* LIGAND DATABASE FILE (OPLS2005)
*
001      72    75    130    220     386
    1     0 S   NP   _N1_     1    29.28634    95.17242   -18.62011
    2     1 S   H    _HN1     2     1.02841    42.75191   139.97496
    3     1 S   H    _H1_     3     1.02783    70.40168   -70.20137
    4     1 S   H    _H2_     4     1.02962   100.15272    35.72230
    5     1 S   CT   _CA1     5     1.50074   145.66550  -171.12405
    6     5 S   HC   _HA1     6     1.09570   105.32798    26.13037
    7     5 S   CO3  _C1_     7     1.53825   112.23818   -94.24521
    8     7 S   O2Z  _O11     8     1.26354   115.06979   -48.58618
    9     7 S   O2Z  _O12     9     1.26236   114.93581   130.83940
   10     5 S   CT   _CB1    10     1.53103   107.44814   144.06800
   11    10 S   HC   HB11    11     1.09815   109.51280   -50.71896
   12    10 S   HC   HB12    12     1.09832   110.37269    65.85128
   13    10 S   CT   _CG1    13     1.53002   112.57876  -171.87414
   14    13 S   HC   HG11    14     1.09498   110.31994   -57.32308
   15    13 S   HC   HG12    15     1.09612   110.24416    61.66364
   16    13 S   C    _CD1    16     1.51779   111.90764  -178.31681
   17    16 S   O    _OE1    17     1.22745   123.00721   -19.75462
   18    16 S   N    _N2_    18     1.38527   111.87679   161.29008
   19    18 S   H    _HN2    19     1.01597   119.06540     0.61739
   20    18 S   CT1  _CA2    20     1.46201   123.46479  -178.47428
   21    20 S   HC   _HA2    21     1.09729   109.42413   -15.95800
   22    20 S   C    _C2_    22     1.53411   108.09472  -131.65679
   23    22 S   O    _O2_    23     1.23004   122.31385  -144.92583
   24    20 S   CT   _CB2    32     1.53522   111.25208   106.34364
   25    24 S   HC   HB21    33     1.09350   109.26455    54.42785
   26    24 S   HC   HB22    34     1.09510   110.22931   172.50171
   27    22 S   N    _N3_    24     1.38531   113.29767    42.40751
   28    27 S   H    _HN3    25     1.01531   118.92439    -0.48497
   29    24 S   S    _SG2    35     1.83317   111.52945   -69.01078
   30    27 S   CT   _CA3    26     1.45449   123.38995   175.08418
   31    30 S   HC   HA31    27     1.09528   109.14986    25.82886
   32    30 S   HC   HA32    28     1.09492   107.13470   142.83299
   33    29 S   CT   _C24    36     1.89329   102.99377   145.40730
   34    30 S   CO3  _C3_    29     1.52940   113.21204   -97.57980
   35    34 S   O2Z  _O31    30     1.26395   115.45837   -42.73885
   36    34 S   O2Z  _O32    31     1.26363   114.94133   138.19551
   37    33 S   CA   _C20    37     1.55075   109.80667   177.83228
   38    33 S   CA   _C21    48     1.52831   108.15395   -59.25435
   39    33 S   CT   _C23    60     1.58713   111.14007    52.19429
   40    39 S   HC   _H38    61     1.09854   110.40121   -19.79996
   41    37 S   CA   _C15    38     1.41076   121.28405   -40.61868
   42    41 S   HA   _H35    39     1.08724   121.05758     0.71052
   43    38 S   CA   _C17    49     1.39244   128.20922   -55.00224
   44    43 S   HA   _H37    50     1.08589   121.24393     1.56923
   45    39 S   CA   _C19    62     1.51468   118.09393   102.97271
   46    41 S   CA   _C9_    40     1.39831   121.65730  -178.09577
   47    46 S   HA   _H29    41     1.08634   119.82310  -179.88636
   48    43 S   CA   _C11    51     1.39873   119.00457  -177.59678
   49    48 S   HA   _H31    52     1.08718   119.68724   179.90309
   50    45 S   CA   _C13    63     1.40430   119.13873   -93.02927
   51    50 S   HA   _H33    64     1.08762   120.33940    -1.01336
   52    46 S   CA   _C5_    42     1.38950   120.16672     0.60458
   53    52 S   HA   _H25    43     1.08575   120.21324   179.86012
   54    48 S   CA   _C6_    53     1.40317   120.75055     0.42104
   55    54 S   HA   _H26    54     1.08676   119.59908   179.83214
   56    50 S   CA   _C7_    65     1.39593   120.77896   178.64044
   57    56 S   HA   _H27    66     1.08623   119.93927  -179.96574
   58    52 S   CA   _C10    44     1.38983   119.57273     0.48859
   59    58 S   HA   _H30    45     1.08649   119.94385   179.13317
   60    54 S   CA   _C12    55     1.39387   120.49518     0.06853
   61    60 S   HA   _H32    56     1.08431   120.80568   179.93744
   62    56 S   CA   _C4_    67     1.39252   120.05831    -0.12972
   63    62 S   HA   _H24    68     1.08605   120.06849  -179.89532
   64    37 S   CA   _C16    46     1.40976   121.85036   143.16307
   65    64 S   HA   _H36    47     1.08669   121.44871    -1.04268
   66    38 S   CA   _C18    57     1.39202   112.71490   127.92564
   67    62 S   CA   _C8_    69     1.39270   119.87924    -0.01978
   68    67 S   HA   _H28    70     1.08629   119.98028  -179.77186
   69    66 S   CO4  _C22    58     1.45387   109.04966    -2.67562
   70    69 S   O    _O22    59     1.21860   123.25820   175.79104
   71    45 S   CA   _C14    71     1.40357   122.39100    85.32140
   72    71 S   HA   _H34    72     1.08709   120.76369     0.91279
  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  11   5   4   3
  20   2   1   1  16  15  15   6   8   4   8   4  12   6   3   6
   3   9   4   5   3   5   3   6   3   3   2   4   2   5   3   1
   1   2   3   2   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    41    64    38    43    66    69    39    40    45  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    41    42    46    58    64    65    38    43    44    48    60    66    69    70    39    40    45    50    71  
   35    36  
   36  
    0  
   41    42    46    47    52    58    59    64    65    38    43    66    69    39    40    45  
   43    44    48    49    54    60    61    66    69    70    39    40    45    41    64  
   40    45    50    51    56    67    71    72    41    43    60    64    66    69    70  
   45    50    71    66    69    70  
   42    46    47    52    53    58    64    65  
   46    47    52    64  
   44    48    49    54    55    60    66    69  
   48    49    54    66  
   50    51    56    57    62    67    68    71    72    66    69    70  
   47    52    53    58    59    64  
   52    53    58  
   49    54    55    60    61    66  
   54    55    60  
   51    56    57    62    63    67    71    72    69  
   56    57    62    71  
   53    58    59    64    65  
   58    59    64  
   55    60    61    66    69  
   60    61    66  
   57    62    63    67    68    71  
   62    63    67  
   59    64    65  
   64    65  
   61    66    69    70  
   66    69  
   63    67    68    71    72  
   67    68    71  
   65  
    0  
   69    70  
   68    71    72  
   71    72  
   70    71  
    0  
   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   0.397500   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   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5000   0.0660   0.055000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.060000   1.3810   1.2100   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   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   44   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   45   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   46   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   47   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   48   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   50   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   51   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   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   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   55   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   56   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   57   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   58   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   59   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   60   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   61   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   62   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   63   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   64   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   65   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   66   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   67   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   68   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   69   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   70   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   71   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   72   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   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    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    39   268.000  1.529
   37    41   469.000  1.400
   37    64   469.000  1.400
   41    42   367.000  1.080
   41    46   469.000  1.400
   46    47   367.000  1.080
   46    52   469.000  1.400
   52    53   367.000  1.080
   52    58   469.000  1.400
   58    59   367.000  1.080
   58    64   469.000  1.400
   64    65   367.000  1.080
   38    43   469.000  1.400
   38    66   469.000  1.400
   43    44   367.000  1.080
   43    48   469.000  1.400
   48    49   367.000  1.080
   48    54   469.000  1.400
   54    55   367.000  1.080
   54    60   469.000  1.400
   60    61   367.000  1.080
   60    66   469.000  1.400
   66    69   310.000  1.470
   69    70   570.000  1.229
   69    39   317.000  1.522
   39    40   340.000  1.090
   39    45   317.000  1.510
   45    50   469.000  1.400
   45    71   469.000  1.400
   50    51   367.000  1.080
   50    56   469.000  1.400
   56    57   367.000  1.080
   56    62   469.000  1.400
   62    63   367.000  1.080
   62    67   469.000  1.400
   67    68   367.000  1.080
   67    71   469.000  1.400
   71    72   367.000  1.080
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    80.00000  109.48900
   29    33    39    75.00000  111.63000
   33    37    41    70.00000  120.00000
   33    37    64    70.00000  120.00000
   33    38    43    70.00000  120.00000
   33    38    66    70.00000  120.00000
   33    39    69    63.00000  111.10000
   33    39    40    37.50000  110.70000
   33    39    45    70.00000  112.17500
   37    41    42    35.00000  120.00000
   37    41    46    63.00000  120.00000
   37    64    58    63.00000  120.00000
   37    64    65    35.00000  120.00000
   41    46    47    35.00000  120.00000
   41    46    52    63.00000  120.00000
   46    41    42    35.00000  120.00000
   46    52    53    35.00000  120.00000
   46    52    58    63.00000  120.00000
   52    46    47    35.00000  120.00000
   52    58    59    35.00000  120.00000
   52    58    64    63.00000  120.00000
   58    52    53    35.00000  120.00000
   58    64    65    35.00000  120.00000
   64    37    41    63.00000  120.00000
   64    58    59    35.00000  120.00000
   38    33    37    70.00000  112.04700
   38    43    44    35.00000  120.00000
   38    43    48    63.00000  120.00000
   38    66    60    63.00000  120.00000
   38    66    69    60.00000  119.52600
   43    48    49    35.00000  120.00000
   43    48    54    63.00000  120.00000
   48    43    44    35.00000  120.00000
   48    54    55    35.00000  120.00000
   48    54    60    63.00000  120.00000
   54    48    49    35.00000  120.00000
   54    60    61    35.00000  120.00000
   54    60    66    63.00000  120.00000
   60    54    55    35.00000  120.00000
   60    66    69    60.00000  119.52600
   66    38    43    63.00000  120.00000
   66    60    61    35.00000  120.00000
   66    69    70    75.00000  123.78400
   66    69    39    65.00000  115.47100
   69    39    40    35.00000  109.50000
   69    39    45    70.00000  110.93000
   39    33    37    70.00000  112.17500
   39    33    38    70.00000  112.17500
   39    69    70    80.00000  120.40000
   39    45    50    70.00000  120.00000
   39    45    71    70.00000  120.00000
   45    39    40    35.00000  109.50000
   45    50    51    35.00000  120.00000
   45    50    56    63.00000  120.00000
   45    71    67    63.00000  120.00000
   45    71    72    35.00000  120.00000
   50    56    57    35.00000  120.00000
   50    56    62    63.00000  120.00000
   56    50    51    35.00000  120.00000
   56    62    63    35.00000  120.00000
   56    62    67    63.00000  120.00000
   62    56    57    35.00000  120.00000
   62    67    68    35.00000  120.00000
   62    67    71    63.00000  120.00000
   67    62    63    35.00000  120.00000
   67    71    72    35.00000  120.00000
   71    45    50    63.00000  120.00000
   71    67    68    35.00000  120.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37  -0.23050  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  -0.23050  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   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   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    41  -0.16000  1.0 1.0
   29    33    37    41  -0.03200 -1.0 2.0
   29    33    37    41   0.04500  1.0 3.0
   29    33    37    64  -0.16000  1.0 1.0
   29    33    37    64  -0.03200 -1.0 2.0
   29    33    37    64   0.04500  1.0 3.0
   29    33    38    43  -0.16000  1.0 1.0
   29    33    38    43  -0.03200 -1.0 2.0
   29    33    38    43   0.04500  1.0 3.0
   29    33    38    66  -0.16000  1.0 1.0
   29    33    38    66  -0.03200 -1.0 2.0
   29    33    38    66   0.04500  1.0 3.0
   29    33    39    69   0.56750  1.0 1.0
   29    33    39    69  -0.07550 -1.0 2.0
   29    33    39    69   0.20000  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    45   0.56750  1.0 1.0
   29    33    39    45  -0.07550 -1.0 2.0
   29    33    39    45   0.20000  1.0 3.0
   33    37    41    42   3.62500 -1.0 2.0
   33    37    41    46   3.62500 -1.0 2.0
   33    37    64    58   3.62500 -1.0 2.0
   33    37    64    65   3.62500 -1.0 2.0
   33    38    43    44   3.62500 -1.0 2.0
   33    38    43    48   3.62500 -1.0 2.0
   33    38    66    60   3.62500 -1.0 2.0
   33    38   -66    69   3.62500 -1.0 2.0
   33    39    45    50   0.04150 -1.0 2.0
   33    39    45    71   0.04150 -1.0 2.0
   37    33    38    43   0.04300 -1.0 2.0
   37    33    38    66   0.04300 -1.0 2.0
   37    33    39    69   0.56750  1.0 1.0
   37    33    39    69  -0.07550 -1.0 2.0
   37    33    39    69   0.20000  1.0 3.0
   37    33    39    40   0.43200  1.0 3.0
   37    33    39    45  -0.94300  1.0 1.0
   37    33    39    45   1.32550 -1.0 2.0
   37    33    39    45  -0.07100  1.0 3.0
   37    41    46    47   3.62500 -1.0 2.0
   37    41    46    52   3.62500 -1.0 2.0
   41    37    64    58   3.62500 -1.0 2.0
   41    37    64    65   3.62500 -1.0 2.0
   41    46    52    53   3.62500 -1.0 2.0
   41    46   -52    58   3.62500 -1.0 2.0
   42    41    46    47   3.62500 -1.0 2.0
   42    41    46    52   3.62500 -1.0 2.0
   46    52    58    59   3.62500 -1.0 2.0
   46    52    58    64   3.62500 -1.0 2.0
   47    46    52    53   3.62500 -1.0 2.0
   47    46    52    58   3.62500 -1.0 2.0
   52    58   -64    37   3.62500 -1.0 2.0
   52    58    64    65   3.62500 -1.0 2.0
   53    52    58    59   3.62500 -1.0 2.0
   53    52    58    64   3.62500 -1.0 2.0
   59    58    64    37   3.62500 -1.0 2.0
   59    58    64    65   3.62500 -1.0 2.0
   64    37    41    42   3.62500 -1.0 2.0
   64    37   -41    46   3.62500 -1.0 2.0
   38    33    37    41   0.04300 -1.0 2.0
   38    33    37    64   0.04300 -1.0 2.0
   38    33   -39    69   0.56750  1.0 1.0
   38    33   -39    69  -0.07550 -1.0 2.0
   38    33   -39    69   0.20000  1.0 3.0
   38    33    39    40   0.43200  1.0 3.0
   38    33    39    45  -0.94300  1.0 1.0
   38    33    39    45   1.32550 -1.0 2.0
   38    33    39    45  -0.07100  1.0 3.0
   38    43    48    49   3.62500 -1.0 2.0
   38    43    48    54   3.62500 -1.0 2.0
   38    66    69    70   1.05000 -1.0 2.0
   38    66   -69    39   2.26350  1.0 1.0
   38    66   -69    39   0.76750 -1.0 2.0
   38    66   -69    39   0.22500  1.0 3.0
   43    38    66    60   3.62500 -1.0 2.0
   43    38    66    69   3.62500 -1.0 2.0
   43    48    54    55   3.62500 -1.0 2.0
   43    48   -54    60   3.62500 -1.0 2.0
   44    43    48    49   3.62500 -1.0 2.0
   44    43    48    54   3.62500 -1.0 2.0
   48    54    60    61   3.62500 -1.0 2.0
   48    54    60    66   3.62500 -1.0 2.0
   49    48    54    55   3.62500 -1.0 2.0
   49    48    54    60   3.62500 -1.0 2.0
   54    60   -66    38   3.62500 -1.0 2.0
   54    60    66    69   3.62500 -1.0 2.0
   55    54    60    61   3.62500 -1.0 2.0
   55    54    60    66   3.62500 -1.0 2.0
   60    66    69    70   1.05000 -1.0 2.0
   60    66    69    39   2.26350  1.0 1.0
   60    66    69    39   0.76750 -1.0 2.0
   60    66    69    39   0.22500  1.0 3.0
   61    60    66    38   3.62500 -1.0 2.0
   61    60    66    69   3.62500 -1.0 2.0
   66    38    43    44   3.62500 -1.0 2.0
   66    38   -43    48   3.62500 -1.0 2.0
   66    69   -39    33   0.05850 -1.0 2.0
   66    69   -39    33   0.17250  1.0 3.0
   66    69    39    40   0.00000  1.0 1.0
   66    69    39    45   0.65300  1.0 1.0
   66    69    39    45  -0.03850 -1.0 2.0
   66    69    39    45   0.33900  1.0 3.0
   69    39    45    50   0.04300 -1.0 2.0
   69    39    45    71   0.04300 -1.0 2.0
   70    69    39    33   0.30150 -1.0 2.0
   70    69    39    40   0.00000  1.0 1.0
   70    69    39    45   0.30150 -1.0 2.0
   39    33    37    41   0.04150 -1.0 2.0
   39    33    37    64   0.04150 -1.0 2.0
   39    33    38    43   0.04150 -1.0 2.0
   39    33   -38    66   0.04150 -1.0 2.0
   39    45    50    51   3.62500 -1.0 2.0
   39    45    50    56   3.62500 -1.0 2.0
   39    45    71    67   3.62500 -1.0 2.0
   39    45    71    72   3.62500 -1.0 2.0
   40    39    45    50   0.00000  1.0 1.0
   40    39    45    71   0.00000  1.0 1.0
   45    50    56    57   3.62500 -1.0 2.0
   45    50    56    62   3.62500 -1.0 2.0
   50    45    71    67   3.62500 -1.0 2.0
   50    45    71    72   3.62500 -1.0 2.0
   50    56    62    63   3.62500 -1.0 2.0
   50    56   -62    67   3.62500 -1.0 2.0
   51    50    56    57   3.62500 -1.0 2.0
   51    50    56    62   3.62500 -1.0 2.0
   56    62    67    68   3.62500 -1.0 2.0
   56    62    67    71   3.62500 -1.0 2.0
   57    56    62    63   3.62500 -1.0 2.0
   57    56    62    67   3.62500 -1.0 2.0
   62    67   -71    45   3.62500 -1.0 2.0
   62    67    71    72   3.62500 -1.0 2.0
   63    62    67    68   3.62500 -1.0 2.0
   63    62    67    71   3.62500 -1.0 2.0
   68    67    71    45   3.62500 -1.0 2.0
   68    67    71    72   3.62500 -1.0 2.0
   71    45    50    51   3.62500 -1.0 2.0
   71    45   -50    56   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
   41    64    37    33   4.00000 -1.0 2.0
   46    42    41    37   1.10000 -1.0 2.0
   52    47    46    41   1.10000 -1.0 2.0
   58    53    52    46   1.10000 -1.0 2.0
   64    59    58    52   1.10000 -1.0 2.0
   58    65    64    37   1.10000 -1.0 2.0
   43    66    38    33   4.00000 -1.0 2.0
   48    44    43    38   1.10000 -1.0 2.0
   54    49    48    43   1.10000 -1.0 2.0
   60    55    54    48   1.10000 -1.0 2.0
   66    61    60    54   1.10000 -1.0 2.0
   60    69    66    38   4.00000 -1.0 2.0
   66    39    69    70  10.50000 -1.0 2.0
   50    71    45    39   4.00000 -1.0 2.0
   56    51    50    45   1.10000 -1.0 2.0
   62    57    56    50   1.10000 -1.0 2.0
   67    63    62    56   1.10000 -1.0 2.0
   71    68    67    62   1.10000 -1.0 2.0
   67    72    71    45   1.10000 -1.0 2.0
END
