* LIGAND DATABASE FILE (OPLS2005)
*
001      72    75    132    220     393
    1     0 S   NP   _N1_     1    28.84414    94.71201   -21.11770
    2     1 S   H    _HN1     2     1.02954    85.39161    12.32992
    3     1 S   H    _H1_     3     1.02828    34.77924   141.42696
    4     1 S   H    _H2_     4     1.02782    90.07959   -96.10172
    5     1 S   CT   _CA1     5     1.50148   145.24428   132.11816
    6     5 S   HC   _HA1     6     1.09555   105.21490    64.96529
    7     5 S   CO3  _C1_     7     1.53906   112.43902   -55.33081
    8     7 S   O2Z  _O11     8     1.26383   115.01339   -38.33412
    9     7 S   O2Z  _O12     9     1.26311   115.18886   141.00595
   10     5 S   CT   _CB1    10     1.53166   107.39740  -176.78180
   11    10 S   HC   HB11    11     1.09818   109.77435   -46.14178
   12    10 S   HC   HB12    12     1.09815   110.27469    70.64133
   13    10 S   CT   _CG1    13     1.52902   112.46152  -167.00445
   14    13 S   HC   HG11    14     1.09364   110.42049   -60.52469
   15    13 S   HC   HG12    15     1.09650   109.92191    58.58744
   16    13 S   C    _CD1    16     1.51733   112.62327   179.39542
   17    16 S   O    _OE1    17     1.22700   123.37280     0.59413
   18    16 S   N    _N2_    18     1.38657   111.46783  -179.64557
   19    18 S   H    _HN2    19     1.01593   118.85052     2.89185
   20    18 S   CT1  _CA2    20     1.46213   123.52579  -179.38962
   21    20 S   HC   _HA2    21     1.09723   109.41057    -1.96423
   22    20 S   C    _C2_    22     1.53407   108.63661  -117.68669
   23    22 S   O    _O2_    23     1.23045   122.27206  -148.15754
   24    20 S   CT   _CB2    32     1.53380   111.22253   119.99826
   25    24 S   HC   HB21    33     1.09421   109.71435    58.46119
   26    24 S   HC   HB22    34     1.09529   110.52982   176.47108
   27    22 S   N    _N3_    24     1.38327   113.61689    39.25447
   28    27 S   H    _HN3    25     1.01618   119.52742    -3.52614
   29    24 S   S    _SG2    35     1.83189   111.17666   -64.68836
   30    27 S   CT   _CA3    26     1.45293   123.16947   177.04302
   31    30 S   HC   HA31    27     1.09551   107.49794   -64.49607
   32    30 S   HC   HA32    28     1.09557   107.98480    51.92666
   33    29 S   CT   _C20    36     1.88179   101.35584   139.84741
   34    30 S   CO3  _C3_    29     1.52949   114.10988   173.90500
   35    34 S   O2Z  _O31    30     1.26371   116.05055    -1.57768
   36    34 S   O2Z  _O32    31     1.26428   114.41719   178.50367
   37    33 S   CO4  _C17    37     1.52684   106.50444    57.42380
   38    37 S   O    _O21    38     1.23053   121.71344    53.27619
   39    33 S   CT   _C19    68     1.57331   107.80028   176.56219
   40    39 S   HC   _H31    69     1.09625   112.10277   -31.51118
   41    37 S   CA   _C10    39     1.48513   119.18297  -128.22455
   42    39 S   NT   _N19    70     1.46531   113.64350  -155.95294
   43    42 S   H    _H35    71     1.01993   109.37607  -174.42219
   44    42 S   H    _H36    72     1.01993   109.42793    70.28972
   45    41 S   CA   _C9_    40     1.39779   120.25821   -13.24613
   46    45 S   CA   _C5_    41     1.40213   120.55065  -177.19991
   47    46 S   HA   _H26    42     1.08745   121.04032   179.88809
   48    45 S   CO4  _C16    50     1.47509   121.14762     2.74045
   49    48 S   O    _O20    51     1.22693   119.60480  -157.24639
   50    46 S   CA   _C4_    43     1.39288   120.14763    -0.76923
   51    50 S   HA   _H25    44     1.08629   120.06945  -179.63309
   52    33 S   CT   _C18    52     1.54782   109.79359   -69.21817
   53    52 S   HC   _H30    53     1.09534   113.07246    32.11816
   54    50 S   CA   _C6_    45     1.39136   119.85964     0.25717
   55    54 S   HA   _H27    46     1.08694   119.65587  -179.95154
   56    52 S   CA   _C12    54     1.50673   101.58196   -85.49022
   57    41 S   CA   _C14    47     1.40478   121.10822   168.97011
   58    56 S   CA   _C11    55     1.39899   110.97470   -19.02899
   59    57 S   OH   _O22    48     1.36958   123.51970    -2.38860
   60    59 S   HO   _H37    49     0.97373   108.99754     3.21199
   61    58 S   CA   _C7_    56     1.38812   121.11821   179.54030
   62    61 S   HA   _H28    57     1.08584   120.34595  -179.68410
   63    61 S   CA   _C13    58     1.40249   118.87854    -0.00000
   64    63 S   CA   _C8_    59     1.40900   119.79120    -1.00814
   65    64 S   HA   _H29    60     1.08766   119.51356  -178.72237
   66    63 S   CT   _C21    64     1.50029   120.22117  -178.11768
   67    66 S   HC   _H32    65     1.09432   109.96407    90.52558
   68    66 S   HC   _H33    66     1.09507   110.85093  -148.97307
   69    66 S   HC   _H34    67     1.09507   110.96155   -29.94770
   70    56 S   CA   _C15    61     1.38336   128.64721   159.48841
   71    70 S   OH   _O23    62     1.36323   119.46466    -0.00000
   72    71 S   HO   _H38    63     0.97612   108.66533  -168.57597
  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  12   5   4   3
  18   2   1   1  15   5  14   7  12   6   2   1  12   9   4   8
   3   5   3   7   3   4   2   9   2   7   1   1   9   3   8   8
   3   4   2   1   1   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    52    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    48    52    53    56    58    39    40    42  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    45    57    48    49    52    53    56    58    61    70    39    40    42    43    44  
   35    36  
   36  
    0  
   38    41    45    46    54    57    59    48    52    53    56    58    39    40    42  
   41    45    57    52    39  
   40    42    43    44    41    48    52    53    56    58    61    62    63    70  
   42    43    44    52    56    58    61  
   45    46    47    50    54    55    57    59    60    48    49    52  
   43    44    52    56    58    61  
   44    58  
   58  
   46    47    50    51    54    57    59    48    49    52    53    56  
   47    50    51    54    55    57    48    49    52  
   50    51    54    48  
   49    52    53    56    58    70    50    57  
   52    53    56  
   51    54    55    57    59  
   54    55    57  
   53    56    58    61    64    70    71  
   56    58    70  
   55    57    59    60  
   57    59  
   58    61    62    63    64    65    70    71    72  
   59    60  
   61    62    63    64    70    71    66  
   60  
    0  
   62    63    64    65    70    66    67    68    69  
   63    64    66  
   64    65    70    71    66    67    68    69  
   65    70    71    72    66    67    68    69  
   70    71    66  
   67    68    69    70  
   68    69  
   69  
    0  
   71    72  
   72  
    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   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   39   3.5000   0.0660   0.235000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   42   3.3000   0.1700  -0.900000   1.8650   1.6500   0.051222218  -2.220205820
   43   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   44   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   45   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   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   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   49   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   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   0.055000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   54   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   55   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   56   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   57   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   58   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   59   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   60   0.5000   0.0300   0.435000   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   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   64   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   65   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   66   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   71   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   72   0.5000   0.0300   0.435000   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    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.522
   33    52   268.000  1.529
   33    39   268.000  1.529
   37    38   570.000  1.229
   37    41   310.000  1.470
   41    45   469.000  1.400
   41    57   469.000  1.400
   45    46   469.000  1.400
   45    48   310.000  1.470
   46    47   367.000  1.080
   46    50   469.000  1.400
   50    51   367.000  1.080
   50    54   469.000  1.400
   54    55   367.000  1.080
   54    57   469.000  1.400
   57    59   450.000  1.364
   59    60   553.000  0.945
   48    49   570.000  1.229
   48    52   317.000  1.522
   52    53   340.000  1.090
   52    56   317.000  1.510
   56    58   469.000  1.400
   56    70   469.000  1.400
   58    61   469.000  1.400
   58    39   317.000  1.510
   61    62   367.000  1.080
   61    63   469.000  1.400
   63    64   469.000  1.400
   63    66   317.000  1.510
   64    65   367.000  1.080
   64    70   469.000  1.400
   70    71   450.000  1.364
   71    72   553.000  0.945
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    69   340.000  1.090
   39    40   340.000  1.090
   39    42   382.000  1.448
   42    43   434.000  1.010
   42    44   434.000  1.010
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  110.18000
   29    33    52    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    80.00000  120.40000
   33    37    41    65.00000  115.47100
   33    52    48    63.00000  111.10000
   33    52    53    37.50000  110.70000
   33    52    56    70.00000  112.17500
   33    39    58    70.00000  112.17500
   33    39    40    37.50000  110.70000
   33    39    42    56.20000  109.47000
   37    41    45    60.00000  119.52600
   37    41    57    60.00000  119.52600
   41    37    38    75.00000  123.78400
   41    45    46    63.00000  120.00000
   41    45    48    60.00000  119.52600
   41    57    54    63.00000  120.00000
   41    57    59    70.00000  120.00000
   45    46    47    35.00000  120.00000
   45    46    50    63.00000  120.00000
   45    48    49    75.00000  123.78400
   45    48    52    65.00000  115.47100
   46    50    51    35.00000  120.00000
   46    50    54    63.00000  120.00000
   50    46    47    35.00000  120.00000
   50    54    55    35.00000  120.00000
   50    54    57    63.00000  120.00000
   54    50    51    35.00000  120.00000
   54    57    59    70.00000  120.00000
   57    41    45    63.00000  120.00000
   57    54    55    35.00000  120.00000
   57    59    60    35.00000  113.00000
   48    45    46    60.00000  119.52600
   48    52    53    35.00000  109.50000
   48    52    56    70.00000  110.93000
   52    33    37    63.00000  111.10000
   52    48    49    80.00000  120.40000
   52    56    58    70.00000  120.00000
   52    56    70    70.00000  120.00000
   56    52    53    35.00000  109.50000
   56    58    61    63.00000  120.00000
   56    58    39    70.00000  120.00000
   56    70    64    63.00000  120.00000
   56    70    71    70.00000  120.00000
   58    61    62    35.00000  120.00000
   58    61    63    63.00000  120.00000
   58    39    40    35.00000  109.50000
   58    39    42    75.00000  112.33000
   61    63    64    63.00000  120.00000
   61    63    66    70.00000  120.00000
   63    61    62    35.00000  120.00000
   63    64    65    35.00000  120.00000
   63    64    70    63.00000  120.00000
   63    66    67    35.00000  109.50000
   63    66    68    35.00000  109.50000
   63    66    69    35.00000  109.50000
   64    70    71    70.00000  120.00000
   70    56    58    63.00000  120.00000
   70    64    65    35.00000  120.00000
   70    71    72    35.00000  113.00000
   66    63    64    70.00000  120.00000
   68    66    67    33.00000  107.80000
   69    66    67    33.00000  107.80000
   69    66    68    33.00000  107.80000
   39    33    37    63.00000  111.10000
   39    33    52    58.35000  112.70000
   39    58    61    70.00000  120.00000
   39    42    43    35.00000  109.50000
   39    42    44    35.00000  109.50000
   42    39    40    35.00000  109.50000
   44    42    43    43.60000  106.40000
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    52   0.01700  1.0 1.0
   24    29    33    52  -0.23550 -1.0 2.0
   24    29    33    52   0.21350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   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   0.30150 -1.0 2.0
   29    33    37    41   0.65300  1.0 1.0
   29    33    37    41  -0.03850 -1.0 2.0
   29    33    37    41   0.33900  1.0 3.0
   29    33    52    48   0.56750  1.0 1.0
   29    33    52    48  -0.07550 -1.0 2.0
   29    33    52    48   0.20000  1.0 3.0
   29    33    52    53   0.15000  1.0 3.0
   29    33    52    56   0.56750  1.0 1.0
   29    33    52    56  -0.07550 -1.0 2.0
   29    33    52    56   0.20000  1.0 3.0
   29    33    39    58   0.56750  1.0 1.0
   29    33    39    58  -0.07550 -1.0 2.0
   29    33    39    58   0.20000  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    42   0.56750  1.0 1.0
   29    33    39    42  -0.07550 -1.0 2.0
   29    33    39    42   0.20000  1.0 3.0
   33    37    41    45   2.26350  1.0 1.0
   33    37    41    45   0.76750 -1.0 2.0
   33    37    41    45   0.22500  1.0 3.0
   33    37    41    57   2.26350  1.0 1.0
   33    37    41    57   0.76750 -1.0 2.0
   33    37    41    57   0.22500  1.0 3.0
   33    52   -56    58   0.04150 -1.0 2.0
   33    52    56    70   0.04150 -1.0 2.0
   33    39    42    43  -0.05950  1.0 1.0
   33    39    42    43   0.08850 -1.0 2.0
   33    39    42    43   0.11750  1.0 3.0
   33    39    42    44  -0.05950  1.0 1.0
   33    39    42    44   0.08850 -1.0 2.0
   33    39    42    44   0.11750  1.0 3.0
   37    33    52    48   0.11950  1.0 1.0
   37    33    52    48   0.20300 -1.0 2.0
   37    33    52    48  -0.70800  1.0 3.0
   37    33    52    53  -0.11250  1.0 3.0
   37    33    52    56   0.56750  1.0 1.0
   37    33    52    56  -0.07550 -1.0 2.0
   37    33    52    56   0.20000  1.0 3.0
   37    33    39    58   0.56750  1.0 1.0
   37    33    39    58  -0.07550 -1.0 2.0
   37    33    39    58   0.20000  1.0 3.0
   37    33    39    40  -0.11250  1.0 3.0
   37    33    39    42  -3.56550  1.0 1.0
   37    33    39    42  -0.67500 -1.0 2.0
   37    33    39    42   1.11300  1.0 3.0
   37    41    45    46   3.62500 -1.0 2.0
   37    41   -45    48   3.62500 -1.0 2.0
   37    41    57    54   3.62500 -1.0 2.0
   37    41    57    59   3.62500 -1.0 2.0
   38    37    41    45   1.05000 -1.0 2.0
   38    37    41    57   1.05000 -1.0 2.0
   41    45    46    47   3.62500 -1.0 2.0
   41    45    46    50   3.62500 -1.0 2.0
   41    45    48    49   1.05000 -1.0 2.0
   41    45    48    52   2.26350  1.0 1.0
   41    45    48    52   0.76750 -1.0 2.0
   41    45    48    52   0.22500  1.0 3.0
   41    57    59    60   0.84100 -1.0 2.0
   45    41    57    54   3.62500 -1.0 2.0
   45    41    57    59   3.62500 -1.0 2.0
   45    46    50    51   3.62500 -1.0 2.0
   45    46   -50    54   3.62500 -1.0 2.0
   45    48   -52    33   0.05850 -1.0 2.0
   45    48   -52    33   0.17250  1.0 3.0
   45    48    52    53   0.00000  1.0 1.0
   45    48    52    56   0.65300  1.0 1.0
   45    48    52    56  -0.03850 -1.0 2.0
   45    48    52    56   0.33900  1.0 3.0
   46    45    48    49   1.05000 -1.0 2.0
   46    45    48    52   2.26350  1.0 1.0
   46    45    48    52   0.76750 -1.0 2.0
   46    45    48    52   0.22500  1.0 3.0
   46    50    54    55   3.62500 -1.0 2.0
   46    50    54    57   3.62500 -1.0 2.0
   47    46    50    51   3.62500 -1.0 2.0
   47    46    50    54   3.62500 -1.0 2.0
   50    54   -57    41   3.62500 -1.0 2.0
   50    54    57    59   3.62500 -1.0 2.0
   51    50    54    55   3.62500 -1.0 2.0
   51    50    54    57   3.62500 -1.0 2.0
   54    57    59    60   0.84100 -1.0 2.0
   55    54    57    41   3.62500 -1.0 2.0
   55    54    57    59   3.62500 -1.0 2.0
   57    41   -45    46   3.62500 -1.0 2.0
   57    41    45    48   3.62500 -1.0 2.0
   48    45    46    47   3.62500 -1.0 2.0
   48    45    46    50   3.62500 -1.0 2.0
   48    52    56    58   0.04300 -1.0 2.0
   48    52    56    70   0.04300 -1.0 2.0
   49    48    52    33   0.30150 -1.0 2.0
   49    48    52    53   0.00000  1.0 1.0
   49    48    52    56   0.30150 -1.0 2.0
   52    33    37    38   0.30150 -1.0 2.0
   52    33   -37    41   0.05850 -1.0 2.0
   52    33   -37    41   0.17250  1.0 3.0
   52    33   -39    58  -0.03700  1.0 1.0
   52    33   -39    58   0.37200 -1.0 2.0
   52    33   -39    58  -0.47300  1.0 3.0
   52    33    39    40   0.15000  1.0 3.0
   52    33    39    42   1.85550  1.0 1.0
   52    33    39    42  -0.84100 -1.0 2.0
   52    56    58    61   3.62500 -1.0 2.0
   52    56   -58    39   3.62500 -1.0 2.0
   52    56    70    64   3.62500 -1.0 2.0
   52    56    70    71   3.62500 -1.0 2.0
   53    52    56    58   0.00000  1.0 1.0
   53    52    56    70   0.00000  1.0 1.0
   56    58    61    62   3.62500 -1.0 2.0
   56    58    61    63   3.62500 -1.0 2.0
   56    58   -39    33   0.04150 -1.0 2.0
   56    58    39    40   0.00000  1.0 1.0
   56    58    39    42   0.18550 -1.0 2.0
   56    58    39    42   0.14000  1.0 3.0
   56    70    71    72   0.84100 -1.0 2.0
   58    56    70    64   3.62500 -1.0 2.0
   58    56    70    71   3.62500 -1.0 2.0
   58    61   -63    64   3.62500 -1.0 2.0
   58    61    63    66   3.62500 -1.0 2.0
   58    39    42    43   0.76500  1.0 1.0
   58    39    42    43   0.05700 -1.0 2.0
   58    39    42    43  -0.90900  1.0 3.0
   58    39    42    44   0.76500  1.0 1.0
   58    39    42    44   0.05700 -1.0 2.0
   58    39    42    44  -0.90900  1.0 3.0
   61    58    39    33   0.04150 -1.0 2.0
   61    58    39    40   0.00000  1.0 1.0
   61    58    39    42   0.18550 -1.0 2.0
   61    58    39    42   0.14000  1.0 3.0
   61    63    64    65   3.62500 -1.0 2.0
   61    63    64    70   3.62500 -1.0 2.0
   61    63    66    67   0.00000  1.0 1.0
   61    63    66    68   0.00000  1.0 1.0
   61    63    66    69   0.00000  1.0 1.0
   62    61    63    64   3.62500 -1.0 2.0
   62    61    63    66   3.62500 -1.0 2.0
   63    64   -70    56   3.62500 -1.0 2.0
   63    64    70    71   3.62500 -1.0 2.0
   64    63    66    67   0.00000  1.0 1.0
   64    63    66    68   0.00000  1.0 1.0
   64    63    66    69   0.00000  1.0 1.0
   64    70    71    72   0.84100 -1.0 2.0
   65    64    70    56   3.62500 -1.0 2.0
   65    64    70    71   3.62500 -1.0 2.0
   70    56   -58    61   3.62500 -1.0 2.0
   70    56    58    39   3.62500 -1.0 2.0
   66    63    64    65   3.62500 -1.0 2.0
   66    63    64    70   3.62500 -1.0 2.0
   39    33    37    38   0.30150 -1.0 2.0
   39    33    37    41   0.05850 -1.0 2.0
   39    33    37    41   0.17250  1.0 3.0
   39    33    52    48  -0.95700  1.0 1.0
   39    33    52    48  -0.18200 -1.0 2.0
   39    33    52    48   0.29450  1.0 3.0
   39    33    52    53   0.15000  1.0 3.0
   39    33   -52    56  -0.03700  1.0 1.0
   39    33   -52    56   0.37200 -1.0 2.0
   39    33   -52    56  -0.47300  1.0 3.0
   39    58    61    62   3.62500 -1.0 2.0
   39    58    61    63   3.62500 -1.0 2.0
   40    39    42    43   0.20000  1.0 3.0
   40    39    42    44   0.20000  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
   33    41    37    38  10.50000 -1.0 2.0
   45    57    41    37   4.00000 -1.0 2.0
   46    48    45    41   4.00000 -1.0 2.0
   50    47    46    45   1.10000 -1.0 2.0
   54    51    50    46   1.10000 -1.0 2.0
   57    55    54    50   1.10000 -1.0 2.0
   54    59    57    41   4.00000 -1.0 2.0
   45    52    48    49  10.50000 -1.0 2.0
   58    70    56    52   4.00000 -1.0 2.0
   61    39    58    56   4.00000 -1.0 2.0
   63    62    61    58   1.10000 -1.0 2.0
   64    66    63    61   4.00000 -1.0 2.0
   70    65    64    63   1.10000 -1.0 2.0
   64    71    70    56   4.00000 -1.0 2.0
END
