* LIGAND DATABASE FILE (OPLS2005)
*
001      71    74    126    211     374
    1     0 S   NP   _N1_     1    30.37058    99.86031   -24.33073
    2     1 S   H    _HN1     2     1.02834    62.39800   -52.03792
    3     1 S   H    _H1_     3     1.02745    60.82300   175.29048
    4     1 S   H    _H2_     4     1.03472   157.88843  -121.71579
    5     1 S   CT   _CA1     5     1.50057    90.55465    61.41013
    6     5 S   HC   _HA1     6     1.09548   104.80308   118.36291
    7     5 S   CO3  _C1_     7     1.53674   113.53772    -2.09975
    8     7 S   O2Z  _O11     8     1.26403   115.10953   -29.33986
    9     7 S   O2Z  _O12     9     1.26256   115.04588   150.10961
   10     5 S   CT   _CB1    10     1.53029   107.42986  -123.11149
   11    10 S   HC   HB11    11     1.09563   109.59352   -38.45266
   12    10 S   HC   HB12    12     1.09831   110.53670    77.36631
   13    10 S   CT   _CG1    13     1.53153   112.76467  -160.70843
   14    13 S   HC   HG11    14     1.09526   111.14756   -91.53462
   15    13 S   HC   HG12    15     1.09443   110.82988    27.72537
   16    13 S   C    _CD1    16     1.51464   109.21328   148.33457
   17    16 S   O    _OE1    17     1.22844   121.63997    78.98606
   18    16 S   N    _N2_    18     1.38530   112.72876   -97.27031
   19    18 S   H    _HN2    19     1.01691   119.41825    -7.72080
   20    18 S   CT1  _CA2    20     1.46133   123.38589   170.34697
   21    20 S   HC   _HA2    21     1.09726   109.10840    -3.69077
   22    20 S   C    _C2_    22     1.53945   109.35323  -119.20858
   23    22 S   O    _O2_    23     1.23121   121.94671  -160.36012
   24    20 S   CT   _CB2    32     1.53458   112.00518   118.47582
   25    24 S   HC   HB21    33     1.09566   109.42222    57.15015
   26    24 S   HC   HB22    34     1.09378   109.55805   175.82275
   27    22 S   N    _N3_    24     1.38352   114.40835    26.23879
   28    27 S   H    _HN3    25     1.01424   119.19106    -4.10713
   29    24 S   S    _SG2    35     1.83325   111.47640   -63.51408
   30    27 S   CT   _CA3    26     1.45325   123.16524   177.62521
   31    30 S   HC   HA31    27     1.09567   107.40365   -62.87610
   32    30 S   HC   HA32    28     1.09562   107.89912    53.31957
   33    29 S   CT   _C11    36     1.86499   102.72422  -173.44818
   34    33 S   OM   _O40    37     1.31479   114.30809   -28.93228
   35    30 S   CO3  _C3_    29     1.52997   114.60310   175.18358
   36    35 S   O2Z  _O31    30     1.26414   116.40031    -8.04818
   37    35 S   O2Z  _O32    31     1.26432   114.41949   172.05871
   38    33 S   CM   _C12    38     1.53793   111.77066  -152.34362
   39    38 S   CM   _C14    39     1.36407   130.92141    31.88252
   40    38 S   CO4  _C13    57     1.49897   112.07362  -145.04109
   41    40 S   O    _O34    58     1.22332   124.06861  -123.44409
   42    39 S   CM   _C19    40     1.47270   126.87013     8.54128
   43    40 S   CA   _C8_    59     1.46207   115.16386    54.13338
   44    42 S   CM   _C18    41     1.34818   119.49304  -134.78680
   45    43 S   CA   _C9_    60     1.38406   118.37489   -38.66061
   46    44 S   CM   _C17    42     1.46375   119.60643    -4.10465
   47    44 S   CO4  _C23    49     1.48497   119.21108   178.99575
   48    47 S   O    _O36    50     1.22758   122.43124   174.00576
   49    45 S   CA   _C4_    61     1.40554   119.81751  -179.08828
   50    49 S   HA   _H3_    62     1.09167   118.71813   179.70993
   51    33 S   CO4  _C10    70     1.55894   102.73311    85.89686
   52    51 S   O    _O33    71     1.23233   123.82679   -65.24401
   53    46 S   CM   _C16    43     1.33943   121.38407   -16.96581
   54    53 S   HC   _H5_    44     1.08297   122.70214  -174.32770
   55    46 S   OH   _O38    47     1.38200   119.17111   167.12621
   56    55 S   HO   _H7_    48     0.97327   109.11799     1.77740
   57    47 S   CM   _C22    51     1.47165   117.68119    -8.22591
   58    57 S   HC   _H6_    52     1.08775   115.07335  -168.49289
   59    49 S   CA   _C5_    63     1.41482   122.93579    -0.42887
   60    59 S   OM   _O42    64     1.27675   122.64647  -179.42973
   61    39 S   CO4  _C15    45     1.51444   119.44371  -158.91498
   62    61 S   O    _O39    46     1.22176   126.25447   -52.47769
   63    57 S   CMA  _C21    53     1.34154   124.77178    12.37312
   64    63 S   OM   _O37    54     1.26220   129.17417   179.94065
   65    59 S   CA   _C6_    65     1.41370   114.74343     0.83626
   66    65 S   HA   _H4_    66     1.09148   118.97017   179.60933
   67    42 S   CO4  _C20    55     1.49843   120.29073    54.44618
   68    67 S   O    _O35    56     1.23094   119.85496    19.27020
   69    43 S   CA   _C7_    67     1.39054   121.99235   142.93046
   70    69 S   OH   _O41    68     1.36821   122.98068    -1.14483
   71    70 S   HO   _H8_    69     0.97410   108.97431     4.79015
  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   8   5   4   3
  12   6   2   1   1  14  15  10   3  13  11  13   9  10   8   3
   8   4   3   1   5   3   2   1   5   3   5   3   2   1   3   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    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    45    51    52  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    42    61    40    41    43    45    49    51    52  
   38    39    40    45    51    52  
   36    37  
   37  
    0  
   39    42    44    53    61    62    67    40    41    43    45    69    51    52  
   42    44    46    53    54    61    62    47    63    67    68    40    41    43    51  
   41    43    45    49    65    69    70    51    42    61  
   43    45    69  
   44    46    53    61    62    55    47    48    57    63    64    67    68  
   45    49    50    59    65    66    69    70    71    51    52  
   46    53    54    61    55    56    47    48    57    58    63    67    68  
   49    50    59    60    65    69    70    51    52  
   53    54    61    62    55    56    47    48    57    67  
   48    57    58    63    64    67    53    55  
   57    58    63  
   50    59    60    65    66    69    51    52  
   59    60    65    51  
   52    59    69  
    0  
   54    61    62    55    56  
   61    62    55  
   56    61  
    0  
   58    63    64    67    68  
   63    64    67  
   60    65    66    69    70  
   65    66    69  
   62    67  
    0  
   64    67    68  
   67    68  
   66    69    70    71  
   69    70  
   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  -0.175000   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   4.2000   0.3000  -0.012500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   40   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   41   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   42   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   43   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   44   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   45   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   46   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   47   3.7500   0.1050   0.470000   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   2.0020   1.7750   0.001000000  -0.843144165
   50   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   51   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   52   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   53   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   54   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   55   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   56   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   57   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   58   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5500   0.0700  -0.170000   2.5000   1.7750   0.001000000  -0.843144165
   60   3.1500   0.2500  -0.830000   1.7825   1.5750   0.001000000  -0.126889456
   61   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   62   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   63   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   64   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   65   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   67   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   68   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   69   3.5500   0.0700   0.150000   2.0020   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    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   570.000  1.307
   33    38   317.000  1.510
   33    51   317.000  1.522
   38    39   549.000  1.340
   38    40   320.000  1.462
   39    42   380.000  1.444
   39    61   320.000  1.462
   42    44   549.000  1.340
   42    67   320.000  1.462
   44    46   380.000  1.444
   44    47   320.000  1.462
   46    53   549.000  1.340
   46    55   510.000  1.338
   53    54   340.000  1.080
   53    61   320.000  1.462
   61    62   570.000  1.229
   55    56   553.000  0.945
   47    48   570.000  1.229
   47    57   320.000  1.462
   57    58   340.000  1.080
   57    63   465.000  1.376
   63    64   745.000  1.250
   63    67   270.000  1.476
   67    68   570.000  1.229
   40    41   570.000  1.229
   40    43   310.000  1.470
   43    45   469.000  1.400
   43    69   469.000  1.400
   45    49   469.000  1.400
   45    51   310.000  1.470
   49    50   367.000  1.080
   49    59   469.000  1.400
   59    60   450.000  1.364
   59    65   469.000  1.400
   65    66   367.000  1.080
   65    69   469.000  1.400
   69    70   450.000  1.364
   70    71   553.000  0.945
   51    52   570.000  1.229
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    85.00000  114.68000
   29    33    38    75.00000  112.20000
   29    33    51    75.00000  110.18000
   33    38    39    70.00000  124.00000
   33    38    40    65.00000  116.34900
   33    51    45    65.00000  115.47100
   33    51    52    80.00000  120.40000
   38    33    34    85.00000  110.90400
   38    39    42    70.00000  123.01800
   38    39    61    65.00000  118.96000
   38    40    41    80.00000  123.72100
   38    40    43    65.00000  117.02400
   39    42    44    70.00000  123.01800
   39    42    67    65.00000  118.96000
   39    61    53    65.00000  118.65900
   39    61    62    80.00000  123.72100
   42    44    46    70.00000  123.01800
   42    44    47    65.00000  118.96000
   42    67    63    65.00000  118.65900
   42    67    68    80.00000  123.72100
   44    46    53    70.00000  123.01800
   44    46    55    80.00000  121.38400
   44    47    48    80.00000  123.72100
   44    47    57    65.00000  118.65900
   46    53    54    35.00000  120.00000
   46    53    61    65.00000  118.96000
   46    55    56    70.00000  107.45700
   53    61    62    80.00000  123.72100
   61    39    42    65.00000  118.96000
   61    53    54    40.00000  117.72500
   55    46    53    80.00000  121.38400
   47    44    46    65.00000  118.96000
   47    57    58    40.00000  117.72500
   47    57    63    60.00000  125.92000
   57    47    48    80.00000  123.72100
   57    63    64    65.00000  137.10300
   57    63    67    65.00000  114.61000
   63    57    58    40.00000  120.50800
   63    67    68    80.00000  120.81000
   67    42    44    65.00000  118.96000
   67    63    64    85.00000  116.28000
   40    38    39    65.00000  118.96000
   40    43    45    60.00000  119.52600
   40    43    69    60.00000  119.52600
   43    40    41    75.00000  123.78400
   43    45    49    63.00000  120.00000
   43    45    51    60.00000  119.52600
   43    69    65    63.00000  120.00000
   43    69    70    70.00000  120.00000
   45    49    50    35.00000  120.00000
   45    49    59    63.00000  120.00000
   45    51    52    75.00000  123.78400
   49    59    60    70.00000  120.00000
   49    59    65    63.00000  120.00000
   59    49    50    35.00000  120.00000
   59    65    66    35.00000  120.00000
   59    65    69    63.00000  120.00000
   65    59    60    70.00000  120.00000
   65    69    70    70.00000  120.00000
   69    43    45    63.00000  120.00000
   69    65    66    35.00000  120.00000
   69    70    71    35.00000  113.00000
   51    33    34    90.00000  108.74100
   51    33    38    70.00000  109.06800
   51    45    49    60.00000  119.52600
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   0.13850  1.0 1.0
   24    29    33    34  -1.34450 -1.0 2.0
   24    29    33    34   0.57400  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  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   0.42700  1.0 1.0
   29    33    38    39  -0.70350 -1.0 2.0
   29    33    38    39  -0.43150  1.0 3.0
   29    33    38    40   0.09700  1.0 1.0
   29    33    38    40   0.15600 -1.0 2.0
   29    33    38    40  -0.50800  1.0 3.0
   29    33    51    45   0.65300  1.0 1.0
   29    33    51    45  -0.03850 -1.0 2.0
   29    33    51    45   0.33900  1.0 3.0
   29    33    51    52   0.30150 -1.0 2.0
   33    38    39    42   7.00000 -1.0 2.0
   33    38    39    61   7.00000 -1.0 2.0
   33    38    40    41  -0.64400  1.0 1.0
   33    38    40    41   0.26850 -1.0 2.0
   33    38    40    43   1.50000 -1.0 2.0
   34    33    38    39   0.39000  1.0 1.0
   34    33    38    39  -0.05800 -1.0 2.0
   34    33    38    39  -0.55150  1.0 3.0
   34    33    38    40   0.09700  1.0 1.0
   34    33    38    40   0.15600 -1.0 2.0
   34    33    38    40  -0.50800  1.0 3.0
   34    33    51    45   0.65300  1.0 1.0
   34    33    51    45  -0.03850 -1.0 2.0
   34    33    51    45   0.33900  1.0 3.0
   34    33    51    52   0.30150 -1.0 2.0
   38    33    51    45   0.65300  1.0 1.0
   38    33    51    45  -0.03850 -1.0 2.0
   38    33    51    45   0.33900  1.0 3.0
   38    33    51    52   0.30150 -1.0 2.0
   38    39    42    44   0.28850  1.0 1.0
   38    39    42    44   2.61350 -1.0 2.0
   38    39    42    44   0.78400  1.0 3.0
   38    39    42    67  -0.18600  1.0 3.0
   38    39    61    53  -1.18350  1.0 1.0
   38    39    61    53   1.45950 -1.0 2.0
   38    39    61    62   1.00000 -1.0 2.0
   38    40   -43    45  -0.11500  1.0 1.0
   38    40   -43    45   1.10450 -1.0 2.0
   38    40   -43    45  -0.48050  1.0 3.0
   38    40    43    69  -0.11500  1.0 1.0
   38    40    43    69   1.10450 -1.0 2.0
   38    40    43    69  -0.48050  1.0 3.0
   39    38    40    41   1.00000 -1.0 2.0
   39    38    40    43  -1.65800  1.0 1.0
   39    38    40    43   0.77650 -1.0 2.0
   39    42    44    46   7.00000 -1.0 2.0
   39    42    44    47   7.00000 -1.0 2.0
   39    42    67    63  -1.18350  1.0 1.0
   39    42    67    63   1.45950 -1.0 2.0
   39    42    67    68   1.00000 -1.0 2.0
   42    39    61    53  -1.18350  1.0 1.0
   42    39    61    53   1.45950 -1.0 2.0
   42    39    61    62   1.00000 -1.0 2.0
   42    44   -46    53   0.28850  1.0 1.0
   42    44   -46    53   2.61350 -1.0 2.0
   42    44   -46    53   0.78400  1.0 3.0
   42    44    46    55   0.50950  1.0 1.0
   42    44    46    55   0.56650 -1.0 2.0
   42    44    46    55   0.34050  1.0 3.0
   42    44    47    48   1.00000 -1.0 2.0
   42    44    47    57  -1.18350  1.0 1.0
   42    44    47    57   1.45950 -1.0 2.0
   44    42    67    63  -1.18350  1.0 1.0
   44    42    67    63   1.45950 -1.0 2.0
   44    42    67    68   1.00000 -1.0 2.0
   44    46    53    54   7.00000 -1.0 2.0
   44    46    53    61   7.00000 -1.0 2.0
   44    46    55    56  -0.66100  1.0 1.0
   44    46    55    56   1.20850 -1.0 2.0
   44    46    55    56  -0.36000  1.0 3.0
   44    47    57    58   0.93700 -1.0 2.0
   44    47   -57    63  -1.18350  1.0 1.0
   44    47   -57    63   1.45950 -1.0 2.0
   46    44    47    48   1.00000 -1.0 2.0
   46    44    47    57  -1.18350  1.0 1.0
   46    44    47    57   1.45950 -1.0 2.0
   46    53   -61    39  -1.18350  1.0 1.0
   46    53   -61    39   1.45950 -1.0 2.0
   46    53    61    62   1.00000 -1.0 2.0
   53    46    55    56  -0.66100  1.0 1.0
   53    46    55    56   1.20850 -1.0 2.0
   53    46    55    56  -0.36000  1.0 3.0
   54    53    61    39   0.93700 -1.0 2.0
   54    53    61    62   0.00000  1.0 1.0
   61    39   -42    44  -0.18600  1.0 3.0
   61    39    42    67   1.08500 -1.0 2.0
   55    46    53    54   7.00000 -1.0 2.0
   55    46    53    61   7.00000 -1.0 2.0
   47    44    46    53  -0.18600  1.0 3.0
   47    44    46    55   1.08500 -1.0 2.0
   47    57    63    64   7.00000 -1.0 2.0
   47    57    63    67   7.00000 -1.0 2.0
   48    47    57    58   0.00000  1.0 1.0
   48    47    57    63   1.00000 -1.0 2.0
   57    63   -67    42  -1.18350  1.0 1.0
   57    63   -67    42   1.45950 -1.0 2.0
   57    63    67    68   1.00000 -1.0 2.0
   58    57    63    64   7.00000 -1.0 2.0
   58    57    63    67   7.00000 -1.0 2.0
   64    63    67    42   1.50000 -1.0 2.0
   64    63    67    68  -0.11900  1.0 1.0
   64    63    67    68   0.76850 -1.0 2.0
   64    63    67    68   0.14100  1.0 3.0
   67    42    44    46   7.00000 -1.0 2.0
   67    42   -44    47   7.00000 -1.0 2.0
   40    38    39    42   7.00000 -1.0 2.0
   40    38    39    61   7.00000 -1.0 2.0
   40    43    45    49   3.62500 -1.0 2.0
   40    43    45    51   3.62500 -1.0 2.0
   40    43    69    65   3.62500 -1.0 2.0
   40    43    69    70   3.62500 -1.0 2.0
   41    40    43    45   1.05000 -1.0 2.0
   41    40    43    69   1.05000 -1.0 2.0
   43    45    49    50   3.62500 -1.0 2.0
   43    45    49    59   3.62500 -1.0 2.0
   43    45   -51    33   2.26350  1.0 1.0
   43    45   -51    33   0.76750 -1.0 2.0
   43    45   -51    33   0.22500  1.0 3.0
   43    45    51    52   1.05000 -1.0 2.0
   43    69    70    71   0.84100 -1.0 2.0
   45    43    69    65   3.62500 -1.0 2.0
   45    43    69    70   3.62500 -1.0 2.0
   45    49    59    60   3.62500 -1.0 2.0
   45    49   -59    65   3.62500 -1.0 2.0
   49    45    51    33   2.26350  1.0 1.0
   49    45    51    33   0.76750 -1.0 2.0
   49    45    51    33   0.22500  1.0 3.0
   49    45    51    52   1.05000 -1.0 2.0
   49    59    65    66   3.62500 -1.0 2.0
   49    59    65    69   3.62500 -1.0 2.0
   50    49    59    60   3.62500 -1.0 2.0
   50    49    59    65   3.62500 -1.0 2.0
   59    65   -69    43   3.62500 -1.0 2.0
   59    65    69    70   3.62500 -1.0 2.0
   60    59    65    66   3.62500 -1.0 2.0
   60    59    65    69   3.62500 -1.0 2.0
   65    69    70    71   0.84100 -1.0 2.0
   66    65    69    43   3.62500 -1.0 2.0
   66    65    69    70   3.62500 -1.0 2.0
   69    43   -45    49   3.62500 -1.0 2.0
   69    43    45    51   3.62500 -1.0 2.0
   51    33    38    39  -0.51250  1.0 1.0
   51    33    38    39  -0.88800 -1.0 2.0
   51    33    38    39   0.08850  1.0 3.0
   51    33   -38    40   0.09700  1.0 1.0
   51    33   -38    40   0.15600 -1.0 2.0
   51    33   -38    40  -0.50800  1.0 3.0
   51    45    49    50   3.62500 -1.0 2.0
   51    45    49    59   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
   33    40    38    39   1.10000 -1.0 2.0
   42    61    39    38   1.10000 -1.0 2.0
   39    67    42    44   1.10000 -1.0 2.0
   46    47    44    42   1.10000 -1.0 2.0
   44    55    46    53   1.10000 -1.0 2.0
   61    54    53    46   1.10000 -1.0 2.0
   39    53    61    62  10.50000 -1.0 2.0
   44    57    47    48  10.50000 -1.0 2.0
   47    58    57    63   1.10000 -1.0 2.0
   67    64    63    57   1.10000 -1.0 2.0
   42    63    67    68  10.50000 -1.0 2.0
   38    43    40    41  10.50000 -1.0 2.0
   45    69    43    40   4.00000 -1.0 2.0
   49    51    45    43   4.00000 -1.0 2.0
   59    50    49    45   1.10000 -1.0 2.0
   65    60    59    49   4.00000 -1.0 2.0
   69    66    65    59   1.10000 -1.0 2.0
   65    70    69    43   4.00000 -1.0 2.0
   33    45    51    52  10.50000 -1.0 2.0
END
