* LIGAND DATABASE FILE (OPLS2005)
*
001      75    78    130    221     392
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02096    97.47209    26.56142
    3     1 S   H    _H1_     3     1.02102    35.15503   138.58501
    4     1 S   H    _H2_     4     1.02075    81.81651   -81.36376
    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     1.04690   118.93088     8.54895
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08448   106.42696   -11.15906
   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     1.08733   110.25787    59.09629
   26    24 S   HC   HB22    34     1.08755   109.66015   178.71915
   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   _C12    36     1.86477    98.12742  -178.21589
   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   _C14    37     1.54109   115.28955  -179.96574
   38    33 S   CO4  _C13    56     1.54895   102.61503   -62.71619
   39    38 S   O    _O33    57     1.23169   121.54354   -69.93729
   40    37 S   CA   _C19    38     1.40085   123.37589   174.13245
   41    38 S   CA   _C8_    58     1.48584   119.51853   109.86428
   42    40 S   CA   _C18    39     1.39246   119.44052   179.97202
   43    41 S   CA   _C9_    59     1.40178   120.49538     3.48830
   44    42 S   CA   _C17    40     1.39970   120.37659     0.02798
   45    42 S   CO4  _C23    48     1.46718   119.90201  -179.97202
   46    45 S   O    _O35    49     1.22443   123.05429  -179.97202
   47    43 S   CA   _C4_    60     1.40653   118.19367   179.59410
   48    47 S   HA   _H3_    61     1.08838   120.76655   179.89165
   49    43 S   CM   _C10    70     1.46664   120.70514    -0.30647
   50    44 S   CA   _C16    41     1.39368   119.91532    -0.01978
   51    50 S   HA   _H5_    42     1.08761   120.11336  -180.00000
   52    44 S   OH   _O37    46     1.36370   122.72786  -179.97202
   53    52 S   HO   _H7_    47     0.97041   110.12391     0.02798
   54    45 S   CM   _C22    50     1.47589   117.43173    -0.04846
   55    54 S   HC   _H6_    51     1.08910   114.59199  -179.90513
   56    47 S   CA   _C5_    62     1.39645   121.06219    -0.00000
   57    33 S   CM   _C11    71     1.51786   106.24338    56.43001
   58    49 S   OH   _O40    74     1.38081   116.29478   178.52144
   59    58 S   HO   _H10    75     0.96281   109.73765   179.93744
   60    37 S   CA   _C15    43     1.39587   116.37969    -5.88643
   61    54 S   CMA  _C21    52     1.34512   125.70997     0.02798
   62    61 S   OM   _O36    53     1.26274   128.61927   180.00000
   63    56 S   CA   _C6_    63     1.38997   120.06175     0.01978
   64    63 S   HA   _H4_    64     1.08725   120.00881   179.97202
   65    56 S   OH   _O42    68     1.36111   119.96303   179.87805
   66    65 S   HO   _H12    69     0.97142   110.24678     0.03426
   67    57 S   OH   _O39    72     1.38975   116.78426    70.77693
   68    67 S   HO   _H9_    73     0.96019   109.28993    -0.44762
   69    60 S   OH   _O38    44     1.36272   121.15589     0.02798
   70    69 S   HO   _H8_    45     0.96947   110.19602   180.00000
   71    40 S   CO4  _C20    54     1.47832   119.59579    -0.00000
   72    71 S   O    _O34    55     1.22925   120.59437    -0.00000
   73    41 S   CA   _C7_    65     1.40305   118.81247  -176.95342
   74    73 S   OH   _O41    66     1.36402   123.06862     0.66617
   75    74 S   HO   _H11    67     0.96944   110.10568    -0.33862
  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  10   5   4   3
  17   2   1   1  18  12   4  14  12  13  12  10   8   3  10   4
   7   6   3   2   1   5   3   6   5   2   1   3   3   2   6   3
   2   1   1   1   1   1   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    38    57    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    60    38    39    41    49    57    67  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    42    50    60    69    71    38    39    41    43    73    49    57    67    68    58  
   35    36  
   36  
    0  
   40    42    44    50    51    60    69    70    45    61    71    72    38    39    41    49    57    67  
   39    41    43    47    63    73    74    49    57    67    40    60  
   41    43    73    57  
   42    44    50    60    69    52    45    46    54    61    62    71    72    57  
   43    47    48    56    63    64    73    74    75    49    57    58  
   44    50    51    60    52    53    45    46    54    55    61    71    72  
   47    48    56    63    73    74    65    49    57    67    58    59  
   50    51    60    69    52    53    45    46    54    71  
   46    54    55    61    62    71    50    52  
   54    55    61  
   48    56    63    64    73    65    66    49    57    58  
   56    63    65    49  
   57    67    68    58    59    56    73  
   51    60    69    70    52    53  
   60    69    52  
   53    60  
    0  
   55    61    62    71    72  
   61    62    71  
   63    64    73    74    65    66  
   67    68    58    59    60  
   59    67  
    0  
   69    70    71  
   62    71    72  
   71    72  
   64    73    74    75    65    66  
   73    74    65  
   66    73  
    0  
   68  
    0  
   70  
    0  
   72  
    0  
   74    75  
   75  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.282500   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   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   41   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   42   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   43   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   44   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   45   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.470000   1.6780   1.4800   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   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   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   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   53   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   54   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   55   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   57   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   58   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   59   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   60   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   61   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   62   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   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   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   66   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   67   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   68   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   69   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   70   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   71   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   72   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   73   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   74   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   75   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  1.510
   33    38   317.000  1.522
   33    57   317.000  1.510
   37    40   469.000  1.400
   37    60   469.000  1.400
   40    42   469.000  1.400
   40    71   310.000  1.470
   42    44   469.000  1.400
   42    45   310.000  1.470
   44    50   469.000  1.400
   44    52   450.000  1.364
   50    51   367.000  1.080
   50    60   469.000  1.400
   60    69   450.000  1.364
   69    70   553.000  0.945
   52    53   553.000  0.945
   45    46   570.000  1.229
   45    54   320.000  1.462
   54    55   340.000  1.080
   54    61   465.000  1.376
   61    62   745.000  1.250
   61    71   270.000  1.476
   71    72   570.000  1.229
   38    39   570.000  1.229
   38    41   310.000  1.470
   41    43   469.000  1.400
   41    73   469.000  1.400
   43    47   469.000  1.400
   43    49   320.000  1.460
   47    48   367.000  1.080
   47    56   469.000  1.400
   56    63   469.000  1.400
   56    65   450.000  1.364
   63    64   367.000  1.080
   63    73   469.000  1.400
   73    74   450.000  1.364
   74    75   553.000  0.945
   65    66   553.000  0.945
   49    57   549.000  1.340
   49    58   510.000  1.338
   57    67   510.000  1.338
   67    68   553.000  0.945
   58    59   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    57    75.00000  112.20000
   33    37    40    70.00000  120.00000
   33    37    60    70.00000  120.00000
   33    38    39    80.00000  120.40000
   33    38    41    65.00000  115.47100
   33    57    49    70.00000  124.00000
   33    57    67    90.00000  109.34000
   37    40    42    63.00000  120.00000
   37    40    71    60.00000  119.52600
   37    60    50    63.00000  120.00000
   37    60    69    70.00000  120.00000
   40    42    44    63.00000  120.00000
   40    42    45    60.00000  119.52600
   40    71    61    60.00000  117.44000
   40    71    72    75.00000  123.78400
   42    44    50    63.00000  120.00000
   42    44    52    70.00000  120.00000
   42    45    46    75.00000  123.78400
   42    45    54    65.00000  117.02400
   44    50    51    35.00000  120.00000
   44    50    60    63.00000  120.00000
   44    52    53    35.00000  113.00000
   50    60    69    70.00000  120.00000
   60    37    40    63.00000  120.00000
   60    50    51    35.00000  120.00000
   60    69    70    35.00000  113.00000
   52    44    50    70.00000  120.00000
   45    42    44    60.00000  119.52600
   45    54    55    40.00000  117.72500
   45    54    61    60.00000  125.92000
   54    45    46    80.00000  123.72100
   54    61    62    65.00000  137.10300
   54    61    71    65.00000  114.61000
   61    54    55    40.00000  120.50800
   61    71    72    80.00000  120.81000
   71    40    42    60.00000  119.52600
   71    61    62    85.00000  116.28000
   38    33    37    70.00000  110.93000
   38    41    43    60.00000  119.52600
   38    41    73    60.00000  119.52600
   41    38    39    75.00000  123.78400
   41    43    47    63.00000  120.00000
   41    43    49    60.00000  120.93500
   41    73    63    63.00000  120.00000
   41    73    74    70.00000  120.00000
   43    47    48    35.00000  120.00000
   43    47    56    63.00000  120.00000
   43    49    57    60.00000  123.20500
   43    49    58    85.00000  114.86500
   47    56    63    63.00000  120.00000
   47    56    65    70.00000  120.00000
   56    47    48    35.00000  120.00000
   56    63    64    35.00000  120.00000
   56    63    73    63.00000  120.00000
   56    65    66    35.00000  113.00000
   63    73    74    70.00000  120.00000
   73    41    43    63.00000  120.00000
   73    63    64    35.00000  120.00000
   73    74    75    35.00000  113.00000
   65    56    63    70.00000  120.00000
   49    43    47    60.00000  120.93500
   49    57    67    80.00000  121.38400
   49    58    59    70.00000  107.45700
   57    33    37    70.00000  112.99600
   57    33    38    70.00000  109.06800
   57    67    68    70.00000  107.45700
   58    49    57    80.00000  121.38400
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    57  -0.62250  1.0 1.0
   24    29    33    57  -0.38450 -1.0 2.0
   24    29    33    57   0.81900  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    40  -0.16000  1.0 1.0
   29    33    37    40  -0.03200 -1.0 2.0
   29    33    37    40   0.04500  1.0 3.0
   29    33    37    60  -0.16000  1.0 1.0
   29    33    37    60  -0.03200 -1.0 2.0
   29    33    37    60   0.04500  1.0 3.0
   29    33    38    39   0.30150 -1.0 2.0
   29    33    38    41   0.65300  1.0 1.0
   29    33    38    41  -0.03850 -1.0 2.0
   29    33    38    41   0.33900  1.0 3.0
   29    33    57    49   0.42700  1.0 1.0
   29    33    57    49  -0.70350 -1.0 2.0
   29    33    57    49  -0.43150  1.0 3.0
   29    33    57    67   0.09700  1.0 1.0
   29    33    57    67   0.15600 -1.0 2.0
   29    33    57    67  -0.50800  1.0 3.0
   33    37    40    42   3.62500 -1.0 2.0
   33    37    40    71   3.62500 -1.0 2.0
   33    37    60    50   3.62500 -1.0 2.0
   33    37    60    69   3.62500 -1.0 2.0
   33    38    41    43   2.26350  1.0 1.0
   33    38    41    43   0.76750 -1.0 2.0
   33    38    41    43   0.22500  1.0 3.0
   33    38    41    73   2.26350  1.0 1.0
   33    38    41    73   0.76750 -1.0 2.0
   33    38    41    73   0.22500  1.0 3.0
   33    57    67    68   2.00000 -1.0 2.0
   37    33    38    39   0.30150 -1.0 2.0
   37    33    38    41   0.65300  1.0 1.0
   37    33    38    41  -0.03850 -1.0 2.0
   37    33    38    41   0.33900  1.0 3.0
   37    33    57    49   1.44450  1.0 1.0
   37    33    57    49   0.06600 -1.0 2.0
   37    33    57    49   0.29250  1.0 3.0
   37    33    57    67   0.09700  1.0 1.0
   37    33    57    67   0.15600 -1.0 2.0
   37    33    57    67  -0.50800  1.0 3.0
   37    40    42    44   3.62500 -1.0 2.0
   37    40    42    45   3.62500 -1.0 2.0
   37    40    71    61  -0.11500  1.0 1.0
   37    40    71    61   1.10450 -1.0 2.0
   37    40    71    61  -0.48050  1.0 3.0
   37    40    71    72   1.05000 -1.0 2.0
   37    60    69    70   0.84100 -1.0 2.0
   40    37    60    50   3.62500 -1.0 2.0
   40    37    60    69   3.62500 -1.0 2.0
   40    42   -44    50   3.62500 -1.0 2.0
   40    42    44    52   3.62500 -1.0 2.0
   40    42    45    46   1.05000 -1.0 2.0
   40    42    45    54  -0.11500  1.0 1.0
   40    42    45    54   1.10450 -1.0 2.0
   40    42    45    54  -0.48050  1.0 3.0
   42    40    71    61  -0.11500  1.0 1.0
   42    40    71    61   1.10450 -1.0 2.0
   42    40    71    61  -0.48050  1.0 3.0
   42    40    71    72   1.05000 -1.0 2.0
   42    44    50    51   3.62500 -1.0 2.0
   42    44    50    60   3.62500 -1.0 2.0
   42    44    52    53   0.84100 -1.0 2.0
   42    45    54    55   1.64500 -1.0 2.0
   42    45   -54    61  -1.65800  1.0 1.0
   42    45   -54    61   0.77650 -1.0 2.0
   44    42    45    46   1.05000 -1.0 2.0
   44    42    45    54  -0.11500  1.0 1.0
   44    42    45    54   1.10450 -1.0 2.0
   44    42    45    54  -0.48050  1.0 3.0
   44    50   -60    37   3.62500 -1.0 2.0
   44    50    60    69   3.62500 -1.0 2.0
   50    44    52    53   0.84100 -1.0 2.0
   50    60    69    70   0.84100 -1.0 2.0
   51    50    60    37   3.62500 -1.0 2.0
   51    50    60    69   3.62500 -1.0 2.0
   60    37   -40    42   3.62500 -1.0 2.0
   60    37    40    71   3.62500 -1.0 2.0
   52    44    50    51   3.62500 -1.0 2.0
   52    44    50    60   3.62500 -1.0 2.0
   45    42    44    50   3.62500 -1.0 2.0
   45    42    44    52   3.62500 -1.0 2.0
   45    54    61    62   7.00000 -1.0 2.0
   45    54    61    71   7.00000 -1.0 2.0
   46    45    54    55   0.00000  1.0 1.0
   46    45    54    61   1.00000 -1.0 2.0
   54    61   -71    40  -1.65800  1.0 1.0
   54    61   -71    40   0.77650 -1.0 2.0
   54    61    71    72   1.00000 -1.0 2.0
   55    54    61    62   7.00000 -1.0 2.0
   55    54    61    71   7.00000 -1.0 2.0
   62    61    71    40   1.50000 -1.0 2.0
   62    61    71    72  -0.11900  1.0 1.0
   62    61    71    72   0.76850 -1.0 2.0
   62    61    71    72   0.14100  1.0 3.0
   71    40    42    44   3.62500 -1.0 2.0
   71    40   -42    45   3.62500 -1.0 2.0
   38    33    37    40   0.04300 -1.0 2.0
   38    33    37    60   0.04300 -1.0 2.0
   38    33    57    49  -0.51250  1.0 1.0
   38    33    57    49  -0.88800 -1.0 2.0
   38    33    57    49   0.08850  1.0 3.0
   38    33    57    67   0.09700  1.0 1.0
   38    33    57    67   0.15600 -1.0 2.0
   38    33    57    67  -0.50800  1.0 3.0
   38    41    43    47   3.62500 -1.0 2.0
   38    41   -43    49   3.62500 -1.0 2.0
   38    41    73    63   3.62500 -1.0 2.0
   38    41    73    74   3.62500 -1.0 2.0
   39    38    41    43   1.05000 -1.0 2.0
   39    38    41    73   1.05000 -1.0 2.0
   41    43    47    48   3.62500 -1.0 2.0
   41    43    47    56   3.62500 -1.0 2.0
   41    43    49    57   0.15800  1.0 1.0
   41    43    49    57   1.85350 -1.0 2.0
   41    43    49    57  -0.48700  1.0 3.0
   41    43    49    58  -0.01750  1.0 1.0
   41    43    49    58  -0.32000 -1.0 2.0
   41    43    49    58   0.00600  1.0 3.0
   41    73    74    75   0.84100 -1.0 2.0
   43    41    73    63   3.62500 -1.0 2.0
   43    41    73    74   3.62500 -1.0 2.0
   43    47   -56    63   3.62500 -1.0 2.0
   43    47    56    65   3.62500 -1.0 2.0
   43    49   -57    33   7.00000 -1.0 2.0
   43    49    57    67   7.00000 -1.0 2.0
   43    49    58    59   2.00000 -1.0 2.0
   47    43    49    57   0.15800  1.0 1.0
   47    43    49    57   1.85350 -1.0 2.0
   47    43    49    57  -0.48700  1.0 3.0
   47    43    49    58  -0.01750  1.0 1.0
   47    43    49    58  -0.32000 -1.0 2.0
   47    43    49    58   0.00600  1.0 3.0
   47    56    63    64   3.62500 -1.0 2.0
   47    56    63    73   3.62500 -1.0 2.0
   47    56    65    66   0.84100 -1.0 2.0
   48    47    56    63   3.62500 -1.0 2.0
   48    47    56    65   3.62500 -1.0 2.0
   56    63   -73    41   3.62500 -1.0 2.0
   56    63    73    74   3.62500 -1.0 2.0
   63    56    65    66   0.84100 -1.0 2.0
   63    73    74    75   0.84100 -1.0 2.0
   64    63    73    41   3.62500 -1.0 2.0
   64    63    73    74   3.62500 -1.0 2.0
   73    41   -43    47   3.62500 -1.0 2.0
   73    41    43    49   3.62500 -1.0 2.0
   65    56    63    64   3.62500 -1.0 2.0
   65    56    63    73   3.62500 -1.0 2.0
   49    43    47    48   3.62500 -1.0 2.0
   49    43    47    56   3.62500 -1.0 2.0
   49    57    67    68  -0.66100  1.0 1.0
   49    57    67    68   1.20850 -1.0 2.0
   49    57    67    68  -0.36000  1.0 3.0
   57    33    37    40   0.18050 -1.0 2.0
   57    33    37    60   0.18050 -1.0 2.0
   57    33    38    39   0.30150 -1.0 2.0
   57    33   -38    41   0.65300  1.0 1.0
   57    33   -38    41  -0.03850 -1.0 2.0
   57    33   -38    41   0.33900  1.0 3.0
   57    49    58    59  -0.66100  1.0 1.0
   57    49    58    59   1.20850 -1.0 2.0
   57    49    58    59  -0.36000  1.0 3.0
   58    49    57    33   7.00000 -1.0 2.0
   58    49    57    67   7.00000 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   40    60    37    33   4.00000 -1.0 2.0
   42    71    40    37   4.00000 -1.0 2.0
   44    45    42    40   4.00000 -1.0 2.0
   50    52    44    42   4.00000 -1.0 2.0
   60    51    50    44   1.10000 -1.0 2.0
   50    69    60    37   4.00000 -1.0 2.0
   42    54    45    46  10.50000 -1.0 2.0
   45    55    54    61   1.10000 -1.0 2.0
   71    62    61    54   1.10000 -1.0 2.0
   40    61    71    72  10.50000 -1.0 2.0
   33    41    38    39  10.50000 -1.0 2.0
   43    73    41    38   4.00000 -1.0 2.0
   47    49    43    41   4.00000 -1.0 2.0
   56    48    47    43   1.10000 -1.0 2.0
   63    65    56    47   4.00000 -1.0 2.0
   73    64    63    56   1.10000 -1.0 2.0
   63    74    73    41   4.00000 -1.0 2.0
   43    58    49    57   1.10000 -1.0 2.0
   33    67    57    49   1.10000 -1.0 2.0
END
