* LIGAND DATABASE FILE (OPLS2005)
*
001      75    76    133    208     397
    1     0 S   NP   _N1_     1    28.89116    95.39112   -18.77193
    2     1 S   H    _HN1     2     1.02787    82.02845   -59.49569
    3     1 S   H    _H1_     3     1.02952    95.77213    48.20925
    4     1 S   H    _H2_     4     1.02839    33.84094   160.59839
    5     1 S   CT   _CA1     5     1.50155   142.92345  -176.03222
    6     5 S   HC   _HA1     6     1.09610   105.08836    45.50891
    7     5 S   CO3  _C1_     7     1.53635   112.17935   -74.08661
    8     7 S   O2Z  _O11     8     1.26301   115.06484   -50.90389
    9     7 S   O2Z  _O12     9     1.26240   114.80212   127.67580
   10     5 S   CT   _CB1    10     1.53083   107.33711   162.71541
   11    10 S   HC   HB11    11     1.09786   108.58325   -54.45851
   12    10 S   HC   HB12    12     1.09804   110.75463    61.76879
   13    10 S   CT   _CG1    13     1.53011   112.75066  -175.99508
   14    13 S   HC   HG11    14     1.09455   110.11934   -71.41099
   15    13 S   HC   HG12    15     1.09656   110.11542    47.39632
   16    13 S   C    _CD1    16     1.51865   112.46466   166.57285
   17    16 S   O    _OE1    17     1.22779   122.96710   -17.39105
   18    16 S   N    _N2_    18     1.38569   112.06719   165.38466
   19    18 S   H    _HN2    19     1.01730   119.09697    -4.67873
   20    18 S   CT1  _CA2    20     1.46269   123.17424   173.22963
   21    20 S   HC   _HA2    21     1.09748   109.27332   -13.23784
   22    20 S   C    _C2_    22     1.53562   107.66965  -128.24945
   23    22 S   O    _O2_    23     1.23001   122.40663  -145.11833
   24    20 S   CT   _CB2    32     1.53270   112.26451   109.28239
   25    24 S   HC   HB21    33     1.09391   109.87470    55.43425
   26    24 S   HC   HB22    34     1.09539   110.36312   173.01337
   27    22 S   N    _N3_    24     1.38638   113.31330    42.23243
   28    27 S   H    _HN3    25     1.01539   118.80377    -0.00000
   29    24 S   S    _SG2    35     1.82996   112.11994   -68.57195
   30    27 S   CT   _CA3    26     1.45461   123.45791   174.77588
   31    30 S   HC   HA31    27     1.09521   109.21133    24.80081
   32    30 S   HC   HA32    28     1.09499   107.11354   141.80357
   33    29 S   CT   _C10    36     1.84575   100.08483   135.48160
   34    33 S   HC   _H3_    37     1.09579   105.30764    45.62916
   35    30 S   CO3  _C3_    29     1.52920   113.14217   -98.70972
   36    35 S   O2Z  _O31    30     1.26402   115.40911   -43.75086
   37    35 S   O2Z  _O32    31     1.26352   114.96261   137.21498
   38    33 S   CA   _C9_    38     1.51767   110.94103   -73.54000
   39    33 S   CM   _C11    71     1.50616   108.84183   161.84583
   40    39 S   HC   _H13    72     1.09056   118.04684    37.64809
   41    38 S   CA   _C4_    39     1.40408   121.96168   -67.25128
   42    41 S   HA   _H9_    40     1.08727   120.46961    -2.09415
   43    39 S   CMA  _C12    73     1.51690   122.58757  -144.52452
   44    43 S   OM   _O33    74     1.26228   119.37054   176.57915
   45    43 S   OM   _O34    75     1.26213   122.24923    -3.63739
   46    41 S   CA   _C5_    41     1.39585   120.67651   176.98377
   47    46 S   HA   _H10    42     1.08676   119.51391  -179.10125
   48    46 S   CA   _C6_    43     1.39469   120.15051    -1.26254
   49    48 S   CA   _C7_    44     1.39483   119.76354     3.47474
   50    49 S   HA   _H11    45     1.08492   121.66236   177.33266
   51    48 S   OS   _O35    48     1.37060   116.21443  -177.32299
   52    38 S   CA   _C8_    46     1.40281   119.58501   111.31348
   53    52 S   HA   _H12    47     1.08765   120.22143     2.71714
   54    51 S   CO   _C13    49     1.44102   114.57818   139.35638
   55    54 S   HC   _H4_    50     1.09795   108.70585    69.79983
   56    54 S   CT   _C14    51     1.53483   107.31955  -172.33753
   57    56 S   HC   _H5_    52     1.09558   110.11413    52.54008
   58    56 S   CT   _C15    53     1.53230   111.30746   174.88247
   59    58 S   HC   _H6_    54     1.09671   110.10073    75.04351
   60    56 S   OH   _O40    69     1.43067   109.89648   -63.94235
   61    60 S   HO   _H19    70     0.97210   108.24032   -61.69267
   62    58 S   CT   _C16    55     1.53257   111.98336   -47.76850
   63    62 S   HC   _H7_    56     1.09601   109.12539   -73.22780
   64    58 S   OH   _O39    67     1.43005   109.48421  -169.31286
   65    64 S   HO   _H18    68     0.97311   107.83437    60.42428
   66    62 S   CT   _C17    57     1.53135   110.89927    48.31722
   67    66 S   HC   _H8_    58     1.09824   111.02832    65.15976
   68    62 S   OH   _O38    65     1.42702   109.69075   170.16829
   69    68 S   HO   _H17    66     0.97241   108.18650   -57.44021
   70    54 S   OS   _O36    59     1.43064   111.54030   -52.37871
   71    66 S   CT   _C18    60     1.53006   111.62561  -173.98797
   72    71 S   HC   _H14    61     1.09465   111.07717    67.16036
   73    71 S   HC   _H15    62     1.09405   111.40711   -55.13564
   74    71 S   OH   _O37    63     1.42563   109.09386  -174.22793
   75    74 S   HO   _H16    64     0.97292   107.02126   177.40120
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   8   5   4   3
  13   6   2   1   1  12   6   3   8   4   2   1   1   7   3   9
   5   3   9   1   1  13   6  12   7  13   7   4   1  12   7   3
   1   9   6   3   1   4   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    52    39    40    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    46    49    52    53    39    40    43    44    45  
   38    41    52    39    40    43  
   36    37  
   37  
    0  
   41    42    46    47    48    49    50    52    53    39    40    43  
   40    43    44    45    41    52  
   43    44    45  
   42    46    47    48    49    52    53    51  
   46    47    48    52  
   44    45  
   45  
    0  
   47    48    49    50    52    51    54  
   48    49    51  
   49    50    52    53    51    54    55    56    70  
   50    52    53    51    54  
   52    53    51  
   54    55    56    57    58    66    70    60    52  
   53  
    0  
   55    56    57    58    59    62    66    67    70    71    64    60    61  
   56    57    58    66    70    60  
   57    58    59    62    63    66    70    68    64    65    60    61  
   58    59    62    70    64    60    61  
   59    62    63    66    67    70    71    68    69    64    65    60    61  
   62    63    66    68    64    65    60  
   61    62    64    70  
    0  
   63    66    67    70    71    72    73    74    68    69    64    65  
   66    67    70    71    68    69    64  
   65    66    68  
    0  
   67    70    71    72    73    74    75    68    69  
   70    71    72    73    74    68  
   69    70    71  
    0  
   71    72    73    74  
   72    73    74    75  
   73    74    75  
   74    75  
   75  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.222500   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   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   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   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   42   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   43   3.5500   0.0760   0.149000   2.0020   1.7750   0.023028004  -0.852763146
   44   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   45   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   46   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   47   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   48   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   49   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   50   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   51   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   52   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   53   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   54   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   61   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   65   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   66   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   68   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   69   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   70   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   71   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   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
   74   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   75   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    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    39   317.000  1.510
   38    41   469.000  1.400
   38    52   469.000  1.400
   41    42   367.000  1.080
   41    46   469.000  1.400
   46    47   367.000  1.080
   46    48   469.000  1.400
   48    49   469.000  1.400
   48    51   450.000  1.364
   49    50   367.000  1.080
   49    52   469.000  1.400
   52    53   367.000  1.080
   51    54   320.000  1.380
   54    55   340.000  1.090
   54    56   250.000  1.527
   54    70   320.000  1.380
   56    57   340.000  1.090
   56    58   268.000  1.529
   56    60   320.000  1.410
   58    59   340.000  1.090
   58    62   268.000  1.529
   58    64   320.000  1.410
   62    63   340.000  1.090
   62    66   268.000  1.529
   62    68   320.000  1.410
   66    67   340.000  1.090
   66    70   320.000  1.410
   66    71   268.000  1.529
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   320.000  1.410
   74    75   553.000  0.945
   68    69   553.000  0.945
   64    65   553.000  0.945
   60    61   553.000  0.945
   39    40   340.000  1.080
   39    43   465.000  1.376
   43    44   745.000  1.250
   43    45   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    80.00000  109.48900
   29    33    39    75.00000  112.20000
   33    38    41    70.00000  120.00000
   33    38    52    70.00000  120.00000
   33    39    40    35.00000  117.00000
   33    39    43    70.00000  124.00000
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    46    63.00000  120.00000
   38    52    49    63.00000  120.00000
   38    52    53    35.00000  120.00000
   41    46    47    35.00000  120.00000
   41    46    48    63.00000  120.00000
   46    41    42    35.00000  120.00000
   46    48    49    63.00000  120.00000
   46    48    51    70.00000  120.00000
   48    46    47    35.00000  120.00000
   48    49    50    35.00000  120.00000
   48    49    52    63.00000  120.00000
   48    51    54   100.00000  112.36700
   49    52    53    35.00000  120.00000
   52    38    41    63.00000  120.00000
   52    49    50    35.00000  120.00000
   51    48    49    70.00000  120.00000
   51    54    55    35.00000  109.50000
   51    54    56    90.00000  108.56700
   51    54    70    92.60000  111.55000
   54    56    57    45.00000  108.72000
   54    56    58    75.00000  109.43000
   54    56    60    90.00000  111.58700
   54    70    66    60.00000  109.50000
   56    54    55    45.00000  112.01100
   56    58    59    37.50000  110.70000
   56    58    62    58.35000  112.70000
   56    58    64    50.00000  109.50000
   56    60    61    55.00000  108.50000
   58    56    57    37.50000  110.70000
   58    62    63    37.50000  110.70000
   58    62    66    58.35000  112.70000
   58    62    68    50.00000  109.50000
   58    64    65    55.00000  108.50000
   62    58    59    37.50000  110.70000
   62    66    67    37.50000  110.70000
   62    66    70    50.00000  109.50000
   62    66    71    58.35000  112.70000
   62    68    69    55.00000  108.50000
   66    62    63    37.50000  110.70000
   66    71    72    37.50000  110.70000
   66    71    73    37.50000  110.70000
   66    71    74    50.00000  109.50000
   70    54    55    35.00000  109.50000
   70    54    56    90.00000  108.56700
   70    66    67    35.00000  109.50000
   71    66    67    37.50000  110.70000
   71    66    70    50.00000  109.50000
   71    74    75    55.00000  108.50000
   73    71    72    33.00000  107.80000
   74    71    72    35.00000  109.50000
   74    71    73    35.00000  109.50000
   68    62    63    35.00000  109.50000
   68    62    66    50.00000  109.50000
   64    58    59    35.00000  109.50000
   64    58    62    50.00000  109.50000
   60    56    57    35.00000  109.50000
   60    56    58    50.00000  109.50000
   39    33    34    35.00000  109.50000
   39    33    38    70.00000  112.99600
   39    43    44    65.00000  137.10300
   39    43    45    65.00000  137.10300
   43    39    40    40.00000  120.50800
   45    43    44    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  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  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    38    41  -0.16000  1.0 1.0
   29    33    38    41  -0.03200 -1.0 2.0
   29    33    38    41   0.04500  1.0 3.0
   29    33    38    52  -0.16000  1.0 1.0
   29    33    38    52  -0.03200 -1.0 2.0
   29    33    38    52   0.04500  1.0 3.0
   29    33    39    40   0.00000  1.0 1.0
   29    33    39    43   0.42700  1.0 1.0
   29    33    39    43  -0.70350 -1.0 2.0
   29    33    39    43  -0.43150  1.0 3.0
   33    38    41    42   3.62500 -1.0 2.0
   33    38    41    46   3.62500 -1.0 2.0
   33    38    52    49   3.62500 -1.0 2.0
   33    38    52    53   3.62500 -1.0 2.0
   33    39    43    44   7.00000 -1.0 2.0
   33    39    43    45   7.00000 -1.0 2.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    52   0.00000  1.0 1.0
   34    33    39    40   0.33100  1.0 3.0
   34    33    39    43   0.00000  1.0 1.0
   38    33    39    40   0.00000  1.0 1.0
   38    33    39    43   1.44450  1.0 1.0
   38    33    39    43   0.06600 -1.0 2.0
   38    33    39    43   0.29250  1.0 3.0
   38    41    46    47   3.62500 -1.0 2.0
   38    41    46    48   3.62500 -1.0 2.0
   41    38    52    49   3.62500 -1.0 2.0
   41    38    52    53   3.62500 -1.0 2.0
   41    46   -48    49   3.62500 -1.0 2.0
   41    46    48    51   3.62500 -1.0 2.0
   42    41    46    47   3.62500 -1.0 2.0
   42    41    46    48   3.62500 -1.0 2.0
   46    48    49    50   3.62500 -1.0 2.0
   46    48    49    52   3.62500 -1.0 2.0
   46    48    51    54   1.63200 -1.0 2.0
   47    46    48    49   3.62500 -1.0 2.0
   47    46    48    51   3.62500 -1.0 2.0
   48    49   -52    38   3.62500 -1.0 2.0
   48    49    52    53   3.62500 -1.0 2.0
   48    51    54    55   0.08050  1.0 3.0
   48    51    54    56  -0.32850  1.0 1.0
   48    51    54    56  -0.35800 -1.0 2.0
   48    51    54    56   0.33950  1.0 3.0
   48    51    54    70  -0.25600  1.0 1.0
   48    51    54    70  -0.40050 -1.0 2.0
   48    51    54    70   0.34700  1.0 3.0
   49    48    51    54   1.63200 -1.0 2.0
   50    49    52    38   3.62500 -1.0 2.0
   50    49    52    53   3.62500 -1.0 2.0
   52    38    41    42   3.62500 -1.0 2.0
   52    38   -41    46   3.62500 -1.0 2.0
   51    48    49    50   3.62500 -1.0 2.0
   51    48    49    52   3.62500 -1.0 2.0
   51    54    56    57   0.23400  1.0 3.0
   51    54    56    58   0.62750  1.0 1.0
   51    54    56    58  -0.30950 -1.0 2.0
   51    54    56    58   0.27300  1.0 3.0
   51    54    56    60   3.69350  1.0 1.0
   51    54    56    60  -1.82950 -1.0 2.0
   51    54    70    66  -0.81800  1.0 1.0
   54    56    58    59   0.15000  1.0 3.0
   54    56    58    62   3.97050  1.0 1.0
   54    56    58    64   0.86500  1.0 1.0
   54    56    58    64  -0.17500 -1.0 2.0
   54    56    58    64   0.20800  1.0 3.0
   54    56    60    61  -0.11600  1.0 1.0
   54    56    60    61  -0.09450 -1.0 2.0
   54    56    60    61   0.21250  1.0 3.0
   55    54    56    57   0.15000  1.0 3.0
   55    54    56    58   0.15000  1.0 3.0
   55    54    56    60   0.23400  1.0 3.0
   55    54    70    66   0.37050  1.0 3.0
   56    54    70    66   0.06250  1.0 1.0
   56    54    70    66  -0.01100 -1.0 2.0
   56    54    70    66   0.28050  1.0 3.0
   56    58    62    63   0.15000  1.0 3.0
   56    58   -62    66   0.56750  1.0 1.0
   56    58   -62    66  -0.07550 -1.0 2.0
   56    58   -62    66   0.20000  1.0 3.0
   56    58    62    68   0.86500  1.0 1.0
   56    58    62    68  -0.17500 -1.0 2.0
   56    58    62    68   0.20800  1.0 3.0
   56    58    64    65  -0.11600  1.0 1.0
   56    58    64    65  -0.09450 -1.0 2.0
   56    58    64    65   0.21250  1.0 3.0
   57    56    58    59   0.15000  1.0 3.0
   57    56    58    62   0.15000  1.0 3.0
   57    56    58    64   0.23400  1.0 3.0
   57    56    60    61   0.19450  1.0 3.0
   58    56    60    61  -0.11600  1.0 1.0
   58    56    60    61  -0.09450 -1.0 2.0
   58    56    60    61   0.21250  1.0 3.0
   58    62    66    67   0.15000  1.0 3.0
   58    62    66    70   0.62750  1.0 1.0
   58    62    66    70  -0.30950 -1.0 2.0
   58    62    66    70   0.27300  1.0 3.0
   58    62    66    71   0.56750  1.0 1.0
   58    62    66    71  -0.07550 -1.0 2.0
   58    62    66    71   0.20000  1.0 3.0
   58    62    68    69  -0.11600  1.0 1.0
   58    62    68    69  -0.09450 -1.0 2.0
   58    62    68    69   0.21250  1.0 3.0
   59    58    62    63   0.15000  1.0 3.0
   59    58    62    66   0.15000  1.0 3.0
   59    58    62    68   0.23400  1.0 3.0
   59    58    64    65   0.19450  1.0 3.0
   62    58    64    65  -0.11600  1.0 1.0
   62    58    64    65  -0.09450 -1.0 2.0
   62    58    64    65   0.21250  1.0 3.0
   62    66   -70    54   0.06250  1.0 1.0
   62    66   -70    54  -0.01100 -1.0 2.0
   62    66   -70    54   0.28050  1.0 3.0
   62    66    71    72   0.15000  1.0 3.0
   62    66    71    73   0.15000  1.0 3.0
   62    66    71    74   0.86500  1.0 1.0
   62    66    71    74  -0.17500 -1.0 2.0
   62    66    71    74   0.20800  1.0 3.0
   63    62    66    67   0.15000  1.0 3.0
   63    62    66    70   0.23400  1.0 3.0
   63    62    66    71   0.15000  1.0 3.0
   63    62    68    69   0.19450  1.0 3.0
   66    62    68    69  -0.11600  1.0 1.0
   66    62    68    69  -0.09450 -1.0 2.0
   66    62    68    69   0.21250  1.0 3.0
   66    71    74    75  -0.11600  1.0 1.0
   66    71    74    75  -0.09450 -1.0 2.0
   66    71    74    75   0.21250  1.0 3.0
   67    66    70    54   0.37050  1.0 3.0
   67    66    71    72   0.15000  1.0 3.0
   67    66    71    73   0.15000  1.0 3.0
   67    66    71    74   0.23400  1.0 3.0
   70    54    56    57   0.23400  1.0 3.0
   70    54   -56    58   0.62750  1.0 1.0
   70    54   -56    58  -0.30950 -1.0 2.0
   70    54   -56    58   0.27300  1.0 3.0
   70    54    56    60   3.69350  1.0 1.0
   70    54    56    60  -1.82950 -1.0 2.0
   70    66    71    72   0.23400  1.0 3.0
   70    66    71    73   0.23400  1.0 3.0
   70    66    71    74   3.69350  1.0 1.0
   70    66    71    74  -1.82950 -1.0 2.0
   71    66    70    54   0.06250  1.0 1.0
   71    66    70    54  -0.01100 -1.0 2.0
   71    66    70    54   0.28050  1.0 3.0
   72    71    74    75   0.19450  1.0 3.0
   73    71    74    75   0.19450  1.0 3.0
   68    62    66    67   0.23400  1.0 3.0
   68    62    66    70   3.69350  1.0 1.0
   68    62    66    70  -1.82950 -1.0 2.0
   68    62    66    71   0.86500  1.0 1.0
   68    62    66    71  -0.17500 -1.0 2.0
   68    62    66    71   0.20800  1.0 3.0
   64    58    62    63   0.23400  1.0 3.0
   64    58    62    66   0.86500  1.0 1.0
   64    58    62    66  -0.17500 -1.0 2.0
   64    58    62    66   0.20800  1.0 3.0
   64    58    62    68   3.75450  1.0 1.0
   60    56    58    59   0.23400  1.0 3.0
   60    56    58    62   0.86500  1.0 1.0
   60    56    58    62  -0.17500 -1.0 2.0
   60    56    58    62   0.20800  1.0 3.0
   60    56    58    64   3.75450  1.0 1.0
   39    33    38    41   0.18050 -1.0 2.0
   39    33    38    52   0.18050 -1.0 2.0
   40    39    43    44   7.00000 -1.0 2.0
   40    39    43    45   7.00000 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   41    52    38    33   4.00000 -1.0 2.0
   46    42    41    38   1.10000 -1.0 2.0
   48    47    46    41   1.10000 -1.0 2.0
   49    51    48    46   4.00000 -1.0 2.0
   52    50    49    48   1.10000 -1.0 2.0
   49    53    52    38   1.10000 -1.0 2.0
   33    40    39    43  15.00000 -1.0 2.0
   44    45    43    39  15.00000 -1.0 2.0
END
