* LIGAND DATABASE FILE (OPLS2005)
*
001      70    70    119    171     341
    1     0 S   NP   _N1_     1    30.48653    89.79963   -18.50578
    2     1 S   H    _HN1     2     1.02878    95.88324   -48.15778
    3     1 S   H    _H1_     3     1.02975   133.87368    73.72668
    4     1 S   H    _H2_     4     1.02805    26.74419    70.77972
    5     1 S   CT   _CA1     5     1.50196    95.26562  -161.31237
    6     5 S   HC   _HA1     6     1.09552   105.33723    35.92562
    7     5 S   CO3  _C1_     7     1.53722   112.43188   -84.70463
    8     7 S   O2Z  _O11     8     1.26383   115.02171   -43.51244
    9     7 S   O2Z  _O12     9     1.26228   114.94680   135.65562
   10     5 S   CT   _CB1    10     1.52820   107.22162   153.99786
   11    10 S   HC   HB11    11     1.09729   109.13568   -49.86878
   12    10 S   HC   HB12    12     1.09796   110.32266    66.54970
   13    10 S   CT   _CG1    13     1.52907   113.38995  -170.41380
   14    13 S   HC   HG11    14     1.09513   111.35943   -62.43640
   15    13 S   HC   HG12    15     1.09574   110.90790    57.14178
   16    13 S   C    _CD1    16     1.51400   108.99490   176.23360
   17    16 S   O    _OE1    17     1.22840   121.58209   -86.60570
   18    16 S   N    _N2_    18     1.38280   112.92433    90.44010
   19    18 S   H    _HN2    19     1.01521   119.46865     7.38015
   20    18 S   CT1  _CA2    20     1.45806   122.81351  -174.57249
   21    20 S   HC   _HA2    21     1.09558   108.34141    28.19948
   22    20 S   C    _C2_    22     1.52895   107.30147   -89.10976
   23    22 S   O    _O2_    23     1.23044   122.67278   -30.96500
   24    20 S   CT   _CB2    32     1.53556   112.41341   151.37483
   25    24 S   HC   HB21    33     1.09676   109.58227    71.71555
   26    24 S   HC   HB22    34     1.09540   110.78085  -171.50146
   27    22 S   N    _N3_    24     1.38530   112.85187   152.23430
   28    27 S   H    _HN3    25     1.02011   120.01941    -3.28086
   29    24 S   S    _SG2    35     1.83052   114.84219   -47.13067
   30    27 S   CT   _CA3    26     1.45391   122.39301   177.50362
   31    30 S   HC   HA31    27     1.09487   107.28046  -161.63563
   32    30 S   HC   HA32    28     1.09590   107.97498   -45.10950
   33    29 S   CT   _C12    36     1.84104   100.57687   -67.20852
   34    33 S   HC   _H3_    37     1.09176   107.13370    14.79698
   35    30 S   CO3  _C3_    29     1.53016   114.61813    77.69792
   36    35 S   O2Z  _O31    30     1.26290   116.14466    35.08310
   37    35 S   O2Z  _O32    31     1.26523   114.55074  -145.89122
   38    33 S   CA   _C7_    38     1.52437   110.90390   131.23338
   39    33 S   CM   _C13    58     1.51268   108.78749  -103.83015
   40    39 S   HC   _H13    59     1.09069   115.96776   -76.29941
   41    38 S   CA   _C6_    39     1.40728   119.08050  -120.36203
   42    41 S   HA   _H7_    40     1.08695   118.17248    -0.52489
   43    39 S   CMA  _C14    60     1.35619   126.36294   104.76981
   44    43 S   OM   _O36    61     1.26753   123.97344   179.64668
   45    41 S   CA   _C5_    41     1.39723   121.08429   178.86581
   46    43 S   OS   _O37    62     1.41363   111.53781    -3.26860
   47    45 S   CA   _C10    42     1.39861   118.62916     0.05935
   48    45 S   OS   _O33    53     1.37061   125.16702  -178.98896
   49    46 S   CT   _C15    63     1.43765   116.46158   138.20099
   50    49 S   HC   _H14    64     1.09680   110.98620    50.14696
   51    47 S   CA   _C9_    43     1.40036   121.64698     0.29007
   52    47 S   OH   _O34    51     1.37394   118.67102  -178.98606
   53    52 S   HO   _H9_    52     0.97397   107.27094  -175.30356
   54    48 S   CT   _C4_    54     1.42324   116.95676    -1.98574
   55    54 S   HC   _H4_    55     1.09426   107.70248  -178.89429
   56    54 S   HC   _H5_    56     1.09490   111.09200    63.47626
   57    54 S   HC   _H6_    57     1.09504   111.20964   -61.16196
   58    49 S   CO3  _C16    65     1.53547   108.31404   168.84788
   59    58 S   O2Z  _O39    66     1.26699   114.63031  -158.13573
   60    58 S   O2Z  _O38    67     1.26497   116.77765    20.91661
   61    49 S   CO3  _C17    68     1.53271   110.27897   -75.13665
   62    61 S   O2Z  _O41    69     1.26476   116.54672   -45.84751
   63    61 S   O2Z  _O40    70     1.26656   114.76530   134.38266
   64    38 S   CA   _C8_    44     1.40748   121.99607    59.13715
   65    64 S   HA   _H8_    45     1.08615   118.44307     0.82992
   66    51 S   OS   _O35    46     1.37096   115.51332  -179.56704
   67    66 S   CT   _C11    47     1.42294   116.90929   178.82964
   68    67 S   HC   _H10    48     1.09427   107.72536  -179.54716
   69    67 S   HC   _H11    49     1.09496   111.12465    62.73187
   70    67 S   HC   _H12    50     1.09504   111.13662   -61.82749
  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   9   4   6   2  11   8   9   6
   7   6   9   3   1   3   2   1   1   5   2   1   2   1   1   3
   1   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    64    39    40    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    45    51    64    65    39    40    43    44    46  
   38    41    64    39    40    43  
   36    37  
   37  
    0  
   41    42    45    47    51    64    65    66    48    39    40    43  
   40    43    44    46    49    41    64  
   43    44    46  
   42    45    47    51    64    65    52    48    54  
   45    47    64    48  
   44    46    49    50    58    61  
   46    49  
   47    51    64    66    52    53    48    54    55    56    57  
   49    50    58    59    60    61    62    63  
   51    64    65    66    67    52    53    48    54  
   54    55    56    57    51    52  
   50    58    59    60    61    62    63  
   58    59    60    61    62    63  
   64    65    66    67    68    69    70    52    53  
   53    64    66  
    0  
   55    56    57  
   56    57  
   57  
    0  
   59    60    61    62    63  
   60    61  
   61  
   62    63  
   63  
    0  
   65    66    67  
   66  
   67    68    69    70  
   68    69    70  
   69    70  
   70  
    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   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   46   2.8500   0.1400  -0.685000   1.5900   1.4000   0.020110767  -0.896042159
   47   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   48   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   49   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.030000   1.3810   1.2100   0.008598240   0.268726247
   51   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   52   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   53   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   54   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   58   3.7500   0.1050   0.600000   2.1120   1.8750   0.001000000  -0.126889456
   59   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   60   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   61   3.7500   0.1050   0.600000   2.1120   1.8750   0.001000000  -0.126889456
   62   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   63   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   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   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   67   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
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    64   469.000  1.400
   41    42   367.000  1.080
   41    45   469.000  1.400
   45    47   469.000  1.400
   45    48   450.000  1.364
   47    51   469.000  1.400
   47    52   450.000  1.364
   51    64   469.000  1.400
   51    66   450.000  1.364
   64    65   367.000  1.080
   66    67   320.000  1.410
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   340.000  1.090
   52    53   553.000  0.945
   48    54   320.000  1.410
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   340.000  1.090
   39    40   340.000  1.080
   39    43   465.000  1.376
   43    44   745.000  1.250
   43    46   440.000  1.360
   46    49   320.000  1.410
   49    50   340.000  1.090
   49    58   317.000  1.522
   49    61   317.000  1.522
   58    59   656.000  1.250
   58    60   656.000  1.250
   61    62   656.000  1.250
   61    63   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    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    64    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    64    51    63.00000  120.00000
   38    64    65    35.00000  120.00000
   41    45    47    63.00000  120.00000
   41    45    48    70.00000  120.00000
   45    41    42    35.00000  120.00000
   45    47    51    63.00000  120.00000
   45    47    52    70.00000  120.00000
   45    48    54    75.00000  111.00000
   47    51    64    63.00000  120.00000
   47    51    66    70.00000  120.00000
   47    52    53    35.00000  113.00000
   51    64    65    35.00000  120.00000
   51    66    67    75.00000  111.00000
   64    38    41    63.00000  120.00000
   66    51    64    70.00000  120.00000
   66    67    68    35.00000  109.50000
   66    67    69    35.00000  109.50000
   66    67    70    35.00000  109.50000
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    33.00000  107.80000
   52    47    51    70.00000  120.00000
   48    45    47    70.00000  120.00000
   48    54    55    35.00000  109.50000
   48    54    56    35.00000  109.50000
   48    54    57    35.00000  109.50000
   56    54    55    33.00000  107.80000
   57    54    55    33.00000  107.80000
   57    54    56    33.00000  107.80000
   39    33    34    35.00000  109.50000
   39    33    38    70.00000  112.99600
   39    43    44    65.00000  137.10300
   39    43    46    80.00000  120.01400
   43    39    40    40.00000  120.50800
   43    46    49    90.00000  111.18400
   46    43    44    65.00000  121.00000
   46    49    50    35.00000  109.50000
   46    49    58    85.00000  109.63000
   46    49    61    85.00000  109.63000
   49    58    59    70.00000  117.00000
   49    58    60    70.00000  117.00000
   49    61    62    70.00000  117.00000
   49    61    63    70.00000  117.00000
   58    49    50    35.00000  109.50000
   60    58    59    80.00000  126.00000
   61    49    50    35.00000  109.50000
   61    49    58    75.00000  103.47400
   63    61    62    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    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    64  -0.16000  1.0 1.0
   29    33    38    64  -0.03200 -1.0 2.0
   29    33    38    64   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    64    51   3.62500 -1.0 2.0
   33    38    64    65   3.62500 -1.0 2.0
   33    39    43    44   7.00000 -1.0 2.0
   33    39    43    46   7.00000 -1.0 2.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    64   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    47   3.62500 -1.0 2.0
   38    41    45    48   3.62500 -1.0 2.0
   41    38    64    51   3.62500 -1.0 2.0
   41    38    64    65   3.62500 -1.0 2.0
   41    45   -47    51   3.62500 -1.0 2.0
   41    45    47    52   3.62500 -1.0 2.0
   41    45    48    54   1.63200 -1.0 2.0
   42    41    45    47   3.62500 -1.0 2.0
   42    41    45    48   3.62500 -1.0 2.0
   45    47    51    64   3.62500 -1.0 2.0
   45    47    51    66   3.62500 -1.0 2.0
   45    47    52    53   0.84100 -1.0 2.0
   45    48    54    55   0.08050  1.0 3.0
   45    48    54    56   0.08050  1.0 3.0
   45    48    54    57   0.08050  1.0 3.0
   47    45    48    54   1.63200 -1.0 2.0
   47    51   -64    38   3.62500 -1.0 2.0
   47    51    64    65   3.62500 -1.0 2.0
   47    51    66    67   1.63200 -1.0 2.0
   51    47    52    53   0.84100 -1.0 2.0
   51    66    67    68   0.08050  1.0 3.0
   51    66    67    69   0.08050  1.0 3.0
   51    66    67    70   0.08050  1.0 3.0
   64    38    41    42   3.62500 -1.0 2.0
   64    38   -41    45   3.62500 -1.0 2.0
   64    51    66    67   1.63200 -1.0 2.0
   66    51    64    38   3.62500 -1.0 2.0
   66    51    64    65   3.62500 -1.0 2.0
   52    47    51    64   3.62500 -1.0 2.0
   52    47    51    66   3.62500 -1.0 2.0
   48    45    47    51   3.62500 -1.0 2.0
   48    45    47    52   3.62500 -1.0 2.0
   39    33    38    41   0.18050 -1.0 2.0
   39    33    38    64   0.18050 -1.0 2.0
   39    43    46    49  -2.26850  1.0 1.0
   39    43    46    49   3.39050 -1.0 2.0
   40    39    43    44   7.00000 -1.0 2.0
   40    39    43    46   7.00000 -1.0 2.0
   43    46    49    50   0.08050  1.0 3.0
   43    46    49    58  -0.48150  1.0 1.0
   43    46    49    58   0.09250 -1.0 2.0
   43    46    49    58  -0.12850  1.0 3.0
   43    46    49    61  -0.48150  1.0 1.0
   43    46    49    61   0.09250 -1.0 2.0
   43    46    49    61  -0.12850  1.0 3.0
   44    43    46    49   2.00000 -1.0 2.0
   46    49    58    59   0.30150 -1.0 2.0
   46    49    58    60   0.30150 -1.0 2.0
   46    49    61    62   0.30150 -1.0 2.0
   46    49    61    63   0.30150 -1.0 2.0
   50    49    58    59   0.00000  1.0 1.0
   50    49    58    60   0.00000  1.0 1.0
   50    49    61    62   0.00000  1.0 1.0
   50    49    61    63   0.00000  1.0 1.0
   58    49    61    62   0.30150 -1.0 2.0
   58    49    61    63   0.30150 -1.0 2.0
   61    49    58    59   0.30150 -1.0 2.0
   61    49    58    60   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    64    38    33   4.00000 -1.0 2.0
   45    42    41    38   1.10000 -1.0 2.0
   47    48    45    41   4.00000 -1.0 2.0
   51    52    47    45   4.00000 -1.0 2.0
   64    66    51    47   4.00000 -1.0 2.0
   51    65    64    38   1.10000 -1.0 2.0
   33    40    39    43  15.00000 -1.0 2.0
   44    46    43    39  15.00000 -1.0 2.0
   59    49    58    60  10.50000 -1.0 2.0
   62    49    61    63  10.50000 -1.0 2.0
END
