* LIGAND DATABASE FILE (OPLS2005)
*
001      72    75    127    215     380
    1     0 S   NP   _N1_     1    29.43055    97.70377   -19.83527
    2     1 S   H    _HN1     2     1.02788    89.69931  -107.83853
    3     1 S   H    _H1_     3     1.02945    64.06166     2.81550
    4     1 S   H    _H2_     4     1.02830    55.36234   140.04785
    5     1 S   CT   _CA1     5     1.50141   157.69404    83.46601
    6     5 S   HC   _HA1     6     1.09560   105.22202   106.73616
    7     5 S   CO3  _C1_     7     1.53822   112.21516   -13.67894
    8     7 S   O2Z  _O11     8     1.26400   114.99474   -45.57547
    9     7 S   O2Z  _O12     9     1.26189   114.96614   133.31708
   10     5 S   CT   _CB1    10     1.53044   107.40819  -135.11408
   11    10 S   HC   HB11    11     1.09838   109.65320   -46.97190
   12    10 S   HC   HB12    12     1.09816   110.34853    69.68223
   13    10 S   CT   _CG1    13     1.53030   112.59203  -167.78909
   14    13 S   HC   HG11    14     1.09535   110.71828   -62.09286
   15    13 S   HC   HG12    15     1.09649   109.79169    57.12974
   16    13 S   C    _CD1    16     1.51816   111.84692   177.74971
   17    16 S   O    _OE1    17     1.22774   123.09017    10.19376
   18    16 S   N    _N2_    18     1.38596   111.99152  -170.47581
   19    18 S   H    _HN2    19     1.01676   119.14263     2.24106
   20    18 S   CT1  _CA2    20     1.46167   123.22870   179.39316
   21    20 S   HC   _HA2    21     1.09735   109.24437     1.61495
   22    20 S   C    _C2_    22     1.53510   108.86754  -113.85575
   23    22 S   O    _O2_    23     1.23068   122.24107  -149.73393
   24    20 S   CT   _CB2    32     1.53358   111.77997   123.37117
   25    24 S   HC   HB21    33     1.09384   110.15751    61.61741
   26    24 S   HC   HB22    34     1.09565   110.00978   178.88583
   27    22 S   N    _N3_    24     1.38333   113.73436    37.89377
   28    27 S   H    _HN3    25     1.01588   119.52836    -3.76192
   29    24 S   S    _SG2    35     1.83480   111.57563   -62.99158
   30    27 S   CT   _CA3    26     1.45270   123.20227   177.03958
   31    30 S   HC   HA31    27     1.09550   107.58887   -62.97593
   32    30 S   HC   HA32    28     1.09559   107.88826    53.43850
   33    29 S   CT   _C23    36     1.89598   101.77455   125.36241
   34    30 S   CO3  _C3_    29     1.52953   114.10905   175.43803
   35    34 S   O2Z  _O31    30     1.26376   116.08825     1.48925
   36    34 S   O2Z  _O32    31     1.26433   114.40676  -178.50132
   37    33 S   CA   _C16    37     1.56594   109.28121  -178.03497
   38    33 S   CM   _C20    56     1.51178   109.54281   -55.12911
   39    38 S   HC   _H35    57     1.08908   115.60443   -43.90202
   40    37 S   CA   _C8_    38     1.41172   117.80330  -119.25570
   41    40 S   HA   _H31    39     1.08556   122.13160     1.65977
   42    38 S   CMA  _C21    58     1.35343   129.63470   133.83503
   43    42 S   OM   _O21    59     1.26672   124.47490  -177.30093
   44    40 S   CA   _C11    40     1.38642   122.16661  -178.23154
   45    44 S   HA   _H34    41     1.08655   119.08782   179.93744
   46    42 S   CA   _C15    60     1.51106   114.48347     2.41589
   47    44 S   CA   _C18    42     1.38716   119.79533     0.18663
   48    46 S   CA   _C14    61     1.40458   120.88570   -16.69997
   49    47 S   CA   _C13    43     1.41550   121.97423    -0.39416
   50    47 S   OH   _O24    54     1.37354   117.49136   179.75531
   51    50 S   HO   _H37    55     0.97162   109.39798    -0.26907
   52    48 S   CA   _C7_    62     1.40674   121.85803  -176.72966
   53    52 S   HA   _H30    63     1.08732   121.06760  -179.96044
   54    33 S   CO4  _C22    71     1.54332   104.21553    60.87631
   55    54 S   O    _O22    72     1.23078   123.50901    37.12000
   56    37 S   CA   _C12    44     1.45130   124.28646    62.11308
   57    52 S   CA   _C5_    64     1.38957   120.36228    -0.93209
   58    57 S   HA   _H28    65     1.08575   120.27095  -179.60091
   59    56 S   CA   _C6_    45     1.42182   124.21156    -2.53235
   60    59 S   HA   _H29    46     1.08285   121.58007    -1.42395
   61    57 S   CA   _C10    66     1.38708   119.45495    -0.06256
   62    61 S   HA   _H33    67     1.08674   119.75192  -179.61033
   63    59 S   CA   _C4_    47     1.39590   123.80965   179.26378
   64    63 S   HA   _H27    48     1.08626   119.95620  -179.77619
   65    46 S   CA   _C19    68     1.41724   123.08910   165.46583
   66    63 S   CA   _C9_    49     1.37799   119.73780     0.26319
   67    66 S   HA   _H32    50     1.08570   119.52066  -179.84423
   68    65 S   OH   _O25    69     1.37388   123.03508    -3.07148
   69    68 S   HO   _H38    70     0.97561   107.39326     3.61070
   70    49 S   CA   _C17    51     1.42644   122.74214   179.92087
   71    70 S   OH   _O23    52     1.37501   120.20903    -0.40494
   72    71 S   HO   _H36    53     0.97169   109.28757  -179.40324
  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
  16   2   1   1  17  10   4   9   4   8   3   7   3  11   8   9
  11   3   1   8   4   4   1   7   5   3   6   3   4   2   5   3
   2   4   2   1   1   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    38    54    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    56    38    39    42    48    54    55  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    41    44    49    56    59    38    39    42    43    46    48    52    54    55  
   35    36  
   36  
    0  
   40    41    44    45    47    49    56    59    60    63    70    38    39    42    48    54    55  
   39    42    43    46    48    65    54    55    40    56  
   42    43    46    54  
   41    44    45    47    49    56    59    50    54  
   44    45    47    56  
   43    46    48    52    61    65    68    54  
   46    48    65  
   45    47    49    56    70    50    51  
   47    49    50  
   48    52    53    57    61    62    65    68    69    54    55  
   49    56    59    66    70    71    50    51  
   52    53    57    58    61    65    68    54    55  
   56    59    60    63    66    67    70    71    72    50    51  
   51    56    70  
    0  
   53    57    58    61    62    65    54    55  
   57    58    61    54  
   55    56    57    65  
    0  
   59    60    63    64    66    70    71  
   58    61    62    65    68  
   61    62    65  
   60    63    64    66    67    70  
   63    64    66  
   62    65    68    69  
   65    68  
   64    66    67    70    71  
   66    67    70  
   68    69  
   67    70    71    72  
   70    71  
   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   0.282500   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   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   41   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   42   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   44   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   45   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   46   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   49   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   50   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   51   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   52   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   53   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   54   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   55   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   56   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   57   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   60   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   61   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   63   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   64   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   65   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   66   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   67   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   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   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   71   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   72   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    38   317.000  1.510
   33    54   317.000  1.522
   37    40   469.000  1.400
   37    56   469.000  1.400
   40    41   367.000  1.080
   40    44   469.000  1.400
   44    45   367.000  1.080
   44    47   469.000  1.400
   47    49   469.000  1.400
   47    50   450.000  1.364
   49    56   469.000  1.400
   49    70   469.000  1.400
   56    59   469.000  1.400
   59    60   367.000  1.080
   59    63   469.000  1.400
   63    64   367.000  1.080
   63    66   469.000  1.400
   66    67   367.000  1.080
   66    70   469.000  1.400
   70    71   450.000  1.364
   71    72   553.000  0.945
   50    51   553.000  0.945
   38    39   340.000  1.080
   38    42   465.000  1.376
   42    43   745.000  1.250
   42    46   320.000  1.460
   46    48   469.000  1.400
   46    65   469.000  1.400
   48    52   469.000  1.400
   48    54   310.000  1.470
   52    53   367.000  1.080
   52    57   469.000  1.400
   57    58   367.000  1.080
   57    61   469.000  1.400
   61    62   367.000  1.080
   61    65   469.000  1.400
   65    68   450.000  1.364
   68    69   553.000  0.945
   54    55   570.000  1.229
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  112.20000
   29    33    54    75.00000  110.18000
   33    37    40    70.00000  120.00000
   33    37    56    70.00000  120.00000
   33    38    39    35.00000  117.00000
   33    38    42    70.00000  124.00000
   33    54    48    65.00000  115.47100
   33    54    55    80.00000  120.40000
   37    40    41    35.00000  120.00000
   37    40    44    63.00000  120.00000
   37    56    49    63.00000  120.00000
   37    56    59    63.00000  120.00000
   40    44    45    35.00000  120.00000
   40    44    47    63.00000  120.00000
   44    40    41    35.00000  120.00000
   44    47    49    63.00000  120.00000
   44    47    50    70.00000  120.00000
   47    44    45    35.00000  120.00000
   47    49    56    63.00000  120.00000
   47    49    70    63.00000  120.00000
   47    50    51    35.00000  113.00000
   49    56    59    63.00000  120.00000
   49    70    66    63.00000  120.00000
   49    70    71    70.00000  120.00000
   56    37    40    63.00000  120.00000
   56    59    60    35.00000  120.00000
   56    59    63    63.00000  120.00000
   59    63    64    35.00000  120.00000
   59    63    66    63.00000  120.00000
   63    59    60    35.00000  120.00000
   63    66    67    35.00000  120.00000
   63    66    70    63.00000  120.00000
   66    63    64    35.00000  120.00000
   66    70    71    70.00000  120.00000
   70    49    56    63.00000  120.00000
   70    66    67    35.00000  120.00000
   70    71    72    35.00000  113.00000
   50    47    49    70.00000  120.00000
   38    33    37    70.00000  112.99600
   38    42    43    65.00000  137.10300
   38    42    46    60.00000  123.20500
   42    38    39    40.00000  120.50800
   42    46    48    60.00000  120.93500
   42    46    65    60.00000  120.93500
   46    42    43    85.00000  114.86500
   46    48    52    63.00000  120.00000
   46    48    54    60.00000  119.52600
   46    65    61    63.00000  120.00000
   46    65    68    70.00000  120.00000
   48    52    53    35.00000  120.00000
   48    52    57    63.00000  120.00000
   48    54    55    75.00000  123.78400
   52    57    58    35.00000  120.00000
   52    57    61    63.00000  120.00000
   57    52    53    35.00000  120.00000
   57    61    62    35.00000  120.00000
   57    61    65    63.00000  120.00000
   61    57    58    35.00000  120.00000
   61    65    68    70.00000  120.00000
   65    46    48    63.00000  120.00000
   65    61    62    35.00000  120.00000
   65    68    69    35.00000  113.00000
   54    33    37    70.00000  110.93000
   54    33    38    70.00000  109.06800
   54    48    52    60.00000  119.52600
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  -0.62250  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    54   0.01700  1.0 1.0
   24    29    33    54  -0.23550 -1.0 2.0
   24    29    33    54   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    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    56  -0.16000  1.0 1.0
   29    33    37    56  -0.03200 -1.0 2.0
   29    33    37    56   0.04500  1.0 3.0
   29    33    38    39   0.00000  1.0 1.0
   29    33    38    42   0.42700  1.0 1.0
   29    33    38    42  -0.70350 -1.0 2.0
   29    33    38    42  -0.43150  1.0 3.0
   29    33    54    48   0.65300  1.0 1.0
   29    33    54    48  -0.03850 -1.0 2.0
   29    33    54    48   0.33900  1.0 3.0
   29    33    54    55   0.30150 -1.0 2.0
   33    37    40    41   3.62500 -1.0 2.0
   33    37    40    44   3.62500 -1.0 2.0
   33    37    56    49   3.62500 -1.0 2.0
   33    37    56    59   3.62500 -1.0 2.0
   33    38    42    43   7.00000 -1.0 2.0
   33    38    42    46   7.00000 -1.0 2.0
   37    33    38    39   0.00000  1.0 1.0
   37    33    38    42   1.44450  1.0 1.0
   37    33    38    42   0.06600 -1.0 2.0
   37    33    38    42   0.29250  1.0 3.0
   37    33    54    48   0.65300  1.0 1.0
   37    33    54    48  -0.03850 -1.0 2.0
   37    33    54    48   0.33900  1.0 3.0
   37    33    54    55   0.30150 -1.0 2.0
   37    40    44    45   3.62500 -1.0 2.0
   37    40    44    47   3.62500 -1.0 2.0
   37    56    59    60   3.62500 -1.0 2.0
   37    56    59    63   3.62500 -1.0 2.0
   40    37    56    49   3.62500 -1.0 2.0
   40    37    56    59   3.62500 -1.0 2.0
   40    44   -47    49   3.62500 -1.0 2.0
   40    44    47    50   3.62500 -1.0 2.0
   41    40    44    45   3.62500 -1.0 2.0
   41    40    44    47   3.62500 -1.0 2.0
   44    47    49    56   3.62500 -1.0 2.0
   44    47    49    70   3.62500 -1.0 2.0
   44    47    50    51   0.84100 -1.0 2.0
   45    44    47    49   3.62500 -1.0 2.0
   45    44    47    50   3.62500 -1.0 2.0
   47    49   -56    37   3.62500 -1.0 2.0
   47    49    56    59   3.62500 -1.0 2.0
   47    49    70    66   3.62500 -1.0 2.0
   47    49    70    71   3.62500 -1.0 2.0
   49    47    50    51   0.84100 -1.0 2.0
   49    56    59    60   3.62500 -1.0 2.0
   49    56    59    63   3.62500 -1.0 2.0
   49    70    71    72   0.84100 -1.0 2.0
   56    37    40    41   3.62500 -1.0 2.0
   56    37   -40    44   3.62500 -1.0 2.0
   56    49    70    66   3.62500 -1.0 2.0
   56    49    70    71   3.62500 -1.0 2.0
   56    59    63    64   3.62500 -1.0 2.0
   56    59   -63    66   3.62500 -1.0 2.0
   59    63    66    67   3.62500 -1.0 2.0
   59    63    66    70   3.62500 -1.0 2.0
   60    59    63    64   3.62500 -1.0 2.0
   60    59    63    66   3.62500 -1.0 2.0
   63    66   -70    49   3.62500 -1.0 2.0
   63    66    70    71   3.62500 -1.0 2.0
   64    63    66    67   3.62500 -1.0 2.0
   64    63    66    70   3.62500 -1.0 2.0
   66    70    71    72   0.84100 -1.0 2.0
   67    66    70    49   3.62500 -1.0 2.0
   67    66    70    71   3.62500 -1.0 2.0
   70    49    56    37   3.62500 -1.0 2.0
   70    49   -56    59   3.62500 -1.0 2.0
   50    47    49    56   3.62500 -1.0 2.0
   50    47    49    70   3.62500 -1.0 2.0
   38    33    37    40   0.18050 -1.0 2.0
   38    33    37    56   0.18050 -1.0 2.0
   38    33    54    48   0.65300  1.0 1.0
   38    33    54    48  -0.03850 -1.0 2.0
   38    33    54    48   0.33900  1.0 3.0
   38    33    54    55   0.30150 -1.0 2.0
   38    42   -46    48   0.15800  1.0 1.0
   38    42   -46    48   1.85350 -1.0 2.0
   38    42   -46    48  -0.48700  1.0 3.0
   38    42    46    65   0.15800  1.0 1.0
   38    42    46    65   1.85350 -1.0 2.0
   38    42    46    65  -0.48700  1.0 3.0
   39    38    42    43   7.00000 -1.0 2.0
   39    38    42    46   7.00000 -1.0 2.0
   42    46    48    52   3.62500 -1.0 2.0
   42    46    48    54   3.62500 -1.0 2.0
   42    46    65    61   3.62500 -1.0 2.0
   42    46    65    68   3.62500 -1.0 2.0
   43    42    46    48  -0.01750  1.0 1.0
   43    42    46    48  -0.32000 -1.0 2.0
   43    42    46    48   0.00600  1.0 3.0
   43    42    46    65  -0.01750  1.0 1.0
   43    42    46    65  -0.32000 -1.0 2.0
   43    42    46    65   0.00600  1.0 3.0
   46    48    52    53   3.62500 -1.0 2.0
   46    48    52    57   3.62500 -1.0 2.0
   46    48   -54    33   2.26350  1.0 1.0
   46    48   -54    33   0.76750 -1.0 2.0
   46    48   -54    33   0.22500  1.0 3.0
   46    48    54    55   1.05000 -1.0 2.0
   46    65    68    69   0.84100 -1.0 2.0
   48    46    65    61   3.62500 -1.0 2.0
   48    46    65    68   3.62500 -1.0 2.0
   48    52    57    58   3.62500 -1.0 2.0
   48    52   -57    61   3.62500 -1.0 2.0
   52    48    54    33   2.26350  1.0 1.0
   52    48    54    33   0.76750 -1.0 2.0
   52    48    54    33   0.22500  1.0 3.0
   52    48    54    55   1.05000 -1.0 2.0
   52    57    61    62   3.62500 -1.0 2.0
   52    57    61    65   3.62500 -1.0 2.0
   53    52    57    58   3.62500 -1.0 2.0
   53    52    57    61   3.62500 -1.0 2.0
   57    61   -65    46   3.62500 -1.0 2.0
   57    61    65    68   3.62500 -1.0 2.0
   58    57    61    62   3.62500 -1.0 2.0
   58    57    61    65   3.62500 -1.0 2.0
   61    65    68    69   0.84100 -1.0 2.0
   62    61    65    46   3.62500 -1.0 2.0
   62    61    65    68   3.62500 -1.0 2.0
   65    46   -48    52   3.62500 -1.0 2.0
   65    46    48    54   3.62500 -1.0 2.0
   54    33    37    40   0.04300 -1.0 2.0
   54    33    37    56   0.04300 -1.0 2.0
   54    33    38    39   0.00000  1.0 1.0
   54    33   -38    42  -0.51250  1.0 1.0
   54    33   -38    42  -0.88800 -1.0 2.0
   54    33   -38    42   0.08850  1.0 3.0
   54    48    52    53   3.62500 -1.0 2.0
   54    48    52    57   3.62500 -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
   40    56    37    33   4.00000 -1.0 2.0
   44    41    40    37   1.10000 -1.0 2.0
   47    45    44    40   1.10000 -1.0 2.0
   49    50    47    44   4.00000 -1.0 2.0
   56    70    49    47   4.00000 -1.0 2.0
   49    59    56    37   4.00000 -1.0 2.0
   63    60    59    56   1.10000 -1.0 2.0
   66    64    63    59   1.10000 -1.0 2.0
   70    67    66    63   1.10000 -1.0 2.0
   66    71    70    49   4.00000 -1.0 2.0
   33    39    38    42   1.10000 -1.0 2.0
   46    43    42    38   1.10000 -1.0 2.0
   48    65    46    42   4.00000 -1.0 2.0
   52    54    48    46   4.00000 -1.0 2.0
   57    53    52    48   1.10000 -1.0 2.0
   61    58    57    52   1.10000 -1.0 2.0
   65    62    61    57   1.10000 -1.0 2.0
   61    68    65    46   4.00000 -1.0 2.0
   33    48    54    55  10.50000 -1.0 2.0
END
