* LIGAND DATABASE FILE (OPLS2005)
*
001      73    75    135    208     389
    1     0 S   NP   _N1_     1    29.45960    98.21772   -20.45353
    2     1 S   H    _HN1     2     1.02840    62.08901   -15.65365
    3     1 S   H    _H1_     3     1.02962    50.20894   135.89363
    4     1 S   H    _H2_     4     1.02798   101.54829  -120.40093
    5     1 S   CT   _CA1     5     1.50602   145.65078    71.68804
    6     5 S   HC   _HA1     6     1.09692   104.50832   111.44283
    7     5 S   CO3  _C1_     7     1.54467   110.95312    -4.05106
    8     7 S   O2Z  _O11     8     1.25984   116.80320  -125.64827
    9     7 S   O2Z  _O12     9     1.26620   113.67923    53.33392
   10     5 S   CT   _CB1    10     1.53135   106.86712  -132.41294
   11    10 S   HC   HB11    11     1.09843   110.02652   -40.33525
   12    10 S   HC   HB12    12     1.09764   110.20807    76.41497
   13    10 S   CT   _CG1    13     1.52920   112.29384  -160.78691
   14    13 S   HC   HG11    14     1.09381   110.91631   -61.84249
   15    13 S   HC   HG12    15     1.09663   109.54914    57.24401
   16    13 S   C    _CD1    16     1.51771   112.27267   177.97938
   17    16 S   O    _OE1    17     1.22724   123.28787    12.93138
   18    16 S   N    _N2_    18     1.38612   111.66271  -167.63632
   19    18 S   H    _HN2    19     1.01526   118.82600     3.27034
   20    18 S   CT1  _CA2    20     1.46040   123.64000   178.74899
   21    20 S   HC   _HA2    21     1.09715   109.26981     5.58497
   22    20 S   C    _C2_    22     1.53653   108.87339  -110.09844
   23    22 S   O    _O2_    23     1.23084   122.11946  -151.48062
   24    20 S   CT   _CB2    32     1.53401   111.72214   127.64849
   25    24 S   HC   HB21    33     1.09528   110.54911    60.11260
   26    24 S   HC   HB22    34     1.09563   109.97326   177.57941
   27    22 S   N    _N3_    24     1.38262   113.96514    35.72185
   28    27 S   H    _HN3    25     1.01558   119.56322    -2.85650
   29    24 S   S    _SG2    35     1.83096   112.33745   -64.05605
   30    27 S   CT   _CA3    26     1.45276   123.33795   177.55279
   31    30 S   HC   HA31    27     1.09543   107.46257   -66.81983
   32    30 S   HC   HA32    28     1.09556   108.07330    49.67036
   33    29 S   CT   _C12    36     1.84207   100.30817   120.90725
   34    33 S   HC   _H3_    37     1.09624   107.80496    45.39410
   35    30 S   CO3  _C3_    29     1.52981   114.00660   171.74025
   36    35 S   O2Z  _O31    30     1.26384   116.07108     0.64891
   37    35 S   O2Z  _O32    31     1.26425   114.41259  -179.28045
   38    33 S   CM   _C11    38     1.50850   108.51628   -75.64762
   39    38 S   HC   _H8_    39     1.08885   116.68246   -62.37901
   40    33 S   CT   _C13    56     1.53723   108.28637   163.39323
   41    40 S   HC   _H9_    57     1.09688   110.22004    70.23010
   42    40 S   HC   _H10    58     1.09786   109.99624   -48.98686
   43    38 S   CM   _C10    40     1.34278   123.45177   116.71233
   44    43 S   HC   _H7_    41     1.08696   120.07455    -0.69380
   45    40 S   C    _C14    59     1.52608   113.16838  -167.91267
   46    45 S   O    _O33    60     1.23174   121.95034     3.23035
   47    43 S   CA   _C9_    42     1.46899   123.67581  -177.86448
   48    45 S   N    _N4_    61     1.38547   115.20358  -177.82076
   49    47 S   CA   _C4_    43     1.41352   118.46165   139.40259
   50    49 S   HA   _H4_    44     1.08847   120.25324    -0.72578
   51    48 S   CT   _C15    62     1.45534   121.89777  -178.29039
   52    51 S   HC   _H11    63     1.09402   111.05531    43.29877
   53    51 S   HC   _H12    64     1.09563   107.65774   -75.79206
   54    49 S   CA   _C5_    45     1.39840   121.10683  -179.96044
   55    54 S   HA   _H5_    46     1.08409   120.86897   179.38643
   56    51 S   CT   _C16    65     1.52076   104.47610   165.52681
   57    56 S   HC   _H13    66     1.09668   110.06661   -85.36864
   58    56 S   HC   _H14    67     1.09329   112.70627   153.55940
   59    54 S   CA   _C6_    47     1.37776   117.71231    -0.77278
   60    56 S   CT   _C17    68     1.52303   102.81686    31.47647
   61    60 S   HC   _H15    69     1.09674   109.69400    79.45865
   62    60 S   HC   _H16    70     1.09334   113.10172  -159.55812
   63    59 S   CA   _C7_    48     1.37445   121.66971    -0.15702
   64    48 S   CT   _C18    71     1.45953   127.09275     0.33862
   65    64 S   HC   _H17    72     1.09291   111.29135    49.30012
   66    64 S   HC   _H18    73     1.09524   107.85682   -70.43684
   67    47 S   CA   _C8_    49     1.40385   122.02919   -42.03512
   68    67 S   HA   _H6_    50     1.08527   121.81818     0.19782
   69    63 S   OS   _O34    51     1.36086   112.32138  -179.36265
   70    69 S   CO   _C19    52     1.44175   101.00216     0.04846
   71    70 S   HC   _H19    53     1.09548   108.89166  -121.45095
   72    70 S   HC   _H20    54     1.09614   108.62534   120.42372
   73    59 S   OS   _O35    55     1.36043   125.93068  -179.77445
  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   9   5   4   3
  12   7   2   1   1  10   4   8   4   3   8   3  10   3   9  12
   8   4  11   6   5   7   3   8   5   4   8   5   4   3   7   2
   1   1   4   1   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    43    40    41    42    45  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    43    44    47    40    41    42    45    46    48  
   38    39    43    40    41    42    45  
   36    37  
   37  
    0  
   39    43    44    47    49    67    40    41    42    45  
   43    44    47    40  
   41    42    45    46    48    51    64    43  
   42    45    46    48  
   45    46    48  
   44    47    49    50    54    63    67    68  
   47    49    67  
   46    48    51    52    53    56    60    64    65    66  
   48    51    64  
   49    50    54    55    59    63    67    68    69  
   51    52    53    56    57    58    60    61    62    64    65    66  
   50    54    55    59    63    67    68    73  
   54    55    59    67  
   52    53    56    57    58    60    61    62    64    65    66  
   53    56    57    58    60    64  
   56    57    58    60    64  
   55    59    63    67    69    70    73  
   59    63    73  
   57    58    60    61    62    64    65    66  
   58    60    61    62    64  
   60    61    62    64  
   63    67    68    69    70    71    72    73  
   61    62    64    65    66  
   62    64    65    66  
   64    65    66  
   67    68    69    70    71    72    73  
   65    66  
   66  
    0  
   68    69    70    73  
   69  
   70    71    72    73  
   71    72    73  
   72    73  
   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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   44   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   45   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   47   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.2500   0.1700  -0.140000   1.8100   1.6000   0.054801302  -1.445846770
   49   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   50   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   51   3.5000   0.0660  -0.050000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   53   2.5000   0.0300   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   60   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   64   3.5000   0.0660  -0.050000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   67   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   68   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   69   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   70   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   73   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    40   268.000  1.529
   38    39   340.000  1.080
   38    43   549.000  1.340
   43    44   340.000  1.080
   43    47   320.000  1.460
   47    49   469.000  1.400
   47    67   469.000  1.400
   49    50   367.000  1.080
   49    54   469.000  1.400
   54    55   367.000  1.080
   54    59   469.000  1.400
   59    63   469.000  1.400
   59    73   450.000  1.364
   63    67   469.000  1.400
   63    69   450.000  1.364
   67    68   367.000  1.080
   69    70   320.000  1.380
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   320.000  1.380
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    45   317.000  1.522
   45    46   570.000  1.229
   45    48   490.000  1.335
   48    51   337.000  1.449
   48    64   337.000  1.449
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    56   268.000  1.529
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    60   268.000  1.529
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    64   268.000  1.529
   64    65   340.000  1.090
   64    66   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    40    75.00000  111.63000
   33    38    39    35.00000  117.00000
   33    38    43    70.00000  124.00000
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   33    40    45    63.00000  111.10000
   38    33    34    35.00000  109.50000
   38    43    44    35.00000  120.00000
   38    43    47    60.00000  123.20500
   43    38    39    35.00000  120.00000
   43    47    49    60.00000  120.93500
   43    47    67    60.00000  120.93500
   47    43    44    40.00000  117.26300
   47    49    50    35.00000  120.00000
   47    49    54    63.00000  120.00000
   47    67    63    63.00000  120.00000
   47    67    68    35.00000  120.00000
   49    54    55    35.00000  120.00000
   49    54    59    63.00000  120.00000
   54    49    50    35.00000  120.00000
   54    59    63    63.00000  120.00000
   54    59    73    70.00000  120.00000
   59    54    55    35.00000  120.00000
   59    63    67    63.00000  120.00000
   59    63    69    70.00000  120.00000
   59    73    70   100.00000  112.36700
   63    67    68    35.00000  120.00000
   63    69    70   100.00000  112.36700
   67    47    49    63.00000  120.00000
   69    63    67    70.00000  120.00000
   69    70    71    35.00000  109.50000
   69    70    72    35.00000  109.50000
   69    70    73    92.60000  111.55000
   72    70    71    33.00000  109.50000
   73    59    63    70.00000  120.00000
   73    70    71    35.00000  109.50000
   73    70    72    35.00000  109.50000
   40    33    34    37.50000  110.70000
   40    33    38    70.00000  112.02700
   40    45    46    80.00000  120.40000
   40    45    48    70.00000  116.60000
   42    40    41    33.00000  107.80000
   45    40    41    35.00000  109.50000
   45    40    42    35.00000  109.50000
   45    48    51    50.00000  121.90000
   45    48    64    50.00000  121.90000
   48    45    46    80.00000  122.90000
   48    51    52    35.00000  109.50000
   48    51    53    35.00000  109.50000
   48    51    56    70.00000  110.72300
   48    64    60    70.00000  110.72300
   48    64    65    35.00000  109.50000
   48    64    66    35.00000  109.50000
   51    56    57    37.50000  110.70000
   51    56    58    37.50000  110.70000
   51    56    60    58.35000  112.70000
   53    51    52    33.00000  107.80000
   56    51    52    37.50000  110.70000
   56    51    53    37.50000  110.70000
   56    60    61    37.50000  110.70000
   56    60    62    37.50000  110.70000
   56    60    64    58.35000  112.70000
   58    56    57    33.00000  107.80000
   60    56    57    37.50000  110.70000
   60    56    58    37.50000  110.70000
   60    64    65    37.50000  110.70000
   60    64    66    37.50000  110.70000
   62    60    61    33.00000  107.80000
   64    48    51    50.00000  118.00000
   64    60    61    37.50000  110.70000
   64    60    62    37.50000  110.70000
   66    64    65    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  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    38    39   0.00000  1.0 1.0
   29    33    38    43   0.42700  1.0 1.0
   29    33    38    43  -0.70350 -1.0 2.0
   29    33    38    43  -0.43150  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    42   0.15000  1.0 3.0
   29    33    40    45   0.56750  1.0 1.0
   29    33    40    45  -0.07550 -1.0 2.0
   29    33    40    45   0.20000  1.0 3.0
   33    38    43    44   7.00000 -1.0 2.0
   33    38    43    47   7.00000 -1.0 2.0
   33    40    45    46   0.30150 -1.0 2.0
   33    40    45    48   1.39750  1.0 1.0
   33    40    45    48  -0.07950 -1.0 2.0
   33    40    45    48  -0.18750  1.0 3.0
   34    33    38    39   0.33100  1.0 3.0
   34    33    38    43   0.00000  1.0 1.0
   34    33    40    41   0.15000  1.0 3.0
   34    33    40    42   0.15000  1.0 3.0
   34    33    40    45  -0.11250  1.0 3.0
   38    33    40    41   0.15000  1.0 3.0
   38    33    40    42   0.15000  1.0 3.0
   38    33    40    45  -0.98800  1.0 1.0
   38    33    40    45   0.48800 -1.0 2.0
   38    33    40    45   0.76800  1.0 3.0
   38    43    47    49   0.15800  1.0 1.0
   38    43    47    49   1.85350 -1.0 2.0
   38    43    47    49  -0.48700  1.0 3.0
   38    43    47    67   0.15800  1.0 1.0
   38    43    47    67   1.85350 -1.0 2.0
   38    43    47    67  -0.48700  1.0 3.0
   39    38    43    44   7.00000 -1.0 2.0
   39    38    43    47   7.00000 -1.0 2.0
   43    47    49    50   3.62500 -1.0 2.0
   43    47    49    54   3.62500 -1.0 2.0
   43    47    67    63   3.62500 -1.0 2.0
   43    47    67    68   3.62500 -1.0 2.0
   44    43    47    49   0.56550  1.0 3.0
   44    43    47    67   0.56550  1.0 3.0
   47    49    54    55   3.62500 -1.0 2.0
   47    49    54    59   3.62500 -1.0 2.0
   49    47    67    63   3.62500 -1.0 2.0
   49    47    67    68   3.62500 -1.0 2.0
   49    54   -59    63   3.62500 -1.0 2.0
   49    54    59    73   3.62500 -1.0 2.0
   50    49    54    55   3.62500 -1.0 2.0
   50    49    54    59   3.62500 -1.0 2.0
   54    59    63    67   3.62500 -1.0 2.0
   54    59    63    69   3.62500 -1.0 2.0
   54    59    73    70   1.63200 -1.0 2.0
   55    54    59    63   3.62500 -1.0 2.0
   55    54    59    73   3.62500 -1.0 2.0
   59    63   -67    47   3.62500 -1.0 2.0
   59    63    67    68   3.62500 -1.0 2.0
   59    63   -69    70   1.63200 -1.0 2.0
   63    59   -73    70   1.63200 -1.0 2.0
   63    69    70    71   0.08050  1.0 3.0
   63    69    70    72   0.08050  1.0 3.0
   63    69   -70    73  -0.25600  1.0 1.0
   63    69   -70    73  -0.40050 -1.0 2.0
   63    69   -70    73   0.34700  1.0 3.0
   67    47    49    50   3.62500 -1.0 2.0
   67    47   -49    54   3.62500 -1.0 2.0
   67    63    69    70   1.63200 -1.0 2.0
   69    63    67    47   3.62500 -1.0 2.0
   69    63    67    68   3.62500 -1.0 2.0
   69    70   -73    59  -0.25600  1.0 1.0
   69    70   -73    59  -0.40050 -1.0 2.0
   69    70   -73    59   0.34700  1.0 3.0
   71    70    73    59   0.08050  1.0 3.0
   72    70    73    59   0.08050  1.0 3.0
   73    59    63    67   3.62500 -1.0 2.0
   73    59   -63    69   3.62500 -1.0 2.0
   40    33    38    39   0.00000  1.0 1.0
   40    33    38    43   0.09850  1.0 1.0
   40    33    38    43   0.15250 -1.0 2.0
   40    33    38    43  -0.50650  1.0 3.0
   40    45    48    51   1.49850  1.0 1.0
   40    45    48    51   1.53950 -1.0 2.0
   40    45    48    64   1.49850  1.0 1.0
   40    45    48    64   1.53950 -1.0 2.0
   41    40    45    46   0.00000  1.0 1.0
   41    40    45    48   0.00000  1.0 1.0
   42    40    45    46   0.00000  1.0 1.0
   42    40    45    48   0.00000  1.0 1.0
   45    48    51    52   0.00000  1.0 1.0
   45    48    51    53   0.00000  1.0 1.0
   45    48    51    56  -0.43950  1.0 1.0
   45    48    51    56  -0.08100 -1.0 2.0
   45    48    51    56   0.03350  1.0 3.0
   45    48    64    60  -0.43950  1.0 1.0
   45    48    64    60  -0.08100 -1.0 2.0
   45    48    64    60   0.03350  1.0 3.0
   45    48    64    65   0.00000  1.0 1.0
   45    48    64    66   0.00000  1.0 1.0
   46    45    48    51   3.04450 -1.0 2.0
   46    45    48    64   3.04450 -1.0 2.0
   48    51    56    57   0.15000  1.0 3.0
   48    51    56    58   0.15000  1.0 3.0
   48    51   -56    60   0.43900  1.0 1.0
   48    51   -56    60   0.49100 -1.0 2.0
   48    51   -56    60   0.28400  1.0 3.0
   51    48   -64    60  -0.05900 -1.0 2.0
   51    48    64    65   0.00000  1.0 1.0
   51    48    64    66   0.00000  1.0 1.0
   51    56    60    61   0.15000  1.0 3.0
   51    56    60    62   0.15000  1.0 3.0
   51    56   -60    64   0.56750  1.0 1.0
   51    56   -60    64  -0.07550 -1.0 2.0
   51    56   -60    64   0.20000  1.0 3.0
   52    51    56    57   0.15000  1.0 3.0
   52    51    56    58   0.15000  1.0 3.0
   52    51    56    60   0.15000  1.0 3.0
   53    51    56    57   0.15000  1.0 3.0
   53    51    56    58   0.15000  1.0 3.0
   53    51    56    60   0.15000  1.0 3.0
   56    60   -64    48   0.43900  1.0 1.0
   56    60   -64    48   0.49100 -1.0 2.0
   56    60   -64    48   0.28400  1.0 3.0
   56    60    64    65   0.15000  1.0 3.0
   56    60    64    66   0.15000  1.0 3.0
   57    56    60    61   0.15000  1.0 3.0
   57    56    60    62   0.15000  1.0 3.0
   57    56    60    64   0.15000  1.0 3.0
   58    56    60    61   0.15000  1.0 3.0
   58    56    60    62   0.15000  1.0 3.0
   58    56    60    64   0.15000  1.0 3.0
   61    60    64    48   0.15000  1.0 3.0
   61    60    64    65   0.15000  1.0 3.0
   61    60    64    66   0.15000  1.0 3.0
   62    60    64    48   0.15000  1.0 3.0
   62    60    64    65   0.15000  1.0 3.0
   62    60    64    66   0.15000  1.0 3.0
   64    48    51    52   0.00000  1.0 1.0
   64    48    51    53   0.00000  1.0 1.0
   64    48   -51    56  -0.05900 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   33    39    38    43  15.00000 -1.0 2.0
   47    44    43    38  15.00000 -1.0 2.0
   49    67    47    43   4.00000 -1.0 2.0
   54    50    49    47   1.10000 -1.0 2.0
   59    55    54    49   1.10000 -1.0 2.0
   63    73    59    54   4.00000 -1.0 2.0
   67    69    63    59   4.00000 -1.0 2.0
   63    68    67    47   1.10000 -1.0 2.0
   40    48    45    46  10.50000 -1.0 2.0
   64    45    48    51   1.00000 -1.0 2.0
END
