* LIGAND DATABASE FILE (OPLS2005)
*
001      73    75    129    211     384
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02033    55.49609    88.11909
    3     1 S   H    _H1_     3     1.02125    56.62156  -115.19042
    4     1 S   H    _H2_     4     1.02035   106.65758   -13.48739
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08610   110.54789    58.78698
   26    24 S   HC   HB22    34     1.08612   109.94660   179.10082
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CT   _C11    36     1.86998    97.74666   161.83013
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CA   _C8_    37     1.54486   113.75652   -59.95941
   38    33 S   CO4  _C20    54     1.54596   101.78634    58.33429
   39    38 S   O    _O36    55     1.23003   122.22313   -87.17283
   40    33 S   CT   _C12    67     1.54271   111.35776   176.07444
   41    40 S   HC   _H9_    68     1.11167   107.78405   179.17481
   42    37 S   CA   _C7_    38     1.39502   120.33387   143.49306
   43    38 S   CA   _C15    56     1.48791   118.80465    88.93584
   44    40 S   CO3  _C21    69     1.52502   112.63143    63.05638
   45    44 S   O2Z  _O38    70     1.26230   115.26731   -62.57652
   46    44 S   O2Z  _O37    71     1.26306   114.78677   117.40178
   47    42 S   CA   _C6_    39     1.39471   119.97710   179.94405
   48    47 S   HA   _H6_    40     1.08777   120.21179   179.80218
   49    42 S   CO4  _C22    51     1.45645   121.23590    -0.10279
   50    49 S   O    _O39    52     1.23305   122.97227  -119.92903
   51    49 S   HC   _H14    53     1.11018   117.32922    60.06489
   52    43 S   CA   _C16    57     1.40125   119.02596  -174.80869
   53    52 S   HA   _H10    58     1.08923   121.08825    -3.32567
   54    47 S   CA   _C5_    41     1.39535   120.00073     0.00000
   55    52 S   CA   _C17    59     1.39589   120.24866   177.54098
   56    55 S   HA   _H11    60     1.08612   119.91176   179.53228
   57    54 S   CA   _C10    42     1.39433   120.01637     0.03426
   58    57 S   HA   _H7_    43     1.08723   120.17870   179.95577
   59    54 S   CT   _C4_    47     1.49171   119.99825   179.88636
   60    59 S   HC   _H3_    48     1.09736   110.32479    90.06387
   61    59 S   HC   _H4_    49     1.09774   111.27993  -149.49420
   62    59 S   HC   _H5_    50     1.09798   111.28826   -30.41898
   63    55 S   CA   _C18    61     1.39244   120.06873    -0.25564
   64    63 S   HA   _H12    62     1.08647   119.53665  -179.34568
   65    37 S   CA   _C9_    44     1.39535   119.64390   -36.56136
   66    63 S   CA   _C19    63     1.39485   120.04160     0.40542
   67    65 S   OH   _O33    45     1.36234   120.81176     0.01978
   68    67 S   HO   _H8_    46     0.97005   110.13831   179.97202
   69    43 S   CA   _C14    64     1.39685   121.48098     3.00648
   70    66 S   OH   _O35    72     1.36360   117.23850  -179.45106
   71    70 S   HO   _H13    73     0.97025   110.12172  -179.97202
   72    69 S   CO4  _C13    65     1.47677   120.64415     3.84267
   73    72 S   O    _O34    66     1.22597   120.23969  -165.79452
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  11   5   4   3
  19   2   1   1  19  13   4  11   6  10  10   5   2   1  12   4
   4   1   1   8   4   8   6   3   8   3   4   2   1   1   6   3
   2   5   1   1   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    38    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    42    65    38    39    43    72    40    41    44  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    42    47    57    65    67    49    38    39    43    52    69    72    73    40    41    44    45    46  
   35    36  
   36  
    0  
   42    47    48    54    57    58    65    67    68    49    50    51    38    39    43    72    40    41    44  
   39    43    52    53    55    66    69    72    40    41    44    42    65  
   43    52    69    40  
   41    44    45    46    42    43    65    66    69    72    73  
   44    45    46    69    72    73  
   47    48    54    57    65    67    59    49    50    51  
   52    53    55    56    63    66    69    72    73    70  
   45    46    69    72    73  
   46    72  
   72  
   48    54    57    58    65    59    60    61    62    49    50    51  
   54    57    59    49  
   50    51    54    65  
   51  
    0  
   53    55    56    63    64    66    69    72  
   55    56    63    69  
   57    58    65    67    59    60    61    62  
   56    63    64    66    69    70  
   63    64    66  
   58    65    67    68    59    60    61    62  
   65    67    59  
   60    61    62    65  
   61    62  
   62  
    0  
   64    66    69    72    70    71  
   66    69    70  
   67    68  
   69    72    73    70    71  
   68  
    0  
   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   0.282500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   38   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   39   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   40   3.5000   0.0660  -0.160000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   42   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   43   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   44   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   47   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   48   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   49   3.7500   0.1050   0.565000   2.1120   1.8750   0.001000000  -0.126889456
   50   2.9600   0.2100  -0.450000   1.6780   1.4800   0.001000000  -0.126889456
   51   2.4200   0.0150   0.000000   1.3810   1.2100   0.008598240   0.268726247
   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   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   55   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   56   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   57   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   64   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   65   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   66   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   67   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   68   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   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   317.000  1.510
   33    38   317.000  1.522
   33    40   268.000  1.529
   37    42   469.000  1.400
   37    65   469.000  1.400
   42    47   469.000  1.400
   42    49   310.000  1.470
   47    48   367.000  1.080
   47    54   469.000  1.400
   54    57   469.000  1.400
   54    59   317.000  1.510
   57    58   367.000  1.080
   57    65   469.000  1.400
   65    67   450.000  1.364
   67    68   553.000  0.945
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   340.000  1.090
   49    50   570.000  1.229
   49    51   340.000  1.090
   38    39   570.000  1.229
   38    43   310.000  1.470
   43    52   469.000  1.400
   43    69   469.000  1.400
   52    53   367.000  1.080
   52    55   469.000  1.400
   55    56   367.000  1.080
   55    63   469.000  1.400
   63    64   367.000  1.080
   63    66   469.000  1.400
   66    69   469.000  1.400
   66    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    44   317.000  1.522
   44    45   656.000  1.250
   44    46   656.000  1.250
   70    71   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    80.00000  109.48900
   29    33    38    75.00000  110.18000
   29    33    40    75.00000  111.63000
   33    37    42    70.00000  120.00000
   33    37    65    70.00000  120.00000
   33    38    39    80.00000  120.40000
   33    38    43    65.00000  115.47100
   33    40    72    63.00000  111.10000
   33    40    41    37.50000  110.70000
   33    40    44    70.00000  109.69300
   37    42    47    63.00000  120.00000
   37    42    49    60.00000  119.52600
   37    65    57    63.00000  120.00000
   37    65    67    70.00000  120.00000
   42    47    48    35.00000  120.00000
   42    47    54    63.00000  120.00000
   42    49    50    75.00000  123.78400
   42    49    51    35.00000  115.00000
   47    54    57    63.00000  120.00000
   47    54    59    70.00000  120.00000
   54    47    48    35.00000  120.00000
   54    57    58    35.00000  120.00000
   54    57    65    63.00000  120.00000
   54    59    60    35.00000  109.50000
   54    59    61    35.00000  109.50000
   54    59    62    35.00000  109.50000
   57    65    67    70.00000  120.00000
   65    37    42    63.00000  120.00000
   65    57    58    35.00000  120.00000
   65    67    68    35.00000  113.00000
   59    54    57    70.00000  120.00000
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    33.00000  107.80000
   49    42    47    60.00000  119.52600
   51    49    50    35.00000  123.00000
   38    33    37    70.00000  110.93000
   38    43    52    60.00000  119.52600
   38    43    69    60.00000  119.52600
   43    38    39    75.00000  123.78400
   43    52    53    35.00000  120.00000
   43    52    55    63.00000  120.00000
   43    69    66    63.00000  120.00000
   43    69    72    60.00000  119.52600
   52    55    56    35.00000  120.00000
   52    55    63    63.00000  120.00000
   55    52    53    35.00000  120.00000
   55    63    64    35.00000  120.00000
   55    63    66    63.00000  120.00000
   63    55    56    35.00000  120.00000
   63    66    69    63.00000  120.00000
   63    66    70    70.00000  120.00000
   66    63    64    35.00000  120.00000
   66    69    72    60.00000  119.52600
   66    70    71    35.00000  113.00000
   69    43    52    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    44    70.00000  107.85200
   40    33    37    70.00000  112.17500
   40    33    38    63.00000  111.10000
   40    72    73    80.00000  120.40000
   40    44    45    70.00000  117.00000
   40    44    46    70.00000  117.00000
   44    40    41    35.00000  109.50000
   46    44    45    80.00000  126.00000
   70    66    69    70.00000  120.00000
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    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  -0.23050  1.0 1.0
   24    29    33    37   0.06200 -1.0 2.0
   24    29    33    37   0.47200  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   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
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    42  -0.16000  1.0 1.0
   29    33    37    42  -0.03200 -1.0 2.0
   29    33    37    42   0.04500  1.0 3.0
   29    33    37    65  -0.16000  1.0 1.0
   29    33    37    65  -0.03200 -1.0 2.0
   29    33    37    65   0.04500  1.0 3.0
   29    33    38    39   0.30150 -1.0 2.0
   29    33    38    43   0.65300  1.0 1.0
   29    33    38    43  -0.03850 -1.0 2.0
   29    33    38    43   0.33900  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    44   0.56750  1.0 1.0
   29    33    40    44  -0.07550 -1.0 2.0
   29    33    40    44   0.20000  1.0 3.0
   33    37    42    47   3.62500 -1.0 2.0
   33    37    42    49   3.62500 -1.0 2.0
   33    37    65    57   3.62500 -1.0 2.0
   33    37    65    67   3.62500 -1.0 2.0
   33    38    43    52   2.26350  1.0 1.0
   33    38    43    52   0.76750 -1.0 2.0
   33    38    43    52   0.22500  1.0 3.0
   33    38    43    69   2.26350  1.0 1.0
   33    38    43    69   0.76750 -1.0 2.0
   33    38    43    69   0.22500  1.0 3.0
   33    40    44    45   0.41150 -1.0 2.0
   33    40    44    46   0.41150 -1.0 2.0
   37    33    38    39   0.30150 -1.0 2.0
   37    33    38    43   0.65300  1.0 1.0
   37    33    38    43  -0.03850 -1.0 2.0
   37    33    38    43   0.33900  1.0 3.0
   37    33    40    72   0.56750  1.0 1.0
   37    33    40    72  -0.07550 -1.0 2.0
   37    33    40    72   0.20000  1.0 3.0
   37    33    40    41   0.43200  1.0 3.0
   37    33    40    44  -2.95950  1.0 1.0
   37    33    40    44   0.02300  1.0 3.0
   37    42    47    48   3.62500 -1.0 2.0
   37    42    47    54   3.62500 -1.0 2.0
   37    42    49    50   1.05000 -1.0 2.0
   37    42    49    51   0.56600 -1.0 2.0
   37    65    67    68   0.84100 -1.0 2.0
   42    37    65    57   3.62500 -1.0 2.0
   42    37    65    67   3.62500 -1.0 2.0
   42    47   -54    57   3.62500 -1.0 2.0
   42    47    54    59   3.62500 -1.0 2.0
   47    42    49    50   1.05000 -1.0 2.0
   47    42    49    51   0.56600 -1.0 2.0
   47    54    57    58   3.62500 -1.0 2.0
   47    54    57    65   3.62500 -1.0 2.0
   47    54    59    60   0.00000  1.0 1.0
   47    54    59    61   0.00000  1.0 1.0
   47    54    59    62   0.00000  1.0 1.0
   48    47    54    57   3.62500 -1.0 2.0
   48    47    54    59   3.62500 -1.0 2.0
   54    57   -65    37   3.62500 -1.0 2.0
   54    57    65    67   3.62500 -1.0 2.0
   57    54    59    60   0.00000  1.0 1.0
   57    54    59    61   0.00000  1.0 1.0
   57    54    59    62   0.00000  1.0 1.0
   57    65    67    68   0.84100 -1.0 2.0
   58    57    65    37   3.62500 -1.0 2.0
   58    57    65    67   3.62500 -1.0 2.0
   65    37   -42    47   3.62500 -1.0 2.0
   65    37    42    49   3.62500 -1.0 2.0
   59    54    57    58   3.62500 -1.0 2.0
   59    54    57    65   3.62500 -1.0 2.0
   49    42    47    48   3.62500 -1.0 2.0
   49    42    47    54   3.62500 -1.0 2.0
   38    33    37    42   0.04300 -1.0 2.0
   38    33    37    65   0.04300 -1.0 2.0
   38    33    40    72   0.11950  1.0 1.0
   38    33    40    72   0.20300 -1.0 2.0
   38    33    40    72  -0.70800  1.0 3.0
   38    33    40    41  -0.11250  1.0 3.0
   38    33    40    44  -0.30950  1.0 1.0
   38    33    40    44   1.11150 -1.0 2.0
   38    33    40    44   0.40350  1.0 3.0
   38    43    52    53   3.62500 -1.0 2.0
   38    43    52    55   3.62500 -1.0 2.0
   38    43    69    66   3.62500 -1.0 2.0
   38    43   -69    72   3.62500 -1.0 2.0
   39    38    43    52   1.05000 -1.0 2.0
   39    38    43    69   1.05000 -1.0 2.0
   43    52    55    56   3.62500 -1.0 2.0
   43    52    55    63   3.62500 -1.0 2.0
   43    69    72    73   1.05000 -1.0 2.0
   43    69    72    40   2.26350  1.0 1.0
   43    69    72    40   0.76750 -1.0 2.0
   43    69    72    40   0.22500  1.0 3.0
   52    43    69    66   3.62500 -1.0 2.0
   52    43    69    72   3.62500 -1.0 2.0
   52    55    63    64   3.62500 -1.0 2.0
   52    55   -63    66   3.62500 -1.0 2.0
   53    52    55    56   3.62500 -1.0 2.0
   53    52    55    63   3.62500 -1.0 2.0
   55    63    66    69   3.62500 -1.0 2.0
   55    63    66    70   3.62500 -1.0 2.0
   56    55    63    64   3.62500 -1.0 2.0
   56    55    63    66   3.62500 -1.0 2.0
   63    66   -69    43   3.62500 -1.0 2.0
   63    66    69    72   3.62500 -1.0 2.0
   63    66    70    71   0.84100 -1.0 2.0
   64    63    66    69   3.62500 -1.0 2.0
   64    63    66    70   3.62500 -1.0 2.0
   66    69    72    73   1.05000 -1.0 2.0
   66    69    72    40   2.26350  1.0 1.0
   66    69    72    40   0.76750 -1.0 2.0
   66    69    72    40   0.22500  1.0 3.0
   69    43    52    53   3.62500 -1.0 2.0
   69    43   -52    55   3.62500 -1.0 2.0
   69    66    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    44   0.65300  1.0 1.0
   69    72    40    44  -0.03850 -1.0 2.0
   69    72    40    44   0.33900  1.0 3.0
   72    40    44    45   0.30150 -1.0 2.0
   72    40    44    46   0.30150 -1.0 2.0
   73    72    40    33   0.30150 -1.0 2.0
   73    72    40    41   0.00000  1.0 1.0
   73    72    40    44   0.30150 -1.0 2.0
   40    33    37    42   0.04150 -1.0 2.0
   40    33    37    65   0.04150 -1.0 2.0
   40    33    38    39   0.30150 -1.0 2.0
   40    33   -38    43   0.05850 -1.0 2.0
   40    33   -38    43   0.17250  1.0 3.0
   41    40    44    45   0.00000  1.0 1.0
   41    40    44    46   0.00000  1.0 1.0
   70    66    69    43   3.62500 -1.0 2.0
   70    66    69    72   3.62500 -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
   35    30    34    36  10.50000 -1.0 2.0
   42    65    37    33   4.00000 -1.0 2.0
   47    49    42    37   4.00000 -1.0 2.0
   54    48    47    42   1.10000 -1.0 2.0
   57    59    54    47   4.00000 -1.0 2.0
   65    58    57    54   1.10000 -1.0 2.0
   57    67    65    37   4.00000 -1.0 2.0
   42    51    49    50  10.50000 -1.0 2.0
   33    43    38    39  10.50000 -1.0 2.0
   52    69    43    38   4.00000 -1.0 2.0
   55    53    52    43   1.10000 -1.0 2.0
   63    56    55    52   1.10000 -1.0 2.0
   66    64    63    55   1.10000 -1.0 2.0
   69    70    66    63   4.00000 -1.0 2.0
   66    72    69    43   4.00000 -1.0 2.0
   69    40    72    73  10.50000 -1.0 2.0
   45    40    44    46  10.50000 -1.0 2.0
END
