* LIGAND DATABASE FILE (OPLS2005)
*
001      73    74    132    209     394
    1     0 S   NP   _N1_     1    28.73672    94.49399   -24.47286
    2     1 S   H    _HN1     2     1.02950    81.79155    15.19875
    3     1 S   H    _H1_     3     1.02829    26.44094   178.40762
    4     1 S   H    _H2_     4     1.02786   109.96469   -91.41947
    5     1 S   CT   _CA1     5     1.50112   128.74699   124.83481
    6     5 S   HC   _HA1     6     1.09573   105.20316    81.83022
    7     5 S   CO3  _C1_     7     1.53773   112.37906   -38.42082
    8     7 S   O2Z  _O11     8     1.26370   115.00701   -44.56811
    9     7 S   O2Z  _O12     9     1.26225   114.92645   134.48118
   10     5 S   CT   _CB1    10     1.53064   107.41215  -160.21934
   11    10 S   HC   HB11    11     1.09835   109.36403   -49.85562
   12    10 S   HC   HB12    12     1.09812   110.46378    66.73406
   13    10 S   CT   _CG1    13     1.53000   112.61778  -170.82418
   14    13 S   HC   HG11    14     1.09589   110.66158   -65.54367
   15    13 S   HC   HG12    15     1.09667   109.79379    53.71061
   16    13 S   C    _CD1    16     1.51802   112.12026   174.15601
   17    16 S   O    _OE1    17     1.22739   123.26026     7.55622
   18    16 S   N    _N2_    18     1.38622   111.72832  -172.62328
   19    18 S   H    _HN2    19     1.01598   118.97012     1.55293
   20    18 S   CT1  _CA2    20     1.46241   123.36015   177.74059
   21    20 S   HC   _HA2    21     1.09737   109.40821     1.65339
   22    20 S   C    _C2_    22     1.53535   108.65555  -113.85243
   23    22 S   O    _O2_    23     1.23058   122.26329  -148.50310
   24    20 S   CT   _CB2    32     1.53432   111.42050   123.70533
   25    24 S   HC   HB21    33     1.09314   109.28580    56.59380
   26    24 S   HC   HB22    34     1.09457   109.91872   175.34234
   27    22 S   N    _N3_    24     1.38324   113.69521    39.00102
   28    27 S   H    _HN3    25     1.01590   119.56873    -3.47801
   29    24 S   S    _SG2    35     1.82955   110.95441   -65.33383
   30    27 S   CT   _CA3    26     1.45286   123.22367   177.08308
   31    30 S   HC   HA31    27     1.09549   107.52157   -64.32427
   32    30 S   HC   HA32    28     1.09556   107.97172    52.11290
   33    29 S   CT   _C15    36     1.87444   102.65473   167.66217
   34    30 S   CO3  _C3_    29     1.52962   114.07510   174.10342
   35    34 S   O2Z  _O31    30     1.26377   116.06432    -0.53741
   36    34 S   O2Z  _O32    31     1.26427   114.41453   179.52235
   37    33 S   CT   _C13    37     1.54698   109.52883    49.76854
   38    37 S   HC   _H27    38     1.09709   111.29470    45.85928
   39    37 S   HC   _H28    39     1.09779   109.60104   -72.09212
   40    33 S   CT   _C14    51     1.55435   107.99193   168.55139
   41    40 S   HC   _H29    52     1.09652   108.42687    68.31244
   42    33 S   CT   _C18    61     1.57267   108.78579   -69.39330
   43    42 S   HC   _H35    62     1.09685   108.44814   175.92778
   44    42 S   HC   _H36    63     1.09618   108.66508    62.20545
   45    37 S   CA   _C8_    40     1.51116   113.53726   167.14460
   46    40 S   CO4  _C11    53     1.53553   115.40694   -50.14687
   47    46 S   O    _O19    54     1.23081   122.43795   -62.70975
   48    42 S   CT   _C19    64     1.54259   117.53121   -61.57211
   49    48 S   HC   _H37    65     1.09351   110.82320    38.14399
   50    45 S   CA   _C5_    41     1.40539   118.17122   159.62523
   51    50 S   HA   _H25    42     1.08788   120.18408    -0.38206
   52    46 S   CT   _C16    55     1.50821   116.73736   120.20042
   53    52 S   HC   _H30    56     1.09272   109.42031    64.80100
   54    52 S   HC   _H31    57     1.09242   110.01064   -56.33147
   55    52 S   HC   _H32    58     1.09355   109.64088  -175.64135
   56    48 S   CT   _C17    66     1.53192   112.50498   158.16173
   57    56 S   HC   _H33    67     1.09744   109.22528   175.58385
   58    56 S   HC   _H34    68     1.09742   108.80112   -67.58408
   59    48 S   OH   _O22    72     1.42615   110.39574   -79.50411
   60    59 S   HO   _H39    73     0.97557   107.23632   -69.66453
   61    50 S   CA   _C4_    43     1.39360   120.88523   179.89721
   62    61 S   HA   _H24    44     1.08614   120.04602   179.64778
   63    56 S   CO3  _C12    69     1.53321   116.38875    55.48943
   64    63 S   O2Z  _O17    70     1.26360   114.62237  -144.87888
   65    63 S   O2Z  _O20    71     1.26288   115.82954    35.74045
   66    61 S   CA   _C6_    45     1.39066   119.87131    -0.30964
   67    66 S   HA   _H26    46     1.08670   119.70449   179.88986
   68    66 S   CA   _C9_    47     1.39501   119.91907    -0.35936
   69    45 S   CA   _C7_    48     1.40494   122.64977   -21.74626
   70    68 S   OH   _O21    59     1.36927   115.78698  -179.58599
   71    70 S   HO   _H38    60     0.97380   108.79687  -178.61238
   72    69 S   CO4  _C10    49     1.48912   119.33999    -0.40300
   73    72 S   O    _O18    50     1.22898   120.34435   176.68418
  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  13   5   4   3
  20   2   1   1  16   6   5  16   7  13   5   4  10   8   5   9
   6   8   4   4   2   1   1   7   5   4   2   1   6   3   2   1
   1   6   3   5   4   2   1   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    40    42    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    45    72    40    41    46    42    43    44    48  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    45    50    69    72    73    40    41    46    47    52    42    43    44    48    49    56    59  
   35    36  
   36  
    0  
   38    39    45    50    51    61    68    69    72    40    41    46    42    43    44    48  
   39    45    50    69    40    42  
   45    50    69    40    42  
   41    46    47    52    53    54    55    42    43    44    48    45    68    69    72    73  
   46    47    52    42    69    72    73  
   43    44    48    49    56    57    58    63    59    60    45    46    72  
   44    48    49    56    59  
   48    49    56    59  
   50    51    61    62    66    68    69    72    73    70  
   47    52    53    54    55    69    72    73  
   52    53    54    55    72  
   49    56    57    58    63    64    65    59    60  
   56    57    58    63    59    60  
   51    61    62    66    67    68    69    72  
   61    62    66    69  
   53    54    55    72  
   54    55  
   55  
    0  
   57    58    63    64    65    59    60  
   58    63    64    65    59  
   63    64    65    59  
   60    63  
    0  
   62    66    67    68    69    70  
   66    67    68  
   64    65  
   65  
    0  
   67    68    69    72    70    71  
   68    69    70  
   69    72    73    70    71  
   72    73    70    71  
   71    72  
    0  
   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   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   42   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   46   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   47   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   48   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   51   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   52   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   59   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   60   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   61   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   63   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   64   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   65   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   66   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   67   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   68   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   69   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   70   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   71   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   72   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   73   2.9600   0.2100  -0.470000   1.6780   1.4800   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    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   268.000  1.529
   33    40   268.000  1.529
   33    42   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    45   317.000  1.510
   45    50   469.000  1.400
   45    69   469.000  1.400
   50    51   367.000  1.080
   50    61   469.000  1.400
   61    62   367.000  1.080
   61    66   469.000  1.400
   66    67   367.000  1.080
   66    68   469.000  1.400
   68    69   469.000  1.400
   68    70   450.000  1.364
   69    72   310.000  1.470
   72    73   570.000  1.229
   72    40   317.000  1.522
   40    41   340.000  1.090
   40    46   317.000  1.522
   46    47   570.000  1.229
   46    52   317.000  1.522
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   340.000  1.090
   70    71   553.000  0.945
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    48   268.000  1.529
   48    49   340.000  1.090
   48    56   268.000  1.529
   48    59   320.000  1.410
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    63   317.000  1.522
   63    64   656.000  1.250
   63    65   656.000  1.250
   59    60   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    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  111.63000
   29    33    40    75.00000  111.63000
   29    33    42    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    45    70.00000  112.17500
   33    40    72    63.00000  111.10000
   33    40    41    37.50000  110.70000
   33    40    46    63.00000  111.10000
   33    42    43    37.50000  110.70000
   33    42    44    37.50000  110.70000
   33    42    48    58.35000  112.70000
   37    45    50    70.00000  120.00000
   37    45    69    70.00000  120.00000
   39    37    38    33.00000  107.80000
   45    37    38    35.00000  109.50000
   45    37    39    35.00000  109.50000
   45    50    51    35.00000  120.00000
   45    50    61    63.00000  120.00000
   45    69    68    63.00000  120.00000
   45    69    72    60.00000  119.52600
   50    61    62    35.00000  120.00000
   50    61    66    63.00000  120.00000
   61    50    51    35.00000  120.00000
   61    66    67    35.00000  120.00000
   61    66    68    63.00000  120.00000
   66    61    62    35.00000  120.00000
   66    68    69    63.00000  120.00000
   66    68    70    70.00000  120.00000
   68    66    67    35.00000  120.00000
   68    69    72    60.00000  119.52600
   68    70    71    35.00000  113.00000
   69    45    50    63.00000  120.00000
   69    72    73    75.00000  123.78400
   69    72    40    65.00000  115.47100
   72    40    41    35.00000  109.50000
   72    40    46    75.00000  107.99600
   40    33    37    58.35000  112.70000
   40    72    73    80.00000  120.40000
   40    46    47    80.00000  120.40000
   40    46    52    70.00000  116.00000
   46    40    41    35.00000  109.50000
   46    52    53    35.00000  109.50000
   46    52    54    35.00000  109.50000
   46    52    55    35.00000  109.50000
   52    46    47    80.00000  120.40000
   54    52    53    33.00000  107.80000
   55    52    53    33.00000  107.80000
   55    52    54    33.00000  107.80000
   70    68    69    70.00000  120.00000
   42    33    37    58.35000  112.70000
   42    33    40    58.35000  112.70000
   42    48    49    37.50000  110.70000
   42    48    56    58.35000  112.70000
   42    48    59    50.00000  109.50000
   44    42    43    33.00000  107.80000
   48    42    43    37.50000  110.70000
   48    42    44    37.50000  110.70000
   48    56    57    37.50000  110.70000
   48    56    58    37.50000  110.70000
   48    56    63    70.00000  109.69300
   48    59    60    55.00000  108.50000
   56    48    49    37.50000  110.70000
   56    63    64    70.00000  117.00000
   56    63    65    70.00000  117.00000
   58    56    57    33.00000  107.80000
   63    56    57    35.00000  109.50000
   63    56    58    35.00000  109.50000
   65    63    64    80.00000  126.00000
   59    48    49    35.00000  109.50000
   59    48    56    50.00000  109.50000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    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   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   0.21350  1.0 3.0
   24    29    33    42   0.01700  1.0 1.0
   24    29    33    42  -0.23550 -1.0 2.0
   24    29    33    42   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.15000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    45   0.56750  1.0 1.0
   29    33    37    45  -0.07550 -1.0 2.0
   29    33    37    45   0.20000  1.0 3.0
   29    33    40    72   0.56750  1.0 1.0
   29    33    40    72  -0.07550 -1.0 2.0
   29    33    40    72   0.20000  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    46   0.56750  1.0 1.0
   29    33    40    46  -0.07550 -1.0 2.0
   29    33    40    46   0.20000  1.0 3.0
   29    33    42    43   0.15000  1.0 3.0
   29    33    42    44   0.15000  1.0 3.0
   29    33    42    48   0.44750  1.0 1.0
   29    33    42    48  -0.17800 -1.0 2.0
   29    33    42    48   0.20200  1.0 3.0
   33    37    45    50   0.04150 -1.0 2.0
   33    37    45    69   0.04150 -1.0 2.0
   33    40    46    47   0.30150 -1.0 2.0
   33    40    46    52   0.60050  1.0 1.0
   33    40    46    52   0.05600 -1.0 2.0
   33    40    46    52   0.26150  1.0 3.0
   33    42    48    49   0.15000  1.0 3.0
   33    42    48    56   0.56750  1.0 1.0
   33    42    48    56  -0.07550 -1.0 2.0
   33    42    48    56   0.20000  1.0 3.0
   33    42    48    59   0.86500  1.0 1.0
   33    42    48    59  -0.17500 -1.0 2.0
   33    42    48    59   0.20800  1.0 3.0
   37    33    40    72  -0.95700  1.0 1.0
   37    33    40    72  -0.18200 -1.0 2.0
   37    33    40    72   0.29450  1.0 3.0
   37    33    40    41   0.15000  1.0 3.0
   37    33    40    46  -0.95700  1.0 1.0
   37    33    40    46  -0.18200 -1.0 2.0
   37    33    40    46   0.29450  1.0 3.0
   37    33    42    43   0.15000  1.0 3.0
   37    33    42    44   0.15000  1.0 3.0
   37    33    42    48   0.56750  1.0 1.0
   37    33    42    48  -0.07550 -1.0 2.0
   37    33    42    48   0.20000  1.0 3.0
   37    45    50    51   3.62500 -1.0 2.0
   37    45    50    61   3.62500 -1.0 2.0
   37    45    69    68   3.62500 -1.0 2.0
   37    45   -69    72   3.62500 -1.0 2.0
   38    37    45    50   0.00000  1.0 1.0
   38    37    45    69   0.00000  1.0 1.0
   39    37    45    50   0.00000  1.0 1.0
   39    37    45    69   0.00000  1.0 1.0
   45    50    61    62   3.62500 -1.0 2.0
   45    50    61    66   3.62500 -1.0 2.0
   45    69    72    73   1.05000 -1.0 2.0
   45    69    72    40   2.26350  1.0 1.0
   45    69    72    40   0.76750 -1.0 2.0
   45    69    72    40   0.22500  1.0 3.0
   50    45    69    68   3.62500 -1.0 2.0
   50    45    69    72   3.62500 -1.0 2.0
   50    61    66    67   3.62500 -1.0 2.0
   50    61   -66    68   3.62500 -1.0 2.0
   51    50    61    62   3.62500 -1.0 2.0
   51    50    61    66   3.62500 -1.0 2.0
   61    66    68    69   3.62500 -1.0 2.0
   61    66    68    70   3.62500 -1.0 2.0
   62    61    66    67   3.62500 -1.0 2.0
   62    61    66    68   3.62500 -1.0 2.0
   66    68   -69    45   3.62500 -1.0 2.0
   66    68    69    72   3.62500 -1.0 2.0
   66    68    70    71   0.84100 -1.0 2.0
   67    66    68    69   3.62500 -1.0 2.0
   67    66    68    70   3.62500 -1.0 2.0
   68    69    72    73   1.05000 -1.0 2.0
   68    69    72    40   2.26350  1.0 1.0
   68    69    72    40   0.76750 -1.0 2.0
   68    69    72    40   0.22500  1.0 3.0
   69    45    50    51   3.62500 -1.0 2.0
   69    45   -50    61   3.62500 -1.0 2.0
   69    68    70    71   0.84100 -1.0 2.0
   69    72   -40    33   0.05850 -1.0 2.0
   69    72   -40    33   0.17250  1.0 3.0
   69    72    40    41   0.00000  1.0 1.0
   69    72    40    46   0.65300  1.0 1.0
   69    72    40    46  -0.03850 -1.0 2.0
   69    72    40    46   0.33900  1.0 3.0
   72    40    46    47   0.30150 -1.0 2.0
   72    40    46    52   0.65300  1.0 1.0
   72    40    46    52  -0.03850 -1.0 2.0
   72    40    46    52   0.33900  1.0 3.0
   73    72    40    33   0.30150 -1.0 2.0
   73    72    40    41   0.00000  1.0 1.0
   73    72    40    46   0.30150 -1.0 2.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33   -37    45  -0.03700  1.0 1.0
   40    33   -37    45   0.37200 -1.0 2.0
   40    33   -37    45  -0.47300  1.0 3.0
   40    33    42    43   0.15000  1.0 3.0
   40    33    42    44   0.15000  1.0 3.0
   40    33    42    48   0.56750  1.0 1.0
   40    33    42    48  -0.07550 -1.0 2.0
   40    33    42    48   0.20000  1.0 3.0
   40    46    52    53   0.00000  1.0 1.0
   40    46    52    54   0.00000  1.0 1.0
   40    46    52    55   0.00000  1.0 1.0
   41    40    46    47   0.00000  1.0 1.0
   41    40    46    52   0.00000  1.0 1.0
   47    46    52    53   0.00000  1.0 1.0
   47    46    52    54   0.00000  1.0 1.0
   47    46    52    55   0.00000  1.0 1.0
   70    68    69    45   3.62500 -1.0 2.0
   70    68    69    72   3.62500 -1.0 2.0
   42    33    37    38   0.15000  1.0 3.0
   42    33    37    39   0.15000  1.0 3.0
   42    33    37    45  -0.03700  1.0 1.0
   42    33    37    45   0.37200 -1.0 2.0
   42    33    37    45  -0.47300  1.0 3.0
   42    33    40    72  -0.95700  1.0 1.0
   42    33    40    72  -0.18200 -1.0 2.0
   42    33    40    72   0.29450  1.0 3.0
   42    33    40    41   0.15000  1.0 3.0
   42    33    40    46  -0.95700  1.0 1.0
   42    33    40    46  -0.18200 -1.0 2.0
   42    33    40    46   0.29450  1.0 3.0
   42    48    56    57   0.15000  1.0 3.0
   42    48    56    58   0.15000  1.0 3.0
   42    48    56    63  -1.63150  1.0 1.0
   42    48    56    63  -0.43550 -1.0 2.0
   42    48    56    63   0.24500  1.0 3.0
   42    48    59    60  -0.11600  1.0 1.0
   42    48    59    60  -0.09450 -1.0 2.0
   42    48    59    60   0.21250  1.0 3.0
   43    42    48    49   0.15000  1.0 3.0
   43    42    48    56   0.15000  1.0 3.0
   43    42    48    59   0.23400  1.0 3.0
   44    42    48    49   0.15000  1.0 3.0
   44    42    48    56   0.15000  1.0 3.0
   44    42    48    59   0.23400  1.0 3.0
   48    56    63    64   0.41150 -1.0 2.0
   48    56    63    65   0.41150 -1.0 2.0
   49    48    56    57   0.15000  1.0 3.0
   49    48    56    58   0.15000  1.0 3.0
   49    48    56    63  -0.11250  1.0 3.0
   49    48    59    60   0.19450  1.0 3.0
   56    48    59    60  -0.11600  1.0 1.0
   56    48    59    60  -0.09450 -1.0 2.0
   56    48    59    60   0.21250  1.0 3.0
   57    56    63    64   0.00000  1.0 1.0
   57    56    63    65   0.00000  1.0 1.0
   58    56    63    64   0.00000  1.0 1.0
   58    56    63    65   0.00000  1.0 1.0
   59    48    56    57   0.23400  1.0 3.0
   59    48    56    58   0.23400  1.0 3.0
   59    48    56    63  -5.33000  1.0 1.0
   59    48    56    63  -0.54250 -1.0 2.0
   59    48    56    63  -0.07300  1.0 3.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    34    35  10.50000 -1.0 2.0
   50    69    45    37   4.00000 -1.0 2.0
   61    51    50    45   1.10000 -1.0 2.0
   66    62    61    50   1.10000 -1.0 2.0
   68    67    66    61   1.10000 -1.0 2.0
   69    70    68    66   4.00000 -1.0 2.0
   68    72    69    45   4.00000 -1.0 2.0
   69    40    72    73  10.50000 -1.0 2.0
   40    52    46    47  10.50000 -1.0 2.0
   64    56    63    65  10.50000 -1.0 2.0
END
