* LIGAND DATABASE FILE (OPLS2005)
*
001      72    74    126    205     373
    1     0 S   NP   _N1_     1    28.09318    97.90952   -21.18127
    2     1 S   H    _HN1     2     1.02777    97.87630  -115.19742
    3     1 S   H    _H1_     3     1.02957    70.37930    -8.46761
    4     1 S   H    _H2_     4     1.02836    43.65227   137.08727
    5     1 S   CT   _CA1     5     1.50134   146.89650    89.03003
    6     5 S   HC   _HA1     6     1.09576   105.20578    92.46312
    7     5 S   CO3  _C1_     7     1.53781   112.34983   -27.70402
    8     7 S   O2Z  _O11     8     1.26366   114.99246   -44.10392
    9     7 S   O2Z  _O12     9     1.26235   114.92954   134.93947
   10     5 S   CT   _CB1    10     1.53095   107.41788  -149.64991
   11    10 S   HC   HB11    11     1.09827   109.30709   -50.55855
   12    10 S   HC   HB12    12     1.09815   110.44328    65.99227
   13    10 S   CT   _CG1    13     1.53018   112.67603  -171.62717
   14    13 S   HC   HG11    14     1.09597   110.49595   -64.85898
   15    13 S   HC   HG12    15     1.09659   109.90647    54.33374
   16    13 S   C    _CD1    16     1.51853   112.31255   174.68474
   17    16 S   O    _OE1    17     1.22752   123.28101     0.93899
   18    16 S   N    _N2_    18     1.38532   111.69420  -179.02683
   19    18 S   H    _HN2    19     1.01563   119.04573     4.16283
   20    18 S   CT1  _CA2    20     1.45905   122.95264   177.89643
   21    20 S   HC   _HA2    21     1.09718   108.97546    24.37738
   22    20 S   C    _C2_    22     1.52897   106.74522   -92.81394
   23    22 S   O    _O2_    23     1.23010   122.94582   -29.16083
   24    20 S   CT   _CB2    32     1.53262   112.14226   147.63958
   25    24 S   HC   HB21    33     1.09487   109.46647    54.26710
   26    24 S   HC   HB22    34     1.09401   109.91635   172.88352
   27    22 S   N    _N3_    24     1.38491   112.71604   153.47345
   28    27 S   H    _HN3    25     1.01675   120.38161    -1.27257
   29    24 S   S    _SG2    35     1.83068   110.59741   -66.03686
   30    27 S   CT   _CA3    26     1.45360   122.31851   178.68686
   31    30 S   HC   HA31    27     1.09574   107.51533   -61.58877
   32    30 S   HC   HA32    28     1.09575   107.85206    54.67386
   33    29 S   CT   _C21    36     1.86040   101.83984  -174.81624
   34    30 S   CO3  _C3_    29     1.52864   114.51434   176.61551
   35    34 S   O2Z  _O31    30     1.26307   116.13178    -2.53513
   36    34 S   O2Z  _O32    31     1.26463   114.37400   177.55319
   37    33 S   CM   _C16    37     1.53014   109.83607  -173.35061
   38    33 S   CO4  _C18    66     1.52569   106.86298   -54.98429
   39    38 S   O    _O22    67     1.22821   124.33021    96.92236
   40    33 S   CO3  _C20    70     1.55714   107.22045    64.93762
   41    40 S   O2Z  _O21    71     1.26825   115.23725  -153.46247
   42    40 S   O2Z  _O24    72     1.26585   117.76470    29.24743
   43    37 S   CA   _C11    38     1.50208   116.92256   -93.54133
   44    37 S   CMA  _C17    55     1.37001   125.60300    88.62532
   45    44 S   OM   _O20    56     1.27118   127.10805   178.45187
   46    43 S   CA   _C12    39     1.41217   122.09051   -93.64523
   47    44 S   CA   _C9_    57     1.51644   114.07960    -1.13142
   48    46 S   CA   _C7_    40     1.40455   120.64243   180.00000
   49    48 S   HA   _H31    41     1.08812   120.25314  -178.96580
   50    46 S   CO4  _C19    52     1.48360   121.85470    -0.45197
   51    50 S   O    _O23    53     1.22629   122.31386  -178.35337
   52    50 S   HC   _H33    54     1.10063   117.71420     1.40750
   53    47 S   CA   _C5_    58     1.41349   120.44408  -162.07392
   54    53 S   HA   _H29    59     1.08856   120.77086     3.12368
   55    48 S   CA   _C13    42     1.39873   120.77533     1.29028
   56    53 S   CA   _C4_    60     1.39760   121.85501  -176.81845
   57    56 S   HA   _H28    61     1.08618   119.87274  -179.98022
   58    55 S   CA   _C8_    43     1.39644   119.05298    -0.61802
   59    58 S   HA   _H32    44     1.08722   119.61476  -179.80719
   60    55 S   CT   _C22    48     1.49913   120.41521  -178.39685
   61    60 S   HC   _H34    49     1.09433   109.98584    88.03790
   62    60 S   HC   _H35    50     1.09513   110.96504  -151.48202
   63    60 S   HC   _H36    51     1.09512   110.92016   -32.46596
   64    56 S   CA   _C6_    62     1.38822   120.00041     0.28667
   65    64 S   HA   _H30    63     1.08618   119.90586   179.86583
   66    43 S   CA   _C15    45     1.40739   120.23389    88.32245
   67    64 S   CA   _C14    64     1.39118   119.49025    -0.57946
   68    66 S   OH   _O26    46     1.37106   119.77149     0.98357
   69    68 S   HO   _H38    47     0.97115   109.12856  -179.02442
   70    47 S   CA   _C10    65     1.40350   122.47094    20.64911
   71    67 S   OH   _O25    68     1.36941   116.09293  -178.98741
   72    71 S   HO   _H37    69     0.97405   108.63299  -175.07725
  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
  14   2   1   1  17  12   4   5   1   1  15   9   3  10   8  12
   4   4   1   1   7   4   8   6   3   8   3   4   2   1   1   5
   3   2   3   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    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    43    44    70    38    39    40    41    42  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    43    46    66    44    45    47    67    70    38    39    40    41    42  
   35    36  
   36  
    0  
   43    46    48    58    66    68    50    44    45    47    53    70    38    39    40    41    42  
   39    71    40    41    42    43    44    47    53    64    67    70  
   40    47    67    70  
   41    42    43    44    70  
   42  
    0  
   46    48    49    55    58    59    66    68    69    50    51    52    44    45    47  
   45    47    53    54    56    67    70    46    66  
   47    53    70  
   48    49    55    58    66    68    60    50    51    52  
   53    54    56    57    64    67    70    71  
   49    55    58    59    66    60    61    62    63    50    51    52  
   55    58    60    50  
   51    52    55    66  
   52  
    0  
   54    56    57    64    65    67    70  
   56    57    64    70  
   58    59    66    68    60    61    62    63  
   57    64    65    67    70    71  
   64    65    67  
   59    66    68    69    60    61    62    63  
   66    68    60  
   61    62    63    66  
   62    63  
   63  
    0  
   65    67    70    71    72  
   67    70    71  
   68    69  
   70    71    72  
   69  
    0  
   71    72  
   72  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.067500   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   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   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   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   41   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   43   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   44   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   45   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   46   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   50   3.7500   0.1050   0.565000   2.1120   1.8750   0.001000000  -0.126889456
   51   2.9600   0.2100  -0.450000   1.6780   1.4800   0.001000000  -0.126889456
   52   2.4200   0.0150   0.000000   1.3810   1.2100   0.008598240   0.268726247
   53   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   54   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   55   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   56   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   57   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   58   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   59   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   60   3.5000   0.0660  -0.065000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   65   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   66   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   67   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   68   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   69   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   70   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   71   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   72   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    38   317.000  1.522
   33    40   317.000  1.522
   37    43   320.000  1.460
   37    44   465.000  1.376
   43    46   469.000  1.400
   43    66   469.000  1.400
   46    48   469.000  1.400
   46    50   310.000  1.470
   48    49   367.000  1.080
   48    55   469.000  1.400
   55    58   469.000  1.400
   55    60   317.000  1.510
   58    59   367.000  1.080
   58    66   469.000  1.400
   66    68   450.000  1.364
   68    69   553.000  0.945
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   340.000  1.090
   50    51   570.000  1.229
   50    52   340.000  1.090
   44    45   745.000  1.250
   44    47   320.000  1.460
   47    53   469.000  1.400
   47    70   469.000  1.400
   53    54   367.000  1.080
   53    56   469.000  1.400
   56    57   367.000  1.080
   56    64   469.000  1.400
   64    65   367.000  1.080
   64    67   469.000  1.400
   67    70   469.000  1.400
   67    71   450.000  1.364
   70    38   310.000  1.470
   38    39   570.000  1.229
   71    72   553.000  0.945
   40    41   656.000  1.250
   40    42   656.000  1.250
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    38    75.00000  110.18000
   29    33    40    70.00000  116.78000
   33    37    43    60.00000  124.00000
   33    37    44    70.00000  124.00000
   33    38    70    65.00000  115.47100
   33    38    39    80.00000  120.40000
   33    40    41    70.00000  117.00000
   33    40    42    70.00000  117.00000
   37    43    46    60.00000  118.70000
   37    43    66    60.00000  118.70000
   37    44    45    65.00000  137.10300
   37    44    47    60.00000  123.20500
   43    46    48    63.00000  120.00000
   43    46    50    60.00000  119.52600
   43    66    58    63.00000  120.00000
   43    66    68    70.00000  120.00000
   46    48    49    35.00000  120.00000
   46    48    55    63.00000  120.00000
   46    50    51    75.00000  123.78400
   46    50    52    35.00000  115.00000
   48    55    58    63.00000  120.00000
   48    55    60    70.00000  120.00000
   55    48    49    35.00000  120.00000
   55    58    59    35.00000  120.00000
   55    58    66    63.00000  120.00000
   55    60    61    35.00000  109.50000
   55    60    62    35.00000  109.50000
   55    60    63    35.00000  109.50000
   58    66    68    70.00000  120.00000
   66    43    46    63.00000  120.00000
   66    58    59    35.00000  120.00000
   66    68    69    35.00000  113.00000
   60    55    58    70.00000  120.00000
   62    60    61    33.00000  107.80000
   63    60    61    33.00000  107.80000
   63    60    62    33.00000  107.80000
   50    46    48    60.00000  119.52600
   52    50    51    35.00000  123.00000
   44    37    43    60.00000  123.66000
   44    47    53    60.00000  120.93500
   44    47    70    60.00000  120.93500
   47    44    45    85.00000  114.86500
   47    53    54    35.00000  120.00000
   47    53    56    63.00000  120.00000
   47    70    67    63.00000  120.00000
   47    70    38    60.00000  119.52600
   53    56    57    35.00000  120.00000
   53    56    64    63.00000  120.00000
   56    53    54    35.00000  120.00000
   56    64    65    35.00000  120.00000
   56    64    67    63.00000  120.00000
   64    56    57    35.00000  120.00000
   64    67    70    63.00000  120.00000
   64    67    71    70.00000  120.00000
   67    64    65    35.00000  120.00000
   67    70    38    60.00000  119.52600
   67    71    72    35.00000  113.00000
   70    47    53    63.00000  120.00000
   70    38    39    75.00000  123.78400
   38    33    37    70.00000  109.06800
   71    67    70    70.00000  120.00000
   40    33    37    65.00000  111.94000
   40    33    38    70.00000  107.85200
   42    40    41    80.00000  126.00000
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  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  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    43   0.09700  1.0 1.0
   29    33    37    43   0.15600 -1.0 2.0
   29    33    37    43  -0.50800  1.0 3.0
   29    33    37    44   0.42700  1.0 1.0
   29    33    37    44  -0.70350 -1.0 2.0
   29    33    37    44  -0.43150  1.0 3.0
   29    33    38    70   0.65300  1.0 1.0
   29    33    38    70  -0.03850 -1.0 2.0
   29    33    38    70   0.33900  1.0 3.0
   29    33    38    39   0.30150 -1.0 2.0
   29    33    40    41   0.30150 -1.0 2.0
   29    33    40    42   0.30150 -1.0 2.0
   33    37    43    46  -0.02500  1.0 1.0
   33    37    43    46  -0.32150 -1.0 2.0
   33    37    43    46  -0.01500  1.0 3.0
   33    37    43    66  -0.02500  1.0 1.0
   33    37    43    66  -0.32150 -1.0 2.0
   33    37    43    66  -0.01500  1.0 3.0
   33    37    44    45   7.00000 -1.0 2.0
   33    37    44    47   7.00000 -1.0 2.0
   37    33    38    70   0.65300  1.0 1.0
   37    33    38    70  -0.03850 -1.0 2.0
   37    33    38    70   0.33900  1.0 3.0
   37    33    38    39   0.30150 -1.0 2.0
   37    33    40    41   0.30150 -1.0 2.0
   37    33    40    42   0.30150 -1.0 2.0
   37    43    46    48   3.62500 -1.0 2.0
   37    43    46    50   3.62500 -1.0 2.0
   37    43    66    58   3.62500 -1.0 2.0
   37    43    66    68   3.62500 -1.0 2.0
   37    44    47    53   0.15800  1.0 1.0
   37    44    47    53   1.85350 -1.0 2.0
   37    44    47    53  -0.48700  1.0 3.0
   37    44   -47    70   0.15800  1.0 1.0
   37    44   -47    70   1.85350 -1.0 2.0
   37    44   -47    70  -0.48700  1.0 3.0
   43    37    44    45   7.00000 -1.0 2.0
   43    37    44    47   7.00000 -1.0 2.0
   43    46    48    49   3.62500 -1.0 2.0
   43    46    48    55   3.62500 -1.0 2.0
   43    46    50    51   1.05000 -1.0 2.0
   43    46    50    52   0.56600 -1.0 2.0
   43    66    68    69   0.84100 -1.0 2.0
   46    43    66    58   3.62500 -1.0 2.0
   46    43    66    68   3.62500 -1.0 2.0
   46    48   -55    58   3.62500 -1.0 2.0
   46    48    55    60   3.62500 -1.0 2.0
   48    46    50    51   1.05000 -1.0 2.0
   48    46    50    52   0.56600 -1.0 2.0
   48    55    58    59   3.62500 -1.0 2.0
   48    55    58    66   3.62500 -1.0 2.0
   48    55    60    61   0.00000  1.0 1.0
   48    55    60    62   0.00000  1.0 1.0
   48    55    60    63   0.00000  1.0 1.0
   49    48    55    58   3.62500 -1.0 2.0
   49    48    55    60   3.62500 -1.0 2.0
   55    58   -66    43   3.62500 -1.0 2.0
   55    58    66    68   3.62500 -1.0 2.0
   58    55    60    61   0.00000  1.0 1.0
   58    55    60    62   0.00000  1.0 1.0
   58    55    60    63   0.00000  1.0 1.0
   58    66    68    69   0.84100 -1.0 2.0
   59    58    66    43   3.62500 -1.0 2.0
   59    58    66    68   3.62500 -1.0 2.0
   66    43   -46    48   3.62500 -1.0 2.0
   66    43    46    50   3.62500 -1.0 2.0
   60    55    58    59   3.62500 -1.0 2.0
   60    55    58    66   3.62500 -1.0 2.0
   50    46    48    49   3.62500 -1.0 2.0
   50    46    48    55   3.62500 -1.0 2.0
   44    37    43    46   0.15800  1.0 1.0
   44    37    43    46   1.85350 -1.0 2.0
   44    37    43    46  -0.48700  1.0 3.0
   44    37    43    66   0.15800  1.0 1.0
   44    37    43    66   1.85350 -1.0 2.0
   44    37    43    66  -0.48700  1.0 3.0
   44    47    53    54   3.62500 -1.0 2.0
   44    47    53    56   3.62500 -1.0 2.0
   44    47    70    67   3.62500 -1.0 2.0
   44    47    70    38   3.62500 -1.0 2.0
   45    44    47    53  -0.01750  1.0 1.0
   45    44    47    53  -0.32000 -1.0 2.0
   45    44    47    53   0.00600  1.0 3.0
   45    44    47    70  -0.01750  1.0 1.0
   45    44    47    70  -0.32000 -1.0 2.0
   45    44    47    70   0.00600  1.0 3.0
   47    53    56    57   3.62500 -1.0 2.0
   47    53    56    64   3.62500 -1.0 2.0
   47    70   -38    33   2.26350  1.0 1.0
   47    70   -38    33   0.76750 -1.0 2.0
   47    70   -38    33   0.22500  1.0 3.0
   47    70    38    39   1.05000 -1.0 2.0
   53    47    70    67   3.62500 -1.0 2.0
   53    47    70    38   3.62500 -1.0 2.0
   53    56    64    65   3.62500 -1.0 2.0
   53    56   -64    67   3.62500 -1.0 2.0
   54    53    56    57   3.62500 -1.0 2.0
   54    53    56    64   3.62500 -1.0 2.0
   56    64    67    70   3.62500 -1.0 2.0
   56    64    67    71   3.62500 -1.0 2.0
   57    56    64    65   3.62500 -1.0 2.0
   57    56    64    67   3.62500 -1.0 2.0
   64    67   -70    47   3.62500 -1.0 2.0
   64    67    70    38   3.62500 -1.0 2.0
   64    67    71    72   0.84100 -1.0 2.0
   65    64    67    70   3.62500 -1.0 2.0
   65    64    67    71   3.62500 -1.0 2.0
   67    70    38    33   2.26350  1.0 1.0
   67    70    38    33   0.76750 -1.0 2.0
   67    70    38    33   0.22500  1.0 3.0
   67    70    38    39   1.05000 -1.0 2.0
   70    47    53    54   3.62500 -1.0 2.0
   70    47   -53    56   3.62500 -1.0 2.0
   70    67    71    72   0.84100 -1.0 2.0
   38    33    37    43   0.09700  1.0 1.0
   38    33    37    43   0.15600 -1.0 2.0
   38    33    37    43  -0.50800  1.0 3.0
   38    33   -37    44  -0.51250  1.0 1.0
   38    33   -37    44  -0.88800 -1.0 2.0
   38    33   -37    44   0.08850  1.0 3.0
   38    33    40    41   0.30150 -1.0 2.0
   38    33    40    42   0.30150 -1.0 2.0
   71    67    70    47   3.62500 -1.0 2.0
   71    67    70    38   3.62500 -1.0 2.0
   40    33    37    43   0.09700  1.0 1.0
   40    33    37    43   0.15600 -1.0 2.0
   40    33    37    43  -0.50800  1.0 3.0
   40    33    37    44  -0.51250  1.0 1.0
   40    33    37    44  -0.88800 -1.0 2.0
   40    33    37    44   0.08850  1.0 3.0
   40    33    38    70   0.65300  1.0 1.0
   40    33    38    70  -0.03850 -1.0 2.0
   40    33    38    70   0.33900  1.0 3.0
   40    33    38    39   0.30150 -1.0 2.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    34    35  10.50000 -1.0 2.0
   33    43    37    44   1.10000 -1.0 2.0
   46    66    43    37   4.00000 -1.0 2.0
   48    50    46    43   4.00000 -1.0 2.0
   55    49    48    46   1.10000 -1.0 2.0
   58    60    55    48   4.00000 -1.0 2.0
   66    59    58    55   1.10000 -1.0 2.0
   58    68    66    43   4.00000 -1.0 2.0
   46    52    50    51  10.50000 -1.0 2.0
   47    45    44    37   1.10000 -1.0 2.0
   53    70    47    44   4.00000 -1.0 2.0
   56    54    53    47   1.10000 -1.0 2.0
   64    57    56    53   1.10000 -1.0 2.0
   67    65    64    56   1.10000 -1.0 2.0
   70    71    67    64   4.00000 -1.0 2.0
   67    38    70    47   4.00000 -1.0 2.0
   33    70    38    39  10.50000 -1.0 2.0
   41    33    40    42  10.50000 -1.0 2.0
END
