* LIGAND DATABASE FILE (OPLS2005)
*
001      74    76    135    218     394
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02115    72.24516   -94.02273
    3     1 S   H    _H1_     3     1.02140   103.00838    11.71568
    4     1 S   H    _H2_     4     1.02072    41.41937   115.35385
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.05972   107.41041    47.01581
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34015   114.76575   162.47883
   19    18 S   H    _HN2    19     1.04724   118.98282     8.58904
   20    18 S   CT1  _CA2    20     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    21     1.08448   106.40438   -11.12153
   22    20 S   C    _C2_    22     1.54037   112.60135  -130.27230
   23    22 S   O    _O2_    23     1.23085   119.01196  -169.64989
   24    20 S   CT   _CB2    32     1.54652   109.46586   105.32505
   25    24 S   HC   HB21    33     1.08733   110.25787    59.12705
   26    24 S   HC   HB22    34     1.08755   109.66015   178.75008
   27    22 S   N    _N3_    24     1.34263   118.97450    10.45203
   28    27 S   H    _HN3    25     1.03492   120.05970     5.06895
   29    24 S   S    _SG2    35     1.81647   112.43692   -61.22030
   30    27 S   CT   _CA3    26     1.46098   124.53040  -172.10347
   31    30 S   HC   HA31    27     1.12298   109.15732    14.31073
   32    30 S   HC   HA32    28     1.12301   109.23063   127.81991
   33    29 S   CT   _C16    36     1.84370    98.14351  -178.19398
   34    33 S   Cl   _CL1    37     1.81649   106.11959    62.87506
   35    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   36    35 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   37    35 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   38    33 S   CT   _C14    38     1.54798   108.65454  -180.00000
   39    38 S   HC   _H13    39     1.09615   110.74087   -58.45917
   40    38 S   HC   _H14    40     1.09590   110.87160    60.15492
   41    38 S   S    _S1_    41     1.83769   114.27579  -178.78905
   42    41 S   C4T  _C15    42     1.81907    96.25027   -56.46046
   43    42 S   HC   _H15    43     1.09430   115.17937   -77.98626
   44    42 S   C4T  _C12    44     1.54613   114.30876   145.71552
   45    44 S   HC   _H12    45     1.09631   113.32662   134.83475
   46    42 S   N4   _N6_    48     1.45526   109.37395    50.55237
   47    44 S   C4   _C13    46     1.54716    85.70709  -112.58996
   48    47 S   O    _O33    47     1.20908   136.46043  -179.23459
   49    33 S   CT1  _C17    49     1.54404   110.56273   -54.41990
   50    49 S   HC   _H16    50     1.09706   111.70908    71.64680
   51    44 S   N    _N5_    55     1.46193   119.03184     2.27331
   52    51 S   H    _H11    56     1.00776   116.54798   -76.10988
   53    49 S   C    _C18    51     1.50231   115.12954   -50.82989
   54    53 S   OC3  _O3_    52     1.22143   125.02538   -55.10181
   55    51 S   C    _C5_    57     1.37948   122.69198   103.78269
   56    55 S   O    _O1_    58     1.22936   125.55923     0.06256
   57    53 S   OH   _O4_    53     1.35480   110.67735   125.04851
   58    57 S   HO   _H17    54     0.98106   111.91322   179.87967
   59    55 S   CT1  _C4_    59     1.52371   111.54335  -177.93322
   60    59 S   HC   _H5_    60     1.09706   108.91886   -31.97190
   61    59 S   NT   _N4_    61     1.44235   108.20834  -145.96257
   62    61 S   H    _H3_    62     1.00582   118.95441  -160.39530
   63    61 S   H    _H4_    63     1.00552   118.94018    33.01193
   64    59 S   CA   _C11    64     1.51131   111.74555    90.35587
   65    64 S   CA   _C9_    65     1.39526   120.05500   -90.02301
   66    65 S   HA   _H9_    66     1.08704   120.49743     0.03956
   67    65 S   CA   _C7_    67     1.39427   120.00282  -179.94766
   68    67 S   HA   _H7_    68     1.08628   119.96116   180.00000
   69    67 S   CA   _C6_    69     1.39478   120.03085    -0.02798
   70    69 S   HA   _H6_    70     1.08592   120.04676   179.94766
   71    69 S   CA   _C8_    71     1.39526   119.96642     0.01978
   72    71 S   HA   _H8_    72     1.08631   120.02278   179.89347
   73    64 S   CA   _C10    73     1.39481   119.94353    90.05774
   74    73 S   HA   _H10    74     1.08634   120.54200    -0.04423
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  10   5   4   3
  13   8   2   1   1  10   4   3   8  12   6  10   6   8   7   2
   5   3   7   3   3   2   9   4   1   1  11   6   5   2   1   9
   8   4   6   3   5   3   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    49    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    41    46    49    50    53  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    47    46    49    50    53    54    57  
   38    39    40    41    46    49    50    53  
   36    37  
   37  
    0  
   39    40    41    42    43    44    46    49    50    53  
   40    41    42    49  
   41    42    49  
   42    43    44    45    47    46    49    51  
   43    44    45    47    48    46    49    50    53    51    52    55  
   44    45    47    46    49    51  
   45    47    48    46    49    51    52    55    56    59  
   47    48    46    51    52    55  
   49    50    53    54    57    51    47    48  
   48    49    50    53    51    52    55  
   49    51  
   50    53    54    57    58  
   53    54    57  
   52    55    56    59    60    61    64  
   55    56    59  
   54    57    58  
   57    58  
   56    59    60    61    62    63    64    65    73  
   59    60    61    64  
   58  
    0  
   60    61    62    63    64    65    66    67    71    73    74  
   61    62    63    64    65    73  
   62    63    64    65    73  
   63    64  
   64  
   65    66    67    68    69    71    72    73    74  
   66    67    68    69    70    71    73    74  
   67    68    69    73  
   68    69    70    71    72    73  
   69    70    71  
   70    71    72    73    74  
   71    72    73  
   72    73    74  
   73    74  
   74  
    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  -0.175000   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   0.207500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   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   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.6000   0.3550  -0.324000   2.0300   1.8000   0.025682759  -1.666211680
   42   3.5000   0.0660   0.219000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   44   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   46   3.2500   0.1700  -0.445000   1.8100   1.6000   0.054801302  -1.445846770
   47   3.7500   0.1050   0.629000   1.9250   1.7000   0.001000000  -0.126889456
   48   2.9600   0.2100  -0.506500   1.5250   1.4250   0.001000000  -1.480495490
   49   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   51   3.2500   0.1700  -0.500000   2.1120   1.8750   0.051222218  -2.220205820
   52   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   53   3.7500   0.1050   0.520000   2.1120   1.8750   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.440000   1.9750   1.7500   0.001000000  -0.126889456
   55   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   56   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   57   3.0000   0.1700  -0.530000   1.7660   1.5600   0.021068034  -0.322181743
   58   0.5000   0.0300   0.450000   0.9960   0.8600   0.030040813  -0.651083722
   59   3.5000   0.0660   0.278900   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.3000   0.1700  -0.943900   1.8650   1.6500   0.051222218  -2.220205820
   62   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   63   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   64   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   65   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   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   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   70   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   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
   73   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   74   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    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   245.000  1.781
   33    38   268.000  1.529
   33    49   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    41   222.000  1.810
   41    42   200.000  1.824
   42    43   340.000  1.090
   42    44   268.000  1.529
   42    46   305.000  1.456
   44    45   340.000  1.090
   44    47   250.000  1.540
   44    51   337.000  1.449
   47    48   930.000  1.212
   47    46   440.000  1.369
   46    49   337.000  1.449
   49    50   340.000  1.090
   49    53   317.000  1.522
   53    54   570.000  1.229
   53    57   450.000  1.364
   57    58   553.000  0.945
   51    52   434.000  1.010
   51    55   490.000  1.335
   55    56   570.000  1.229
   55    59   317.000  1.522
   59    60   340.000  1.090
   59    61   305.000  1.457
   59    64   275.000  1.474
   61    62   434.000  1.010
   61    63   434.000  1.010
   64    65   469.000  1.400
   64    73   469.000  1.400
   65    66   367.000  1.080
   65    67   469.000  1.400
   67    68   367.000  1.080
   67    69   469.000  1.400
   69    70   367.000  1.080
   69    71   469.000  1.400
   71    72   367.000  1.080
   71    73   469.000  1.400
   73    74   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    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    85.00000  110.65400
   29    33    38    75.00000  111.63000
   29    33    49    75.00000  108.68000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    41    75.00000  111.63000
   33    49    46    80.00000  109.70000
   33    49    50    37.50000  110.70000
   33    49    53    63.00000  111.10000
   38    33    34    69.00000  109.80000
   38    41    42    85.00000   99.86700
   40    38    39    33.00000  107.80000
   41    38    39    35.00000  109.50000
   41    38    40    35.00000  109.50000
   41    42    43    45.00000  109.41400
   41    42    44    65.00000  119.05700
   41    42    46    80.00000  108.62000
   42    44    45    37.50000  110.70000
   42    44    47   100.00000   86.36000
   42    44    51    80.00000  110.05700
   42    46    47   100.00000   93.00000
   42    46    49    50.00000  132.70000
   44    42    43    37.50000  110.70000
   44    47    48    60.00000  136.58000
   44    47    46    95.00000   92.72400
   44    51    52    38.00000  118.40000
   44    51    55    50.00000  121.90000
   47    44    45    40.00000  113.37500
   47    46    49    50.00000  132.10000
   46    42    43    50.00000  112.01000
   46    42    44   105.00000   87.49700
   46    47    48    75.00000  131.60000
   46    49    50    35.00000  109.50000
   46    49    53    63.00000  110.10000
   49    33    34    69.00000  109.80000
   49    33    38    58.35000  112.70000
   49    53    54    75.00000  119.65400
   49    53    57    80.00000  116.87500
   53    49    50    35.00000  109.50000
   53    57    58    35.00000  113.00000
   57    53    54    80.00000  121.00000
   51    44    45    50.00000  112.01000
   51    44    47    75.00000  110.24000
   51    55    56    80.00000  122.90000
   51    55    59    70.00000  116.60000
   55    51    52    35.00000  119.80000
   55    59    60    35.00000  109.50000
   55    59    61    75.00000  111.54000
   55    59    64    70.00000  102.60000
   59    55    56    80.00000  120.40000
   59    61    62    50.00000  111.55300
   59    61    63    50.00000  111.55300
   59    64    65    60.00000  125.54000
   59    64    73    60.00000  125.54000
   61    59    60    50.00000  109.55000
   63    61    62    43.60000  106.40000
   64    59    60    45.00000  110.88000
   64    59    61    75.00000  112.33000
   64    65    66    35.00000  120.00000
   64    65    67    63.00000  120.00000
   64    73    71    63.00000  120.00000
   64    73    74    35.00000  120.00000
   65    67    68    35.00000  120.00000
   65    67    69    63.00000  120.00000
   67    65    66    35.00000  120.00000
   67    69    70    35.00000  120.00000
   67    69    71    63.00000  120.00000
   69    67    68    35.00000  120.00000
   69    71    72    35.00000  120.00000
   69    71    73    63.00000  120.00000
   71    69    70    35.00000  120.00000
   71    73    74    35.00000  120.00000
   73    64    65    63.00000  120.00000
   73    71    72    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    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   0.01700  1.0 1.0
   24    29    33    34  -0.23550 -1.0 2.0
   24    29    33    34   0.21350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    49   0.01700  1.0 1.0
   24    29    33    49  -0.23550 -1.0 2.0
   24    29    33    49   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    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.56750  1.0 1.0
   29    33    38    41  -0.07550 -1.0 2.0
   29    33    38    41   0.20000  1.0 3.0
   29    33    49    46   0.71400  1.0 1.0
   29    33    49    46   0.04300 -1.0 2.0
   29    33    49    46   0.01450  1.0 3.0
   29    33    49    50   0.15000  1.0 3.0
   29    33    49    53  -2.17200  1.0 1.0
   29    33    49    53  -0.85700 -1.0 2.0
   33    38    41    42  -0.25000 -1.0 2.0
   33    38    41    42  -0.01800  1.0 3.0
   33    49    53    54   0.27300 -1.0 2.0
   33    49    53    57   0.50000  1.0 1.0
   33    49    53    57   0.27300 -1.0 2.0
   33    49    53    57   0.22500  1.0 3.0
   34    33    38    39   0.27000  1.0 3.0
   34    33    38    40   0.27000  1.0 3.0
   34    33    38    41   0.56750  1.0 1.0
   34    33    38    41  -0.07550 -1.0 2.0
   34    33    38    41   0.20000  1.0 3.0
   34    33    49    46   0.56750  1.0 1.0
   34    33    49    46  -0.07550 -1.0 2.0
   34    33    49    46   0.20000  1.0 3.0
   34    33    49    50   0.27000  1.0 3.0
   34    33    49    53   0.56750  1.0 1.0
   34    33    49    53  -0.07550 -1.0 2.0
   34    33    49    53   0.20000  1.0 3.0
   38    33    49    46   0.42250  1.0 1.0
   38    33    49    46  -0.48100 -1.0 2.0
   38    33    49    46   0.35650  1.0 3.0
   38    33    49    50   0.15000  1.0 3.0
   38    33    49    53  -0.84850  1.0 1.0
   38    33    49    53  -0.22800 -1.0 2.0
   38    33    49    53   0.29250  1.0 3.0
   38    41    42    43   0.00000  1.0 1.0
   38    41    42    44   0.25150  1.0 1.0
   38    41    42    44  -1.17200 -1.0 2.0
   38    41    42    44   0.53050  1.0 3.0
   38    41   -42    46   0.01700  1.0 1.0
   38    41   -42    46  -0.23550 -1.0 2.0
   38    41   -42    46   0.21350  1.0 3.0
   39    38    41    42   0.32350  1.0 3.0
   40    38    41    42   0.32350  1.0 3.0
   41    42    44    45   0.00000  1.0 1.0
   41    42    44    47   0.00000  1.0 1.0
   41    42    44    51   0.00000  1.0 1.0
   41    42   -46    47   0.00000  1.0 1.0
   41    42    46    49   0.00000  1.0 1.0
   42    44    47    48  -0.11250  1.0 1.0
   42    44    47    48   0.11400 -1.0 2.0
   42    44    47    48  -0.28950  1.0 3.0
   42    44   -47    46   3.00000 -1.0 2.0
   42    44    51    52   0.00000  1.0 1.0
   42    44    51    55  -0.43950  1.0 1.0
   42    44    51    55  -0.08100 -1.0 2.0
   42    44    51    55   0.03350  1.0 3.0
   42    46   -49    33   0.00000  1.0 1.0
   42    46    49    50   0.00000  1.0 1.0
   42    46    49    53   0.00000  1.0 1.0
   43    42    44    45   0.15000  1.0 3.0
   43    42    44    47   0.15000  1.0 3.0
   43    42    44    51   0.15000  1.0 3.0
   43    42   -46    47   0.00000  1.0 1.0
   43    42    46    49   0.00000  1.0 1.0
   44    42   -46    47   0.00000  1.0 1.0
   44    42    46    49   0.00000  1.0 1.0
   44    47   -46    42   3.00000 -1.0 2.0
   44    47   -46    49   3.00000 -1.0 2.0
   44    51    55    56   3.04450 -1.0 2.0
   44    51    55    59   1.15000  1.0 1.0
   44    51    55    59   3.04450 -1.0 2.0
   45    44    47    48   0.00000  1.0 1.0
   45    44    47    46   0.00000  1.0 1.0
   45    44    51    52   0.00000  1.0 1.0
   45    44    51    55   0.00000  1.0 1.0
   47    44    51    52   0.00000  1.0 1.0
   47    44    51    55  -0.42300  1.0 1.0
   47    44    51    55  -0.07000 -1.0 2.0
   47    44    51    55   0.04150  1.0 3.0
   47    46    49    33   0.00000  1.0 1.0
   47    46    49    50   0.00000  1.0 1.0
   47    46    49    53   0.00000  1.0 1.0
   48    47   -46    42   3.00000 -1.0 2.0
   48    47    46    49   3.00000 -1.0 2.0
   46    42   -44    45   0.15000  1.0 3.0
   46    42   -44    47   3.00000 -1.0 2.0
   46    42    44    51   2.20050  1.0 1.0
   46    42    44    51   0.63450 -1.0 2.0
   46    42    44    51  -0.91300  1.0 3.0
   46    49    53    54   0.00000  1.0 1.0
   46    49    53    57   0.40000  1.0 3.0
   49    33    38    39   0.15000  1.0 3.0
   49    33    38    40   0.15000  1.0 3.0
   49    33   -38    41   0.44750  1.0 1.0
   49    33   -38    41  -0.17800 -1.0 2.0
   49    33   -38    41   0.20200  1.0 3.0
   49    53    57    58   1.50000  1.0 1.0
   49    53    57    58   2.45000 -1.0 2.0
   50    49    53    54   0.00000  1.0 1.0
   50    49    53    57   0.00000  1.0 1.0
   54    53    57    58   2.45000 -1.0 2.0
   51    44    47    48   0.30150 -1.0 2.0
   51    44   -47    46   0.00000  1.0 1.0
   51    55    59    60   0.00000  1.0 1.0
   51    55    59    61   0.00000  1.0 1.0
   51    55    59    64   0.00000  1.0 1.0
   52    51    55    56   2.45000 -1.0 2.0
   52    51    55    59   2.45000 -1.0 2.0
   55    59    61    62   0.21900  1.0 1.0
   55    59    61    62  -0.24900 -1.0 2.0
   55    59    61    62   0.15200  1.0 3.0
   55    59    61    63   0.21900  1.0 1.0
   55    59    61    63  -0.24900 -1.0 2.0
   55    59    61    63   0.15200  1.0 3.0
   55    59    64    65   0.04300 -1.0 2.0
   55    59    64    73   0.04300 -1.0 2.0
   56    55    59    60   0.00000  1.0 1.0
   56    55    59    61   0.30150 -1.0 2.0
   56    55    59    64   0.30150 -1.0 2.0
   59    64    65    66   3.62500 -1.0 2.0
   59    64    65    67   3.62500 -1.0 2.0
   59    64    73    71   3.62500 -1.0 2.0
   59    64    73    74   3.62500 -1.0 2.0
   60    59    61    62   0.20000  1.0 3.0
   60    59    61    63   0.20000  1.0 3.0
   60    59    64    65   0.00000  1.0 1.0
   60    59    64    73   0.00000  1.0 1.0
   61    59    64    65   0.18550 -1.0 2.0
   61    59    64    65   0.14000  1.0 3.0
   61    59    64    73   0.18550 -1.0 2.0
   61    59    64    73   0.14000  1.0 3.0
   64    59    61    62   0.76500  1.0 1.0
   64    59    61    62   0.05700 -1.0 2.0
   64    59    61    62  -0.90900  1.0 3.0
   64    59    61    63   0.76500  1.0 1.0
   64    59    61    63   0.05700 -1.0 2.0
   64    59    61    63  -0.90900  1.0 3.0
   64    65    67    68   3.62500 -1.0 2.0
   64    65    67    69   3.62500 -1.0 2.0
   65    64    73    71   3.62500 -1.0 2.0
   65    64    73    74   3.62500 -1.0 2.0
   65    67    69    70   3.62500 -1.0 2.0
   65    67   -69    71   3.62500 -1.0 2.0
   66    65    67    68   3.62500 -1.0 2.0
   66    65    67    69   3.62500 -1.0 2.0
   67    69    71    72   3.62500 -1.0 2.0
   67    69    71    73   3.62500 -1.0 2.0
   68    67    69    70   3.62500 -1.0 2.0
   68    67    69    71   3.62500 -1.0 2.0
   69    71   -73    64   3.62500 -1.0 2.0
   69    71    73    74   3.62500 -1.0 2.0
   70    69    71    72   3.62500 -1.0 2.0
   70    69    71    73   3.62500 -1.0 2.0
   72    71    73    64   3.62500 -1.0 2.0
   72    71    73    74   3.62500 -1.0 2.0
   73    64    65    66   3.62500 -1.0 2.0
   73    64   -65    67   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
   37    30    35    36  10.50000 -1.0 2.0
   44    46    47    48  10.50000 -1.0 2.0
   49    47    46    42   1.00000 -1.0 2.0
   49    57    53    54  10.50000 -1.0 2.0
   52    55    51    44   1.00000 -1.0 2.0
   51    59    55    56  10.50000 -1.0 2.0
   65    73    64    59   4.00000 -1.0 2.0
   67    66    65    64   1.10000 -1.0 2.0
   69    68    67    65   1.10000 -1.0 2.0
   71    70    69    67   1.10000 -1.0 2.0
   73    72    71    69   1.10000 -1.0 2.0
   71    74    73    64   1.10000 -1.0 2.0
END
