* LIGAND DATABASE FILE (OPLS2005)
*
001      74    77    143    230     422
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02068   103.00280   -40.25952
    3     1 S   H    _H1_     3     1.02066    72.13932    65.49100
    4     1 S   H    _H2_     4     1.02070    41.50916  -143.80805
    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     1.04748   118.84952     8.59078
   20    18 S   CT1  _CA2    20     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    21     1.08457   106.27517   -11.11459
   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     1.08519   110.61667    58.77943
   26    24 S   HC   HB22    34     1.08547   109.95733   179.17291
   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   _C19    36     1.85789    97.09698   161.86177
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CM   _C10    37     1.53089   110.52789   160.01119
   38    33 S   CT   _C15    67     1.55638   108.40782   -78.26390
   39    38 S   HC   _H33    68     1.09899   108.76751   147.65824
   40    38 S   HC   _H34    69     1.09875   110.71946    34.26827
   41    37 S   CMA  _C11    38     1.35969   122.50517  -100.31879
   42    41 S   OM   _O19    39     1.26421   131.00196  -178.65725
   43    37 S   CT   _C17    57     1.53990   116.11021    88.56875
   44    43 S   HC   _H36    58     1.09530   112.18258   177.56554
   45    41 S   CT   _C12    40     1.52586   118.74603    -3.74125
   46    45 S   HC   _H27    41     1.10017   111.37043   135.20144
   47    45 S   HC   _H28    42     1.10268   107.32754  -108.96321
   48    43 S   CT   _C13    59     1.53521   114.06988   -58.00415
   49    48 S   HC   _H29    60     1.09249   113.79165   -35.00846
   50    48 S   HC   _H30    61     1.09861   110.07492  -154.61714
   51    45 S   CT   _C16    43     1.53290   115.04341    12.02757
   52    51 S   HC   _H35    44     1.10597   109.83503    82.45295
   53    48 S   CT   _C14    62     1.53628   104.49625    88.77130
   54    53 S   HC   _H31    63     1.09800   108.83147   117.35377
   55    53 S   HC   _H32    64     1.09308   112.96535  -124.21634
   56    51 S   CA   _C9_    45     1.51600   111.40603  -160.48915
   57    33 S   OS   _O20    56     1.44096   110.01122    36.70635
   58    53 S   CT   _C18    65     1.53157   104.61229    -0.45067
   59    58 S   HC   _H37    66     1.09561   110.31879   148.16341
   60    56 S   CA   _C7_    46     1.39484   119.95090    90.01969
   61    60 S   HA   _H25    47     1.08651   120.53093     0.01978
   62    43 S   NT   _N18    70     1.47222   111.61716    53.26739
   63    60 S   CA   _C5_    48     1.39457   119.99846  -180.00000
   64    63 S   HA   _H23    49     1.08627   120.01750  -179.93744
   65    62 S   CT   _C20    71     1.45219   115.86873    60.03785
   66    65 S   HC   _H38    72     1.09377   110.09586  -180.00000
   67    65 S   HC   _H39    73     1.09341   110.21536    60.04676
   68    65 S   HC   _H40    74     1.09312   110.27322   -59.98589
   69    63 S   CA   _C4_    50     1.39520   120.02660    -0.01978
   70    69 S   HA   _H22    51     1.08598   120.04672  -179.91377
   71    69 S   CA   _C6_    52     1.39484   119.97493     0.00000
   72    71 S   HA   _H24    53     1.08616   120.03382  -179.98022
   73    56 S   CA   _C8_    54     1.39474   120.03885   -89.96010
   74    73 S   HA   _H26    55     1.08722   120.51786     0.01978
  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
  18   2   1   1  19  14   6   5  12   5  16   7   8   5   4   9
   6   5   9   4   6   4   3  10   3   6   2   8   4   4   6   3
   3   2   1   1   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    57    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    41    51    57    43    58    38    39    40  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    41    42    45    51    52    56    57    43    44    48    53    58    59    38    39    40    62  
   35    36  
   36  
    0  
   41    42    45    46    47    51    57    43    44    48    49    50    53    58    38    39    40    62    65  
   39    40    62    65    41    43    48    51    53    54    55    57    58    59  
   40    62    53    57    58    59  
   62    53    57    58    59  
   42    45    46    47    51    52    56    57    43    44    48    62  
   45    46    47    51    43  
   44    48    49    50    53    54    55    58    59    62    65    66    67    68    45    57  
   48    49    50    53    58    62    65  
   46    47    51    52    56    60    73    57  
   47    51    52    56    57  
   51    52    56    57  
   49    50    53    54    55    58    59    62    65  
   50    53    54    55    58    62  
   53    54    55    58    62  
   52    56    60    61    63    71    73    74    57  
   56    60    73    57  
   54    55    58    59    62    65  
   55    58    59    62  
   58    59    62  
   60    61    63    64    69    71    72    73    74    57  
   58    60    73  
   59    62    65    66    67    68  
   62    65  
   61    63    64    69    70    71    73    74  
   63    64    69    73  
   65    66    67    68  
   64    69    70    71    72    73  
   69    70    71  
   66    67    68  
   67    68  
   68  
    0  
   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  -0.316400   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   0.417900   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   0.0760  -0.670200   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660  -0.120000   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   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   43   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660   0.211800   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5500   0.0700  -0.041800   2.5000   1.7750   0.001000000  -0.843144165
   57   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   58   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   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   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
   63   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   64   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   65   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   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    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    57   320.000  1.410
   33    38   268.000  1.529
   37    41   465.000  1.376
   37    43   317.000  1.510
   41    42   745.000  1.250
   41    45   270.000  1.512
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    51   268.000  1.529
   51    52   340.000  1.090
   51    56   317.000  1.510
   51    57   320.000  1.410
   56    60   469.000  1.400
   56    73   469.000  1.400
   60    61   367.000  1.080
   60    63   469.000  1.400
   63    64   367.000  1.080
   63    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
   43    44   340.000  1.090
   43    48   268.000  1.529
   43    62   382.000  1.448
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    53   268.000  1.529
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    58   268.000  1.529
   58    59   340.000  1.090
   58    38   268.000  1.529
   58    62   382.000  1.448
   38    39   340.000  1.090
   38    40   340.000  1.090
   62    65   382.000  1.448
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   340.000  1.090
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    75.00000  112.20000
   29    33    57    85.00000  114.68000
   29    33    38    75.00000  111.63000
   33    37    41    70.00000  124.00000
   33    37    43    65.00000  117.92700
   33    57    51    60.00000  109.50000
   33    38    58    58.35000  112.70000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   37    41    42    65.00000  137.10300
   37    41    45    65.00000  122.18000
   37    43    44    35.00000  109.50000
   37    43    48    70.00000  112.02700
   37    43    62    75.00000  110.70900
   41    45    46    45.00000  110.52000
   41    45    47    45.00000  110.52000
   41    45    51    70.00000  112.02700
   45    41    42    85.00000  112.85300
   45    51    52    37.50000  110.70000
   45    51    56    70.00000  112.17500
   45    51    57    50.00000  109.50000
   47    45    46    33.00000  107.80000
   51    45    46    37.50000  110.70000
   51    45    47    37.50000  110.70000
   51    56    60    70.00000  120.00000
   51    56    73    70.00000  120.00000
   56    51    52    35.00000  109.50000
   56    60    61    35.00000  120.00000
   56    60    63    63.00000  120.00000
   56    73    71    63.00000  120.00000
   56    73    74    35.00000  120.00000
   60    63    64    35.00000  120.00000
   60    63    69    63.00000  120.00000
   63    60    61    35.00000  120.00000
   63    69    70    35.00000  120.00000
   63    69    71    63.00000  120.00000
   69    63    64    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    56    60    63.00000  120.00000
   73    71    72    35.00000  120.00000
   57    33    37    85.00000  110.90400
   57    51    52    35.00000  109.50000
   57    51    56    85.00000  111.85700
   43    37    41    70.00000  124.00000
   43    48    49    37.50000  110.70000
   43    48    50    37.50000  110.70000
   43    48    53    58.35000  112.70000
   43    62    58    51.80000  107.20000
   43    62    65    51.80000  107.20000
   48    43    44    37.50000  110.70000
   48    53    54    37.50000  110.70000
   48    53    55    37.50000  110.70000
   48    53    58    58.35000  112.70000
   50    48    49    33.00000  107.80000
   53    48    49    37.50000  110.70000
   53    48    50    37.50000  110.70000
   53    58    59    37.50000  110.70000
   53    58    38    58.35000  112.70000
   53    58    62    56.20000  109.47000
   55    53    54    33.00000  107.80000
   58    53    54    37.50000  110.70000
   58    53    55    37.50000  110.70000
   58    38    39    37.50000  110.70000
   58    38    40    37.50000  110.70000
   58    62    65    51.80000  107.20000
   38    33    37    70.00000  112.02700
   38    33    57    50.00000  109.50000
   38    58    59    37.50000  110.70000
   40    38    39    33.00000  107.80000
   62    43    44    35.00000  109.50000
   62    43    48    56.20000  109.47000
   62    58    59    35.00000  109.50000
   62    58    38    56.20000  109.47000
   62    65    66    35.00000  109.50000
   62    65    67    35.00000  109.50000
   62    65    68    35.00000  109.50000
   67    65    66    33.00000  107.80000
   68    65    66    33.00000  107.80000
   68    65    67    33.00000  107.80000
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  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    57   0.13850  1.0 1.0
   24    29    33    57  -1.34450 -1.0 2.0
   24    29    33    57   0.57400  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
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    41   0.42700  1.0 1.0
   29    33    37    41  -0.70350 -1.0 2.0
   29    33    37    41  -0.43150  1.0 3.0
   29    33    37    43   0.30250  1.0 1.0
   29    33    37    43  -0.14950 -1.0 2.0
   29    33    37    43   0.36900  1.0 3.0
   29    33    57    51   0.14700  1.0 1.0
   29    33    57    51  -1.16150 -1.0 2.0
   29    33    57    51   0.48700  1.0 3.0
   29    33    38    58   0.44750  1.0 1.0
   29    33    38    58  -0.17800 -1.0 2.0
   29    33    38    58   0.20200  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   33    37    41    42   7.00000 -1.0 2.0
   33    37    41    45   7.00000 -1.0 2.0
   33    37    43    44   0.34800  1.0 3.0
   33    37    43    48   0.46850  1.0 1.0
   33    37    43    48   0.08550 -1.0 2.0
   33    37    43    48   0.09800  1.0 3.0
   33    37    43    62   0.52100  1.0 1.0
   33    37    43    62  -0.20350 -1.0 2.0
   33    37    43    62   0.29750  1.0 3.0
   37    33    57    51  -0.77900  1.0 1.0
   37    33    57    51  -0.36900 -1.0 2.0
   37    33    57    51   0.40400  1.0 3.0
   37    33    38    58   0.34400  1.0 1.0
   37    33    38    58   0.09450 -1.0 2.0
   37    33    38    58   0.11100  1.0 3.0
   37    33    38    39   0.15000  1.0 3.0
   37    33    38    40   0.15000  1.0 3.0
   37    41    45    46   0.00000  1.0 1.0
   37    41    45    47   0.00000  1.0 1.0
   37    41   -45    51   0.09850  1.0 1.0
   37    41   -45    51   0.15250 -1.0 2.0
   37    41   -45    51  -0.50650  1.0 3.0
   37    43    48    49   0.15000  1.0 3.0
   37    43    48    50   0.15000  1.0 3.0
   37    43    48    53   0.34400  1.0 1.0
   37    43    48    53   0.09450 -1.0 2.0
   37    43    48    53   0.11100  1.0 3.0
   37    43   -62    58  -0.60800  1.0 1.0
   37    43   -62    58   1.10050 -1.0 2.0
   37    43   -62    58   0.47000  1.0 3.0
   37    43    62    65  -0.60800  1.0 1.0
   37    43    62    65   1.10050 -1.0 2.0
   37    43    62    65   0.47000  1.0 3.0
   41    37    43    44   0.00000  1.0 1.0
   41    37    43    48   0.09850  1.0 1.0
   41    37    43    48   0.15250 -1.0 2.0
   41    37    43    48  -0.50650  1.0 3.0
   41    37    43    62   0.90200  1.0 1.0
   41    37    43    62   0.57900 -1.0 2.0
   41    37    43    62  -0.62100  1.0 3.0
   41    45    51    52   0.15000  1.0 3.0
   41    45    51    56   0.21200  1.0 1.0
   41    45    51    56   0.16900 -1.0 2.0
   41    45    51    56  -1.15100  1.0 3.0
   41    45    51    57   0.61850  1.0 1.0
   41    45    51    57  -0.22750 -1.0 2.0
   41    45    51    57   0.15300  1.0 3.0
   42    41    45    46   0.00000  1.0 1.0
   42    41    45    47   0.00000  1.0 1.0
   42    41    45    51   0.09700  1.0 1.0
   42    41    45    51   0.15600 -1.0 2.0
   42    41    45    51  -0.50800  1.0 3.0
   45    51    56    60   0.04150 -1.0 2.0
   45    51    56    73   0.04150 -1.0 2.0
   45    51   -57    33   0.06250  1.0 1.0
   45    51   -57    33  -0.01100 -1.0 2.0
   45    51   -57    33   0.28050  1.0 3.0
   46    45    51    52   0.15000  1.0 3.0
   46    45    51    56   0.43200  1.0 3.0
   46    45    51    57   0.23400  1.0 3.0
   47    45    51    52   0.15000  1.0 3.0
   47    45    51    56   0.43200  1.0 3.0
   47    45    51    57   0.23400  1.0 3.0
   51    56    60    61   3.62500 -1.0 2.0
   51    56    60    63   3.62500 -1.0 2.0
   51    56    73    71   3.62500 -1.0 2.0
   51    56    73    74   3.62500 -1.0 2.0
   52    51    56    60   0.00000  1.0 1.0
   52    51    56    73   0.00000  1.0 1.0
   52    51    57    33   0.37050  1.0 3.0
   56    51    57    33   0.37500  1.0 3.0
   56    60    63    64   3.62500 -1.0 2.0
   56    60    63    69   3.62500 -1.0 2.0
   60    56    73    71   3.62500 -1.0 2.0
   60    56    73    74   3.62500 -1.0 2.0
   60    63    69    70   3.62500 -1.0 2.0
   60    63   -69    71   3.62500 -1.0 2.0
   61    60    63    64   3.62500 -1.0 2.0
   61    60    63    69   3.62500 -1.0 2.0
   63    69    71    72   3.62500 -1.0 2.0
   63    69    71    73   3.62500 -1.0 2.0
   64    63    69    70   3.62500 -1.0 2.0
   64    63    69    71   3.62500 -1.0 2.0
   69    71   -73    56   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    56   3.62500 -1.0 2.0
   72    71    73    74   3.62500 -1.0 2.0
   73    56    60    61   3.62500 -1.0 2.0
   73    56   -60    63   3.62500 -1.0 2.0
   57    33   -37    41   0.39000  1.0 1.0
   57    33   -37    41  -0.05800 -1.0 2.0
   57    33   -37    41  -0.55150  1.0 3.0
   57    33    37    43   0.09700  1.0 1.0
   57    33    37    43   0.15600 -1.0 2.0
   57    33    37    43  -0.50800  1.0 3.0
   57    33    38    58   0.62750  1.0 1.0
   57    33    38    58  -0.30950 -1.0 2.0
   57    33    38    58   0.27300  1.0 3.0
   57    33    38    39   0.23400  1.0 3.0
   57    33    38    40   0.23400  1.0 3.0
   57    51    56    60   0.64500  1.0 1.0
   57    51    56    60   0.14800 -1.0 2.0
   57    51    56    60   0.20650  1.0 3.0
   57    51    56    73   0.64500  1.0 1.0
   57    51    56    73   0.14800 -1.0 2.0
   57    51    56    73   0.20650  1.0 3.0
   43    37    41    42   7.00000 -1.0 2.0
   43    37    41    45   7.00000 -1.0 2.0
   43    48    53    54   0.15000  1.0 3.0
   43    48    53    55   0.15000  1.0 3.0
   43    48   -53    58   0.56750  1.0 1.0
   43    48   -53    58  -0.07550 -1.0 2.0
   43    48   -53    58   0.20000  1.0 3.0
   43    62    65    66   0.28000  1.0 3.0
   43    62    65    67   0.28000  1.0 3.0
   43    62    65    68   0.28000  1.0 3.0
   44    43    48    49   0.15000  1.0 3.0
   44    43    48    50   0.15000  1.0 3.0
   44    43    48    53   0.15000  1.0 3.0
   44    43    62    58   0.28000  1.0 3.0
   44    43    62    65   0.28000  1.0 3.0
   48    43   -62    58   0.23450  1.0 1.0
   48    43   -62    58   0.02050 -1.0 2.0
   48    43   -62    58   0.25250  1.0 3.0
   48    43    62    65   0.58650  1.0 1.0
   48    43    62    65   0.12600 -1.0 2.0
   48    43    62    65   0.33350  1.0 3.0
   48    53    58    59   0.15000  1.0 3.0
   48    53    58    38   0.56750  1.0 1.0
   48    53    58    38  -0.07550 -1.0 2.0
   48    53    58    38   0.20000  1.0 3.0
   48    53   -58    62   1.53400  1.0 1.0
   48    53   -58    62  -0.09950 -1.0 2.0
   48    53   -58    62   0.05700  1.0 3.0
   49    48    53    54   0.15000  1.0 3.0
   49    48    53    55   0.15000  1.0 3.0
   49    48    53    58   0.15000  1.0 3.0
   50    48    53    54   0.15000  1.0 3.0
   50    48    53    55   0.15000  1.0 3.0
   50    48    53    58   0.15000  1.0 3.0
   53    58    38    33   0.56750  1.0 1.0
   53    58    38    33  -0.07550 -1.0 2.0
   53    58    38    33   0.20000  1.0 3.0
   53    58    38    39   0.15000  1.0 3.0
   53    58    38    40   0.15000  1.0 3.0
   53    58   -62    43   0.23450  1.0 1.0
   53    58   -62    43   0.02050 -1.0 2.0
   53    58   -62    43   0.25250  1.0 3.0
   53    58    62    65   0.58650  1.0 1.0
   53    58    62    65   0.12600 -1.0 2.0
   53    58    62    65   0.33350  1.0 3.0
   54    53    58    59   0.15000  1.0 3.0
   54    53    58    38   0.15000  1.0 3.0
   54    53    58    62   0.15000  1.0 3.0
   55    53    58    59   0.15000  1.0 3.0
   55    53    58    38   0.15000  1.0 3.0
   55    53    58    62   0.15000  1.0 3.0
   58    62    65    66   0.28000  1.0 3.0
   58    62    65    67   0.28000  1.0 3.0
   58    62    65    68   0.28000  1.0 3.0
   59    58    38    33   0.15000  1.0 3.0
   59    58    38    39   0.15000  1.0 3.0
   59    58    38    40   0.15000  1.0 3.0
   59    58    62    43   0.28000  1.0 3.0
   59    58    62    65   0.28000  1.0 3.0
   38    33    37    41   0.09850  1.0 1.0
   38    33    37    41   0.15250 -1.0 2.0
   38    33    37    41  -0.50650  1.0 3.0
   38    33    37    43   0.46850  1.0 1.0
   38    33    37    43   0.08550 -1.0 2.0
   38    33    37    43   0.09800  1.0 3.0
   38    33    57    51   0.06250  1.0 1.0
   38    33    57    51  -0.01100 -1.0 2.0
   38    33    57    51   0.28050  1.0 3.0
   38    58   -62    43   0.23450  1.0 1.0
   38    58   -62    43   0.02050 -1.0 2.0
   38    58   -62    43   0.25250  1.0 3.0
   38    58    62    65   0.58650  1.0 1.0
   38    58    62    65   0.12600 -1.0 2.0
   38    58    62    65   0.33350  1.0 3.0
   62    43    48    49   0.15000  1.0 3.0
   62    43    48    50   0.15000  1.0 3.0
   62    43   -48    53   1.53400  1.0 1.0
   62    43   -48    53  -0.09950 -1.0 2.0
   62    43   -48    53   0.05700  1.0 3.0
   62    58   -38    33   1.53400  1.0 1.0
   62    58   -38    33  -0.09950 -1.0 2.0
   62    58   -38    33   0.05700  1.0 3.0
   62    58    38    39   0.15000  1.0 3.0
   62    58    38    40   0.15000  1.0 3.0
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
   33    43    37    41   1.10000 -1.0 2.0
   45    42    41    37   1.10000 -1.0 2.0
   60    73    56    51   4.00000 -1.0 2.0
   63    61    60    56   1.10000 -1.0 2.0
   69    64    63    60   1.10000 -1.0 2.0
   71    70    69    63   1.10000 -1.0 2.0
   73    72    71    69   1.10000 -1.0 2.0
   71    74    73    56   1.10000 -1.0 2.0
END
