* LIGAND DATABASE FILE (OPLS2005)
*
001      72    76    135    229     403
    1     0 S   NP   _N1_     1    28.55651    95.80951   -22.13083
    2     1 S   H    _HN1     2     1.02780    95.77445   -85.97079
    3     1 S   H    _H1_     3     1.02960    79.97087    21.66363
    4     1 S   H    _H2_     4     1.02836    35.55298   161.09689
    5     1 S   CT   _CA1     5     1.50116   143.77481   132.60209
    6     5 S   HC   _HA1     6     1.09576   105.23491    76.42585
    7     5 S   CO3  _C1_     7     1.53785   112.39197   -43.79495
    8     7 S   O2Z  _O11     8     1.26360   115.00837   -44.10737
    9     7 S   O2Z  _O12     9     1.26240   114.91734   135.08369
   10     5 S   CT   _CB1    10     1.53093   107.42692  -165.66805
   11    10 S   HC   HB11    11     1.09827   109.32477   -50.87600
   12    10 S   HC   HB12    12     1.09820   110.41921    65.66783
   13    10 S   CT   _CG1    13     1.53013   112.68087  -171.97767
   14    13 S   HC   HG11    14     1.09596   110.45556   -63.90222
   15    13 S   HC   HG12    15     1.09654   109.97349    55.32578
   16    13 S   C    _CD1    16     1.51817   112.30789   175.67319
   17    16 S   O    _OE1    17     1.22720   123.24312    -1.68853
   18    16 S   N    _N2_    18     1.38634   111.63654   178.58875
   19    18 S   H    _HN2    19     1.01572   119.03923     1.58807
   20    18 S   CT1  _CA2    20     1.46224   123.42522   179.86730
   21    20 S   HC   _HA2    21     1.09737   109.39240    -2.59337
   22    20 S   C    _C2_    22     1.53518   108.48045  -118.16630
   23    22 S   O    _O2_    23     1.23030   122.21144  -145.62018
   24    20 S   CT   _CB2    32     1.53421   111.54086   119.32445
   25    24 S   HC   HB21    33     1.09586   109.97851    56.37502
   26    24 S   HC   HB22    34     1.09409   109.94877   175.25728
   27    22 S   N    _N3_    24     1.38506   113.51505    41.73369
   28    27 S   H    _HN3    25     1.01497   118.95486    -0.63056
   29    24 S   S    _SG2    35     1.82838   111.55463   -64.35373
   30    27 S   CT   _CA3    26     1.45459   123.55620   175.21762
   31    30 S   HC   HA31    27     1.09515   109.41428    21.35801
   32    30 S   HC   HA32    28     1.09504   107.08855   138.37914
   33    29 S   CT   _C21    36     1.85444    99.68078   175.18204
   34    33 S   HC   _H4_    37     1.09967   105.43746   -40.28049
   35    30 S   CO3  _C3_    29     1.52909   112.94450  -102.24058
   36    35 S   O2Z  _O31    30     1.26416   115.32552   -46.62359
   37    35 S   O2Z  _O32    31     1.26344   115.03575   134.27056
   38    33 S   CT   _C20    38     1.56462   111.54657    78.68559
   39    38 S   OM   _O35    39     1.32812   107.79442  -162.87555
   40    38 S   HC   _H3_    40     1.09765   104.88448   -35.76497
   41    38 S   CA   _C12    41     1.53717   113.31439    78.63347
   42    41 S   CA   _C13    42     1.42862   121.00814  -159.47117
   43    41 S   CA   _C11    62     1.41305   120.44946    21.14303
   44    42 S   CM   _C19    43     1.48452   122.53029     0.77984
   45    44 S   HC   _H14    44     1.08312   119.45091    -0.58884
   46    43 S   CT   _C23    63     1.51360   123.61320    -2.53026
   47    46 S   HC   _H6_    64     1.09810   107.72711   130.03620
   48    42 S   CR3  _C14    71     1.42375   120.92312  -179.08336
   49    44 S   CM   _C18    45     1.34118   122.02377   179.80617
   50    49 S   HC   _H13    46     1.08462   120.55089   179.83568
   51    33 S   CT   _C22    65     1.54178   109.29570  -155.66423
   52    51 S   HC   _H5_    66     1.09700   109.52660    49.61341
   53    46 S   OH   _O33    69     1.43100   107.33943  -115.00053
   54    53 S   HO   _H15    70     0.97210   107.54722  -175.26145
   55    56 S   CR3  _C15    72     1.40928   118.87607     0.14537
   56    49 S   CA   _C16    47     1.46610   120.64437     0.12511
   57    51 S   OH   _O34    67     1.43487   109.93767   164.09631
   58    57 S   HO   _H16    68     0.97584   107.02497    46.69172
   59    56 S   CA   _C17    48     1.39911   120.47904   180.00000
   60    59 S   HA   _H12    49     1.08715   120.79971     0.12972
   61    59 S   CA   _C4_    50     1.39224   120.03077  -179.83098
   62    61 S   HA   _H7_    51     1.08633   119.98009   180.00000
   63    61 S   CA   _C5_    52     1.39431   120.07768     0.02798
   64    63 S   HA   _H8_    53     1.08802   118.78687   179.97202
   65    63 S   CA   _C6_    54     1.40392   120.67059    -0.01978
   66    65 S   CA   _C7_    55     1.39826   121.23785   180.00000
   67    66 S   HA   _H9_    56     1.08780   120.70714    -0.02798
   68    66 S   CA   _C8_    57     1.39402   120.45096   179.96574
   69    68 S   HA   _H10    58     1.08824   118.63441  -179.92338
   70    68 S   CA   _C9_    59     1.40213   120.85385    -0.00000
   71    70 S   CA   _C10    60     1.39790   120.81056  -179.74056
   72    71 S   HA   _H11    61     1.09024   119.27086     0.29074
  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
  14   8   2   1   1  12   5   4  14  13  13   8   4  10   6  12
   7   3   6   3   3   1  12   8   1   1   6   3   5   3   5   2
   5   5   3   4   2   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    51    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    41    46    51    52    57  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    46    47    51    52    57    58    53  
   38    39    40    41    46    51    52    57  
   36    37  
   37  
    0  
   39    40    41    42    44    71    43    46    51    52    57    48  
   40    41    42    43    51  
   41    42    43    51  
   42    44    45    49    70    71    72    43    46    47    51    53    48    55  
   44    45    49    50    56    65    68    70    71    43    46    48    55  
   46    47    51    52    57    53    54    48    44    68    70    71    72  
   45    49    50    56    59    70    48    55  
   49    50    56    48  
   47    51    52    57    58    53    54    70    71    72  
   51    52    57    53    54    71  
   55    49    56    59    63    65    66    68    69    70    71    72  
   50    56    59    60    61    65    55  
   56    59    55  
   52    57    58    53    54    71  
   57    58    53  
   54    57    71  
    0  
   56    59    60    61    63    64    65    66    67    68    70    71  
   59    60    61    62    63    65    66    70  
   58  
    0  
   60    61    62    63    64    65  
   61    62    63  
   62    63    64    65    66  
   63    64    65  
   64    65    66    67    68  
   65    66  
   66    67    68    69    70  
   67    68    69    70    71  
   68    69    70  
   69    70    71    72  
   70    71  
   71    72  
   72  
    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   4.2000   0.3000   0.035000   1.9750   1.7500   0.005000000  -0.741685710
   39   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   40   2.5000   0.0500   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   42   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   43   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   44   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   45   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660   0.320000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   49   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   50   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   54   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   55   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   56   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   57   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   58   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   59   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   60   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   61   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   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   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   66   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   67   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   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   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   71   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   72   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   268.000  1.529
   33    51   268.000  1.529
   38    39   570.000  1.307
   38    40   340.000  1.090
   38    41   317.000  1.510
   41    42   469.000  1.400
   41    43   469.000  1.400
   42    44   320.000  1.460
   42    48   490.000  1.398
   44    45   340.000  1.080
   44    49   549.000  1.340
   49    50   340.000  1.080
   49    56   320.000  1.460
   56    59   469.000  1.400
   56    55   490.000  1.398
   59    60   367.000  1.080
   59    61   469.000  1.400
   61    62   367.000  1.080
   61    63   469.000  1.400
   63    64   367.000  1.080
   63    65   469.000  1.400
   65    66   469.000  1.400
   65    55   490.000  1.398
   66    67   367.000  1.080
   66    68   469.000  1.400
   68    69   367.000  1.080
   68    70   469.000  1.400
   70    71   469.000  1.400
   70    48   490.000  1.398
   71    72   367.000  1.080
   71    43   469.000  1.400
   43    46   317.000  1.510
   46    47   340.000  1.090
   46    51   268.000  1.529
   46    53   320.000  1.410
   51    52   340.000  1.090
   51    57   320.000  1.410
   57    58   553.000  0.945
   53    54   553.000  0.945
   48    55   490.000  1.398
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    51    75.00000  111.63000
   33    38    39    50.00000  109.50000
   33    38    40    37.50000  110.70000
   33    38    41    70.00000  112.17500
   33    51    46    58.35000  112.70000
   33    51    52    37.50000  110.70000
   33    51    57    50.00000  109.50000
   38    33    34    37.50000  110.70000
   38    41    42    70.00000  120.00000
   38    41    43    70.00000  120.00000
   40    38    39    45.00000  125.66300
   41    38    39    85.00000  111.85700
   41    38    40    35.00000  109.50000
   41    42    44    60.00000  120.93500
   41    42    48    70.00000  112.88000
   41    43    71    63.00000  120.00000
   41    43    46    70.00000  120.00000
   42    44    45    40.00000  117.26300
   42    44    49    60.00000  123.20500
   42    48    70    60.00000  130.80000
   42    48    55    60.00000  130.80000
   44    49    50    35.00000  120.00000
   44    49    56    60.00000  123.20500
   49    44    45    35.00000  120.00000
   49    56    59    60.00000  120.93500
   49    56    55    60.00000  120.93500
   56    49    50    40.00000  117.26300
   56    59    60    35.00000  120.00000
   56    59    61    63.00000  120.00000
   56    55    65    60.00000  130.80000
   56    55    48    60.00000  130.80000
   59    61    62    35.00000  120.00000
   59    61    63    63.00000  120.00000
   61    59    60    35.00000  120.00000
   61    63    64    35.00000  120.00000
   61    63    65    63.00000  120.00000
   63    61    62    35.00000  120.00000
   63    65    66    63.00000  120.00000
   63    65    55    70.00000  112.88000
   65    63    64    35.00000  120.00000
   65    66    67    35.00000  120.00000
   65    66    68    63.00000  120.00000
   65    55    48    60.00000  130.80000
   66    68    69    35.00000  120.00000
   66    68    70    63.00000  120.00000
   68    66    67    35.00000  120.00000
   68    70    71    63.00000  120.00000
   68    70    48    70.00000  112.88000
   70    68    69    35.00000  120.00000
   70    71    72    35.00000  120.00000
   70    71    43    63.00000  120.00000
   70    48    55    60.00000  130.80000
   71    43    46    70.00000  120.00000
   43    41    42    63.00000  120.00000
   43    71    72    35.00000  120.00000
   43    46    47    35.00000  109.50000
   43    46    51    70.00000  112.17500
   43    46    53    90.00000  112.51600
   46    51    52    37.50000  110.70000
   46    51    57    50.00000  109.50000
   46    53    54    55.00000  108.50000
   51    33    34    37.50000  110.70000
   51    33    38    58.35000  112.70000
   51    46    47    37.50000  110.70000
   51    57    58    55.00000  108.50000
   57    51    52    35.00000  109.50000
   53    46    47    35.00000  109.50000
   53    46    51    50.00000  109.50000
   48    42    44    60.00000  120.93500
   48    70    71    70.00000  112.88000
   55    56    59    70.00000  112.88000
   55    65    66    70.00000  112.88000
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    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
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.56750  1.0 1.0
   29    33    38    39  -0.07550 -1.0 2.0
   29    33    38    39   0.20000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.56750  1.0 1.0
   29    33    38    41  -0.07550 -1.0 2.0
   29    33    38    41   0.20000  1.0 3.0
   29    33    51    46   0.44750  1.0 1.0
   29    33    51    46  -0.17800 -1.0 2.0
   29    33    51    46   0.20200  1.0 3.0
   29    33    51    52   0.15000  1.0 3.0
   29    33    51    57   0.56750  1.0 1.0
   29    33    51    57  -0.07550 -1.0 2.0
   29    33    51    57   0.20000  1.0 3.0
   33    38    41    42   0.04150 -1.0 2.0
   33    38    41    43   0.04150 -1.0 2.0
   33    51    57    58  -0.11600  1.0 1.0
   33    51    57    58  -0.09450 -1.0 2.0
   33    51    57    58   0.21250  1.0 3.0
   34    33    38    39   0.23400  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    41   0.43200  1.0 3.0
   34    33    51    46   0.15000  1.0 3.0
   34    33    51    52   0.15000  1.0 3.0
   34    33    51    57   0.23400  1.0 3.0
   38    33    51    46   0.56750  1.0 1.0
   38    33    51    46  -0.07550 -1.0 2.0
   38    33    51    46   0.20000  1.0 3.0
   38    33    51    52   0.15000  1.0 3.0
   38    33    51    57   0.86500  1.0 1.0
   38    33    51    57  -0.17500 -1.0 2.0
   38    33    51    57   0.20800  1.0 3.0
   38    41    42    44   3.62500 -1.0 2.0
   38    41    42    48   3.62500 -1.0 2.0
   38    41    43    71   3.62500 -1.0 2.0
   38    41   -43    46   3.62500 -1.0 2.0
   39    38    41    42   0.64500  1.0 1.0
   39    38    41    42   0.14800 -1.0 2.0
   39    38    41    42   0.20650  1.0 3.0
   39    38    41    43   0.64500  1.0 1.0
   39    38    41    43   0.14800 -1.0 2.0
   39    38    41    43   0.20650  1.0 3.0
   40    38    41    42   0.00000  1.0 1.0
   40    38    41    43   0.00000  1.0 1.0
   41    42    44    45   0.56550  1.0 3.0
   41    42    44    49   0.15800  1.0 1.0
   41    42    44    49   1.85350 -1.0 2.0
   41    42    44    49  -0.48700  1.0 3.0
   41    42    48    70   3.62500 -1.0 2.0
   41    42    48    55   3.62500 -1.0 2.0
   41    43    46    47   0.00000  1.0 1.0
   41    43    46    51   0.04150 -1.0 2.0
   41    43    46    53   0.14300 -1.0 2.0
   41    43    46    53   0.00300  1.0 3.0
   42    41    43    71   3.62500 -1.0 2.0
   42    41    43    46   3.62500 -1.0 2.0
   42    44    49    50   7.00000 -1.0 2.0
   42    44    49    56   7.00000 -1.0 2.0
   42    48   -55    56   3.62500 -1.0 2.0
   42    48    55    65   3.62500 -1.0 2.0
   44    42    48    70   3.62500 -1.0 2.0
   44    42    48    55   3.62500 -1.0 2.0
   44    49    56    59   0.15800  1.0 1.0
   44    49    56    59   1.85350 -1.0 2.0
   44    49    56    59  -0.48700  1.0 3.0
   44    49   -56    55   0.15800  1.0 1.0
   44    49   -56    55   1.85350 -1.0 2.0
   44    49   -56    55  -0.48700  1.0 3.0
   45    44    49    50   7.00000 -1.0 2.0
   45    44    49    56   7.00000 -1.0 2.0
   49    56    59    60   3.62500 -1.0 2.0
   49    56    59    61   3.62500 -1.0 2.0
   49    56    55    65   3.62500 -1.0 2.0
   49    56    55    48   3.62500 -1.0 2.0
   50    49    56    59   0.56550  1.0 3.0
   50    49    56    55   0.56550  1.0 3.0
   56    59    61    62   3.62500 -1.0 2.0
   56    59    61    63   3.62500 -1.0 2.0
   59    56    55    65   3.62500 -1.0 2.0
   59    56    55    48   3.62500 -1.0 2.0
   59    61    63    64   3.62500 -1.0 2.0
   59    61   -63    65   3.62500 -1.0 2.0
   60    59    61    62   3.62500 -1.0 2.0
   60    59    61    63   3.62500 -1.0 2.0
   61    63    65    66   3.62500 -1.0 2.0
   61    63    65    55   3.62500 -1.0 2.0
   62    61    63    64   3.62500 -1.0 2.0
   62    61    63    65   3.62500 -1.0 2.0
   63    65    66    67   3.62500 -1.0 2.0
   63    65    66    68   3.62500 -1.0 2.0
   63    65   -55    56   3.62500 -1.0 2.0
   63    65    55    48   3.62500 -1.0 2.0
   64    63    65    66   3.62500 -1.0 2.0
   64    63    65    55   3.62500 -1.0 2.0
   65    66    68    69   3.62500 -1.0 2.0
   65    66    68    70   3.62500 -1.0 2.0
   66    65    55    56   3.62500 -1.0 2.0
   66    65    55    48   3.62500 -1.0 2.0
   66    68    70    71   3.62500 -1.0 2.0
   66    68   -70    48   3.62500 -1.0 2.0
   67    66    68    69   3.62500 -1.0 2.0
   67    66    68    70   3.62500 -1.0 2.0
   68    70    71    72   3.62500 -1.0 2.0
   68    70    71    43   3.62500 -1.0 2.0
   68    70    48    42   3.62500 -1.0 2.0
   68    70    48    55   3.62500 -1.0 2.0
   69    68    70    71   3.62500 -1.0 2.0
   69    68    70    48   3.62500 -1.0 2.0
   70    71   -43    41   3.62500 -1.0 2.0
   70    71    43    46   3.62500 -1.0 2.0
   70    48    55    56   3.62500 -1.0 2.0
   70    48   -55    65   3.62500 -1.0 2.0
   71    70   -48    42   3.62500 -1.0 2.0
   71    70    48    55   3.62500 -1.0 2.0
   71    43    46    47   0.00000  1.0 1.0
   71    43    46    51   0.04150 -1.0 2.0
   71    43    46    53   0.14300 -1.0 2.0
   71    43    46    53   0.00300  1.0 3.0
   72    71    43    41   3.62500 -1.0 2.0
   72    71    43    46   3.62500 -1.0 2.0
   43    41    42    44   3.62500 -1.0 2.0
   43    41    42    48   3.62500 -1.0 2.0
   43    46   -51    33  -0.03700  1.0 1.0
   43    46   -51    33   0.37200 -1.0 2.0
   43    46   -51    33  -0.47300  1.0 3.0
   43    46    51    52   0.43200  1.0 3.0
   43    46    51    57   1.13150  1.0 1.0
   43    46    51    57  -1.01400 -1.0 2.0
   43    46    53    54   0.31900  1.0 1.0
   43    46    53    54  -0.11800 -1.0 2.0
   43    46    53    54   0.38750  1.0 3.0
   46    51    57    58  -0.11600  1.0 1.0
   46    51    57    58  -0.09450 -1.0 2.0
   46    51    57    58   0.21250  1.0 3.0
   47    46    51    33   0.15000  1.0 3.0
   47    46    51    52   0.15000  1.0 3.0
   47    46    51    57   0.23400  1.0 3.0
   47    46    53    54   0.19450  1.0 3.0
   51    33    38    39   0.62750  1.0 1.0
   51    33    38    39  -0.30950 -1.0 2.0
   51    33    38    39   0.27300  1.0 3.0
   51    33    38    40   0.15000  1.0 3.0
   51    33   -38    41  -0.03700  1.0 1.0
   51    33   -38    41   0.37200 -1.0 2.0
   51    33   -38    41  -0.47300  1.0 3.0
   51    46    53    54  -0.11600  1.0 1.0
   51    46    53    54  -0.09450 -1.0 2.0
   51    46    53    54   0.21250  1.0 3.0
   52    51    57    58   0.19450  1.0 3.0
   53    46    51    33   0.86500  1.0 1.0
   53    46    51    33  -0.17500 -1.0 2.0
   53    46    51    33   0.20800  1.0 3.0
   53    46    51    52   0.23400  1.0 3.0
   53    46    51    57   3.75450  1.0 1.0
   48    42    44    45   0.56550  1.0 3.0
   48    42   -44    49   0.15800  1.0 1.0
   48    42   -44    49   1.85350 -1.0 2.0
   48    42   -44    49  -0.48700  1.0 3.0
   48    70    71    72   3.62500 -1.0 2.0
   48    70   -71    43   3.62500 -1.0 2.0
   55    56    59    60   3.62500 -1.0 2.0
   55    56   -59    61   3.62500 -1.0 2.0
   55    65    66    67   3.62500 -1.0 2.0
   55    65   -66    68   3.62500 -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
   42    43    41    38   4.00000 -1.0 2.0
   44    48    42    41   4.00000 -1.0 2.0
   42    45    44    49   1.10000 -1.0 2.0
   56    50    49    44   1.10000 -1.0 2.0
   59    55    56    49   4.00000 -1.0 2.0
   61    60    59    56   1.10000 -1.0 2.0
   63    62    61    59   1.10000 -1.0 2.0
   65    64    63    61   1.10000 -1.0 2.0
   66    55    65    63   4.00000 -1.0 2.0
   68    67    66    65   1.10000 -1.0 2.0
   70    69    68    66   1.10000 -1.0 2.0
   71    48    70    68   4.00000 -1.0 2.0
   43    72    71    70   1.10000 -1.0 2.0
   71    46    43    41   4.00000 -1.0 2.0
   70    55    48    42   4.00000 -1.0 2.0
   65    48    55    56   4.00000 -1.0 2.0
END
