* LIGAND DATABASE FILE (OPLS2005)
*
001      65    65    115    171     337
    1     0 S   NP   _N1_     1    30.57043    99.48270   -25.39235
    2     1 S   H    _HN1     2     1.02853    65.49072   -57.88625
    3     1 S   H    _H1_     3     1.02755    62.54975   174.77918
    4     1 S   H    _H2_     4     1.03475   163.37222  -128.82918
    5     1 S   CT   _CA1     5     1.50068    84.92656    57.86527
    6     5 S   HC   _HA1     6     1.09551   104.86848   117.83319
    7     5 S   CO3  _C1_     7     1.53643   113.26873    -2.77953
    8     7 S   O2Z  _O11     8     1.26390   115.09749   -35.08385
    9     7 S   O2Z  _O12     9     1.26238   115.00089   144.20923
   10     5 S   CT   _CB1    10     1.53015   107.43861  -123.77835
   11    10 S   HC   HB11    11     1.09556   109.46835   -40.05512
   12    10 S   HC   HB12    12     1.09836   110.46706    75.54590
   13    10 S   CT   _CG1    13     1.53235   112.95125  -162.62632
   14    13 S   HC   HG11    14     1.09549   110.89407   -94.72949
   15    13 S   HC   HG12    15     1.09601   111.56160    24.52289
   16    13 S   C    _CD1    16     1.51555   109.28759   145.30603
   17    16 S   O    _OE1    17     1.22814   121.77385    84.37689
   18    16 S   N    _N2_    18     1.38584   112.55715   -92.16879
   19    18 S   H    _HN2    19     1.01565   119.26756    -4.73114
   20    18 S   CT1  _CA2    20     1.46248   123.55476   173.21710
   21    20 S   HC   _HA2    21     1.09722   109.11434    -5.37341
   22    20 S   C    _C2_    22     1.53894   109.47014  -121.00655
   23    22 S   O    _O2_    23     1.23084   121.97134  -161.82615
   24    20 S   CT   _CB2    32     1.53465   111.58357   116.72243
   25    24 S   HC   HB21    33     1.09588   109.77794    56.03198
   26    24 S   HC   HB22    34     1.09418   110.22020   174.89447
   27    22 S   N    _N3_    24     1.38313   114.33706    24.47624
   28    27 S   H    _HN3    25     1.01414   119.13586    -2.52173
   29    24 S   S    _SG2    35     1.82783   111.56101   -64.84801
   30    27 S   CT   _CA3    26     1.45327   123.36974   178.03596
   31    30 S   HC   HA31    27     1.09556   107.31288   -66.79239
   32    30 S   HC   HA32    28     1.09558   108.07739    49.51941
   33    29 S   CT   _C11    36     1.84417    99.43371   169.93608
   34    33 S   HC   _H4_    37     1.09594   107.32541   -41.93407
   35    30 S   CO3  _C3_    29     1.53029   114.40863   171.52532
   36    35 S   O2Z  _O31    30     1.26439   116.32921    -6.03699
   37    35 S   O2Z  _O32    31     1.26409   114.45102   174.05627
   38    33 S   CM   _C9_    38     1.51328   107.82037  -158.48355
   39    38 S   CT   _C8_    39     1.50713   119.85120   -85.57152
   40    39 S   HC   _H9_    40     1.09705   108.22741    77.70955
   41    39 S   HC   _H10    41     1.09557   109.62647  -166.00870
   42    38 S   CMA  _C10    63     1.52295   120.28515    86.39439
   43    42 S   OM   _O36    64     1.26339   120.66507  -117.64089
   44    42 S   OM   _O37    65     1.26233   120.74614    62.53899
   45    39 S   CT   _C7_    42     1.53685   112.97370   -43.09087
   46    45 S   HC   _H3_    43     1.09735   109.64845   168.15776
   47    45 S   CT   _C13    44     1.53751   109.48998    50.22034
   48    47 S   HC   _H6_    45     1.09677   108.02376    63.46665
   49    45 S   OS   _O35    55     1.43799   111.08070   -70.61000
   50    33 S   CT   _C12    46     1.54193   111.21738    77.19044
   51    50 S   HC   _H5_    47     1.09554   110.98509   -40.94318
   52    47 S   OH   _O38    53     1.42723   109.88828   178.60858
   53    52 S   HO   _H11    54     0.97549   106.91387    82.51804
   54    49 S   CM   _C5_    56     1.38205   114.20878   -78.94375
   55    50 S   OS   _O39    48     1.43501   108.03673  -158.13336
   56    54 S   CM   _C4_    57     1.33743   120.48670   122.74896
   57    56 S   HC   _H7_    58     1.08553   120.32663    -2.99565
   58    56 S   HC   _H8_    59     1.08413   121.98154   177.36136
   59    54 S   CO3  _C6_    60     1.54100   119.34266   -62.41998
   60    59 S   O2Z  _O34    61     1.26574   115.75788   143.95919
   61    59 S   O2Z  _O33    62     1.26529   115.29567   -36.10100
   62    55 S   P3   _P1_    49     1.64999   119.02886   116.96769
   63    62 S   O2Z  _O41    50     1.52500   103.90951  -176.23085
   64    62 S   O2Z  _O42    51     1.52574   104.27658    64.23339
   65    62 S   O2Z  _O40    52     1.52578   104.71390   -56.23785
  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   9   5   4   3
  16   7   2   1   1  13  13   6   5   4   1   1  12   6   9   6
   9   8   3   2   1   6   4   5   2   1   2   1   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    50    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    47    50    51    55    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    45    47    48    50    51    55    62    52    42    43    44  
   38    39    47    50    51    55    42  
   36    37  
   37  
    0  
   39    40    41    45    46    47    50    51    55    49    42    43    44  
   40    41    45    46    47    48    50    52    49    54    42    43    44  
   41    45    46    47    49    42  
   45    46    47    49    42  
   43    44    45    50  
   44  
    0  
   46    47    48    50    51    55    52    53    49    54    56    59  
   47    48    50    52    49    54  
   48    50    51    55    62    52    53    49    54  
   50    51    55    52    53    49  
   54    56    57    58    59    60    61    50    52  
   51    55    62    63    64    65    52    53  
   55    62    52  
   53    55  
    0  
   56    57    58    59    60    61  
   62    63    64    65  
   57    58    59    60    61  
   58    59  
   59  
   60    61  
   61  
    0  
   63    64    65  
   64    65  
   65  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   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   3.5500   0.0760   0.149000   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   44   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   45   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   50   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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  -0.225300   2.0020   1.7750   0.023028004  -0.852763146
   55   2.8500   0.1400  -0.760000   1.5900   1.4000   0.020110767  -0.896042159
   56   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   57   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   58   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   59   3.7500   0.1050   0.910300   2.1120   1.8750   0.001000000  -0.126889456
   60   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   61   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   62   3.7400   0.2000   1.919900   2.1070   1.8700   0.005000000   0.000000000
   63   2.9800   0.2000  -1.119967   1.6890   1.4900   0.001000000  -0.126889456
   64   2.9800   0.2000  -1.119967   1.6890   1.4900   0.001000000  -0.126889456
   65   2.9800   0.2000  -1.119967   1.6890   1.4900   0.001000000  -0.126889456
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    50   268.000  1.529
   38    39   317.000  1.510
   38    42   465.000  1.376
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    45   268.000  1.529
   45    46   340.000  1.090
   45    47   268.000  1.529
   45    49   320.000  1.410
   47    48   340.000  1.090
   47    50   268.000  1.529
   47    52   320.000  1.410
   50    51   340.000  1.090
   50    55   320.000  1.410
   55    62   230.000  1.630
   62    63   525.000  1.516
   62    64   525.000  1.516
   62    65   525.000  1.516
   52    53   553.000  0.945
   49    54   440.000  1.360
   54    56   549.000  1.340
   54    59   230.000  1.545
   56    57   340.000  1.080
   56    58   340.000  1.080
   59    60   656.000  1.250
   59    61   656.000  1.250
   42    43   745.000  1.250
   42    44   745.000  1.250
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    50    75.00000  111.63000
   33    38    39    65.00000  117.92700
   33    38    42    70.00000  124.00000
   33    50    47    58.35000  112.70000
   33    50    51    37.50000  110.70000
   33    50    55    50.00000  109.50000
   38    33    34    35.00000  109.50000
   38    39    40    35.00000  109.50000
   38    39    41    35.00000  109.50000
   38    39    45    70.00000  112.02700
   38    42    43    65.00000  137.10300
   38    42    44    65.00000  137.10300
   39    45    46    37.50000  110.70000
   39    45    47    58.35000  112.70000
   39    45    49    50.00000  109.50000
   41    39    40    33.00000  107.80000
   45    39    40    37.50000  110.70000
   45    39    41    37.50000  110.70000
   45    47    48    37.50000  110.70000
   45    47    50    58.35000  112.70000
   45    47    52    50.00000  109.50000
   45    49    54    90.00000  111.18400
   47    45    46    37.50000  110.70000
   47    50    51    37.50000  110.70000
   47    50    55    50.00000  109.50000
   47    52    53    55.00000  108.50000
   50    33    34    37.50000  110.70000
   50    33    38    70.00000  112.02700
   50    47    48    37.50000  110.70000
   50    55    62    80.00000  112.68000
   55    50    51    35.00000  109.50000
   55    62    63   100.00000  107.00000
   55    62    64   100.00000  107.00000
   55    62    65   100.00000  107.00000
   64    62    63   140.00000  114.00000
   65    62    63   140.00000  114.00000
   65    62    64   140.00000  114.00000
   52    47    48    35.00000  109.50000
   52    47    50    50.00000  109.50000
   49    45    46    35.00000  109.50000
   49    45    47    50.00000  109.50000
   49    54    56    80.00000  120.01400
   49    54    59    80.00000  119.00000
   54    56    57    35.00000  120.00000
   54    56    58    35.00000  120.00000
   54    59    60    85.00000  113.83300
   54    59    61    85.00000  113.83300
   58    56    57    35.00000  117.00000
   59    54    56    55.00000  124.75400
   61    59    60    80.00000  126.00000
   42    38    39    70.00000  124.00000
   44    42    43    65.00000  121.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    50   0.01700  1.0 1.0
   24    29    33    50  -0.23550 -1.0 2.0
   24    29    33    50   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.30250  1.0 1.0
   29    33    38    39  -0.14950 -1.0 2.0
   29    33    38    39   0.36900  1.0 3.0
   29    33    38    42   0.42700  1.0 1.0
   29    33    38    42  -0.70350 -1.0 2.0
   29    33    38    42  -0.43150  1.0 3.0
   29    33    50    47   0.44750  1.0 1.0
   29    33    50    47  -0.17800 -1.0 2.0
   29    33    50    47   0.20200  1.0 3.0
   29    33    50    51   0.15000  1.0 3.0
   29    33    50    55   0.56750  1.0 1.0
   29    33    50    55  -0.07550 -1.0 2.0
   29    33    50    55   0.20000  1.0 3.0
   33    38    39    40   0.34800  1.0 3.0
   33    38    39    41   0.34800  1.0 3.0
   33    38    39    45   0.46850  1.0 1.0
   33    38    39    45   0.08550 -1.0 2.0
   33    38    39    45   0.09800  1.0 3.0
   33    38    42    43   7.00000 -1.0 2.0
   33    38    42    44   7.00000 -1.0 2.0
   33    50    55    62  -2.65550  1.0 1.0
   33    50    55    62  -0.22350 -1.0 2.0
   33    50    55    62   0.24150  1.0 3.0
   34    33    38    39   0.34800  1.0 3.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    50    47   0.15000  1.0 3.0
   34    33    50    51   0.15000  1.0 3.0
   34    33    50    55   0.23400  1.0 3.0
   38    33    50    47   0.34400  1.0 1.0
   38    33    50    47   0.09450 -1.0 2.0
   38    33    50    47   0.11100  1.0 3.0
   38    33    50    51   0.15000  1.0 3.0
   38    33    50    55   0.61850  1.0 1.0
   38    33    50    55  -0.22750 -1.0 2.0
   38    33    50    55   0.15300  1.0 3.0
   38    39    45    46   0.15000  1.0 3.0
   38    39   -45    47   0.34400  1.0 1.0
   38    39   -45    47   0.09450 -1.0 2.0
   38    39   -45    47   0.11100  1.0 3.0
   38    39    45    49   0.61850  1.0 1.0
   38    39    45    49  -0.22750 -1.0 2.0
   38    39    45    49   0.15300  1.0 3.0
   39    38    42    43   7.00000 -1.0 2.0
   39    38    42    44   7.00000 -1.0 2.0
   39    45    47    48   0.15000  1.0 3.0
   39    45    47    50   0.56750  1.0 1.0
   39    45    47    50  -0.07550 -1.0 2.0
   39    45    47    50   0.20000  1.0 3.0
   39    45    47    52   0.86500  1.0 1.0
   39    45    47    52  -0.17500 -1.0 2.0
   39    45    47    52   0.20800  1.0 3.0
   39    45    49    54  -0.46850  1.0 1.0
   39    45    49    54   0.09300 -1.0 2.0
   39    45    49    54  -0.12850  1.0 3.0
   40    39    45    46   0.15000  1.0 3.0
   40    39    45    47   0.15000  1.0 3.0
   40    39    45    49   0.23400  1.0 3.0
   41    39    45    46   0.15000  1.0 3.0
   41    39    45    47   0.15000  1.0 3.0
   41    39    45    49   0.23400  1.0 3.0
   45    47   -50    33   0.56750  1.0 1.0
   45    47   -50    33  -0.07550 -1.0 2.0
   45    47   -50    33   0.20000  1.0 3.0
   45    47    50    51   0.15000  1.0 3.0
   45    47    50    55   0.62750  1.0 1.0
   45    47    50    55  -0.30950 -1.0 2.0
   45    47    50    55   0.27300  1.0 3.0
   45    47    52    53  -0.11600  1.0 1.0
   45    47    52    53  -0.09450 -1.0 2.0
   45    47    52    53   0.21250  1.0 3.0
   45    49    54    56  -2.26850  1.0 1.0
   45    49    54    56   3.39050 -1.0 2.0
   45    49    54    59   0.15100 -1.0 2.0
   46    45    47    48   0.15000  1.0 3.0
   46    45    47    50   0.15000  1.0 3.0
   46    45    47    52   0.23400  1.0 3.0
   46    45    49    54   0.08050  1.0 3.0
   47    45    49    54  -0.46850  1.0 1.0
   47    45    49    54   0.09300 -1.0 2.0
   47    45    49    54  -0.12850  1.0 3.0
   47    50    55    62  -2.65550  1.0 1.0
   47    50    55    62  -0.22350 -1.0 2.0
   47    50    55    62   0.24150  1.0 3.0
   48    47    50    33   0.15000  1.0 3.0
   48    47    50    51   0.15000  1.0 3.0
   48    47    50    55   0.23400  1.0 3.0
   48    47    52    53   0.19450  1.0 3.0
   50    33   -38    39   0.46850  1.0 1.0
   50    33   -38    39   0.08550 -1.0 2.0
   50    33   -38    39   0.09800  1.0 3.0
   50    33    38    42   0.09850  1.0 1.0
   50    33    38    42   0.15250 -1.0 2.0
   50    33    38    42  -0.50650  1.0 3.0
   50    47    52    53  -0.11600  1.0 1.0
   50    47    52    53  -0.09450 -1.0 2.0
   50    47    52    53   0.21250  1.0 3.0
   50    55    62    63   0.00000  1.0 1.0
   50    55    62    64   0.00000  1.0 1.0
   50    55    62    65   0.00000  1.0 1.0
   51    50    55    62   0.03000  1.0 3.0
   52    47    50    33   0.86500  1.0 1.0
   52    47    50    33  -0.17500 -1.0 2.0
   52    47    50    33   0.20800  1.0 3.0
   52    47    50    51   0.23400  1.0 3.0
   52    47    50    55   3.69350  1.0 1.0
   52    47    50    55  -1.82950 -1.0 2.0
   49    45    47    48   0.23400  1.0 3.0
   49    45    47    50   0.62750  1.0 1.0
   49    45    47    50  -0.30950 -1.0 2.0
   49    45    47    50   0.27300  1.0 3.0
   49    45    47    52   3.69350  1.0 1.0
   49    45    47    52  -1.82950 -1.0 2.0
   49    54    56    57   7.00000 -1.0 2.0
   49    54    56    58   7.00000 -1.0 2.0
   49    54    59    60  -0.11900  1.0 1.0
   49    54    59    60   0.76850 -1.0 2.0
   49    54    59    60   0.14100  1.0 3.0
   49    54    59    61  -0.11900  1.0 1.0
   49    54    59    61   0.76850 -1.0 2.0
   49    54    59    61   0.14100  1.0 3.0
   56    54    59    60  -0.04000 -1.0 2.0
   56    54    59    60  -0.29050  1.0 3.0
   56    54    59    61  -0.04000 -1.0 2.0
   56    54    59    61  -0.29050  1.0 3.0
   59    54    56    57   7.00000 -1.0 2.0
   59    54    56    58   7.00000 -1.0 2.0
   42    38    39    40   0.00000  1.0 1.0
   42    38    39    41   0.00000  1.0 1.0
   42    38    39    45   0.09850  1.0 1.0
   42    38    39    45   0.15250 -1.0 2.0
   42    38    39    45  -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
   36    30    35    37  10.50000 -1.0 2.0
   33    39    38    42   1.10000 -1.0 2.0
   49    59    54    56  15.00000 -1.0 2.0
   57    58    56    54  15.00000 -1.0 2.0
   60    54    59    61  10.50000 -1.0 2.0
   43    44    42    38   1.10000 -1.0 2.0
END
