298   109.15732    14.31073
   32    30 S   HC   HA32    28     1.12301   109.23063   127.81991
   33    29 S   CT   _C20    36     1.85126    97.23418  -158.14280
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   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   CM   _C16    37     1.52308   108.26029  -160.06663
   38    33 S   CO4  _C18    68     1.51549   107.01611   -40.58701
   39    38 S   O    _O21    69     1.22655   122.30899    95.47604
   40    37 S   CA   _C11    38     1.48112   105.11595   -94.04976
   41    37 S   CMA  _C17    57     1.36042   127.31879    92.09721
   42    41 S   OM   _O20    58     1.26725   128.66235   174.40830
   43    40 S   CA   _C12    39     1.40351   108.98587   -16.77532
   44    41 S   CA   _C9_    59     1.52057   113.00189    -1.53850
   45    43 S   CA   _C7_    40     1.39011   121.13058  -178.86151
   46    45 S   HA   _H28    41     1.08574   120.75539   178.07919
   47    33 S   CT   _C19    52     1.55752   114.12114    84.18675
   48    47 S   HC   _H30    53     1.09937   110.20973  -156.70653
   49    44 S   CA   _C5_    60     1.41191   120.77363  -164.47653
   50    49 S   HA   _H26    61     1.08910   121.24627     3.82428
   51    45 S   CA   _C13    42     1.39436   118.73454    -1.85720
   52    47 S   NT   _N19    54     1.45827   115.56569   -33.97309
   53    52 S   H    _H34    55     0.99812   118.15444   -40.64662
   54    52 S   H    _H35    56     0.99761   118.11603   152.79358
   55    49 S   CA   _C4_    62     1.39805   121.67447  -176.20770
   56    55 S   HA   _H25    63     1.08684   119.85957  -179.97202
   57    51 S   CA   _C8_    43     1.39924   120.40922     0.39217
   58    57 S   HA   _H29    44     1.08838   119.66043  -178.83282
   59    51 S   CT   _C21    48     1.49239   119.82828  -179.46918
   60    59 S   HC   _H31    49     1.09606   110.31272    90.00824
   61    59 S   HC   _H32    50     1.09728   111.26188  -149.46626
   62    59 S   HC   _H33    51     1.09799   111.25108   -30.45440
   63    55 S   CA   _C6_    64     1.39025   120.18089     0.22985
   64    63 S   HA   _H27    65     1.08645   119.65657   180.00000
   65    40 S   CA   _C15    45     1.39078   131.00043   161.70322
   66    63 S   CA   _C14    66     1.39044   119.70129    -0.65611
   67    65 S   OH   _O23    46     1.35803   123.82737    -4.08758
   68    67 S   HO   _H37    47     0.97162   110.43941  -175.83802
   69    44 S   CA   _C10    67     1.40621   122.49300    18.84944
   70    66 S   OH   _O22    70     1.36314   117.42175  -178.25213
   71    70 S   HO   _H36    71     0.96964   110.12770   179.97202
  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
  17   2   1   1  16  13   4  15  10   3  12   8  12   4   7   3
   7   4   8   2   1   1   6   3   8   3   4   2   1   1   5   3
   2   3   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    47    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    43    47    48    52    41    69    38    39  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    43    45    65    47    48    52    53    54    41    42    44    66    69    38    39  
   35    36  
   36  
    0  
   40    43    45    57    65    67    47    48    52    41    42    44    49    69    38    39  
   39    70    40    41    43    44    47    48    49    52    63    66    69  
   44    47    66    69  
   43    45    46    51    57    58    65    67    68    47    48    52    41    42    44  
   42    44    49    50    55    66    69    43    47    65  
   44    49    69  
   45    46    51    57    65    67    59    47    48    52    53    54  
   49    50    55    56    63    66    69    70  
   46    51    57    58    65    59    60    61    62    47    48    52  
   51    57    59    47  
   48    52    53    54    69    51    65  
   52    53    54  
   50    55    56    63    64    66    69  
   55    56    63    69  
   57    58    65    67    59    60    61    62  
   53    54  
   54  
    0  
   56    63    64    66    69    70  
   63    64    66  
   58    65    67    68    59    60    61    62  
   65    67    59  
   60    61    62    65  
   61    62  
   62  
    0  
   64    66    69    70    71  
   66    69    70  
   67    68  
   69    70    71  
   68  
    0  
   70    71  
   71  
    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   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   38   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   39   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   40   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   41   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   43   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   44   3.5500   0.0700   0.000000   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   3.5000   0.0660   0.235000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   50   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   51   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   52   3.3000   0.1700  -0.900000   1.8650   1.6500   0.051222218  -2.220205820
   53   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   54   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   55   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   56   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   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   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   64   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   65   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   66   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   67   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   68   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   69   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   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
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  1.510
   33    47   268.000  1.529
   33    38   317.000  1.522
   37    40   320.000  1.460
   37    41   465.000  1.376
   40    43   469.000  1.400
   40    65   469.000  1.400
   43    45   469.000  1.400
   43    47   317.000  1.510
   45    46   367.000  1.080
   45    51   469.000  1.400
   51    57   469.000  1.400
   51    59   317.000  1.510
   57    58   367.000  1.080
   57    65   469.000  1.400
   65    67   450.000  1.364
   67    68   553.000  0.945
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   340.000  1.090
   47    48   340.000  1.090
   47    52   382.000  1.448
   52    53   434.000  1.010
   52    54   434.000  1.010
   41    42   745.000  1.250
   41    44   320.000  1.460
   44    49   469.000  1.400
   44    69   469.000  1.400
   49    50   367.000  1.080
   49    55   469.000  1.400
   55    56   367.000  1.080
   55    63   469.000  1.400
   63    64   367.000  1.080
   63    66   469.000  1.400
   66    69   469.000  1.400
   66    70   450.000  1.364
   69    38   310.000  1.470
   38    39   570.000  1.229
   70    71   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    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  112.20000
   29    33    47    75.00000  111.63000
   29    33    38    75.00000  110.18000
   33    37    40    65.00000  118.87000
   33    37    41    70.00000  124.00000
   33    47    43    70.00000  112.17500
   33    47    48    37.50000  110.70000
   33    47    52    56.20000  109.47000
   33    38    69    65.00000  115.47100
   33    38    39    80.00000  120.40000
   37    40    43    60.00000  120.93500
   37    40    65    60.00000  120.93500
   37    41    42    65.00000  137.10300
   37    41    44    60.00000  123.20500
   40    43    45    63.00000  120.00000
   40    43    47    70.00000  120.00000
   40    65    57    63.00000  120.00000
   40    65    67    70.00000  120.00000
   43    45    46    35.00000  120.00000
   43    45    51    63.00000  120.00000
   43    47    48    35.00000  109.50000
   43    47    52    75.00000  112.33000
   45    51    57    63.00000  120.00000
   45    51    59    70.00000  120.00000
   51    45    46    35.00000  120.00000
   51    57    58    35.00000  120.00000
   51    57    65    63.00000  120.00000
   51    59    60    35.00000  109.50000
   51    59    61    35.00000  109.50000
   51    59    62    35.00000  109.50000
   57    65    67    70.00000  120.00000
   65    40    43    63.00000  120.00000
   65    57    58    35.00000  120.00000
   65    67    68    35.00000  113.00000
   59    51    57    70.00000  120.00000
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    33.00000  107.80000
   47    33    37    70.00000  112.02700
   47    43    45    70.00000  120.00000
   47    52    53    35.00000  109.50000
   47    52    54    35.00000  109.50000
   52    47    48    35.00000  109.50000
   54    52    53    43.60000  106.40000
   41    37    40    60.00000  123.20500
   41    44    49    60.00000  120.93500
   41    44    69    60.00000  120.93500
   44    41    42    85.00000  114.86500
   44    49    50    35.00000  120.00000
   44    49    55    63.00000  120.00000
   44    69    66    63.00000  120.00000
   44    69    38    60.00000  119.52600
   49    55    56    35.00000  120.00000
   49    55    63    63.00000  120.00000
   55    49    50    35.00000  120.00000
   55    63    64    35.00000  120.00000
   55    63    66    63.00000  120.00000
   63    55    56    35.00000  120.00000
   63    66    69    63.00000  120.00000
   63    66    70    70.00000  120.00000
   66    63    64    35.00000  120.00000
   66    69    38    60.00000  119.52600
   66    70    71    35.00000  113.00000
   69    44    49    63.00000  120.00000
   69    38    39    75.00000  123.78400
   38    33    37    70.00000  109.06800
   38    33    47    63.00000  111.10000
   70    66    69    70.00000  120.00000
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  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    47   0.01700  1.0 1.0
   24    29    33    47  -0.23550 -1.0 2.0
   24    29    33    47   0.21350  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
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    40   0.09700  1.0 1.0
   29    33    37    40   0.15600 -1.0 2.0
   29    33    37    40  -0.50800  1.0 3.0
   29    33    37    41   0.42700  1.0 1.0
   29    33    37    41  -0.70350 -1.0 2.0
   29    33    37    41  -0.43150  1.0 3.0
   29    33    47    43   0.56750  1.0 1.0
   29    33    47    43  -0.07550 -1.0 2.0
   29    33    47    43   0.20000  1.0 3.0
   29    33    47    48   0.15000  1.0 3.0
   29    33    47    52   0.56750  1.0 1.0
   29    33    47    52  -0.07550 -1.0 2.0
   29    33    47    52   0.20000  1.0 3.0
   29    33    38    69   0.65300  1.0 1.0
   29    33    38    69  -0.03850 -1.0 2.0
   29    33    38    69   0.33900  1.0 3.0
   29    33    38    39   0.30150 -1.0 2.0
   33    37   -40    43  -0.02500  1.0 1.0
   33    37   -40    43  -0.32150 -1.0 2.0
   33    37   -40    43  -0.01500  1.0 3.0
   33    37    40    65  -0.02500  1.0 1.0
   33    37    40    65  -0.32150 -1.0 2.0
   33    37    40    65  -0.01500  1.0 3.0
   33    37    41    42   7.00000 -1.0 2.0
   33    37    41    44   7.00000 -1.0 2.0
   33    47    52    53  -0.05950  1.0 1.0
   33    47    52    53   0.08850 -1.0 2.0
   33    47    52    53   0.11750  1.0 3.0
   33    47    52    54  -0.05950  1.0 1.0
   33    47    52    54   0.08850 -1.0 2.0
   33    47    52    54   0.11750  1.0 3.0
   37    33   -47    43   0.21200  1.0 1.0
   37    33   -47    43   0.16900 -1.0 2.0
   37    33   -47    43  -1.15100  1.0 3.0
   37    33    47    48   0.15000  1.0 3.0
   37    33    47    52   0.59950  1.0 1.0
   37    33    47    52  -0.21400 -1.0 2.0
   37    33    47    52   0.56200  1.0 3.0
   37    33    38    69   0.65300  1.0 1.0
   37    33    38    69  -0.03850 -1.0 2.0
   37    33    38    69   0.33900  1.0 3.0
   37    33    38    39   0.30150 -1.0 2.0
   37    40    43    45   3.62500 -1.0 2.0
   37    40   -43    47   3.62500 -1.0 2.0
   37    40    65    57   3.62500 -1.0 2.0
   37    40    65    67   3.62500 -1.0 2.0
   37    41    44    49   0.15800  1.0 1.0
   37    41    44    49   1.85350 -1.0 2.0
   37    41    44    49  -0.48700  1.0 3.0
   37    41   -44    69   0.15800  1.0 1.0
   37    41   -44    69   1.85350 -1.0 2.0
   37    41   -44    69  -0.48700  1.0 3.0
   40    37    41    42   7.00000 -1.0 2.0
   40    37    41    44   7.00000 -1.0 2.0
   40    43    45    46   3.62500 -1.0 2.0
   40    43    45    51   3.62500 -1.0 2.0
   40    43   -47    33   0.04150 -1.0 2.0
   40    43    47    48   0.00000  1.0 1.0
   40    43    47    52   0.18550 -1.0 2.0
   40    43    47    52   0.14000  1.0 3.0
   40    65    67    68   0.84100 -1.0 2.0
   43    40    65    57   3.62500 -1.0 2.0
   43    40    65    67   3.62500 -1.0 2.0
   43    45   -51    57   3.62500 -1.0 2.0
   43    45    51    59   3.62500 -1.0 2.0
   43    47    52    53   0.76500  1.0 1.0
   43    47    52    53   0.05700 -1.0 2.0
   43    47    52    53  -0.90900  1.0 3.0
   43    47    52    54   0.76500  1.0 1.0
   43    47    52    54   0.05700 -1.0 2.0
   43    47    52    54  -0.90900  1.0 3.0
   45    43    47    33   0.04150 -1.0 2.0
   45    43    47    48   0.00000  1.0 1.0
   45    43    47    52   0.18550 -1.0 2.0
   45    43    47    52   0.14000  1.0 3.0
   45    51    57    58   3.62500 -1.0 2.0
   45    51    57    65   3.62500 -1.0 2.0
   45    51    59    60   0.00000  1.0 1.0
   45    51    59    61   0.00000  1.0 1.0
   45    51    59    62   0.00000  1.0 1.0
   46    45    51    57   3.62500 -1.0 2.0
   46    45    51    59   3.62500 -1.0 2.0
   51    57   -65    40   3.62500 -1.0 2.0
   51    57    65    67   3.62500 -1.0 2.0
   57    51    59    60   0.00000  1.0 1.0
   57    51    59    61   0.00000  1.0 1.0
   57    51    59    62   0.00000  1.0 1.0
   57    65    67    68   0.84100 -1.0 2.0
   58    57    65    40   3.62500 -1.0 2.0
   58    57    65    67   3.62500 -1.0 2.0
   65    40   -43    45   3.62500 -1.0 2.0
   65    40    43    47   3.62500 -1.0 2.0
   59    51    57    58   3.62500 -1.0 2.0
   59    51    57    65   3.62500 -1.0 2.0
   47    33   -37    40  -0.01700  1.0 1.0
   47    33   -37    40   0.06550 -1.0 2.0
   47    33   -37    40  -0.91500  1.0 3.0
   47    33    37    41   0.09850  1.0 1.0
   47    33    37    41   0.15250 -1.0 2.0
   47    33    37    41  -0.50650  1.0 3.0
   47    33    38    69   0.05850 -1.0 2.0
   47    33    38    69   0.17250  1.0 3.0
   47    33    38    39   0.30150 -1.0 2.0
   47    43    45    46   3.62500 -1.0 2.0
   47    43    45    51   3.62500 -1.0 2.0
   48    47    52    53   0.20000  1.0 3.0
   48    47    52    54   0.20000  1.0 3.0
   41    37    40    43   0.15800  1.0 1.0
   41    37    40    43   1.85350 -1.0 2.0
   41    37    40    43  -0.48700  1.0 3.0
   41    37    40    65   0.15800  1.0 1.0
   41    37    40    65   1.85350 -1.0 2.0
   41    37    40    65  -0.48700  1.0 3.0
   41    44    49    50   3.62500 -1.0 2.0
   41    44    49    55   3.62500 -1.0 2.0
   41    44    69    66   3.62500 -1.0 2.0
   41    44    69    38   3.62500 -1.0 2.0
   42    41    44    49  -0.01750  1.0 1.0
   42    41    44    49  -0.32000 -1.0 2.0
   42    41    44    49   0.00600  1.0 3.0
   42    41    44    69  -0.01750  1.0 1.0
   42    41    44    69  -0.32000 -1.0 2.0
   42    41    44    69   0.00600  1.0 3.0
   44    49    55    56   3.62500 -1.0 2.0
   44    49    55    63   3.62500 -1.0 2.0
   44    69   -38    33   2.26350  1.0 1.0
   44    69   -38    33   0.76750 -1.0 2.0
   44    69   -38    33   0.22500  1.0 3.0
   44    69    38    39   1.05000 -1.0 2.0
   49    44    69    66   3.62500 -1.0 2.0
   49    44    69    38   3.62500 -1.0 2.0
   49    55    63    64   3.62500 -1.0 2.0
   49    55   -63    66   3.62500 -1.0 2.0
   50    49    55    56   3.62500 -1.0 2.0
   50    49    55    63   3.62500 -1.0 2.0
   55    63    66    69   3.62500 -1.0 2.0
   55    63    66    70   3.62500 -1.0 2.0
   56    55    63    64   3.62500 -1.0 2.0
   56    55    63    66   3.62500 -1.0 2.0
   63    66   -69    44   3.62500 -1.0 2.0
   63    66    69    38   3.62500 -1.0 2.0
   63    66    70    71   0.84100 -1.0 2.0
   64    63    66    69   3.62500 -1.0 2.0
   64    63    66    70   3.62500 -1.0 2.0
   66    69    38    33   2.26350  1.0 1.0
   66    69    38    33   0.76750 -1.0 2.0
   66    69    38    33   0.22500  1.0 3.0
   66    69    38    39   1.05000 -1.0 2.0
   69    44    49    50   3.62500 -1.0 2.0
   69    44   -49    55   3.62500 -1.0 2.0
   69    66    70    71   0.84100 -1.0 2.0
   38    33    37    40   0.09700  1.0 1.0
   38    33    37    40   0.15600 -1.0 2.0
   38    33    37    40  -0.50800  1.0 3.0
   38    33   -37    41  -0.51250  1.0 1.0
   38    33   -37    41  -0.88800 -1.0 2.0
   38    33   -37    41   0.08850  1.0 3.0
   38    33    47    43   0.56750  1.0 1.0
   38    33    47    43  -0.07550 -1.0 2.0
   38    33    47    43   0.20000  1.0 3.0
   38    33    47    48  -0.11250  1.0 3.0
   38    33    47    52  -3.56550  1.0 1.0
   38    33    47    52  -0.67500 -1.0 2.0
   38    33    47    52   1.11300  1.0 3.0
   70    66    69    44   3.62500 -1.0 2.0
   70    66    69    38   3.62500 -1.0 2.0
IPHI
    9     5     7     8  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    34    35  10.50000 -1.0 2.0
   33    40    37    41   1.10000 -1.0 2.0
   43    65    40    37   4.00000 -1.0 2.0
   45    47    43    40   4.00000 -1.0 2.0
   51    46    45    43   1.10000 -1.0 2.0
   57    59    51    45   4.00000 -1.0 2.0
   65    58    57    51   1.10000 -1.0 2.0
   57    67    65    40   4.00000 -1.0 2.0
   44    42    41    37   1.10000 -1.0 2.0
   49    69    44    41   4.00000 -1.0 2.0
   55    50    49    44   1.10000 -1.0 2.0
   63    56    55    49   1.10000 -1.0 2.0
   66    64    63    55   1.10000 -1.0 2.0
   69    70    66    63   4.00000 -1.0 2.0
   66    38    69    44   4.00000 -1.0 2.0
   33    69    38    39  10.50000 -1.0 2.0
END
