* LIGAND DATABASE FILE (OPLS2005)
*
001      75    77    136    219     408
    1     0 S   NP   _N1_     1    28.61797    94.04268   -24.39314
    2     1 S   H    _HN1     2     1.02948    85.54098     8.11801
    3     1 S   H    _H1_     3     1.02827    22.84717   168.78829
    4     1 S   H    _H2_     4     1.02789   108.87701   -99.79386
    5     1 S   CT   _CA1     5     1.50120   127.36680   120.48036
    6     5 S   HC   _HA1     6     1.09573   105.17779    77.29441
    7     5 S   CO3  _C1_     7     1.53781   112.49344   -42.92201
    8     7 S   O2Z  _O11     8     1.26373   115.00558   -41.76183
    9     7 S   O2Z  _O12     9     1.26240   114.94708   137.34505
   10     5 S   CT   _CB1    10     1.53074   107.41684  -164.71722
   11    10 S   HC   HB11    11     1.09835   109.34959   -49.50517
   12    10 S   HC   HB12    12     1.09812   110.45449    67.09873
   13    10 S   CT   _CG1    13     1.53000   112.62751  -170.46863
   14    13 S   HC   HG11    14     1.09577   110.66924   -66.47389
   15    13 S   HC   HG12    15     1.09671   109.74963    52.76593
   16    13 S   C    _CD1    16     1.51804   112.15834   173.22639
   17    16 S   O    _OE1    17     1.22737   123.25247     8.97400
   18    16 S   N    _N2_    18     1.38645   111.71624  -171.07652
   19    18 S   H    _HN2    19     1.01574   118.95706     1.59324
   20    18 S   CT1  _CA2    20     1.46232   123.40527   177.11588
   21    20 S   HC   _HA2    21     1.09739   109.37280     5.01392
   22    20 S   C    _C2_    22     1.53615   108.60454  -110.48912
   23    22 S   O    _O2_    23     1.23054   122.31018  -147.85097
   24    20 S   CT   _CB2    32     1.53473   111.60357   127.08127
   25    24 S   HC   HB21    33     1.09385   109.33630    56.29036
   26    24 S   HC   HB22    34     1.09347   109.48312   175.32555
   27    22 S   N    _N3_    24     1.38331   113.76088    39.59159
   28    27 S   H    _HN3    25     1.01561   119.61529    -3.18075
   29    24 S   S    _SG2    35     1.82934   111.06507   -64.55893
   30    27 S   CT   _CA3    26     1.45278   123.21948   177.22822
   31    30 S   HC   HA31    27     1.09548   107.50382   -64.93593
   32    30 S   HC   HA32    28     1.09556   108.00489    51.51818
   33    29 S   CT   _C16    36     1.87265   102.41744  -178.49338
   34    30 S   CO3  _C3_    29     1.52961   114.05333   173.51871
   35    34 S   O2Z  _O31    30     1.26379   116.06801    -0.67840
   36    34 S   O2Z  _O32    31     1.26423   114.41846   179.37945
   37    33 S   CO4  _C11    37     1.53061   106.01404   -65.37522
   38    37 S   O    _O18    38     1.23168   121.81690   -73.41739
   39    33 S   CT   _C14    62     1.57089   109.62177  -179.53186
   40    39 S   HC   _H29    63     1.09908   109.46504   163.00020
   41    37 S   CA   _C7_    39     1.47598   119.35437   103.97328
   42    39 S   OH   _O21    64     1.43876   111.82863    46.64950
   43    42 S   HO   _H39    65     0.97327   107.48667    54.75689
   44    41 S   CA   _C6_    40     1.39901   119.17346    12.05715
   45    44 S   CA   _C4_    41     1.41969   116.73712  -177.70953
   46    45 S   HA   _H26    42     1.09013   120.17061   179.40983
   47    44 S   CMA  _C10    54     1.51590   123.65183     3.09529
   48    47 S   OM   _O17    55     1.26963   118.57030   169.63508
   49    45 S   CA   _C8_    43     1.40117   122.98403    -0.48092
   50    33 S   CM   _C12    56     1.52539   110.94196    58.26613
   51    49 S   CA   _C5_    44     1.38658   118.96589    -0.03426
   52    51 S   HA   _H27    45     1.08543   121.86380  -179.98022
   53    49 S   OS   _O24    49     1.36924   115.06807  -180.00000
   54    50 S   CT   _C13    57     1.54467   114.89492    74.43208
   55    54 S   HC   _H28    58     1.09554   111.34680   173.19038
   56    41 S   CA   _C9_    46     1.41096   120.42094  -166.34901
   57    53 S   CT   _C19    50     1.42267   116.83562  -179.77272
   58    57 S   HC   _H34    51     1.09428   107.75521   179.85196
   59    57 S   HC   _H35    52     1.09503   111.13868    62.08658
   60    57 S   HC   _H36    53     1.09501   111.12966   -62.38966
   61    54 S   CT   _C17    59     1.54162   112.14918    53.12655
   62    54 S   OH   _O20    74     1.42713   110.19763   -69.99449
   63    62 S   HO   _H38    75     0.97303   106.95076   -54.20155
   64    56 S   OH   _O19    47     1.37177   123.57607    -1.29074
   65    64 S   HO   _H37    48     0.97345   108.89838    -2.71383
   66    61 S   CT   _C15    60     1.53768   110.02989   -55.66183
   67    66 S   HC   _H30    61     1.09705   111.04937   -66.70270
   68    61 S   CT   _C18    68     1.53522   111.06752  -179.33618
   69    68 S   HC   _H31    69     1.09554   111.32412  -170.59019
   70    68 S   HC   _H32    70     1.09454   111.95299    67.68542
   71    68 S   HC   _H33    71     1.09627   110.62435   -53.19332
   72    61 S   OH   _O23    72     1.43598   108.70852    63.34647
   73    72 S   HO   _H41    73     0.97294   108.03400    52.26987
   74    66 S   OH   _O22    66     1.43398   110.21766   175.77664
   75    74 S   HO   _H40    67     0.97149   107.66586    71.98021
  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
  19   2   1   1  14   5  14   7  12   6   1  11  10   4   8   2
   9   8   6   3   5  13   6   2   3   2   1   1  12   4   1   1
   1   9   4   6   3   2   1   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    50    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    47    50    54    66    39    40    42  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    44    56    47    48    50    54    55    61    66    67    39    40    42    43    74    62  
   35    36  
   36  
    0  
   38    41    44    45    51    56    64    47    50    54    66    39    40    42  
   41    44    56    50    39  
   40    42    43    74    75    68    72    41    47    50    54    61    66    67  
   42    43    74    50    61    66    67  
   44    45    46    49    51    52    56    64    65    47    48    50  
   43    74    50    61    66    67  
   66  
   45    46    49    51    56    64    53    47    48    50    54  
   46    49    51    52    56    53    57    47    48    50  
   49    51    53    47  
   48    50    54    55    61    62    49    56  
   50    54  
   51    52    56    64    53    57    58    59    60  
   54    55    61    66    68    72    62    63  
   52    56    64    65    53    57  
   56    64    53  
   57    58    59    60    56  
   55    61    66    67    74    68    69    70    71    72    73    62    63  
   61    66    68    72    62    63  
   64    65  
   58    59    60  
   59    60  
   60  
    0  
   66    67    74    75    68    69    70    71    72    73    62    63  
   63    66    68    72  
    0  
   65  
    0  
   67    74    75    68    69    70    71    72    73  
   74    75    68    72  
   69    70    71    72    73    74  
   70    71    72  
   71    72  
   72  
   73    74  
    0  
   75  
    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   0.167500   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   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   39   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   42   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   43   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   44   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   48   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   49   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   50   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   51   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   52   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   53   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   54   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   57   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   62   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   63   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   64   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   65   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   66   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   73   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   74   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   75   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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  1.522
   33    50   317.000  1.510
   33    39   268.000  1.529
   37    38   570.000  1.229
   37    41   310.000  1.470
   41    44   469.000  1.400
   41    56   469.000  1.400
   44    45   469.000  1.400
   44    47   320.000  1.460
   45    46   367.000  1.080
   45    49   469.000  1.400
   49    51   469.000  1.400
   49    53   450.000  1.364
   51    52   367.000  1.080
   51    56   469.000  1.400
   56    64   450.000  1.364
   64    65   553.000  0.945
   53    57   320.000  1.410
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   340.000  1.090
   47    48   745.000  1.250
   47    50   465.000  1.376
   50    54   317.000  1.510
   54    55   340.000  1.090
   54    61   268.000  1.529
   54    62   320.000  1.410
   61    66   268.000  1.529
   61    68   268.000  1.529
   61    72   320.000  1.410
   66    67   340.000  1.090
   66    39   268.000  1.529
   66    74   320.000  1.410
   39    40   340.000  1.090
   39    42   320.000  1.410
   42    43   553.000  0.945
   74    75   553.000  0.945
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    71   340.000  1.090
   72    73   553.000  0.945
   62    63   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    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  110.18000
   29    33    50    75.00000  112.20000
   29    33    39    75.00000  111.63000
   33    37    38    80.00000  120.40000
   33    37    41    65.00000  115.47100
   33    50    47    70.00000  124.00000
   33    50    54    65.00000  117.92700
   33    39    66    58.35000  112.70000
   33    39    40    37.50000  110.70000
   33    39    42    50.00000  109.50000
   37    41    44    60.00000  119.52600
   37    41    56    60.00000  119.52600
   41    37    38    75.00000  123.78400
   41    44    45    63.00000  120.00000
   41    44    47    60.00000  120.93500
   41    56    51    63.00000  120.00000
   41    56    64    70.00000  120.00000
   44    45    46    35.00000  120.00000
   44    45    49    63.00000  120.00000
   44    47    48    85.00000  114.86500
   44    47    50    60.00000  123.20500
   45    49    51    63.00000  120.00000
   45    49    53    70.00000  120.00000
   49    45    46    35.00000  120.00000
   49    51    52    35.00000  120.00000
   49    51    56    63.00000  120.00000
   49    53    57    75.00000  111.00000
   51    56    64    70.00000  120.00000
   56    41    44    63.00000  120.00000
   56    51    52    35.00000  120.00000
   56    64    65    35.00000  113.00000
   53    49    51    70.00000  120.00000
   53    57    58    35.00000  109.50000
   53    57    59    35.00000  109.50000
   53    57    60    35.00000  109.50000
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    33.00000  107.80000
   47    44    45    60.00000  120.93500
   47    50    54    70.00000  124.00000
   50    33    37    70.00000  109.06800
   50    47    48    65.00000  137.10300
   50    54    55    35.00000  109.50000
   50    54    61    70.00000  112.02700
   50    54    62    90.00000  110.39200
   54    61    66    58.35000  112.70000
   54    61    68    58.35000  112.70000
   54    61    72    50.00000  109.50000
   54    62    63    55.00000  108.50000
   61    54    55    37.50000  110.70000
   61    66    67    37.50000  110.70000
   61    66    39    58.35000  112.70000
   61    66    74    50.00000  109.50000
   61    68    69    37.50000  110.70000
   61    68    70    37.50000  110.70000
   61    68    71    37.50000  110.70000
   61    72    73    55.00000  108.50000
   66    39    40    37.50000  110.70000
   66    39    42    50.00000  109.50000
   66    74    75    55.00000  108.50000
   39    33    37    63.00000  111.10000
   39    33    50    70.00000  112.02700
   39    66    67    37.50000  110.70000
   39    42    43    55.00000  108.50000
   42    39    40    35.00000  109.50000
   74    66    67    35.00000  109.50000
   74    66    39    50.00000  109.50000
   68    61    66    58.35000  112.70000
   70    68    69    33.00000  107.80000
   71    68    69    33.00000  107.80000
   71    68    70    33.00000  107.80000
   72    61    66    50.00000  109.50000
   72    61    68    50.00000  109.50000
   62    54    55    35.00000  109.50000
   62    54    61    50.00000  109.50000
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   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    50  -0.62250  1.0 1.0
   24    29    33    50  -0.38450 -1.0 2.0
   24    29    33    50   0.81900  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    38   0.30150 -1.0 2.0
   29    33    37    41   0.65300  1.0 1.0
   29    33    37    41  -0.03850 -1.0 2.0
   29    33    37    41   0.33900  1.0 3.0
   29    33    50    47   0.42700  1.0 1.0
   29    33    50    47  -0.70350 -1.0 2.0
   29    33    50    47  -0.43150  1.0 3.0
   29    33    50    54   0.30250  1.0 1.0
   29    33    50    54  -0.14950 -1.0 2.0
   29    33    50    54   0.36900  1.0 3.0
   29    33    39    66   0.44750  1.0 1.0
   29    33    39    66  -0.17800 -1.0 2.0
   29    33    39    66   0.20200  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    42   0.56750  1.0 1.0
   29    33    39    42  -0.07550 -1.0 2.0
   29    33    39    42   0.20000  1.0 3.0
   33    37    41    44   2.26350  1.0 1.0
   33    37    41    44   0.76750 -1.0 2.0
   33    37    41    44   0.22500  1.0 3.0
   33    37    41    56   2.26350  1.0 1.0
   33    37    41    56   0.76750 -1.0 2.0
   33    37    41    56   0.22500  1.0 3.0
   33    50    54    55   0.34800  1.0 3.0
   33    50    54    61   0.46850  1.0 1.0
   33    50    54    61   0.08550 -1.0 2.0
   33    50    54    61   0.09800  1.0 3.0
   33    50    54    62   0.18000  1.0 1.0
   33    50    54    62   0.16450 -1.0 2.0
   33    50    54    62   0.04450  1.0 3.0
   33    39    42    43  -0.11600  1.0 1.0
   33    39    42    43  -0.09450 -1.0 2.0
   33    39    42    43   0.21250  1.0 3.0
   37    33    50    47  -0.51250  1.0 1.0
   37    33    50    47  -0.88800 -1.0 2.0
   37    33    50    47   0.08850  1.0 3.0
   37    33    50    54   0.17250  1.0 1.0
   37    33    50    54  -0.04100 -1.0 2.0
   37    33    50    54  -0.33850  1.0 3.0
   37    33    39    66  -0.95700  1.0 1.0
   37    33    39    66  -0.18200 -1.0 2.0
   37    33    39    66   0.29450  1.0 3.0
   37    33    39    40  -0.11250  1.0 3.0
   37    33    39    42  -0.09450  1.0 1.0
   37    33    39    42  -1.12950 -1.0 2.0
   37    33    39    42   0.54000  1.0 3.0
   37    41    44    45   3.62500 -1.0 2.0
   37    41   -44    47   3.62500 -1.0 2.0
   37    41    56    51   3.62500 -1.0 2.0
   37    41    56    64   3.62500 -1.0 2.0
   38    37    41    44   1.05000 -1.0 2.0
   38    37    41    56   1.05000 -1.0 2.0
   41    44    45    46   3.62500 -1.0 2.0
   41    44    45    49   3.62500 -1.0 2.0
   41    44    47    48  -0.01750  1.0 1.0
   41    44    47    48  -0.32000 -1.0 2.0
   41    44    47    48   0.00600  1.0 3.0
   41    44    47    50   0.15800  1.0 1.0
   41    44    47    50   1.85350 -1.0 2.0
   41    44    47    50  -0.48700  1.0 3.0
   41    56    64    65   0.84100 -1.0 2.0
   44    41    56    51   3.62500 -1.0 2.0
   44    41    56    64   3.62500 -1.0 2.0
   44    45   -49    51   3.62500 -1.0 2.0
   44    45    49    53   3.62500 -1.0 2.0
   44    47   -50    33   7.00000 -1.0 2.0
   44    47    50    54   7.00000 -1.0 2.0
   45    44    47    48  -0.01750  1.0 1.0
   45    44    47    48  -0.32000 -1.0 2.0
   45    44    47    48   0.00600  1.0 3.0
   45    44    47    50   0.15800  1.0 1.0
   45    44    47    50   1.85350 -1.0 2.0
   45    44    47    50  -0.48700  1.0 3.0
   45    49    51    52   3.62500 -1.0 2.0
   45    49    51    56   3.62500 -1.0 2.0
   45    49    53    57   1.63200 -1.0 2.0
   46    45    49    51   3.62500 -1.0 2.0
   46    45    49    53   3.62500 -1.0 2.0
   49    51   -56    41   3.62500 -1.0 2.0
   49    51    56    64   3.62500 -1.0 2.0
   49    53    57    58   0.08050  1.0 3.0
   49    53    57    59   0.08050  1.0 3.0
   49    53    57    60   0.08050  1.0 3.0
   51    49    53    57   1.63200 -1.0 2.0
   51    56    64    65   0.84100 -1.0 2.0
   52    51    56    41   3.62500 -1.0 2.0
   52    51    56    64   3.62500 -1.0 2.0
   56    41   -44    45   3.62500 -1.0 2.0
   56    41    44    47   3.62500 -1.0 2.0
   53    49    51    52   3.62500 -1.0 2.0
   53    49    51    56   3.62500 -1.0 2.0
   47    44    45    46   3.62500 -1.0 2.0
   47    44    45    49   3.62500 -1.0 2.0
   47    50    54    55   0.00000  1.0 1.0
   47    50    54    61   0.09850  1.0 1.0
   47    50    54    61   0.15250 -1.0 2.0
   47    50    54    61  -0.50650  1.0 3.0
   47    50    54    62   0.67800  1.0 1.0
   47    50    54    62   0.47050 -1.0 2.0
   47    50    54    62  -0.62500  1.0 3.0
   48    47    50    33   7.00000 -1.0 2.0
   48    47    50    54   7.00000 -1.0 2.0
   50    33    37    38   0.30150 -1.0 2.0
   50    33   -37    41   0.65300  1.0 1.0
   50    33   -37    41  -0.03850 -1.0 2.0
   50    33   -37    41   0.33900  1.0 3.0
   50    33    39    66   0.34400  1.0 1.0
   50    33    39    66   0.09450 -1.0 2.0
   50    33    39    66   0.11100  1.0 3.0
   50    33    39    40   0.15000  1.0 3.0
   50    33    39    42   1.05650  1.0 1.0
   50    33    39    42   0.15600 -1.0 2.0
   50    33    39    42   0.53150  1.0 3.0
   50    54   -61    66   0.34400  1.0 1.0
   50    54   -61    66   0.09450 -1.0 2.0
   50    54   -61    66   0.11100  1.0 3.0
   50    54    61    68   0.34400  1.0 1.0
   50    54    61    68   0.09450 -1.0 2.0
   50    54    61    68   0.11100  1.0 3.0
   50    54    61    72   1.05650  1.0 1.0
   50    54    61    72   0.15600 -1.0 2.0
   50    54    61    72   0.53150  1.0 3.0
   50    54    62    63  -0.07800  1.0 1.0
   50    54    62    63  -0.21500 -1.0 2.0
   50    54    62    63  -0.03150  1.0 3.0
   54    61    66    67   0.15000  1.0 3.0
   54    61    66    39   0.56750  1.0 1.0
   54    61    66    39  -0.07550 -1.0 2.0
   54    61    66    39   0.20000  1.0 3.0
   54    61    66    74   0.86500  1.0 1.0
   54    61    66    74  -0.17500 -1.0 2.0
   54    61    66    74   0.20800  1.0 3.0
   54    61    68    69   0.15000  1.0 3.0
   54    61    68    70   0.15000  1.0 3.0
   54    61    68    71   0.15000  1.0 3.0
   54    61    72    73  -0.11600  1.0 1.0
   54    61    72    73  -0.09450 -1.0 2.0
   54    61    72    73   0.21250  1.0 3.0
   55    54    61    66   0.15000  1.0 3.0
   55    54    61    68   0.15000  1.0 3.0
   55    54    61    72   0.23400  1.0 3.0
   55    54    62    63   0.19450  1.0 3.0
   61    54    62    63  -0.11600  1.0 1.0
   61    54    62    63  -0.09450 -1.0 2.0
   61    54    62    63   0.21250  1.0 3.0
   61    66   -39    33   0.56750  1.0 1.0
   61    66   -39    33  -0.07550 -1.0 2.0
   61    66   -39    33   0.20000  1.0 3.0
   61    66    39    40   0.15000  1.0 3.0
   61    66    39    42   0.86500  1.0 1.0
   61    66    39    42  -0.17500 -1.0 2.0
   61    66    39    42   0.20800  1.0 3.0
   61    66    74    75  -0.11600  1.0 1.0
   61    66    74    75  -0.09450 -1.0 2.0
   61    66    74    75   0.21250  1.0 3.0
   66    61    68    69   0.15000  1.0 3.0
   66    61    68    70   0.15000  1.0 3.0
   66    61    68    71   0.15000  1.0 3.0
   66    61    72    73  -0.11600  1.0 1.0
   66    61    72    73  -0.09450 -1.0 2.0
   66    61    72    73   0.21250  1.0 3.0
   66    39    42    43  -0.11600  1.0 1.0
   66    39    42    43  -0.09450 -1.0 2.0
   66    39    42    43   0.21250  1.0 3.0
   67    66    39    33   0.15000  1.0 3.0
   67    66    39    40   0.15000  1.0 3.0
   67    66    39    42   0.23400  1.0 3.0
   67    66    74    75   0.19450  1.0 3.0
   39    33    37    38   0.30150 -1.0 2.0
   39    33    37    41   0.05850 -1.0 2.0
   39    33    37    41   0.17250  1.0 3.0
   39    33    50    47   0.09850  1.0 1.0
   39    33    50    47   0.15250 -1.0 2.0
   39    33    50    47  -0.50650  1.0 3.0
   39    33   -50    54   0.46850  1.0 1.0
   39    33   -50    54   0.08550 -1.0 2.0
   39    33   -50    54   0.09800  1.0 3.0
   39    66    74    75  -0.11600  1.0 1.0
   39    66    74    75  -0.09450 -1.0 2.0
   39    66    74    75   0.21250  1.0 3.0
   40    39    42    43   0.19450  1.0 3.0
   74    66    39    33   0.86500  1.0 1.0
   74    66    39    33  -0.17500 -1.0 2.0
   74    66    39    33   0.20800  1.0 3.0
   74    66    39    40   0.23400  1.0 3.0
   74    66    39    42   3.75450  1.0 1.0
   68    61    66    67   0.15000  1.0 3.0
   68    61    66    39   0.56750  1.0 1.0
   68    61    66    39  -0.07550 -1.0 2.0
   68    61    66    39   0.20000  1.0 3.0
   68    61    66    74   0.86500  1.0 1.0
   68    61    66    74  -0.17500 -1.0 2.0
   68    61    66    74   0.20800  1.0 3.0
   68    61    72    73  -0.11600  1.0 1.0
   68    61    72    73  -0.09450 -1.0 2.0
   68    61    72    73   0.21250  1.0 3.0
   72    61    66    67   0.23400  1.0 3.0
   72    61    66    39   0.86500  1.0 1.0
   72    61    66    39  -0.17500 -1.0 2.0
   72    61    66    39   0.20800  1.0 3.0
   72    61    66    74   3.75450  1.0 1.0
   72    61    68    69   0.23400  1.0 3.0
   72    61    68    70   0.23400  1.0 3.0
   72    61    68    71   0.23400  1.0 3.0
   62    54    61    66   0.86500  1.0 1.0
   62    54    61    66  -0.17500 -1.0 2.0
   62    54    61    66   0.20800  1.0 3.0
   62    54    61    68   0.86500  1.0 1.0
   62    54    61    68  -0.17500 -1.0 2.0
   62    54    61    68   0.20800  1.0 3.0
   62    54    61    72   3.75450  1.0 1.0
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    41    37    38  10.50000 -1.0 2.0
   44    56    41    37   4.00000 -1.0 2.0
   45    47    44    41   4.00000 -1.0 2.0
   49    46    45    44   1.10000 -1.0 2.0
   51    53    49    45   4.00000 -1.0 2.0
   56    52    51    49   1.10000 -1.0 2.0
   51    64    56    41   4.00000 -1.0 2.0
   44    48    47    50   1.10000 -1.0 2.0
   33    54    50    47   1.10000 -1.0 2.0
END
