* LIGAND DATABASE FILE (OPLS2005)
*
001      71    73    133    208     391
    1     0 S   NP   _N1_     1    29.98553    90.98399   -19.12873
    2     1 S   H    _HN1     2     1.03208   128.92650   -25.83242
    3     1 S   H    _H1_     3     1.02965   106.88446   103.81689
    4     1 S   H    _H2_     4     1.02726    24.11543     8.82686
    5     1 S   CT   _CA1     5     1.50275    89.92706  -145.01154
    6     5 S   HC   _HA1     6     1.09561   105.37273    64.67377
    7     5 S   CO3  _C1_     7     1.53634   112.82823   -56.03674
    8     7 S   O2Z  _O11     8     1.26376   115.09229   -41.68694
    9     7 S   O2Z  _O12     9     1.26263   114.96355   137.64966
   10     5 S   CT   _CB1    10     1.52688   106.82400  -177.71321
   11    10 S   HC   HB11    11     1.09737   108.68752   -54.45342
   12    10 S   HC   HB12    12     1.09812   110.00970    61.39024
   13    10 S   CT   _CG1    13     1.53071   114.21133  -175.37170
   14    13 S   HC   HG11    14     1.09529   111.30173   -76.25783
   15    13 S   HC   HG12    15     1.09573   110.90439    43.94537
   16    13 S   C    _CD1    16     1.51473   109.05965   162.88883
   17    16 S   O    _OE1    17     1.22836   121.90681  -108.76726
   18    16 S   N    _N2_    18     1.38342   112.77613    68.48368
   19    18 S   H    _HN2    19     1.01549   119.38739    10.26617
   20    18 S   CT1  _CA2    20     1.45467   122.58316  -168.55224
   21    20 S   HC   _HA2    21     1.09689   108.25017    27.39971
   22    20 S   C    _C2_    22     1.52875   108.10146   -89.73554
   23    22 S   O    _O2_    23     1.22949   123.12791   -24.68863
   24    20 S   CT   _CB2    32     1.53364   112.32184   149.41788
   25    24 S   HC   HB21    33     1.09665   109.76332    71.24018
   26    24 S   HC   HB22    34     1.09588   110.40847  -171.96073
   27    22 S   N    _N3_    24     1.38517   112.45423   158.06498
   28    27 S   H    _HN3    25     1.01648   120.36403    -2.54745
   29    24 S   S    _SG2    35     1.83025   115.60956   -48.71569
   30    27 S   CT   _CA3    26     1.45351   122.51573   178.53687
   31    30 S   HC   HA31    27     1.09566   107.86504   -54.75788
   32    30 S   HC   HA32    28     1.09560   107.57532    61.59824
   33    29 S   CT   _C18    36     1.82197   100.47077   -55.24036
   34    33 S   HC   _H3_    37     1.09375   110.93986   -41.31736
   35    33 S   HC   _H4_    38     1.09451   108.13326    75.14657
   36    30 S   CO3  _C3_    29     1.52898   114.27815  -176.68973
   37    36 S   O2Z  _O31    30     1.26343   116.04661     0.14265
   38    36 S   O2Z  _O32    31     1.26432   114.41982  -179.89721
   39    33 S   CM   _C8_    39     1.50101   110.06461  -163.76249
   40    39 S   CMA  _C9_    40     1.35464   126.79695   -98.58938
   41    40 S   OM   _O16    41     1.26302   128.69630     2.76031
   42    40 S   OS   _O18    42     1.42377   109.14528  -175.55274
   43    42 S   CT   _C14    43     1.43520   104.53484   -22.05369
   44    43 S   HC   _H27    44     1.10295   106.56791   -79.90262
   45    43 S   CT   _C12    45     1.54067   112.53061   160.40768
   46    45 S   HC   _H25    46     1.09744   110.91274   -77.22033
   47    39 S   CT   _C13    54     1.50966   122.97433    89.25786
   48    47 S   HC   _H26    55     1.10056   105.54715    82.80090
   49    45 S   CM   _C5_    47     1.51869   109.59614   161.14710
   50    49 S   CM   _C7_    48     1.34605   126.98145    58.11761
   51    49 S   CO4  _C10    62     1.49376   106.23362  -120.06265
   52    51 S   O    _O17    63     1.21638   128.19222   178.28354
   53    50 S   CT   _C11    49     1.51260   120.85252     3.68307
   54    53 S   HC   _H23    50     1.09908   109.36497    60.93619
   55    53 S   HC   _H24    51     1.09925   109.00808   173.52216
   56    50 S   CT   _C16    58     1.50612   125.82188  -177.74918
   57    56 S   HC   _H29    59     1.09580   109.78415   125.27682
   58    56 S   HC   _H30    60     1.08896   114.64370     5.35837
   59    56 S   HC   _H31    61     1.09530   109.93755  -115.73014
   60    51 S   CM   _C4_    64     1.46858   108.61609    -2.38704
   61    60 S   HC   _H22    65     1.07739   123.69213  -176.80224
   62    53 S   CT   _C15    52     1.53837   115.76734   -64.02148
   63    62 S   HC   _H28    53     1.09637   110.90736   -48.49749
   64    45 S   CM   _C6_    66     1.51516   114.98781    45.70373
   65    62 S   OH   _O19    56     1.43186   105.88505  -165.24020
   66    65 S   HO   _H36    57     0.97251   107.56553    68.43153
   67    64 S   CT   _C17    67     1.49376   122.90897   -66.93264
   68    67 S   HC   _H32    68     1.09547   111.25140  -168.68624
   69    67 S   HC   _H33    69     1.09287   111.38799    71.26780
   70    67 S   OH   _O20    70     1.42036   109.42951   -49.63571
   71    70 S   HO   _H37    71     0.97224   106.96682   174.26489
  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   6   5   4   3
  10   4   3   2   1   1  12   8   3   9  15   7  17   7  11   4
  15  14   7   3  10   5   4   4   2   1   1   6   2   3   2   5
   1   1   4   3   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    47  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    62    47    48  
   35    39    40    47  
   39    40    47  
   37    38  
   38  
    0  
   40    41    42    43    44    45    53    62    63    47    48    65  
   41    42    43    44    45    62    47    48  
   42    43    47  
   43    44    45    46    49    62    47    48    64  
   44    45    46    49    50    53    62    63    47    48    65    51    60    64    67  
   45    46    49    62    47    48    64  
   46    49    50    53    62    47    48    56    51    52    60    61    64    67    68    69    70  
   49    50    47    51    60    64    67  
   48    65    66    64    49    50    53    54    55    62    63  
   65    53    62    63  
   50    53    54    55    62    56    57    58    59    51    52    60    61    64    67  
   53    54    55    62    63    65    56    57    58    59    51    52    60    64  
   52    60    61    64    67    53    56  
   60    61    64  
   54    55    62    63    65    66    56    57    58    59  
   55    62    63    65    56  
   62    63    65    56  
   57    58    59    62  
   58    59  
   59  
    0  
   61    64    67    68    69    70  
   64    67  
   63    65    66  
   65    66  
   67    68    69    70    71  
   66  
    0  
   68    69    70    71  
   69    70    71  
   70    71  
   71  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   42   2.8500   0.1400  -0.685000   1.5900   1.4000   0.020110767  -0.896042159
   43   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   50   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   51   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   52   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   53   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   61   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   65   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   66   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   67   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   71   0.5000   0.0300   0.418000   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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    35   340.000  1.090
   33    39   317.000  1.510
   39    40   465.000  1.376
   39    47   317.000  1.510
   40    41   745.000  1.250
   40    42   440.000  1.360
   42    43   320.000  1.410
   43    44   340.000  1.090
   43    45   268.000  1.529
   43    47   268.000  1.529
   45    46   340.000  1.090
   45    49   317.000  1.510
   45    64   317.000  1.510
   49    50   549.000  1.340
   49    51   320.000  1.462
   50    53   317.000  1.510
   50    56   317.000  1.510
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    62   268.000  1.529
   62    63   340.000  1.090
   62    47   268.000  1.529
   62    65   320.000  1.410
   47    48   340.000  1.090
   65    66   553.000  0.945
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    59   340.000  1.090
   51    52   570.000  1.229
   51    60   320.000  1.462
   60    61   340.000  1.080
   60    64   549.000  1.340
   64    67   317.000  1.510
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   320.000  1.410
   70    71   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    35    35.00000  109.50000
   29    33    39    75.00000  112.20000
   33    39    40    70.00000  124.00000
   33    39    47    65.00000  117.92700
   35    33    34    33.00000  107.80000
   39    33    34    35.00000  109.50000
   39    33    35    35.00000  109.50000
   39    40    41    65.00000  137.10300
   39    40    42    80.00000  120.01400
   39    47    43    70.00000  112.02700
   39    47    62    70.00000  112.02700
   39    47    48    35.00000  109.50000
   40    42    43    90.00000  111.18400
   42    40    41    65.00000  121.00000
   42    43    44    35.00000  109.50000
   42    43    45    50.00000  109.50000
   42    43    47    50.00000  109.50000
   43    45    46    37.50000  110.70000
   43    45    49    70.00000  112.02700
   43    45    64    70.00000  112.02700
   43    47    62    58.35000  112.70000
   43    47    48    37.50000  110.70000
   45    43    44    37.50000  110.70000
   45    49    50    70.00000  124.00000
   45    49    51    65.00000  116.34900
   45    64    60    70.00000  124.00000
   45    64    67    65.00000  117.92700
   49    45    46    35.00000  109.50000
   49    50    53    70.00000  124.00000
   49    50    56    70.00000  124.00000
   49    51    52    80.00000  123.72100
   49    51    60    65.00000  118.65900
   50    53    54    35.00000  109.50000
   50    53    55    35.00000  109.50000
   50    53    62    70.00000  112.02700
   50    56    57    35.00000  109.50000
   50    56    58    35.00000  109.50000
   50    56    59    35.00000  109.50000
   53    62    63    37.50000  110.70000
   53    62    47    58.35000  112.70000
   53    62    65    50.00000  109.50000
   55    53    54    33.00000  107.80000
   62    53    54    37.50000  110.70000
   62    53    55    37.50000  110.70000
   62    47    48    37.50000  110.70000
   62    65    66    55.00000  108.50000
   47    39    40    70.00000  124.00000
   47    43    44    37.50000  110.70000
   47    43    45    58.35000  112.70000
   47    62    63    37.50000  110.70000
   65    62    63    35.00000  109.50000
   65    62    47    50.00000  109.50000
   56    50    53    65.00000  117.92700
   58    56    57    33.00000  107.80000
   59    56    57    33.00000  107.80000
   59    56    58    33.00000  107.80000
   51    49    50    65.00000  118.96000
   51    60    61    40.00000  117.72500
   51    60    64    65.00000  118.96000
   60    51    52    80.00000  123.72100
   60    64    67    70.00000  124.00000
   64    45    46    35.00000  109.50000
   64    45    49    70.00000  110.12100
   64    60    61    35.00000  120.00000
   64    67    68    35.00000  109.50000
   64    67    69    35.00000  109.50000
   64    67    70    90.00000  110.39200
   67    70    71    55.00000  108.50000
   69    67    68    33.00000  107.80000
   70    67    68    35.00000  109.50000
   70    67    69    35.00000  109.50000
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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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    35   0.32350  1.0 3.0
   24    29    33    39  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    39    40   0.42700  1.0 1.0
   29    33    39    40  -0.70350 -1.0 2.0
   29    33    39    40  -0.43150  1.0 3.0
   29    33    39    47   0.30250  1.0 1.0
   29    33    39    47  -0.14950 -1.0 2.0
   29    33    39    47   0.36900  1.0 3.0
   33    39    40    41   7.00000 -1.0 2.0
   33    39    40    42   7.00000 -1.0 2.0
   33    39    47    43   0.46850  1.0 1.0
   33    39    47    43   0.08550 -1.0 2.0
   33    39    47    43   0.09800  1.0 3.0
   33    39    47    62   0.46850  1.0 1.0
   33    39    47    62   0.08550 -1.0 2.0
   33    39    47    62   0.09800  1.0 3.0
   33    39    47    48   0.34800  1.0 3.0
   34    33    39    40   0.00000  1.0 1.0
   34    33    39    47   0.34800  1.0 3.0
   35    33    39    40   0.00000  1.0 1.0
   35    33    39    47   0.34800  1.0 3.0
   39    40   -42    43  -2.26850  1.0 1.0
   39    40   -42    43   3.39050 -1.0 2.0
   40    39   -47    43   0.09850  1.0 1.0
   40    39   -47    43   0.15250 -1.0 2.0
   40    39   -47    43  -0.50650  1.0 3.0
   40    39    47    62   0.09850  1.0 1.0
   40    39    47    62   0.15250 -1.0 2.0
   40    39    47    62  -0.50650  1.0 3.0
   40    39    47    48   0.00000  1.0 1.0
   40    42    43    44   0.08050  1.0 3.0
   40    42    43    45  -0.46850  1.0 1.0
   40    42    43    45   0.09300 -1.0 2.0
   40    42    43    45  -0.12850  1.0 3.0
   40    42   -43    47  -0.46850  1.0 1.0
   40    42   -43    47   0.09300 -1.0 2.0
   40    42   -43    47  -0.12850  1.0 3.0
   41    40    42    43   2.00000 -1.0 2.0
   42    43    45    46   0.23400  1.0 3.0
   42    43    45    49   0.61850  1.0 1.0
   42    43    45    49  -0.22750 -1.0 2.0
   42    43    45    49   0.15300  1.0 3.0
   42    43    45    64   0.61850  1.0 1.0
   42    43    45    64  -0.22750 -1.0 2.0
   42    43    45    64   0.15300  1.0 3.0
   42    43   -47    39   0.61850  1.0 1.0
   42    43   -47    39  -0.22750 -1.0 2.0
   42    43   -47    39   0.15300  1.0 3.0
   42    43    47    62   0.62750  1.0 1.0
   42    43    47    62  -0.30950 -1.0 2.0
   42    43    47    62   0.27300  1.0 3.0
   42    43    47    48   0.23400  1.0 3.0
   43    45    49    50   0.09850  1.0 1.0
   43    45    49    50   0.15250 -1.0 2.0
   43    45    49    50  -0.50650  1.0 3.0
   43    45    49    51   0.09700  1.0 1.0
   43    45    49    51   0.15600 -1.0 2.0
   43    45    49    51  -0.50800  1.0 3.0
   43    45    64    60   0.09850  1.0 1.0
   43    45    64    60   0.15250 -1.0 2.0
   43    45    64    60  -0.50650  1.0 3.0
   43    45    64    67   0.46850  1.0 1.0
   43    45    64    67   0.08550 -1.0 2.0
   43    45    64    67   0.09800  1.0 3.0
   44    43    45    46   0.15000  1.0 3.0
   44    43    45    49   0.15000  1.0 3.0
   44    43    45    64   0.15000  1.0 3.0
   44    43    47    39   0.15000  1.0 3.0
   44    43    47    62   0.15000  1.0 3.0
   44    43    47    48   0.15000  1.0 3.0
   45    43    47    39   0.34400  1.0 1.0
   45    43    47    39   0.09450 -1.0 2.0
   45    43    47    39   0.11100  1.0 3.0
   45    43    47    62   0.56750  1.0 1.0
   45    43    47    62  -0.07550 -1.0 2.0
   45    43    47    62   0.20000  1.0 3.0
   45    43    47    48   0.15000  1.0 3.0
   45    49    50    53   7.00000 -1.0 2.0
   45    49    50    56   7.00000 -1.0 2.0
   45    49    51    52  -0.64400  1.0 1.0
   45    49    51    52   0.26850 -1.0 2.0
   45    49   -51    60   1.50000 -1.0 2.0
   45    64    67    68   0.34800  1.0 3.0
   45    64    67    69   0.34800  1.0 3.0
   45    64    67    70   0.18000  1.0 1.0
   45    64    67    70   0.16450 -1.0 2.0
   45    64    67    70   0.04450  1.0 3.0
   46    45    49    50   0.00000  1.0 1.0
   46    45    49    51   0.15000  1.0 3.0
   46    45    64    60   0.00000  1.0 1.0
   46    45    64    67   0.34800  1.0 3.0
   49    45   -64    60  -0.28300  1.0 1.0
   49    45   -64    60   0.26700 -1.0 2.0
   49    45   -64    60  -0.63300  1.0 3.0
   49    45    64    67   0.09700  1.0 1.0
   49    45    64    67   0.15600 -1.0 2.0
   49    45    64    67  -0.50800  1.0 3.0
   49    50    53    54   0.00000  1.0 1.0
   49    50    53    55   0.00000  1.0 1.0
   49    50    53    62   0.09850  1.0 1.0
   49    50    53    62   0.15250 -1.0 2.0
   49    50    53    62  -0.50650  1.0 3.0
   49    50    56    57   0.00000  1.0 1.0
   49    50    56    58   0.00000  1.0 1.0
   49    50    56    59   0.00000  1.0 1.0
   49    51    60    61   0.93700 -1.0 2.0
   49    51   -60    64  -1.18350  1.0 1.0
   49    51   -60    64   1.45950 -1.0 2.0
   50    49    51    52   1.00000 -1.0 2.0
   50    49    51    60  -1.18350  1.0 1.0
   50    49    51    60   1.45950 -1.0 2.0
   50    53    62    63   0.15000  1.0 3.0
   50    53    62    47   0.34400  1.0 1.0
   50    53    62    47   0.09450 -1.0 2.0
   50    53    62    47   0.11100  1.0 3.0
   50    53    62    65   1.05650  1.0 1.0
   50    53    62    65   0.15600 -1.0 2.0
   50    53    62    65   0.53150  1.0 3.0
   53    50    56    57   0.34800  1.0 3.0
   53    50    56    58   0.34800  1.0 3.0
   53    50    56    59   0.34800  1.0 3.0
   53    62    47    39   0.34400  1.0 1.0
   53    62    47    39   0.09450 -1.0 2.0
   53    62    47    39   0.11100  1.0 3.0
   53    62    47    43   0.56750  1.0 1.0
   53    62    47    43  -0.07550 -1.0 2.0
   53    62    47    43   0.20000  1.0 3.0
   53    62    47    48   0.15000  1.0 3.0
   53    62    65    66  -0.11600  1.0 1.0
   53    62    65    66  -0.09450 -1.0 2.0
   53    62    65    66   0.21250  1.0 3.0
   54    53    62    63   0.15000  1.0 3.0
   54    53    62    47   0.15000  1.0 3.0
   54    53    62    65   0.23400  1.0 3.0
   55    53    62    63   0.15000  1.0 3.0
   55    53    62    47   0.15000  1.0 3.0
   55    53    62    65   0.23400  1.0 3.0
   63    62    47    39   0.15000  1.0 3.0
   63    62    47    43   0.15000  1.0 3.0
   63    62    47    48   0.15000  1.0 3.0
   63    62    65    66   0.19450  1.0 3.0
   47    39    40    41   7.00000 -1.0 2.0
   47    39   -40    42   7.00000 -1.0 2.0
   47    43    45    46   0.15000  1.0 3.0
   47    43    45    49   0.34400  1.0 1.0
   47    43    45    49   0.09450 -1.0 2.0
   47    43    45    49   0.11100  1.0 3.0
   47    43    45    64   0.34400  1.0 1.0
   47    43    45    64   0.09450 -1.0 2.0
   47    43    45    64   0.11100  1.0 3.0
   47    62    65    66  -0.11600  1.0 1.0
   47    62    65    66  -0.09450 -1.0 2.0
   47    62    65    66   0.21250  1.0 3.0
   65    62    47    39   1.05650  1.0 1.0
   65    62    47    39   0.15600 -1.0 2.0
   65    62    47    39   0.53150  1.0 3.0
   65    62    47    43   0.86500  1.0 1.0
   65    62    47    43  -0.17500 -1.0 2.0
   65    62    47    43   0.20800  1.0 3.0
   65    62    47    48   0.23400  1.0 3.0
   56    50    53    54   0.34800  1.0 3.0
   56    50    53    55   0.34800  1.0 3.0
   56    50    53    62   0.46850  1.0 1.0
   56    50    53    62   0.08550 -1.0 2.0
   56    50    53    62   0.09800  1.0 3.0
   51    49    50    53   7.00000 -1.0 2.0
   51    49    50    56   7.00000 -1.0 2.0
   51    60   -64    45   7.00000 -1.0 2.0
   51    60    64    67   7.00000 -1.0 2.0
   52    51    60    61   0.00000  1.0 1.0
   52    51    60    64   1.00000 -1.0 2.0
   60    64    67    68   0.00000  1.0 1.0
   60    64    67    69   0.00000  1.0 1.0
   60    64    67    70   0.67800  1.0 1.0
   60    64    67    70   0.47050 -1.0 2.0
   60    64    67    70  -0.62500  1.0 3.0
   61    60    64    45   7.00000 -1.0 2.0
   61    60    64    67   7.00000 -1.0 2.0
   64    45    49    50  -0.28300  1.0 1.0
   64    45    49    50   0.26700 -1.0 2.0
   64    45    49    50  -0.63300  1.0 3.0
   64    45   -49    51   0.09700  1.0 1.0
   64    45   -49    51   0.15600 -1.0 2.0
   64    45   -49    51  -0.50800  1.0 3.0
   64    67    70    71  -0.07800  1.0 1.0
   64    67    70    71  -0.21500 -1.0 2.0
   64    67    70    71  -0.03150  1.0 3.0
   68    67    70    71   0.19450  1.0 3.0
   69    67    70    71   0.19450  1.0 3.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   38    30    36    37  10.50000 -1.0 2.0
   33    47    39    40   1.10000 -1.0 2.0
   41    42    40    39   1.10000 -1.0 2.0
   45    51    49    50   1.10000 -1.0 2.0
   53    56    50    49   1.10000 -1.0 2.0
   49    60    51    52  10.50000 -1.0 2.0
   51    61    60    64   1.10000 -1.0 2.0
   45    67    64    60   1.10000 -1.0 2.0
END
