* LIGAND DATABASE FILE (OPLS2005)
*
001     102   102    181    273     530
    1     0 S   NP   _N1_     1    28.98879    98.45905   -20.23197
    2     1 S   H    _HN1     2     1.02837    49.89161   134.89930
    3     1 S   H    _H1_     3     1.02779    95.78227  -116.56424
    4     1 S   H    _H2_     4     1.02956    65.35720    -9.02090
    5     1 S   CT   _CA1     5     1.50093   150.87840    78.98590
    6     5 S   HC   _HA1     6     1.09592   105.22451   101.84031
    7     5 S   CO3  _C1_     7     1.53777   112.41645   -18.33056
    8     7 S   O2Z  _O11     8     1.26363   114.99030   -44.26646
    9     7 S   O2Z  _O12     9     1.26234   114.94301   134.86854
   10     5 S   CT   _CB1    10     1.53126   107.44597  -140.28057
   11    10 S   HC   HB11    11     1.09822   109.29156   -51.05779
   12    10 S   HC   HB12    12     1.09803   110.55229    65.60451
   13    10 S   CT   _CG1    13     1.52916   112.44539  -172.05962
   14    13 S   HC   HG11    14     1.09594   110.55881   -65.90928
   15    13 S   HC   HG12    15     1.09464   109.55767    53.03729
   16    13 S   C    _CD1    16     1.51776   112.60277   173.39342
   17    16 S   O    _OE1    17     1.22749   123.35995     2.22642
   18    16 S   N    _N2_    18     1.38592   111.71506  -177.98074
   19    18 S   H    _HN2    19     1.01586   119.09078     3.61292
   20    18 S   CT1  _CA2    20     1.45917   122.98877   179.33412
   21    20 S   HC   _HA2    21     1.09650   109.92903    23.05577
   22    20 S   C    _C2_    22     1.52732   104.90021   -94.84686
   23    22 S   O    _O2_    23     1.23015   122.40637   -84.61768
   24    20 S   CT   _CB2    32     1.53187   111.53454   146.17849
   25    24 S   HC   HB21    33     1.09474   109.73509    55.25049
   26    24 S   HC   HB22    34     1.09534   110.05848   174.13151
   27    22 S   N    _N3_    24     1.38463   112.97574    91.26933
   28    27 S   H    _HN3    25     1.01559   119.62965     3.47175
   29    24 S   S    _SG2    35     1.82758   111.15586   -65.47585
   30    27 S   CT   _CA3    26     1.45400   122.68658   179.70195
   31    30 S   HC   HA31    27     1.09533   108.68085    35.69450
   32    30 S   HC   HA32    28     1.09475   107.28645   152.63625
   33    29 S   CT   _C12    36     1.84251   100.13995   176.96165
   34    33 S   HC   _H3_    37     1.09734   105.85384    58.75570
   35    30 S   CO3  _C3_    29     1.52978   113.61754   -87.19869
   36    35 S   O2Z  _O31    30     1.26355   115.68107   -38.33100
   37    35 S   O2Z  _O32    31     1.26398   114.75612   142.48378
   38    33 S   CM   _C10    38     1.52961   111.51601   -60.22054
   39    33 S   CT   _C13    97     1.53529   108.44655   174.47079
   40    39 S   HC   _H15    98     1.09686   110.77280   -54.09648
   41    39 S   HC   _H16    99     1.09618   112.28732    66.47641
   42    38 S   CM   _C9_    39     1.35059   121.73321   -59.08049
   43    42 S   HC   _H11    40     1.08967   118.04892    -0.57437
   44    38 S   CT   _C11    93     1.50955   113.45924   120.50507
   45    44 S   HC   _H12    94     1.09512   110.12139   -59.60663
   46    44 S   HC   _H13    95     1.09117   114.15154   179.85463
   47    44 S   HC   _H14    96     1.09524   109.91922    59.55074
   48    39 S   CO4  _C14   100     1.50827   110.88334  -171.85008
   49    48 S   O    _O33   101     1.22687   123.33526  -127.18634
   50    48 S   HC   _H17   102     1.10362   115.85380    55.25520
   51    42 S   CM   _C8_    41     1.44771   127.46363   178.02236
   52    51 S   HC   _H10    42     1.08481   118.25007     2.89773
   53    51 S   CM   _C7_    43     1.34315   122.74801  -175.94194
   54    53 S   HC   _H9_    44     1.08509   119.32816    -0.41354
   55    53 S   CM   _C6_    45     1.44810   122.44456   178.38723
   56    55 S   HC   _H8_    46     1.09063   114.63566     2.20806
   57    55 S   CM   _C5_    47     1.34796   127.28109  -176.95779
   58    57 S   CM   _C15    48     1.45936   120.41038   179.16444
   59    58 S   HC   _H18    49     1.08930   114.44057   120.13398
   60    57 S   CT   _C4_    89     1.50451   126.32088    -2.29047
   61    60 S   HC   _H5_    90     1.09588   110.45873  -119.56873
   62    60 S   HC   _H6_    91     1.09601   110.23026   120.84328
   63    60 S   HC   _H7_    92     1.09208   113.62039     0.72739
   64    58 S   CM   _C16    50     1.34487   127.82911   -61.61620
   65    64 S   HC   _H19    51     1.08586   116.22520  -179.69162
   66    64 S   CM   _C17    52     1.45069   126.33003    -1.71418
   67    66 S   HC   _H20    53     1.08727   114.39219    -3.14274
   68    66 S   CM   _C18    54     1.34977   127.64529   177.76017
   69    68 S   CM   _C20    55     1.46231   122.16453   179.11001
   70    69 S   HC   _H24    56     1.08654   117.10874   166.76188
   71    68 S   CT   _C19    85     1.50831   125.15155    -1.77630
   72    71 S   HC   _H21    86     1.09618   110.37707  -121.00445
   73    71 S   HC   _H22    87     1.09599   110.23699   119.42573
   74    71 S   HC   _H23    88     1.09176   113.89841    -0.97679
   75    69 S   CZA  _C21    57     1.30282   124.99846   -13.58147
   76    75 S   CM   _C22    58     1.31145   178.90657  -175.37649
   77    76 S   CT   _C27    59     1.54755   121.64151   124.22225
   78    77 S   CT   _C26    60     1.54830   110.37716  -138.73341
   79    78 S   HC   _H27    61     1.09865   110.47540  -171.66874
   80    78 S   HC   _H28    62     1.10006   109.75795    73.30628
   81    77 S   CT   _C28    77     1.55065   112.14496   -20.06948
   82    81 S   HC   _H29    78     1.09672   110.94759  -175.54517
   83    81 S   HC   _H30    79     1.09569   111.87461    65.10759
   84    81 S   HC   _H31    80     1.09638   111.48820   -55.95057
   85    77 S   CT   _C29    81     1.54323   110.47630    98.91885
   86    85 S   HC   _H32    82     1.09624   110.89312  -176.46315
   87    85 S   HC   _H33    83     1.09243   112.83418    63.76508
   88    85 S   HC   _H34    84     1.09535   111.28718   -57.08419
   89    78 S   CT   _C25    63     1.52528   114.02632   -48.37686
   90    89 S   HC   _H4_    64     1.09304   110.56851   -66.12206
   91    89 S   CT   _C24    65     1.52513   110.33664    56.50919
   92    91 S   HC   _H25    66     1.09885   109.41691    64.30647
   93    91 S   HC   _H26    67     1.09752   108.38828   179.03937
   94    89 S   OH   _O34    75     1.42497   108.40956   176.54209
   95    94 S   HO   _H35    76     0.97274   107.40033   179.25244
   96    76 S   CT   _C23    68     1.53580   121.33496   -59.23558
   97    96 S   CT   _C30    69     1.53866   114.07534    12.93337
   98    97 S   HC   _H36    70     1.09677   110.64944  -179.88131
   99    97 S   HC   _H37    71     1.09534   111.94341    59.51600
  100    97 S   HC   _H38    72     1.09644   111.34476   -62.56219
  101    96 S   OH   _O35    73     1.43216   107.86953  -104.96512
  102   101 S   HO   _H39    74     0.97444   108.11916  -170.48052
  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   9   5   4   3
  15   7   2   1   1  13   7   4   3  10   4   4   2   1   1   2
   1   1   6   3   6   3   9   3   9  10   4   4   2   1   1   6
   3   9   3   8   9   3   4   2   1   1   9  23  18  18   7   6
   9   3   2   1   5   2   1   1   9   6  11   5   4   2   1   6
   5   3   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    42    44    39    40    41    48  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    42    43    51    44    45    46    47    39    40    41    48    49    50  
   38    42    44    39    40    41    48  
   36    37  
   37  
    0  
   42    43    51    52    53    44    45    46    47    39    40    41    48  
   40    41    48    49    50    42    44  
   41    48    49    50  
   48    49    50  
   43    51    52    53    54    55    44    45    46    47  
   51    52    53    44  
   45    46    47    51  
   46    47  
   47  
    0  
   49    50  
   50  
    0  
   52    53    54    55    56    57  
   53    54    55  
   54    55    56    57    58    60  
   55    56    57  
   56    57    58    59    64    60    61    62    63  
   57    58    60  
   58    59    64    65    66    60    61    62    63  
   59    64    65    66    67    68    60    61    62    63  
   64    65    66    60  
   61    62    63    64  
   62    63  
   63  
    0  
   65    66    67    68    69    71  
   66    67    68  
   67    68    69    70    75    71    72    73    74  
   68    69    71  
   69    70    75    76    71    72    73    74  
   70    75    76    77    96    71    72    73    74  
   75    76    71  
   72    73    74    75  
   73    74  
   74  
    0  
   76    77    78    91    96    97   101    81    85  
   77    78    79    80    89    91    92    93    96    97    98    99   100   101   102    81    82    83    84    85    86    87    88  
   78    79    80    89    90    91    96    97   101    94    81    82    83    84    85    86    87    88  
   79    80    89    90    91    92    93    96    94    95    81    82    83    84    85    86    87    88  
   80    89    90    91    94    81    85  
   89    90    91    94    81    85  
   82    83    84    85    86    87    88    89    96  
   83    84    85  
   84    85  
   85  
   86    87    88    89    96  
   87    88  
   88  
    0  
   90    91    92    93    96    97   101    94    95  
   91    92    93    96    94    95  
   92    93    96    97    98    99   100   101   102    94    95  
   93    96    97   101    94  
   96    97   101    94  
   95    96  
    0  
   97    98    99   100   101   102  
   98    99   100   101   102  
   99   100   101  
  100   101  
  101  
  102  
    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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   42   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   43   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.7500   0.1050   0.450000   2.1120   1.8750   0.001000000  -0.126889456
   49   2.9600   0.2100  -0.450000   1.6780   1.4800   0.001000000  -0.126889456
   50   2.4200   0.0150   0.000000   1.3810   1.2100   0.008598240   0.268726247
   51   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   52   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   54   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   56   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   58   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   59   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   65   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   67   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   69   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   70   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.6500   0.1500   0.000000   2.0580   1.8250   0.025318638  -1.264311570
   76   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   77   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   78   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   95   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   96   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   97   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   98   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  100   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  101   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  102   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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    39   268.000  1.529
   38    42   549.000  1.340
   38    44   317.000  1.510
   42    43   340.000  1.080
   42    51   380.000  1.444
   51    52   340.000  1.080
   51    53   549.000  1.340
   53    54   340.000  1.080
   53    55   380.000  1.444
   55    56   340.000  1.080
   55    57   549.000  1.340
   57    58   380.000  1.444
   57    60   317.000  1.510
   58    59   340.000  1.080
   58    64   549.000  1.340
   64    65   340.000  1.080
   64    66   380.000  1.444
   66    67   340.000  1.080
   66    68   549.000  1.340
   68    69   380.000  1.444
   68    71   317.000  1.510
   69    70   340.000  1.080
   69    75   660.000  1.312
   75    76   660.000  1.312
   76    77   317.000  1.510
   76    96   317.000  1.510
   77    78   268.000  1.529
   77    81   268.000  1.529
   77    85   268.000  1.529
   78    79   340.000  1.090
   78    80   340.000  1.090
   78    89   268.000  1.529
   89    90   340.000  1.090
   89    91   268.000  1.529
   89    94   320.000  1.410
   91    92   340.000  1.090
   91    93   340.000  1.090
   91    96   268.000  1.529
   96    97   268.000  1.529
   96   101   320.000  1.410
   97    98   340.000  1.090
   97    99   340.000  1.090
   97   100   340.000  1.090
  101   102   553.000  0.945
   94    95   553.000  0.945
   81    82   340.000  1.090
   81    83   340.000  1.090
   81    84   340.000  1.090
   85    86   340.000  1.090
   85    87   340.000  1.090
   85    88   340.000  1.090
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   340.000  1.090
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   340.000  1.090
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   340.000  1.090
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    48   317.000  1.522
   48    49   570.000  1.229
   48    50   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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    39    75.00000  111.63000
   33    38    42    70.00000  124.00000
   33    38    44    65.00000  117.92700
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    48    63.00000  111.10000
   38    33    34    35.00000  109.50000
   38    42    43    35.00000  120.00000
   38    42    51    70.00000  123.01800
   38    44    45    35.00000  109.50000
   38    44    46    35.00000  109.50000
   38    44    47    35.00000  109.50000
   42    51    52    35.00000  120.00000
   42    51    53    70.00000  123.01800
   51    42    43    35.00000  120.00000
   51    53    54    35.00000  120.00000
   51    53    55    70.00000  123.01800
   53    51    52    35.00000  120.00000
   53    55    56    35.00000  120.00000
   53    55    57    70.00000  123.01800
   55    53    54    35.00000  120.00000
   55    57    58    70.00000  123.01800
   55    57    60    70.00000  124.00000
   57    55    56    35.00000  120.00000
   57    58    59    35.00000  120.00000
   57    58    64    70.00000  123.01800
   57    60    61    35.00000  109.50000
   57    60    62    35.00000  109.50000
   57    60    63    35.00000  109.50000
   58    64    65    35.00000  120.00000
   58    64    66    70.00000  123.01800
   64    58    59    35.00000  120.00000
   64    66    67    35.00000  120.00000
   64    66    68    70.00000  123.01800
   66    64    65    35.00000  120.00000
   66    68    69    70.00000  123.01800
   66    68    71    70.00000  124.00000
   68    66    67    35.00000  120.00000
   68    69    70    35.00000  120.00000
   68    69    75    65.00000  126.82800
   68    71    72    35.00000  109.50000
   68    71    73    35.00000  109.50000
   68    71    74    35.00000  109.50000
   69    75    76    30.00000  179.37100
   75    69    70    40.00000  121.46100
   75    76    77    60.00000  122.72200
   75    76    96    60.00000  122.72200
   76    77    78    70.00000  112.02700
   76    77    81    70.00000  112.02700
   76    77    85    70.00000  112.02700
   76    96    91    70.00000  112.02700
   76    96    97    70.00000  112.02700
   76    96   101    90.00000  110.39200
   77    78    79    37.50000  110.70000
   77    78    80    37.50000  110.70000
   77    78    89    58.35000  112.70000
   77    81    82    37.50000  110.70000
   77    81    83    37.50000  110.70000
   77    81    84    37.50000  110.70000
   77    85    86    37.50000  110.70000
   77    85    87    37.50000  110.70000
   77    85    88    37.50000  110.70000
   78    89    90    37.50000  110.70000
   78    89    91    58.35000  112.70000
   78    89    94    50.00000  109.50000
   80    78    79    33.00000  107.80000
   89    78    79    37.50000  110.70000
   89    78    80    37.50000  110.70000
   89    91    92    37.50000  110.70000
   89    91    93    37.50000  110.70000
   89    91    96    58.35000  112.70000
   89    94    95    55.00000  108.50000
   91    89    90    37.50000  110.70000
   91    96    97    58.35000  112.70000
   91    96   101    50.00000  109.50000
   93    91    92    33.00000  107.80000
   96    76    77    65.00000  117.92700
   96    91    92    37.50000  110.70000
   96    91    93    37.50000  110.70000
   96    97    98    37.50000  110.70000
   96    97    99    37.50000  110.70000
   96    97   100    37.50000  110.70000
   96   101   102    55.00000  108.50000
   99    97    98    33.00000  107.80000
  100    97    98    33.00000  107.80000
  100    97    99    33.00000  107.80000
  101    96    97    50.00000  109.50000
   94    89    90    35.00000  109.50000
   94    89    91    50.00000  109.50000
   81    77    78    58.35000  112.70000
   83    81    82    33.00000  107.80000
   84    81    82    33.00000  107.80000
   84    81    83    33.00000  107.80000
   85    77    78    58.35000  112.70000
   85    77    81    58.35000  112.70000
   87    85    86    33.00000  107.80000
   88    85    86    33.00000  107.80000
   88    85    87    33.00000  107.80000
   71    68    69    70.00000  124.00000
   73    71    72    33.00000  107.80000
   74    71    72    33.00000  107.80000
   74    71    73    33.00000  107.80000
   60    57    58    70.00000  124.00000
   62    60    61    33.00000  107.80000
   63    60    61    33.00000  107.80000
   63    60    62    33.00000  107.80000
   44    38    42    70.00000  124.00000
   46    44    45    33.00000  107.80000
   47    44    45    33.00000  107.80000
   47    44    46    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.02700
   39    48    49    80.00000  120.40000
   39    48    50    35.00000  115.00000
   41    39    40    33.00000  107.80000
   48    39    40    35.00000  109.50000
   48    39    41    35.00000  109.50000
   50    48    49    35.00000  123.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   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    38    42   0.42700  1.0 1.0
   29    33    38    42  -0.70350 -1.0 2.0
   29    33    38    42  -0.43150  1.0 3.0
   29    33    38    44   0.30250  1.0 1.0
   29    33    38    44  -0.14950 -1.0 2.0
   29    33    38    44   0.36900  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    48   0.56750  1.0 1.0
   29    33    39    48  -0.07550 -1.0 2.0
   29    33    39    48   0.20000  1.0 3.0
   33    38    42    43   7.00000 -1.0 2.0
   33    38    42    51   7.00000 -1.0 2.0
   33    38    44    45   0.34800  1.0 3.0
   33    38    44    46   0.34800  1.0 3.0
   33    38    44    47   0.34800  1.0 3.0
   33    39    48    49   0.30150 -1.0 2.0
   33    39    48    50   0.74550  1.0 1.0
   33    39    48    50  -0.00500 -1.0 2.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    38    44   0.34800  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    48  -0.11250  1.0 3.0
   38    33    39    40   0.15000  1.0 3.0
   38    33    39    41   0.15000  1.0 3.0
   38    33    39    48  -0.98800  1.0 1.0
   38    33    39    48   0.48800 -1.0 2.0
   38    33    39    48   0.76800  1.0 3.0
   38    42    51    52  -0.18600  1.0 3.0
   38    42    51    53   0.28850  1.0 1.0
   38    42    51    53   2.61350 -1.0 2.0
   38    42    51    53   0.78400  1.0 3.0
   42    38    44    45   0.00000  1.0 1.0
   42    38    44    46   0.00000  1.0 1.0
   42    38    44    47   0.00000  1.0 1.0
   42    51    53    54   7.00000 -1.0 2.0
   42    51    53    55   7.00000 -1.0 2.0
   43    42    51    52   0.00000  1.0 1.0
   43    42    51    53  -0.18600  1.0 3.0
   51    53    55    56  -0.18600  1.0 3.0
   51    53    55    57   0.28850  1.0 1.0
   51    53    55    57   2.61350 -1.0 2.0
   51    53    55    57   0.78400  1.0 3.0
   52    51    53    54   7.00000 -1.0 2.0
   52    51    53    55   7.00000 -1.0 2.0
   53    55    57    58   7.00000 -1.0 2.0
   53    55    57    60   7.00000 -1.0 2.0
   54    53    55    56   0.00000  1.0 1.0
   54    53    55    57  -0.18600  1.0 3.0
   55    57    58    59  -0.18600  1.0 3.0
   55    57    58    64   0.28850  1.0 1.0
   55    57    58    64   2.61350 -1.0 2.0
   55    57    58    64   0.78400  1.0 3.0
   55    57    60    61   0.00000  1.0 1.0
   55    57    60    62   0.00000  1.0 1.0
   55    57    60    63   0.00000  1.0 1.0
   56    55    57    58   7.00000 -1.0 2.0
   56    55    57    60   7.00000 -1.0 2.0
   57    58    64    65   7.00000 -1.0 2.0
   57    58    64    66   7.00000 -1.0 2.0
   58    57    60    61   0.00000  1.0 1.0
   58    57    60    62   0.00000  1.0 1.0
   58    57    60    63   0.00000  1.0 1.0
   58    64    66    67  -0.18600  1.0 3.0
   58    64    66    68   0.28850  1.0 1.0
   58    64    66    68   2.61350 -1.0 2.0
   58    64    66    68   0.78400  1.0 3.0
   59    58    64    65   7.00000 -1.0 2.0
   59    58    64    66   7.00000 -1.0 2.0
   64    66    68    69   7.00000 -1.0 2.0
   64    66    68    71   7.00000 -1.0 2.0
   65    64    66    67   0.00000  1.0 1.0
   65    64    66    68  -0.18600  1.0 3.0
   66    68    69    70  -0.18600  1.0 3.0
   66    68    69    75   2.00000 -1.0 2.0
   66    68    71    72   0.00000  1.0 1.0
   66    68    71    73   0.00000  1.0 1.0
   66    68    71    74   0.00000  1.0 1.0
   67    66    68    69   7.00000 -1.0 2.0
   67    66    68    71   7.00000 -1.0 2.0
   68    69    75    76   0.00000  1.0 1.0
   68    69   -76    77  -2.50000 -1.0 2.0
   68    69   -76    96  -2.50000 -1.0 2.0
   69    68    71    72   0.00000  1.0 1.0
   69    68    71    73   0.00000  1.0 1.0
   69    68    71    74   0.00000  1.0 1.0
   69    75    76    77   0.00000  1.0 1.0
   69    75    76    96   0.00000  1.0 1.0
   70    69    75    76   0.00000  1.0 1.0
   70    69   -76    77  -2.50000 -1.0 2.0
   70    69   -76    96  -2.50000 -1.0 2.0
   75    76    77    78   0.09700  1.0 1.0
   75    76    77    78   0.15600 -1.0 2.0
   75    76    77    78  -0.50800  1.0 3.0
   75    76    77    81   0.09700  1.0 1.0
   75    76    77    81   0.15600 -1.0 2.0
   75    76    77    81  -0.50800  1.0 3.0
   75    76    77    85   0.09700  1.0 1.0
   75    76    77    85   0.15600 -1.0 2.0
   75    76    77    85  -0.50800  1.0 3.0
   75    76    96    91   0.09700  1.0 1.0
   75    76    96    91   0.15600 -1.0 2.0
   75    76    96    91  -0.50800  1.0 3.0
   75    76    96    97   0.09700  1.0 1.0
   75    76    96    97   0.15600 -1.0 2.0
   75    76    96    97  -0.50800  1.0 3.0
   75    76    96   101   0.09700  1.0 1.0
   75    76    96   101   0.15600 -1.0 2.0
   75    76    96   101  -0.50800  1.0 3.0
   76    77    78    79   0.15000  1.0 3.0
   76    77    78    80   0.15000  1.0 3.0
   76    77    78    89   0.34400  1.0 1.0
   76    77    78    89   0.09450 -1.0 2.0
   76    77    78    89   0.11100  1.0 3.0
   76    77    81    82   0.15000  1.0 3.0
   76    77    81    83   0.15000  1.0 3.0
   76    77    81    84   0.15000  1.0 3.0
   76    77    85    86   0.15000  1.0 3.0
   76    77    85    87   0.15000  1.0 3.0
   76    77    85    88   0.15000  1.0 3.0
   76    96    97    98   0.15000  1.0 3.0
   76    96    97    99   0.15000  1.0 3.0
   76    96    97   100   0.15000  1.0 3.0
   76    96   101   102  -0.07800  1.0 1.0
   76    96   101   102  -0.21500 -1.0 2.0
   76    96   101   102  -0.03150  1.0 3.0
   77    76    96    91   0.46850  1.0 1.0
   77    76    96    91   0.08550 -1.0 2.0
   77    76    96    91   0.09800  1.0 3.0
   77    76    96    97   0.46850  1.0 1.0
   77    76    96    97   0.08550 -1.0 2.0
   77    76    96    97   0.09800  1.0 3.0
   77    76    96   101   0.18000  1.0 1.0
   77    76    96   101   0.16450 -1.0 2.0
   77    76    96   101   0.04450  1.0 3.0
   77    78    89    90   0.15000  1.0 3.0
   77    78   -89    91   0.56750  1.0 1.0
   77    78   -89    91  -0.07550 -1.0 2.0
   77    78   -89    91   0.20000  1.0 3.0
   77    78    89    94   0.86500  1.0 1.0
   77    78    89    94  -0.17500 -1.0 2.0
   77    78    89    94   0.20800  1.0 3.0
   78    77    81    82   0.15000  1.0 3.0
   78    77    81    83   0.15000  1.0 3.0
   78    77    81    84   0.15000  1.0 3.0
   78    77    85    86   0.15000  1.0 3.0
   78    77    85    87   0.15000  1.0 3.0
   78    77    85    88   0.15000  1.0 3.0
   78    89    91    92   0.15000  1.0 3.0
   78    89    91    93   0.15000  1.0 3.0
   78    89    91    96   0.56750  1.0 1.0
   78    89    91    96  -0.07550 -1.0 2.0
   78    89    91    96   0.20000  1.0 3.0
   78    89    94    95  -0.11600  1.0 1.0
   78    89    94    95  -0.09450 -1.0 2.0
   78    89    94    95   0.21250  1.0 3.0
   79    78    89    90   0.15000  1.0 3.0
   79    78    89    91   0.15000  1.0 3.0
   79    78    89    94   0.23400  1.0 3.0
   80    78    89    90   0.15000  1.0 3.0
   80    78    89    91   0.15000  1.0 3.0
   80    78    89    94   0.23400  1.0 3.0
   89    91   -96    76   0.34400  1.0 1.0
   89    91   -96    76   0.09450 -1.0 2.0
   89    91   -96    76   0.11100  1.0 3.0
   89    91    96    97   0.56750  1.0 1.0
   89    91    96    97  -0.07550 -1.0 2.0
   89    91    96    97   0.20000  1.0 3.0
   89    91    96   101   0.86500  1.0 1.0
   89    91    96   101  -0.17500 -1.0 2.0
   89    91    96   101   0.20800  1.0 3.0
   90    89    91    92   0.15000  1.0 3.0
   90    89    91    93   0.15000  1.0 3.0
   90    89    91    96   0.15000  1.0 3.0
   90    89    94    95   0.19450  1.0 3.0
   91    89    94    95  -0.11600  1.0 1.0
   91    89    94    95  -0.09450 -1.0 2.0
   91    89    94    95   0.21250  1.0 3.0
   91    96    97    98   0.15000  1.0 3.0
   91    96    97    99   0.15000  1.0 3.0
   91    96    97   100   0.15000  1.0 3.0
   91    96   101   102  -0.11600  1.0 1.0
   91    96   101   102  -0.09450 -1.0 2.0
   91    96   101   102   0.21250  1.0 3.0
   92    91    96    76   0.15000  1.0 3.0
   92    91    96    97   0.15000  1.0 3.0
   92    91    96   101   0.23400  1.0 3.0
   93    91    96    76   0.15000  1.0 3.0
   93    91    96    97   0.15000  1.0 3.0
   93    91    96   101   0.23400  1.0 3.0
   96    76   -77    78   0.46850  1.0 1.0
   96    76   -77    78   0.08550 -1.0 2.0
   96    76   -77    78   0.09800  1.0 3.0
   96    76    77    81   0.46850  1.0 1.0
   96    76    77    81   0.08550 -1.0 2.0
   96    76    77    81   0.09800  1.0 3.0
   96    76    77    85   0.46850  1.0 1.0
   96    76    77    85   0.08550 -1.0 2.0
   96    76    77    85   0.09800  1.0 3.0
   97    96   101   102  -0.11600  1.0 1.0
   97    96   101   102  -0.09450 -1.0 2.0
   97    96   101   102   0.21250  1.0 3.0
  101    96    97    98   0.23400  1.0 3.0
  101    96    97    99   0.23400  1.0 3.0
  101    96    97   100   0.23400  1.0 3.0
   94    89    91    92   0.23400  1.0 3.0
   94    89    91    93   0.23400  1.0 3.0
   94    89    91    96   0.86500  1.0 1.0
   94    89    91    96  -0.17500 -1.0 2.0
   94    89    91    96   0.20800  1.0 3.0
   81    77    78    79   0.15000  1.0 3.0
   81    77    78    80   0.15000  1.0 3.0
   81    77    78    89   0.56750  1.0 1.0
   81    77    78    89  -0.07550 -1.0 2.0
   81    77    78    89   0.20000  1.0 3.0
   81    77    85    86   0.15000  1.0 3.0
   81    77    85    87   0.15000  1.0 3.0
   81    77    85    88   0.15000  1.0 3.0
   85    77    78    79   0.15000  1.0 3.0
   85    77    78    80   0.15000  1.0 3.0
   85    77    78    89   0.56750  1.0 1.0
   85    77    78    89  -0.07550 -1.0 2.0
   85    77    78    89   0.20000  1.0 3.0
   85    77    81    82   0.15000  1.0 3.0
   85    77    81    83   0.15000  1.0 3.0
   85    77    81    84   0.15000  1.0 3.0
   71    68    69    70   0.00000  1.0 1.0
   71    68    69    75   1.08500 -1.0 2.0
   60    57    58    59   0.00000  1.0 1.0
   60    57    58    64  -0.18600  1.0 3.0
   44    38    42    43   7.00000 -1.0 2.0
   44    38    42    51   7.00000 -1.0 2.0
   39    33    38    42   0.09850  1.0 1.0
   39    33    38    42   0.15250 -1.0 2.0
   39    33    38    42  -0.50650  1.0 3.0
   39    33    38    44   0.46850  1.0 1.0
   39    33    38    44   0.08550 -1.0 2.0
   39    33    38    44   0.09800  1.0 3.0
   40    39    48    49   0.00000  1.0 1.0
   40    39    48    50   0.00000  1.0 1.0
   41    39    48    49   0.00000  1.0 1.0
   41    39    48    50   0.00000  1.0 1.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   33    44    38    42  15.00000 -1.0 2.0
   51    43    42    38  15.00000 -1.0 2.0
   42    52    51    53  15.00000 -1.0 2.0
   55    54    53    51  15.00000 -1.0 2.0
   53    56    55    57  15.00000 -1.0 2.0
   58    60    57    55  15.00000 -1.0 2.0
   57    59    58    64  15.00000 -1.0 2.0
   66    65    64    58  15.00000 -1.0 2.0
   64    67    66    68  15.00000 -1.0 2.0
   69    71    68    66  15.00000 -1.0 2.0
   68    70    69    75  15.00000 -1.0 2.0
   77    96    76    75   1.10000 -1.0 2.0
   39    50    48    49  10.50000 -1.0 2.0
END
