* LIGAND DATABASE FILE (OPLS2005)
*
001      76    77    135    217     408
    1     0 S   NP   _N1_     1    28.93052    97.03563   -21.09174
    2     1 S   H    _HN1     2     1.02772    89.17349   -88.86249
    3     1 S   H    _H1_     3     1.02946    76.32686    20.32121
    4     1 S   H    _H2_     4     1.02828    43.92876   153.89425
    5     1 S   CT   _CA1     5     1.50157   152.72080   128.42107
    6     5 S   HC   _HA1     6     1.09561   105.23371    77.99651
    7     5 S   CO3  _C1_     7     1.53976   112.13590   -42.40946
    8     7 S   O2Z  _O11     8     1.26436   114.89608   -43.85873
    9     7 S   O2Z  _O12     9     1.26193   115.15276   134.91522
   10     5 S   CT   _CB1    10     1.53165   107.41074  -163.69868
   11    10 S   HC   HB11    11     1.09815   110.00071   -45.01802
   12    10 S   HC   HB12    12     1.09798   110.35789    71.90744
   13    10 S   CT   _CG1    13     1.52860   112.09514  -165.69134
   14    13 S   HC   HG11    14     1.09503   110.41598   -57.75989
   15    13 S   HC   HG12    15     1.09592   109.56595    61.32416
   16    13 S   C    _CD1    16     1.51770   112.71807  -177.95455
   17    16 S   O    _OE1    17     1.22733   123.26090     2.48774
   18    16 S   N    _N2_    18     1.38518   111.50607  -178.21908
   19    18 S   H    _HN2    19     1.01962   118.83034     4.66241
   20    18 S   CT1  _CA2    20     1.46132   123.83825  -176.30292
   21    20 S   HC   _HA2    21     1.09733   109.22881   -14.50979
   22    20 S   C    _C2_    22     1.53516   109.09148  -130.20621
   23    22 S   O    _O2_    23     1.23075   122.11060  -152.00775
   24    20 S   CT   _CB2    32     1.53460   110.93123   107.52012
   25    24 S   HC   HB21    33     1.09482   109.51109    51.74283
   26    24 S   HC   HB22    34     1.09485   110.99668   170.45087
   27    22 S   N    _N3_    24     1.38442   113.64859    35.96401
   28    27 S   H    _HN3    25     1.01521   118.86882    -3.34205
   29    24 S   S    _SG2    35     1.82980   111.62798   -70.43684
   30    27 S   CT   _CA3    26     1.45374   123.34547   175.11533
   31    30 S   HC   HA31    27     1.09543   108.91871    29.83526
   32    30 S   HC   HA32    28     1.09493   107.19286   146.72838
   33    29 S   CT   _C10    36     1.84362    99.72247   155.25221
   34    33 S   HC   _H3_    37     1.09592   105.65947    39.52497
   35    30 S   CO3  _C3_    29     1.52931   113.37478   -93.45712
   36    35 S   O2Z  _O31    30     1.26399   115.57460   -42.95012
   37    35 S   O2Z  _O32    31     1.26401   114.92976   138.02908
   38    33 S   CA   _C9_    38     1.52142   110.77811   156.29063
   39    33 S   CM   _C11    50     1.51330   109.05128   -79.68027
   40    39 S   HC   _H11    51     1.09107   115.61102   -54.68247
   41    38 S   CA   _C4_    39     1.40521   119.49027  -117.31297
   42    41 S   HA   _H7_    40     1.08762   120.35610     0.01978
   43    39 S   CMA  _C12    52     1.35446   126.87888   124.17177
   44    43 S   OM   _O33    53     1.26696   126.18871     2.28285
   45    41 S   CA   _C5_    41     1.39617   120.82734  -179.83449
   46    45 S   HA   _H8_    42     1.08616   119.82355   179.98022
   47    43 S   OS   _O34    54     1.41903   109.83311  -179.50981
   48    45 S   CA   _C6_    43     1.39069   119.64835     0.09279
   49    47 S   CT   _C13    55     1.44484   115.16385   128.27758
   50    49 S   HC   _H4_    56     1.09740   109.90559    49.73971
   51    48 S   CA   _C7_    44     1.39172   120.70357     0.05234
   52    51 S   HA   _H9_    45     1.08593   121.03307   179.90513
   53    48 S   OH   _O40    48     1.36624   118.22685  -179.97202
   54    53 S   HO   _H19    49     0.97233   108.49869  -179.76677
   55    49 S   CT   _C14    57     1.53976   109.53409   -73.04842
   56    55 S   HC   _H12    58     1.09826   108.98143   -47.86546
   57    55 S   HC   _H13    59     1.09723   108.19581    66.52414
   58    38 S   CA   _C8_    46     1.40657   122.09034    63.10654
   59    58 S   HA   _H10    47     1.08756   120.46917    -0.21940
   60    55 S   CT   _C15    60     1.53461   113.61199  -170.88868
   61    60 S   CT   _C16    61     1.53469   111.09781    51.90973
   62    61 S   HC   _H14    62     1.09767   109.12468  -172.69072
   63    61 S   HC   _H15    63     1.09754   109.88962    69.66498
   64    60 S   CO3  _C19    72     1.55407   108.10785   176.82627
   65    64 S   O2Z  _O38    73     1.26255   116.58093  -123.73964
   66    64 S   O2Z  _O37    74     1.26706   114.72038    56.89501
   67    60 S   OH   _O39    75     1.43289   108.96498   -67.88311
   68    67 S   HO   _H18    76     0.97415   107.20013   -61.95837
   69    61 S   CT   _C17    64     1.53245   113.06946   -51.56917
   70    69 S   HC   _H5_    65     1.09585   109.78508   175.22972
   71    49 S   CT   _C18    66     1.53748   106.81345   167.73897
   72    71 S   HC   _H6_    67     1.09743   109.26554    52.04929
   73    69 S   OH   _O36    70     1.42805   110.60344   -67.84327
   74    73 S   HO   _H17    71     0.97191   107.90516   -43.76119
   75    71 S   OH   _O35    68     1.42997   109.22905   -64.16911
   76    75 S   HO   _H16    69     0.97169   107.51424  -176.92547
  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   8   5   4   3
  13   6   2   1   1  12   7   3   8   4   6   2   7   3  10   6
  15   8   5   3   2   1  15   6   5   1   1  12  14   7   6   5
   2   1   2   1   7   5   5   3   2   1   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    58    39    40    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    45    51    58    59    39    40    43    44    47  
   38    41    58    39    40    43  
   36    37  
   37  
    0  
   41    42    45    46    48    51    52    58    59    39    40    43  
   40    43    44    47    49    41    58  
   43    44    47  
   42    45    46    48    51    58    59    53  
   45    46    48    58  
   44    47    49    50    55    71  
   47    49  
   46    48    51    52    58    53    54  
   48    51    53  
   49    50    55    56    57    60    69    71    72    75  
   51    52    58    59    53    54  
   50    55    56    57    60    61    69    70    71    72    75    76    73    64    67  
   55    56    57    60    69    71    72    75  
   52    58    59    53    54  
   58    59    53  
   54    58  
    0  
   56    57    60    61    62    63    69    71    72    75    64    65    66    67    68  
   57    60    61    71    64    67  
   60    61    71    64    67  
   59  
    0  
   61    62    63    69    70    71    73    64    65    66    67    68  
   62    63    69    70    71    72    75    73    74    64    65    66    67    68  
   63    69    70    71    73    64    67  
   69    70    71    73    64    67  
   65    66    67    68    69  
   66    67  
   67  
   68    69  
    0  
   70    71    72    75    76    73    74  
   71    72    75    73    74  
   72    75    76    73    74  
   75    76    73  
   74    75  
    0  
   76  
    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   0.222500   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   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   40   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   42   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   43   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   44   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   2.8500   0.1400  -0.685000   1.5900   1.4000   0.020110767  -0.896042159
   48   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   49   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   52   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   53   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   54   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   55   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   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   0.165000   1.9750   1.7500   0.005000000  -0.741685710
   61   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   65   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   66   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   67   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   68   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   69   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   74   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   75   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   76   0.5000   0.0300   0.418000   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    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    39   317.000  1.510
   38    41   469.000  1.400
   38    58   469.000  1.400
   41    42   367.000  1.080
   41    45   469.000  1.400
   45    46   367.000  1.080
   45    48   469.000  1.400
   48    51   469.000  1.400
   48    53   450.000  1.364
   51    52   367.000  1.080
   51    58   469.000  1.400
   58    59   367.000  1.080
   53    54   553.000  0.945
   39    40   340.000  1.080
   39    43   465.000  1.376
   43    44   745.000  1.250
   43    47   440.000  1.360
   47    49   320.000  1.410
   49    50   340.000  1.090
   49    55   268.000  1.529
   49    71   268.000  1.529
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    60   268.000  1.529
   60    61   268.000  1.529
   60    64   317.000  1.522
   60    67   320.000  1.410
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    69   268.000  1.529
   69    70   340.000  1.090
   69    71   268.000  1.529
   69    73   320.000  1.410
   71    72   340.000  1.090
   71    75   320.000  1.410
   75    76   553.000  0.945
   73    74   553.000  0.945
   64    65   656.000  1.250
   64    66   656.000  1.250
   67    68   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    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    80.00000  109.48900
   29    33    39    75.00000  112.20000
   33    38    41    70.00000  120.00000
   33    38    58    70.00000  120.00000
   33    39    40    35.00000  117.00000
   33    39    43    70.00000  124.00000
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    45    63.00000  120.00000
   38    58    51    63.00000  120.00000
   38    58    59    35.00000  120.00000
   41    45    46    35.00000  120.00000
   41    45    48    63.00000  120.00000
   45    41    42    35.00000  120.00000
   45    48    51    63.00000  120.00000
   45    48    53    70.00000  120.00000
   48    45    46    35.00000  120.00000
   48    51    52    35.00000  120.00000
   48    51    58    63.00000  120.00000
   48    53    54    35.00000  113.00000
   51    58    59    35.00000  120.00000
   58    38    41    63.00000  120.00000
   58    51    52    35.00000  120.00000
   53    48    51    70.00000  120.00000
   39    33    34    35.00000  109.50000
   39    33    38    70.00000  112.99600
   39    43    44    65.00000  137.10300
   39    43    47    80.00000  120.01400
   43    39    40    40.00000  120.50800
   43    47    49    90.00000  111.18400
   47    43    44    65.00000  121.00000
   47    49    50    35.00000  109.50000
   47    49    55    50.00000  109.50000
   47    49    71    50.00000  109.50000
   49    55    56    37.50000  110.70000
   49    55    57    37.50000  110.70000
   49    55    60    58.35000  112.70000
   49    71    69    58.35000  112.70000
   49    71    72    37.50000  110.70000
   49    71    75    50.00000  109.50000
   55    49    50    37.50000  110.70000
   55    60    61    58.35000  112.70000
   55    60    64    70.00000  109.69300
   55    60    67    50.00000  109.50000
   57    55    56    33.00000  107.80000
   60    55    56    37.50000  110.70000
   60    55    57    37.50000  110.70000
   60    61    62    37.50000  110.70000
   60    61    63    37.50000  110.70000
   60    61    69    58.35000  112.70000
   60    64    65    70.00000  117.00000
   60    64    66    70.00000  117.00000
   60    67    68    55.00000  108.50000
   61    69    70    37.50000  110.70000
   61    69    71    58.35000  112.70000
   61    69    73    50.00000  109.50000
   63    61    62    33.00000  107.80000
   69    61    62    37.50000  110.70000
   69    61    63    37.50000  110.70000
   69    71    72    37.50000  110.70000
   69    71    75    50.00000  109.50000
   69    73    74    55.00000  108.50000
   71    49    50    37.50000  110.70000
   71    49    55    58.35000  112.70000
   71    69    70    37.50000  110.70000
   71    75    76    55.00000  108.50000
   75    71    72    35.00000  109.50000
   73    69    70    35.00000  109.50000
   73    69    71    50.00000  109.50000
   64    60    61    70.00000  109.69300
   66    64    65    80.00000  126.00000
   67    60    61    50.00000  109.50000
   67    60    64    95.00000  109.52300
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  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  1.0 3.0
   24    29    33    39  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    41  -0.16000  1.0 1.0
   29    33    38    41  -0.03200 -1.0 2.0
   29    33    38    41   0.04500  1.0 3.0
   29    33    38    58  -0.16000  1.0 1.0
   29    33    38    58  -0.03200 -1.0 2.0
   29    33    38    58   0.04500  1.0 3.0
   29    33    39    40   0.00000  1.0 1.0
   29    33    39    43   0.42700  1.0 1.0
   29    33    39    43  -0.70350 -1.0 2.0
   29    33    39    43  -0.43150  1.0 3.0
   33    38    41    42   3.62500 -1.0 2.0
   33    38    41    45   3.62500 -1.0 2.0
   33    38    58    51   3.62500 -1.0 2.0
   33    38    58    59   3.62500 -1.0 2.0
   33    39    43    44   7.00000 -1.0 2.0
   33    39    43    47   7.00000 -1.0 2.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    58   0.00000  1.0 1.0
   34    33    39    40   0.33100  1.0 3.0
   34    33    39    43   0.00000  1.0 1.0
   38    33    39    40   0.00000  1.0 1.0
   38    33    39    43   1.44450  1.0 1.0
   38    33    39    43   0.06600 -1.0 2.0
   38    33    39    43   0.29250  1.0 3.0
   38    41    45    46   3.62500 -1.0 2.0
   38    41    45    48   3.62500 -1.0 2.0
   41    38    58    51   3.62500 -1.0 2.0
   41    38    58    59   3.62500 -1.0 2.0
   41    45   -48    51   3.62500 -1.0 2.0
   41    45    48    53   3.62500 -1.0 2.0
   42    41    45    46   3.62500 -1.0 2.0
   42    41    45    48   3.62500 -1.0 2.0
   45    48    51    52   3.62500 -1.0 2.0
   45    48    51    58   3.62500 -1.0 2.0
   45    48    53    54   0.84100 -1.0 2.0
   46    45    48    51   3.62500 -1.0 2.0
   46    45    48    53   3.62500 -1.0 2.0
   48    51   -58    38   3.62500 -1.0 2.0
   48    51    58    59   3.62500 -1.0 2.0
   51    48    53    54   0.84100 -1.0 2.0
   52    51    58    38   3.62500 -1.0 2.0
   52    51    58    59   3.62500 -1.0 2.0
   58    38    41    42   3.62500 -1.0 2.0
   58    38   -41    45   3.62500 -1.0 2.0
   53    48    51    52   3.62500 -1.0 2.0
   53    48    51    58   3.62500 -1.0 2.0
   39    33    38    41   0.18050 -1.0 2.0
   39    33    38    58   0.18050 -1.0 2.0
   39    43    47    49  -2.26850  1.0 1.0
   39    43    47    49   3.39050 -1.0 2.0
   40    39    43    44   7.00000 -1.0 2.0
   40    39    43    47   7.00000 -1.0 2.0
   43    47    49    50   0.08050  1.0 3.0
   43    47    49    55  -0.46850  1.0 1.0
   43    47    49    55   0.09300 -1.0 2.0
   43    47    49    55  -0.12850  1.0 3.0
   43    47    49    71  -0.46850  1.0 1.0
   43    47    49    71   0.09300 -1.0 2.0
   43    47    49    71  -0.12850  1.0 3.0
   44    43    47    49   2.00000 -1.0 2.0
   47    49    55    56   0.23400  1.0 3.0
   47    49    55    57   0.23400  1.0 3.0
   47    49    55    60   0.62750  1.0 1.0
   47    49    55    60  -0.30950 -1.0 2.0
   47    49    55    60   0.27300  1.0 3.0
   47    49    71    69   0.62750  1.0 1.0
   47    49    71    69  -0.30950 -1.0 2.0
   47    49    71    69   0.27300  1.0 3.0
   47    49    71    72   0.23400  1.0 3.0
   47    49    71    75   3.69350  1.0 1.0
   47    49    71    75  -1.82950 -1.0 2.0
   49    55    60    61   0.56750  1.0 1.0
   49    55    60    61  -0.07550 -1.0 2.0
   49    55    60    61   0.20000  1.0 3.0
   49    55    60    64  -1.63150  1.0 1.0
   49    55    60    64  -0.43550 -1.0 2.0
   49    55    60    64   0.24500  1.0 3.0
   49    55    60    67   0.86500  1.0 1.0
   49    55    60    67  -0.17500 -1.0 2.0
   49    55    60    67   0.20800  1.0 3.0
   49    71    75    76  -0.11600  1.0 1.0
   49    71    75    76  -0.09450 -1.0 2.0
   49    71    75    76   0.21250  1.0 3.0
   50    49    55    56   0.15000  1.0 3.0
   50    49    55    57   0.15000  1.0 3.0
   50    49    55    60   0.15000  1.0 3.0
   50    49    71    69   0.15000  1.0 3.0
   50    49    71    72   0.15000  1.0 3.0
   50    49    71    75   0.23400  1.0 3.0
   55    49    71    69   0.56750  1.0 1.0
   55    49    71    69  -0.07550 -1.0 2.0
   55    49    71    69   0.20000  1.0 3.0
   55    49    71    72   0.15000  1.0 3.0
   55    49    71    75   0.86500  1.0 1.0
   55    49    71    75  -0.17500 -1.0 2.0
   55    49    71    75   0.20800  1.0 3.0
   55    60    61    62   0.15000  1.0 3.0
   55    60    61    63   0.15000  1.0 3.0
   55    60   -61    69   0.56750  1.0 1.0
   55    60   -61    69  -0.07550 -1.0 2.0
   55    60   -61    69   0.20000  1.0 3.0
   55    60    64    65   0.41150 -1.0 2.0
   55    60    64    66   0.41150 -1.0 2.0
   55    60    67    68  -0.11600  1.0 1.0
   55    60    67    68  -0.09450 -1.0 2.0
   55    60    67    68   0.21250  1.0 3.0
   56    55    60    61   0.15000  1.0 3.0
   56    55    60    64  -0.11250  1.0 3.0
   56    55    60    67   0.23400  1.0 3.0
   57    55    60    61   0.15000  1.0 3.0
   57    55    60    64  -0.11250  1.0 3.0
   57    55    60    67   0.23400  1.0 3.0
   60    61    69    70   0.15000  1.0 3.0
   60    61    69    71   0.56750  1.0 1.0
   60    61    69    71  -0.07550 -1.0 2.0
   60    61    69    71   0.20000  1.0 3.0
   60    61    69    73   0.86500  1.0 1.0
   60    61    69    73  -0.17500 -1.0 2.0
   60    61    69    73   0.20800  1.0 3.0
   61    60    64    65   0.41150 -1.0 2.0
   61    60    64    66   0.41150 -1.0 2.0
   61    60    67    68  -0.11600  1.0 1.0
   61    60    67    68  -0.09450 -1.0 2.0
   61    60    67    68   0.21250  1.0 3.0
   61    69   -71    49   0.56750  1.0 1.0
   61    69   -71    49  -0.07550 -1.0 2.0
   61    69   -71    49   0.20000  1.0 3.0
   61    69    71    72   0.15000  1.0 3.0
   61    69    71    75   0.86500  1.0 1.0
   61    69    71    75  -0.17500 -1.0 2.0
   61    69    71    75   0.20800  1.0 3.0
   61    69    73    74  -0.11600  1.0 1.0
   61    69    73    74  -0.09450 -1.0 2.0
   61    69    73    74   0.21250  1.0 3.0
   62    61    69    70   0.15000  1.0 3.0
   62    61    69    71   0.15000  1.0 3.0
   62    61    69    73   0.23400  1.0 3.0
   63    61    69    70   0.15000  1.0 3.0
   63    61    69    71   0.15000  1.0 3.0
   63    61    69    73   0.23400  1.0 3.0
   69    71    75    76  -0.11600  1.0 1.0
   69    71    75    76  -0.09450 -1.0 2.0
   69    71    75    76   0.21250  1.0 3.0
   70    69    71    49   0.15000  1.0 3.0
   70    69    71    72   0.15000  1.0 3.0
   70    69    71    75   0.23400  1.0 3.0
   70    69    73    74   0.19450  1.0 3.0
   71    49    55    56   0.15000  1.0 3.0
   71    49    55    57   0.15000  1.0 3.0
   71    49   -55    60   0.56750  1.0 1.0
   71    49   -55    60  -0.07550 -1.0 2.0
   71    49   -55    60   0.20000  1.0 3.0
   71    69    73    74  -0.11600  1.0 1.0
   71    69    73    74  -0.09450 -1.0 2.0
   71    69    73    74   0.21250  1.0 3.0
   72    71    75    76   0.19450  1.0 3.0
   73    69    71    49   0.86500  1.0 1.0
   73    69    71    49  -0.17500 -1.0 2.0
   73    69    71    49   0.20800  1.0 3.0
   73    69    71    72   0.23400  1.0 3.0
   73    69    71    75   3.75450  1.0 1.0
   64    60    61    62  -0.11250  1.0 3.0
   64    60    61    63  -0.11250  1.0 3.0
   64    60    61    69  -1.63150  1.0 1.0
   64    60    61    69  -0.43550 -1.0 2.0
   64    60    61    69   0.24500  1.0 3.0
   64    60    67    68   0.91850  1.0 1.0
   64    60    67    68   0.57950  1.0 3.0
   67    60    61    62   0.23400  1.0 3.0
   67    60    61    63   0.23400  1.0 3.0
   67    60    61    69   0.86500  1.0 1.0
   67    60    61    69  -0.17500 -1.0 2.0
   67    60    61    69   0.20800  1.0 3.0
   67    60    64    65   0.30150 -1.0 2.0
   67    60    64    66   0.30150 -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
   41    58    38    33   4.00000 -1.0 2.0
   45    42    41    38   1.10000 -1.0 2.0
   48    46    45    41   1.10000 -1.0 2.0
   51    53    48    45   4.00000 -1.0 2.0
   58    52    51    48   1.10000 -1.0 2.0
   51    59    58    38   1.10000 -1.0 2.0
   33    40    39    43  15.00000 -1.0 2.0
   44    47    43    39  15.00000 -1.0 2.0
   65    60    64    66  10.50000 -1.0 2.0
END
