* LIGAND DATABASE FILE (OPLS2005)
*
001      73    73    131    199     387
    1     0 S   NP   _N1_     1    29.25164    96.52403   -19.97170
    2     1 S   H    _HN1     2     1.02775    77.81486   -70.88410
    3     1 S   H    _H1_     3     1.02962    87.91371    38.41341
    4     1 S   H    _H2_     4     1.02838    43.53554   155.93755
    5     1 S   CT   _CA1     5     1.50094   153.40516   173.27390
    6     5 S   HC   _HA1     6     1.09570   105.26309    46.33039
    7     5 S   CO3  _C1_     7     1.53878   112.59371   -73.91512
    8     7 S   O2Z  _O11     8     1.26344   114.98273   -38.81308
    9     7 S   O2Z  _O12     9     1.26260   114.97055   140.65797
   10     5 S   CT   _CB1    10     1.53142   107.46457   164.39107
   11    10 S   HC   HB11    11     1.09809   109.52736   -50.24418
   12    10 S   HC   HB12    12     1.09824   110.31541    66.42469
   13    10 S   CT   _CG1    13     1.52902   112.51387  -171.38589
   14    13 S   HC   HG11    14     1.09547   110.17406   -61.21883
   15    13 S   HC   HG12    15     1.09634   110.15772    57.91430
   16    13 S   C    _CD1    16     1.51732   112.62348   178.54344
   17    16 S   O    _OE1    17     1.22663   123.39475    -9.04440
   18    16 S   N    _N2_    18     1.38524   111.26111   171.24144
   19    18 S   H    _HN2    19     1.01551   118.84868     2.28747
   20    18 S   CT1  _CA2    20     1.46179   123.88156  -176.43866
   21    20 S   HC   _HA2    21     1.09716   109.49898   -17.98105
   22    20 S   C    _C2_    22     1.53420   107.88951  -133.80703
   23    22 S   O    _O2_    23     1.22993   122.39348  -144.60259
   24    20 S   CT   _CB2    32     1.53457   110.77088   104.53183
   25    24 S   HC   HB21    33     1.09356   109.09593    50.33942
   26    24 S   HC   HB22    34     1.09484   110.83544   168.95316
   27    22 S   N    _N3_    24     1.38549   113.23578    42.66933
   28    27 S   H    _HN3    25     1.01537   118.90156    -0.41543
   29    24 S   S    _SG2    35     1.82960   111.56132   -72.11232
   30    27 S   CT   _CA3    26     1.45452   123.44518   175.14837
   31    30 S   HC   HA31    27     1.09523   109.22448    24.42811
   32    30 S   HC   HA32    28     1.09494   107.11562   141.44077
   33    29 S   CT   _C13    36     1.87864   102.07263   146.88336
   34    30 S   CO3  _C3_    29     1.52935   113.15513   -99.03689
   35    34 S   O2Z  _O31    30     1.26400   115.43028   -43.31235
   36    34 S   O2Z  _O32    31     1.26359   114.96133   137.62438
   37    33 S   CM   _C12    37     1.52716   106.97437   -72.33921
   38    37 S   HC   _H10    38     1.09008   114.78597   -55.45420
   39    33 S   CM   _C15    65     1.53170   104.71666   173.30160
   40    39 S   HC   _H14    66     1.09324   114.95535    58.58736
   41    33 S   CT   _C14    70     1.54174   108.83158    52.17791
   42    41 S   HC   _H11    71     1.09700   111.79010    55.64886
   43    41 S   HC   _H12    72     1.09507   112.89079   -65.37607
   44    41 S   HC   _H13    73     1.09727   111.22227   175.54003
   45    37 S   CM   _C11    39     1.34564   127.40765   127.14493
   46    45 S   HC   _H9_    40     1.08739   118.41689    -1.19501
   47    39 S   CMA  _C16    67     1.34953   128.82999  -122.08408
   48    47 S   OM   _O34    68     1.25928   131.03564  -179.55063
   49    47 S   HC   _H15    69     1.08840   114.12669     0.41825
   50    45 S   CT   _C10    41     1.52965   126.59932   176.27558
   51    50 S   CM   _C5_    42     1.53192   107.78585  -115.13743
   52    50 S   OH   _O35    63     1.43370   110.04184     1.18680
   53    52 S   HO   _H16    64     0.97085   108.96033    67.74991
   54    51 S   CM   _C6_    43     1.34367   123.00163   -99.16665
   55    54 S   HC   _H6_    44     1.08479   121.96967   179.49720
   56    51 S   CT   _C4_    59     1.50880   117.43367    79.36988
   57    56 S   HC   _H3_    60     1.09455   110.73537   -54.90074
   58    56 S   HC   _H4_    61     1.09554   112.05608  -174.59793
   59    56 S   HC   _H5_    62     1.09462   110.62182    65.68249
   60    54 S   CO4  _C7_    45     1.48102   121.56585     0.85340
   61    60 S   O    _O33    46     1.23006   119.46335   177.40557
   62    60 S   CT   _C8_    47     1.51138   118.99830     0.08623
   63    62 S   HC   _H7_    48     1.09627   107.41590    95.51538
   64    62 S   HC   _H8_    49     1.09723   107.81760  -149.12439
   65    50 S   CT   _C9_    50     1.57986   112.82109   122.11621
   66    65 S   CT   _C17    51     1.55418   111.16381  -167.96035
   67    66 S   HC   _H17    52     1.09575   111.42703    64.86699
   68    66 S   HC   _H18    53     1.09420   112.53221   -55.95175
   69    66 S   HC   _H19    54     1.09647   110.90819  -176.05792
   70    65 S   CT   _C18    55     1.54721   112.24926   -49.23566
   71    70 S   HC   _H20    56     1.09398   111.73096   -58.65322
   72    70 S   HC   _H21    57     1.09662   110.85126  -178.12967
   73    70 S   HC   _H22    58     1.09419   111.91620    62.81212
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  11   5   4   3
  14   2   1   1  14   5   9   4   5   2   1   1  11   4   2   1
   1  22  14   7   1  11   4   5   2   1   1   7   4  11   4   3
   8   7   3   2   1   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    39    41    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    45    39    40    47    41    42    43    44  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    45    46    50    39    40    47    48    49    41    42    43    44  
   35    36  
   36  
    0  
   38    45    46    50    51    65    52    39    40    47    41    42    43    44  
   45    46    50    39    41  
   40    47    48    49    41    42    43    44    45  
   47    48    49    41  
   42    43    44    45    47  
   43    44  
   44  
    0  
   46    50    51    54    62    65    66    70    56    52    53  
   50    51    65    52  
   48    49  
   49  
    0  
   51    54    55    60    62    63    64    65    66    67    68    69    70    71    72    73    56    57    58    59    52    53  
   54    55    60    61    62    65    66    70    56    57    58    59    52    53  
   53    54    56    62    65    66    70  
   65  
   55    60    61    62    63    64    65    56    57    58    59  
   60    61    62    56  
   57    58    59    60    65  
   58    59  
   59  
    0  
   61    62    63    64    65    66    70  
   62    63    64    65  
   63    64    65    66    67    68    69    70    71    72    73  
   64    65    66    70  
   65    66    70  
   66    67    68    69    70    71    72    73  
   67    68    69    70    71    72    73  
   68    69    70  
   69    70  
   70  
   71    72    73  
   72    73  
   73  
    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  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   40   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   46   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5500   0.0760   0.437200   2.0020   1.7750   0.023028004  -0.852763146
   48   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   49   2.5000   0.0500  -0.062100   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   51   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   52   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   53   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   54   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   55   2.4200   0.0300   0.115000   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   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   61   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   62   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   66   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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   317.000  1.510
   33    41   268.000  1.529
   37    38   340.000  1.080
   37    45   549.000  1.340
   45    46   340.000  1.080
   45    50   317.000  1.510
   50    51   317.000  1.510
   50    65   268.000  1.529
   50    52   320.000  1.410
   51    54   549.000  1.340
   51    56   317.000  1.510
   54    55   340.000  1.080
   54    60   320.000  1.462
   60    61   570.000  1.229
   60    62   317.000  1.522
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   268.000  1.529
   65    66   268.000  1.529
   65    70   268.000  1.529
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    69   340.000  1.090
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   340.000  1.090
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    59   340.000  1.090
   52    53   553.000  0.945
   39    40   340.000  1.080
   39    47   465.000  1.376
   47    48   745.000  1.250
   47    49   335.000  1.111
   41    42   340.000  1.090
   41    43   340.000  1.090
   41    44   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  112.20000
   29    33    41    75.00000  111.63000
   33    37    38    35.00000  117.00000
   33    37    45    70.00000  124.00000
   33    39    40    35.00000  117.00000
   33    39    47    70.00000  124.00000
   33    41    42    37.50000  110.70000
   33    41    43    37.50000  110.70000
   33    41    44    37.50000  110.70000
   37    45    46    35.00000  120.00000
   37    45    50    70.00000  124.00000
   45    37    38    35.00000  120.00000
   45    50    51    70.00000  110.12100
   45    50    65    70.00000  112.02700
   45    50    52    90.00000  110.39200
   50    45    46    35.00000  117.00000
   50    51    54    70.00000  124.00000
   50    51    56    65.00000  117.92700
   50    65    62    58.35000  112.70000
   50    65    66    58.35000  112.70000
   50    65    70    58.35000  112.70000
   50    52    53    55.00000  108.50000
   51    54    55    35.00000  120.00000
   51    54    60    65.00000  118.96000
   51    56    57    35.00000  109.50000
   51    56    58    35.00000  109.50000
   51    56    59    35.00000  109.50000
   54    60    61    80.00000  123.72100
   54    60    62    65.00000  118.62400
   60    54    55    40.00000  117.72500
   60    62    63    35.00000  109.50000
   60    62    64    35.00000  109.50000
   60    62    65    63.00000  111.10000
   62    60    61    80.00000  120.40000
   62    65    66    58.35000  112.70000
   62    65    70    58.35000  112.70000
   64    62    63    33.00000  107.80000
   65    50    51    70.00000  112.02700
   65    62    63    37.50000  110.70000
   65    62    64    37.50000  110.70000
   65    66    67    37.50000  110.70000
   65    66    68    37.50000  110.70000
   65    66    69    37.50000  110.70000
   65    70    71    37.50000  110.70000
   65    70    72    37.50000  110.70000
   65    70    73    37.50000  110.70000
   68    66    67    33.00000  107.80000
   69    66    67    33.00000  107.80000
   69    66    68    33.00000  107.80000
   70    65    66    58.35000  112.70000
   72    70    71    33.00000  107.80000
   73    70    71    33.00000  107.80000
   73    70    72    33.00000  107.80000
   56    51    54    70.00000  124.00000
   58    56    57    33.00000  107.80000
   59    56    57    33.00000  107.80000
   59    56    58    33.00000  107.80000
   52    50    51    90.00000  110.39200
   52    50    65    50.00000  109.50000
   39    33    37    70.00000  110.12100
   39    47    48    65.00000  137.10300
   39    47    49    45.00000  105.30000
   47    39    40    40.00000  120.50800
   49    47    48    50.00000  124.16400
   41    33    37    70.00000  112.02700
   41    33    39    70.00000  112.02700
   43    41    42    33.00000  107.80000
   44    41    42    33.00000  107.80000
   44    41    43    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  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  1.0 3.0
   24    29    33    41   0.01700  1.0 1.0
   24    29    33    41  -0.23550 -1.0 2.0
   24    29    33    41   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    45   0.42700  1.0 1.0
   29    33    37    45  -0.70350 -1.0 2.0
   29    33    37    45  -0.43150  1.0 3.0
   29    33    39    40   0.00000  1.0 1.0
   29    33    39    47   0.42700  1.0 1.0
   29    33    39    47  -0.70350 -1.0 2.0
   29    33    39    47  -0.43150  1.0 3.0
   29    33    41    42   0.15000  1.0 3.0
   29    33    41    43   0.15000  1.0 3.0
   29    33    41    44   0.15000  1.0 3.0
   33    37    45    46   7.00000 -1.0 2.0
   33    37    45    50   7.00000 -1.0 2.0
   33    39    47    48   7.00000 -1.0 2.0
   33    39    47    49   7.00000 -1.0 2.0
   37    33    39    40   0.00000  1.0 1.0
   37    33    39    47  -0.28300  1.0 1.0
   37    33    39    47   0.26700 -1.0 2.0
   37    33    39    47  -0.63300  1.0 3.0
   37    33    41    42   0.15000  1.0 3.0
   37    33    41    43   0.15000  1.0 3.0
   37    33    41    44   0.15000  1.0 3.0
   37    45    50    51  -0.28300  1.0 1.0
   37    45    50    51   0.26700 -1.0 2.0
   37    45    50    51  -0.63300  1.0 3.0
   37    45    50    65   0.09850  1.0 1.0
   37    45    50    65   0.15250 -1.0 2.0
   37    45    50    65  -0.50650  1.0 3.0
   37    45    50    52   0.67800  1.0 1.0
   37    45    50    52   0.47050 -1.0 2.0
   37    45    50    52  -0.62500  1.0 3.0
   38    37    45    46   7.00000 -1.0 2.0
   38    37    45    50   7.00000 -1.0 2.0
   45    50    51    54  -0.28300  1.0 1.0
   45    50    51    54   0.26700 -1.0 2.0
   45    50    51    54  -0.63300  1.0 3.0
   45    50    51    56   0.09700  1.0 1.0
   45    50    51    56   0.15600 -1.0 2.0
   45    50    51    56  -0.50800  1.0 3.0
   45    50    65    62   0.34400  1.0 1.0
   45    50    65    62   0.09450 -1.0 2.0
   45    50    65    62   0.11100  1.0 3.0
   45    50    65    66   0.34400  1.0 1.0
   45    50    65    66   0.09450 -1.0 2.0
   45    50    65    66   0.11100  1.0 3.0
   45    50    65    70   0.34400  1.0 1.0
   45    50    65    70   0.09450 -1.0 2.0
   45    50    65    70   0.11100  1.0 3.0
   45    50    52    53  -0.07800  1.0 1.0
   45    50    52    53  -0.21500 -1.0 2.0
   45    50    52    53  -0.03150  1.0 3.0
   46    45    50    51   0.00000  1.0 1.0
   46    45    50    65   0.00000  1.0 1.0
   46    45    50    52   0.00000  1.0 1.0
   50    51    54    55   7.00000 -1.0 2.0
   50    51    54    60   7.00000 -1.0 2.0
   50    51    56    57   0.34800  1.0 3.0
   50    51    56    58   0.34800  1.0 3.0
   50    51    56    59   0.34800  1.0 3.0
   50    65    66    67   0.15000  1.0 3.0
   50    65    66    68   0.15000  1.0 3.0
   50    65    66    69   0.15000  1.0 3.0
   50    65    70    71   0.15000  1.0 3.0
   50    65    70    72   0.15000  1.0 3.0
   50    65    70    73   0.15000  1.0 3.0
   51    50    65    62   0.34400  1.0 1.0
   51    50    65    62   0.09450 -1.0 2.0
   51    50    65    62   0.11100  1.0 3.0
   51    50    65    66   0.34400  1.0 1.0
   51    50    65    66   0.09450 -1.0 2.0
   51    50    65    66   0.11100  1.0 3.0
   51    50    65    70   0.34400  1.0 1.0
   51    50    65    70   0.09450 -1.0 2.0
   51    50    65    70   0.11100  1.0 3.0
   51    50    52    53  -0.07800  1.0 1.0
   51    50    52    53  -0.21500 -1.0 2.0
   51    50    52    53  -0.03150  1.0 3.0
   51    54    60    61   1.00000 -1.0 2.0
   51    54   -60    62  -0.33500  1.0 1.0
   51    54   -60    62   1.06600 -1.0 2.0
   51    54   -60    62  -0.14000  1.0 3.0
   54    51    56    57   0.00000  1.0 1.0
   54    51    56    58   0.00000  1.0 1.0
   54    51    56    59   0.00000  1.0 1.0
   54    60    62    63   0.00000  1.0 1.0
   54    60    62    64   0.00000  1.0 1.0
   54    60    62    65   0.65300  1.0 1.0
   54    60    62    65  -0.03850 -1.0 2.0
   54    60    62    65   0.33900  1.0 3.0
   55    54    60    61   0.00000  1.0 1.0
   55    54    60    62   0.04550  1.0 1.0
   55    54    60    62   0.83000 -1.0 2.0
   55    54    60    62  -0.04000  1.0 3.0
   60    62   -65    50  -0.95700  1.0 1.0
   60    62   -65    50  -0.18200 -1.0 2.0
   60    62   -65    50   0.29450  1.0 3.0
   60    62    65    66  -0.95700  1.0 1.0
   60    62    65    66  -0.18200 -1.0 2.0
   60    62    65    66   0.29450  1.0 3.0
   60    62    65    70  -0.95700  1.0 1.0
   60    62    65    70  -0.18200 -1.0 2.0
   60    62    65    70   0.29450  1.0 3.0
   61    60    62    63   0.00000  1.0 1.0
   61    60    62    64   0.00000  1.0 1.0
   61    60    62    65   0.30150 -1.0 2.0
   62    65    66    67   0.15000  1.0 3.0
   62    65    66    68   0.15000  1.0 3.0
   62    65    66    69   0.15000  1.0 3.0
   62    65    70    71   0.15000  1.0 3.0
   62    65    70    72   0.15000  1.0 3.0
   62    65    70    73   0.15000  1.0 3.0
   63    62    65    50   0.15000  1.0 3.0
   63    62    65    66   0.15000  1.0 3.0
   63    62    65    70   0.15000  1.0 3.0
   64    62    65    50   0.15000  1.0 3.0
   64    62    65    66   0.15000  1.0 3.0
   64    62    65    70   0.15000  1.0 3.0
   65    50   -51    54   0.09850  1.0 1.0
   65    50   -51    54   0.15250 -1.0 2.0
   65    50   -51    54  -0.50650  1.0 3.0
   65    50    51    56   0.46850  1.0 1.0
   65    50    51    56   0.08550 -1.0 2.0
   65    50    51    56   0.09800  1.0 3.0
   65    50    52    53  -0.11600  1.0 1.0
   65    50    52    53  -0.09450 -1.0 2.0
   65    50    52    53   0.21250  1.0 3.0
   66    65    70    71   0.15000  1.0 3.0
   66    65    70    72   0.15000  1.0 3.0
   66    65    70    73   0.15000  1.0 3.0
   70    65    66    67   0.15000  1.0 3.0
   70    65    66    68   0.15000  1.0 3.0
   70    65    66    69   0.15000  1.0 3.0
   56    51    54    55   7.00000 -1.0 2.0
   56    51    54    60   7.00000 -1.0 2.0
   52    50    51    54   0.67800  1.0 1.0
   52    50    51    54   0.47050 -1.0 2.0
   52    50    51    54  -0.62500  1.0 3.0
   52    50    51    56   0.18000  1.0 1.0
   52    50    51    56   0.16450 -1.0 2.0
   52    50    51    56   0.04450  1.0 3.0
   52    50    65    62   0.86500  1.0 1.0
   52    50    65    62  -0.17500 -1.0 2.0
   52    50    65    62   0.20800  1.0 3.0
   52    50    65    66   0.86500  1.0 1.0
   52    50    65    66  -0.17500 -1.0 2.0
   52    50    65    66   0.20800  1.0 3.0
   52    50    65    70   0.86500  1.0 1.0
   52    50    65    70  -0.17500 -1.0 2.0
   52    50    65    70   0.20800  1.0 3.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    45  -0.28300  1.0 1.0
   39    33    37    45   0.26700 -1.0 2.0
   39    33    37    45  -0.63300  1.0 3.0
   39    33    41    42   0.15000  1.0 3.0
   39    33    41    43   0.15000  1.0 3.0
   39    33    41    44   0.15000  1.0 3.0
   40    39    47    48   7.00000 -1.0 2.0
   40    39    47    49   7.00000 -1.0 2.0
   41    33    37    38   0.00000  1.0 1.0
   41    33    37    45   0.09850  1.0 1.0
   41    33    37    45   0.15250 -1.0 2.0
   41    33    37    45  -0.50650  1.0 3.0
   41    33    39    40   0.00000  1.0 1.0
   41    33    39    47   0.09850  1.0 1.0
   41    33    39    47   0.15250 -1.0 2.0
   41    33    39    47  -0.50650  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    45  15.00000 -1.0 2.0
   50    46    45    37  15.00000 -1.0 2.0
   50    56    51    54   1.10000 -1.0 2.0
   60    55    54    51   1.10000 -1.0 2.0
   54    62    60    61  10.50000 -1.0 2.0
   33    40    39    47  15.00000 -1.0 2.0
   48    49    47    39  15.00000 -1.0 2.0
END
