* LIGAND DATABASE FILE (OPLS2005)
*
001      75    78    139    233     419
    1     0 S   NP   _N1_     1    30.24061    93.50594   -16.04951
    2     1 S   H    _HN1     2     1.02765    58.48388   -17.36879
    3     1 S   H    _H1_     3     1.03001   151.40128    51.06418
    4     1 S   H    _H2_     4     1.02989    60.54639   121.92131
    5     1 S   CT   _CA1     5     1.50526    97.70513  -128.93916
    6     5 S   HC   _HA1     6     1.09670   105.01132     2.78207
    7     5 S   CO3  _C1_     7     1.54598   110.72352  -113.42400
    8     7 S   O2Z  _O11     8     1.26200   116.62918  -116.12488
    9     7 S   O2Z  _O12     9     1.26514   113.86261    62.43196
   10     5 S   CT   _CB1    10     1.53100   106.62039   118.72546
   11    10 S   HC   HB11    11     1.09856   109.57771   -50.23942
   12    10 S   HC   HB12    12     1.09634   109.46604    64.77740
   13    10 S   CT   _CG1    13     1.53357   113.37843  -170.54358
   14    13 S   HC   HG11    14     1.09547   112.49565   -21.01932
   15    13 S   HC   HG12    15     1.09607   110.07525    97.65313
   16    13 S   C    _CD1    16     1.51558   110.64892  -142.18564
   17    16 S   O    _OE1    17     1.22778   122.00780  -106.96807
   18    16 S   N    _N2_    18     1.38364   112.40429    71.84799
   19    18 S   H    _HN2    19     1.01882   118.60462     6.46499
   20    18 S   CT1  _CA2    20     1.45736   123.52655  -177.05496
   21    20 S   HC   _HA2    21     1.09727   108.96001    17.97737
   22    20 S   C    _C2_    22     1.52823   107.42487   -99.32337
   23    22 S   O    _O2_    23     1.22930   122.97635   -26.70833
   24    20 S   CT   _CB2    32     1.53482   111.69145   140.73536
   25    24 S   HC   HB21    33     1.09330   109.48269    55.42492
   26    24 S   HC   HB22    34     1.09460   110.04997   174.10685
   27    22 S   N    _N3_    24     1.38645   112.32262   156.20230
   28    27 S   H    _HN3    25     1.01498   119.68396     0.80454
   29    24 S   S    _SG2    35     1.82862   110.57453   -66.20510
   30    27 S   CT   _CA3    26     1.45448   122.88262   175.12050
   31    30 S   HC   HA31    27     1.09536   108.97844    29.67967
   32    30 S   HC   HA32    28     1.09479   107.15759   146.82793
   33    29 S   CT   _C5_    36     1.86197   102.32805   166.36763
   34    30 S   CO3  _C3_    29     1.53070   113.61422   -93.33547
   35    34 S   O2Z  _O31    30     1.26376   115.84827   -30.47802
   36    34 S   O2Z  _O32    31     1.26418   114.67212   150.42737
   37    33 S   CM   _C22    37     1.51492   105.68720   173.42705
   38    37 S   HC   _H17    38     1.09211   115.24152   -76.22303
   39    33 S   CT   _C6_    63     1.54638   114.68422   -65.44563
   40    39 S   HC   _H7_    64     1.09553   110.54720    50.69846
   41    39 S   HC   _H8_    65     1.10007   108.77365   166.21658
   42    33 S   CT   _C4_    72     1.53984   108.97150    56.76694
   43    42 S   HC   _H4_    73     1.09549   111.87218   -70.50375
   44    42 S   HC   _H5_    74     1.09748   110.88353   170.61066
   45    42 S   HC   _H6_    75     1.09684   112.19542    51.23042
   46    37 S   CMA  _C21    39     1.35244   127.25739   109.29057
   47    46 S   OM   _O36    40     1.26441   127.18301   168.41479
   48    46 S   CT   _C20    41     1.54835   119.81148    -5.14514
   49    48 S   HC   _H3_    42     1.10545   103.60323   111.18980
   50    48 S   CA   _C11    43     1.54185   120.37806  -131.53502
   51    50 S   CA   _C12    44     1.40067   124.25690     4.01859
   52    51 S   HA   _H11    45     1.08753   119.86694     1.08065
   53    50 S   CA   _C10    56     1.40767   117.99412  -178.99051
   54    51 S   CA   _C13    46     1.40653   122.30397  -179.90935
   55    53 S   CO4  _C9_    57     1.49154   118.27868    -4.76592
   56    55 S   O    _O33    58     1.22884   120.06869   157.82717
   57    54 S   CA   _C14    47     1.40555   119.35095   179.29640
   58    57 S   HA   _H12    48     1.08900   120.38610    -0.19584
   59    55 S   CT   _C8_    59     1.51961   119.06838   -23.11555
   60    59 S   HC   _H9_    60     1.09671   106.63549   122.84270
   61    59 S   HC   _H10    61     1.09622   107.24679  -120.71677
   62    57 S   CA   _C15    49     1.39218   121.29533  -179.98022
   63    62 S   HA   _H13    50     1.08610   120.05528   179.82306
   64    48 S   CT   _C7_    62     1.55520   114.85753    -5.02430
   65    62 S   CA   _C16    51     1.38672   119.72466    -0.08156
   66    65 S   HA   _H14    52     1.08631   119.29878   180.00000
   67    64 S   OH   _O37    66     1.43344   110.16535   -85.75829
   68    67 S   HO   _H18    67     0.97513   108.10177   178.48057
   69    65 S   CA   _C17    53     1.39800   119.67273    -0.10279
   70    54 S   CA   _C18    54     1.41524   120.44328    -0.91557
   71    69 S   OH   _O35    70     1.37274   117.94894  -179.68534
   72    71 S   HO   _H16    71     0.97184   109.27712    -1.76813
   73    70 S   CA   _C19    55     1.42232   117.22695    -0.88559
   74    73 S   OH   _O34    68     1.37434   117.75356  -177.31183
   75    74 S   HO   _H15    69     0.97323   109.63235  -174.55961
  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  12   5   4   3
  15   2   1   1  14   5  17   6   5   5   2   1   1   9   4  14
   6  13  11   4  12  10   9   5   8   4   6   3   2   6   3   2
   6   3   1   1   5   5   2   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    39    42    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    46    64    39    40    41    42    43    44    45  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    46    47    48    59    64    39    40    41    67    42    43    44    45  
   35    36  
   36  
    0  
   38    46    47    48    49    50    64    39    40    41    42    43    44    45  
   46    47    48    39    42  
   40    41    67    68    42    43    44    45    46    48    49    50    55    59    60    61    64  
   41    67    42    48    59    64  
   67    42    48    59    64  
   43    44    45    46    64  
   44    45  
   45  
    0  
   47    48    49    50    51    53    59    64    67  
   48    49    50    64  
   49    50    51    52    54    73    53    55    59    60    61    64    67    68  
   50    51    53    59    64    67  
   51    52    54    57    70    73    53    55    56    59    64    67    74  
   52    54    57    58    62    69    70    73    53    55    64  
   54    57    70    53  
   55    56    59    60    61    64    74    75    54    69    70    73  
   57    58    62    63    65    69    70    73    74    71  
   56    59    60    61    64    67    74    70    73  
   59    60    61    64    73  
   58    62    63    65    66    69    70    73  
   62    63    65    70  
   60    61    64    67    68    73  
   61    64    67  
   64    67  
   63    65    66    69    70    71  
   65    66    69  
   67    68  
   66    69    70    73    71    72  
   69    70    71  
   68  
    0  
   70    73    74    71    72  
   73    74    75    71    72  
   72    73  
    0  
   74    75  
   75  
    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  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   47   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   48   3.5000   0.0660   0.055000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   51   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   52   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   53   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   54   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   55   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   56   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   57   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   61   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   62   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   63   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   64   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   68   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   69   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   70   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   71   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   72   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   73   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   74   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   75   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    39   268.000  1.529
   33    42   268.000  1.529
   37    38   340.000  1.080
   37    46   465.000  1.376
   46    47   745.000  1.250
   46    48   270.000  1.512
   48    49   340.000  1.090
   48    50   317.000  1.510
   48    64   268.000  1.529
   50    51   469.000  1.400
   50    53   469.000  1.400
   51    52   367.000  1.080
   51    54   469.000  1.400
   54    57   469.000  1.400
   54    70   469.000  1.400
   57    58   367.000  1.080
   57    62   469.000  1.400
   62    63   367.000  1.080
   62    65   469.000  1.400
   65    66   367.000  1.080
   65    69   469.000  1.400
   69    70   469.000  1.400
   69    71   450.000  1.364
   70    73   469.000  1.400
   73    53   469.000  1.400
   73    74   450.000  1.364
   53    55   310.000  1.470
   55    56   570.000  1.229
   55    59   317.000  1.522
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    64   268.000  1.529
   64    39   268.000  1.529
   64    67   320.000  1.410
   39    40   340.000  1.090
   39    41   340.000  1.090
   67    68   553.000  0.945
   74    75   553.000  0.945
   71    72   553.000  0.945
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    45   340.000  1.090
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    39    75.00000  111.63000
   29    33    42    75.00000  111.63000
   33    37    38    35.00000  117.00000
   33    37    46    70.00000  124.00000
   33    39    64    58.35000  112.70000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    42    43    37.50000  110.70000
   33    42    44    37.50000  110.70000
   33    42    45    37.50000  110.70000
   37    46    47    65.00000  137.10300
   37    46    48    65.00000  122.18000
   46    37    38    40.00000  120.50800
   46    48    49    45.00000  110.52000
   46    48    50    70.00000  112.99600
   46    48    64    70.00000  112.02700
   48    46    47    85.00000  112.85300
   48    50    51    70.00000  120.00000
   48    50    53    70.00000  120.00000
   48    64    59    58.35000  112.70000
   48    64    39    58.35000  112.70000
   48    64    67    50.00000  109.50000
   50    48    49    35.00000  109.50000
   50    51    52    35.00000  120.00000
   50    51    54    63.00000  120.00000
   50    53    73    63.00000  120.00000
   50    53    55    60.00000  119.52600
   51    54    57    63.00000  120.00000
   51    54    70    63.00000  120.00000
   54    51    52    35.00000  120.00000
   54    57    58    35.00000  120.00000
   54    57    62    63.00000  120.00000
   54    70    69    63.00000  120.00000
   54    70    73    63.00000  120.00000
   57    62    63    35.00000  120.00000
   57    62    65    63.00000  120.00000
   62    57    58    35.00000  120.00000
   62    65    66    35.00000  120.00000
   62    65    69    63.00000  120.00000
   65    62    63    35.00000  120.00000
   65    69    70    63.00000  120.00000
   65    69    71    70.00000  120.00000
   69    65    66    35.00000  120.00000
   69    70    73    63.00000  120.00000
   69    71    72    35.00000  113.00000
   70    54    57    63.00000  120.00000
   70    73    53    63.00000  120.00000
   70    73    74    70.00000  120.00000
   73    53    55    60.00000  119.52600
   73    74    75    35.00000  113.00000
   53    50    51    63.00000  120.00000
   53    55    56    75.00000  123.78400
   53    55    59    65.00000  115.47100
   55    59    60    35.00000  109.50000
   55    59    61    35.00000  109.50000
   55    59    64    63.00000  111.10000
   59    55    56    80.00000  120.40000
   59    64    39    58.35000  112.70000
   59    64    67    50.00000  109.50000
   61    59    60    33.00000  107.80000
   64    48    49    37.50000  110.70000
   64    48    50    70.00000  112.17500
   64    59    60    37.50000  110.70000
   64    59    61    37.50000  110.70000
   64    39    40    37.50000  110.70000
   64    39    41    37.50000  110.70000
   64    67    68    55.00000  108.50000
   39    33    37    70.00000  112.02700
   41    39    40    33.00000  107.80000
   67    64    39    50.00000  109.50000
   74    73    53    70.00000  120.00000
   71    69    70    70.00000  120.00000
   42    33    37    70.00000  112.02700
   42    33    39    58.35000  112.70000
   44    42    43    33.00000  107.80000
   45    42    43    33.00000  107.80000
   45    42    44    33.00000  107.80000
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    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   24    29    33    42   0.01700  1.0 1.0
   24    29    33    42  -0.23550 -1.0 2.0
   24    29    33    42   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    38   0.00000  1.0 1.0
   29    33    37    46   0.42700  1.0 1.0
   29    33    37    46  -0.70350 -1.0 2.0
   29    33    37    46  -0.43150  1.0 3.0
   29    33    39    64   0.44750  1.0 1.0
   29    33    39    64  -0.17800 -1.0 2.0
   29    33    39    64   0.20200  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    42    43   0.15000  1.0 3.0
   29    33    42    44   0.15000  1.0 3.0
   29    33    42    45   0.15000  1.0 3.0
   33    37    46    47   7.00000 -1.0 2.0
   33    37    46    48   7.00000 -1.0 2.0
   37    33    39    64   0.34400  1.0 1.0
   37    33    39    64   0.09450 -1.0 2.0
   37    33    39    64   0.11100  1.0 3.0
   37    33    39    40   0.15000  1.0 3.0
   37    33    39    41   0.15000  1.0 3.0
   37    33    42    43   0.15000  1.0 3.0
   37    33    42    44   0.15000  1.0 3.0
   37    33    42    45   0.15000  1.0 3.0
   37    46    48    49   0.00000  1.0 1.0
   37    46    48    50   1.44450  1.0 1.0
   37    46    48    50   0.06600 -1.0 2.0
   37    46    48    50   0.29250  1.0 3.0
   37    46   -48    64   0.09850  1.0 1.0
   37    46   -48    64   0.15250 -1.0 2.0
   37    46   -48    64  -0.50650  1.0 3.0
   38    37    46    47   7.00000 -1.0 2.0
   38    37    46    48   7.00000 -1.0 2.0
   46    48    50    51   0.18050 -1.0 2.0
   46    48    50    53   0.18050 -1.0 2.0
   46    48    64    59   0.34400  1.0 1.0
   46    48    64    59   0.09450 -1.0 2.0
   46    48    64    59   0.11100  1.0 3.0
   46    48    64    39   0.34400  1.0 1.0
   46    48    64    39   0.09450 -1.0 2.0
   46    48    64    39   0.11100  1.0 3.0
   46    48    64    67   1.05650  1.0 1.0
   46    48    64    67   0.15600 -1.0 2.0
   46    48    64    67   0.53150  1.0 3.0
   47    46    48    49   0.00000  1.0 1.0
   47    46    48    50   0.09700  1.0 1.0
   47    46    48    50   0.15600 -1.0 2.0
   47    46    48    50  -0.50800  1.0 3.0
   47    46    48    64   0.09700  1.0 1.0
   47    46    48    64   0.15600 -1.0 2.0
   47    46    48    64  -0.50800  1.0 3.0
   48    50    51    52   3.62500 -1.0 2.0
   48    50    51    54   3.62500 -1.0 2.0
   48    50    53    73   3.62500 -1.0 2.0
   48    50    53    55   3.62500 -1.0 2.0
   48    64   -39    33   0.56750  1.0 1.0
   48    64   -39    33  -0.07550 -1.0 2.0
   48    64   -39    33   0.20000  1.0 3.0
   48    64    39    40   0.15000  1.0 3.0
   48    64    39    41   0.15000  1.0 3.0
   48    64    67    68  -0.11600  1.0 1.0
   48    64    67    68  -0.09450 -1.0 2.0
   48    64    67    68   0.21250  1.0 3.0
   49    48    50    51   0.00000  1.0 1.0
   49    48    50    53   0.00000  1.0 1.0
   49    48    64    59   0.15000  1.0 3.0
   49    48    64    39   0.15000  1.0 3.0
   49    48    64    67   0.23400  1.0 3.0
   50    48    64    59  -0.03700  1.0 1.0
   50    48    64    59   0.37200 -1.0 2.0
   50    48    64    59  -0.47300  1.0 3.0
   50    48    64    39  -0.03700  1.0 1.0
   50    48    64    39   0.37200 -1.0 2.0
   50    48    64    39  -0.47300  1.0 3.0
   50    48    64    67   1.13150  1.0 1.0
   50    48    64    67  -1.01400 -1.0 2.0
   50    51    54    57   3.62500 -1.0 2.0
   50    51    54    70   3.62500 -1.0 2.0
   50    53    55    56   1.05000 -1.0 2.0
   50    53   -55    59   2.26350  1.0 1.0
   50    53   -55    59   0.76750 -1.0 2.0
   50    53   -55    59   0.22500  1.0 3.0
   51    50    53    73   3.62500 -1.0 2.0
   51    50    53    55   3.62500 -1.0 2.0
   51    54    57    58   3.62500 -1.0 2.0
   51    54    57    62   3.62500 -1.0 2.0
   51    54    70    69   3.62500 -1.0 2.0
   51    54   -70    73   3.62500 -1.0 2.0
   52    51    54    57   3.62500 -1.0 2.0
   52    51    54    70   3.62500 -1.0 2.0
   54    57    62    63   3.62500 -1.0 2.0
   54    57    62    65   3.62500 -1.0 2.0
   54    70    73    53   3.62500 -1.0 2.0
   54    70    73    74   3.62500 -1.0 2.0
   57    54    70    69   3.62500 -1.0 2.0
   57    54    70    73   3.62500 -1.0 2.0
   57    62    65    66   3.62500 -1.0 2.0
   57    62   -65    69   3.62500 -1.0 2.0
   58    57    62    63   3.62500 -1.0 2.0
   58    57    62    65   3.62500 -1.0 2.0
   62    65    69    70   3.62500 -1.0 2.0
   62    65    69    71   3.62500 -1.0 2.0
   63    62    65    66   3.62500 -1.0 2.0
   63    62    65    69   3.62500 -1.0 2.0
   65    69   -70    54   3.62500 -1.0 2.0
   65    69    70    73   3.62500 -1.0 2.0
   65    69    71    72   0.84100 -1.0 2.0
   66    65    69    70   3.62500 -1.0 2.0
   66    65    69    71   3.62500 -1.0 2.0
   69    70    73    53   3.62500 -1.0 2.0
   69    70    73    74   3.62500 -1.0 2.0
   70    54    57    58   3.62500 -1.0 2.0
   70    54   -57    62   3.62500 -1.0 2.0
   70    69    71    72   0.84100 -1.0 2.0
   70    73   -53    50   3.62500 -1.0 2.0
   70    73    53    55   3.62500 -1.0 2.0
   70    73    74    75   0.84100 -1.0 2.0
   73    53    55    56   1.05000 -1.0 2.0
   73    53    55    59   2.26350  1.0 1.0
   73    53    55    59   0.76750 -1.0 2.0
   73    53    55    59   0.22500  1.0 3.0
   53    50    51    52   3.62500 -1.0 2.0
   53    50   -51    54   3.62500 -1.0 2.0
   53    73    74    75   0.84100 -1.0 2.0
   53    55    59    60   0.00000  1.0 1.0
   53    55    59    61   0.00000  1.0 1.0
   53    55    59    64   0.05850 -1.0 2.0
   53    55    59    64   0.17250  1.0 3.0
   55    59   -64    48  -0.95700  1.0 1.0
   55    59   -64    48  -0.18200 -1.0 2.0
   55    59   -64    48   0.29450  1.0 3.0
   55    59    64    39  -0.95700  1.0 1.0
   55    59    64    39  -0.18200 -1.0 2.0
   55    59    64    39   0.29450  1.0 3.0
   55    59    64    67  -0.09450  1.0 1.0
   55    59    64    67  -1.12950 -1.0 2.0
   55    59    64    67   0.54000  1.0 3.0
   56    55    59    60   0.00000  1.0 1.0
   56    55    59    61   0.00000  1.0 1.0
   56    55    59    64   0.30150 -1.0 2.0
   59    64    39    33   0.56750  1.0 1.0
   59    64    39    33  -0.07550 -1.0 2.0
   59    64    39    33   0.20000  1.0 3.0
   59    64    39    40   0.15000  1.0 3.0
   59    64    39    41   0.15000  1.0 3.0
   59    64    67    68  -0.11600  1.0 1.0
   59    64    67    68  -0.09450 -1.0 2.0
   59    64    67    68   0.21250  1.0 3.0
   60    59    64    48   0.15000  1.0 3.0
   60    59    64    39   0.15000  1.0 3.0
   60    59    64    67   0.23400  1.0 3.0
   61    59    64    48   0.15000  1.0 3.0
   61    59    64    39   0.15000  1.0 3.0
   61    59    64    67   0.23400  1.0 3.0
   64    48    50    51   0.04150 -1.0 2.0
   64    48   -50    53   0.04150 -1.0 2.0
   39    33    37    38   0.00000  1.0 1.0
   39    33   -37    46   0.09850  1.0 1.0
   39    33   -37    46   0.15250 -1.0 2.0
   39    33   -37    46  -0.50650  1.0 3.0
   39    33    42    43   0.15000  1.0 3.0
   39    33    42    44   0.15000  1.0 3.0
   39    33    42    45   0.15000  1.0 3.0
   39    64    67    68  -0.11600  1.0 1.0
   39    64    67    68  -0.09450 -1.0 2.0
   39    64    67    68   0.21250  1.0 3.0
   67    64    39    33   0.86500  1.0 1.0
   67    64    39    33  -0.17500 -1.0 2.0
   67    64    39    33   0.20800  1.0 3.0
   67    64    39    40   0.23400  1.0 3.0
   67    64    39    41   0.23400  1.0 3.0
   74    73    53    50   3.62500 -1.0 2.0
   74    73    53    55   3.62500 -1.0 2.0
   71    69    70    54   3.62500 -1.0 2.0
   71    69    70    73   3.62500 -1.0 2.0
   42    33    37    38   0.00000  1.0 1.0
   42    33    37    46   0.09850  1.0 1.0
   42    33    37    46   0.15250 -1.0 2.0
   42    33    37    46  -0.50650  1.0 3.0
   42    33    39    64   0.56750  1.0 1.0
   42    33    39    64  -0.07550 -1.0 2.0
   42    33    39    64   0.20000  1.0 3.0
   42    33    39    40   0.15000  1.0 3.0
   42    33    39    41   0.15000  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   33    38    37    46   1.10000 -1.0 2.0
   48    47    46    37   1.10000 -1.0 2.0
   51    53    50    48   4.00000 -1.0 2.0
   54    52    51    50   1.10000 -1.0 2.0
   57    70    54    51   4.00000 -1.0 2.0
   62    58    57    54   1.10000 -1.0 2.0
   65    63    62    57   1.10000 -1.0 2.0
   69    66    65    62   1.10000 -1.0 2.0
   70    71    69    65   4.00000 -1.0 2.0
   69    73    70    54   4.00000 -1.0 2.0
   53    74    73    70   4.00000 -1.0 2.0
   73    55    53    50   4.00000 -1.0 2.0
   53    59    55    56  10.50000 -1.0 2.0
END
