* LIGAND DATABASE FILE (OPLS2005)
*
001     106   111    202    326     596
    1     0 S   NP   _N1_     1    28.86481    96.48283   -21.71692
    2     1 S   H    _HN1     2     1.02954    77.08168    22.24986
    3     1 S   H    _H1_     3     1.02827    42.98979   155.68660
    4     1 S   H    _H2_     4     1.02779    89.39454   -86.77092
    5     1 S   CT   _CA1     5     1.50153   151.99246   131.41651
    6     5 S   HC   _HA1     6     1.09578   105.15420    76.58452
    7     5 S   CO3  _C1_     7     1.53835   112.40683   -43.43559
    8     7 S   O2Z  _O11     8     1.26362   114.99416   -41.52409
    9     7 S   O2Z  _O12     9     1.26252   114.97522   137.36963
   10     5 S   CT   _CB1    10     1.53099   107.36300  -165.57307
   11    10 S   HC   HB11    11     1.09818   109.33889   -50.05551
   12    10 S   HC   HB12    12     1.09812   110.45464    66.58422
   13    10 S   CT   _CG1    13     1.52901   112.56507  -171.13242
   14    13 S   HC   HG11    14     1.09549   110.29227   -64.93502
   15    13 S   HC   HG12    15     1.09663   109.99414    54.14294
   16    13 S   C    _CD1    16     1.51837   112.54195   174.44907
   17    16 S   O    _OE1    17     1.22701   123.43771    -2.99898
   18    16 S   N    _N2_    18     1.38515   111.40824   177.40505
   19    18 S   H    _HN2    19     1.01671   118.79976    -0.38001
   20    18 S   CT1  _CA2    20     1.46125   123.98693  -179.53354
   21    20 S   HC   _HA2    21     1.09724   109.39481     0.25256
   22    20 S   C    _C2_    22     1.53439   108.78693  -115.51173
   23    22 S   O    _O2_    23     1.23069   122.26027  -148.90107
   24    20 S   CT   _CB2    32     1.53447   111.00511   122.26418
   25    24 S   HC   HB21    33     1.09260   109.58430    57.52074
   26    24 S   HC   HB22    34     1.09529   110.48203   175.30790
   27    22 S   N    _N3_    24     1.38337   113.71363    38.72132
   28    27 S   H    _HN3    25     1.01608   119.51167    -3.99895
   29    24 S   S    _SG2    35     1.83108   111.01030   -66.37246
   30    27 S   CT   _CA3    26     1.45285   123.12959   176.87732
   31    30 S   HC   HA31    27     1.09553   107.55225   -62.88924
   32    30 S   HC   HA32    28     1.09559   107.90637    53.50081
   33    29 S   CT   _C27    36     1.97251   102.28126   134.24317
   34    30 S   CO3  _C3_    29     1.52936   114.17060   175.44379
   35    34 S   O2Z  _O31    30     1.26364   116.08273    -1.29150
   36    34 S   O2Z  _O32    31     1.26440   114.40481   178.76109
   37    33 S   CA   _C12    37     1.54805   110.02157    45.06844
   38    33 S   CO4  _C17    87     1.52546    99.71675   -78.59406
   39    38 S   O    _O34    88     1.23200   123.02335    64.32509
   40    37 S   CA   _C11    38     1.42304   116.65907    66.22104
   41    40 S   CA   _C7_    39     1.40375   121.08224  -174.09621
   42    41 S   HA   _H45    40     1.08768   120.12038   178.10959
   43    40 S   CO   _C21    51     1.51313   117.62500     8.39814
   44    43 S   HC   _H49    52     1.09402   110.00704   -84.97223
   45    41 S   CA   _C13    41     1.39448   120.58370    -3.51045
   46    43 S   NE   _N31    53     1.45862   108.72557    37.39831
   47    45 S   CA   _C8_    42     1.39566   118.75139    -2.44753
   48    47 S   HA   _H46    43     1.08797   119.21214  -175.95305
   49    45 S   CT   _C28    47     1.49874   120.53092  -177.96116
   50    49 S   HC   _H55    48     1.09435   110.03793    87.60903
   51    49 S   HC   _H56    49     1.09511   110.89761  -151.87495
   52    49 S   HC   _H57    50     1.09512   110.89147   -32.90240
   53    33 S   CM   _C18    54     1.55317   103.17879   162.57913
   54    46 S   CT1  _C22    89     1.46763   108.41861   123.50958
   55    54 S   HC   _H50    90     1.09354   108.92274   118.10079
   56    37 S   CA   _C15    44     1.40275   126.48174  -116.19996
   57    53 S   CMA  _C16    55     1.37280   123.68474    97.61092
   58    57 S   OM   _O33    56     1.26917   124.85900  -163.35888
   59    54 S   CO4  _C19    91     1.51660   102.97774     5.14049
   60    59 S   O    _O35    92     1.22189   126.00924   171.93413
   61    54 S   CTE  _C33    94     1.55469   113.69077  -114.97371
   62    61 S   HC   _H69    95     1.09508   108.73975   -57.86983
   63    56 S   OH   _O38    45     1.36642   120.99852    -6.80294
   64    63 S   HO   _H70    46     0.97174   109.60373   179.05664
   65    57 S   CA   _C10    57     1.52879   116.59945    17.12252
   66    43 S   OS   _O36    93     1.42664   112.88360   157.18992
   67    61 S   CT   _C31    96     1.53688   113.63520    59.32440
   68    67 S   HC   _H64    97     1.09439   111.98271    60.59465
   69    67 S   HC   _H65    98     1.09253   111.32482   -61.19776
   70    67 S   HC   _H66    99     1.09586   110.52405  -179.60336
   71    61 S   CT   _C32   100     1.54681   113.72342  -175.64841
   72    71 S   HC   _H67   101     1.09560   110.73560   -68.33740
   73    71 S   HC   _H68   102     1.09790   108.49002   175.80997
   74    65 S   CA   _C9_    58     1.40122   122.11504   -13.04828
   75    71 S   CT   _C30   103     1.52153   114.36829    55.59730
   76    75 S   HC   _H61   104     1.09351   111.18682    52.79582
   77    75 S   HC   _H62   105     1.09350   111.66606   -68.78845
   78    75 S   HC   _H63   106     1.09493   109.93159   172.20127
   79    74 S   CA   _C5_    59     1.41188   122.04211  -177.89346
   80    79 S   HA   _H43    60     1.08799   121.26058   179.00122
   81    79 S   CA   _C4_    61     1.38597   120.99189    -0.39614
   82    81 S   HA   _H42    62     1.08558   120.40930   178.64506
   83    81 S   CA   _C6_    63     1.38184   119.00403    -1.57682
   84    83 S   HA   _H44    64     1.08651   119.16749  -179.87805
   85    65 S   CA   _C14    65     1.42913   122.74868   165.32317
   86    85 S   OS   _O41    66     1.37753   120.77161    -1.44848
   87    86 S   CO   _C26    67     1.43786   113.25284  -118.04758
   88    87 S   HC   _H54    68     1.09852   110.75596    15.88239
   89    87 S   CT   _C20    69     1.53478   109.45964   133.50911
   90    89 S   HC   _H47    70     1.09463   109.75783   -52.80000
   91    89 S   HC   _H48    71     1.09699   108.78570  -170.93618
   92    89 S   CT   _C23    72     1.52955   111.72026    69.59748
   93    92 S   HC   _H51    73     1.09530   110.22624   173.90609
   94    92 S   CT   _C24    74     1.53294   109.34091    52.54712
   95    94 S   HC   _H52    75     1.09755   108.33312    66.48112
   96    92 S   OH   _O39    85     1.42719   111.29506   -68.18973
   97    96 S   HO   _H71    86     0.97536   108.87237   -27.07579
   98    94 S   CT   _C25    76     1.53508   110.55897   -53.07910
   99    98 S   HC   _H53    77     1.09738   110.74400   -64.77264
  100    94 S   OH   _O40    83     1.42366   110.74647  -175.57752
  101   100 S   HO   _H72    84     0.97213   107.69470   -47.67379
  102    87 S   OS   _O37    78     1.43405   112.56911  -103.62142
  103    98 S   CT   _C29    79     1.52592   111.64459   175.69234
  104   103 S   HC   _H58    80     1.09563   110.93156   -59.92841
  105   103 S   HC   _H59    81     1.09561   110.26027  -177.78990
  106   103 S   HC   _H60    82     1.09394   111.72038    61.58950
  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
  17   2   1   1  18  12   4  14  13   4  12   5   8  13   8   3
   4   2   1   1  11  15   7   2   7   3   6   2  13   8   1   1
   9   1   7   3   2   1   6   5   4   7   3   2   1   1   6   3
   5   3   4   2   5   8  12   6  11   6   5  11   6  12   7   3
   1   8   6   3   1   4   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    53    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    56    46    53    57    74    38    39  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    41    47    56    63    43    46    53    57    58    65    74    79    38    39    54  
   35    36  
   36  
    0  
   40    41    42    45    47    48    56    63    64    43    44    46    53    57    74    38    39    66  
   39    40    46    53    56    57    65    74    79    80    81    85  
   53    65    74    79  
   41    42    45    47    56    63    49    43    44    46    53    54    59    66  
   42    45    47    48    56    49    50    51    52    43    44    46    66  
   45    47    49    43  
   44    46    53    57    54    55    59    60    66    61    45    56  
   46    53    54    59    66  
   47    48    56    63    49    50    51    52  
   53    57    58    65    54    55    59    60    66    61    62    67    71  
   48    56    63    64    49    50    51    52  
   56    63    49  
   50    51    52    56  
   51    52  
   52  
    0  
   57    58    65    74    85    54    55    59    66    61    56  
   55    59    60    66    61    62    67    68    69    70    71    72    73    75    57  
   59    60    66    61    62    67    71  
   63    64  
   58    65    74    79    83    85    86  
   65    74    85  
   60    66    61    62    67    71  
   66    61  
   62    67    68    69    70    71    72    73    75    76    77    78    66  
   67    68    69    70    71    72    73    75  
   64  
    0  
   74    79    80    81    83    84    85    86    87  
    0  
   68    69    70    71    72    73    75  
   69    70    71  
   70    71  
   71  
   72    73    75    76    77    78  
   73    75    76    77    78  
   75    76    77    78  
   79    80    81    82    83    85    86  
   76    77    78  
   77    78  
   78  
    0  
   80    81    82    83    84    85  
   81    82    83  
   82    83    84    85    86  
   83    84    85  
   84    85    86    87  
   85    86  
   86    87    88    89   102  
   87    88    89    90    91    92    98   102  
   88    89    90    91    92    93    94    98    99   102   103    96  
   89    90    91    92    98   102  
   90    91    92    93    94    95    98   102   100    96    97  
   91    92    93    94   102    96  
   92    93    94   102    96  
   93    94    95    98    99   102   103   100   101    96    97  
   94    95    98   100    96    97  
   95    98    99   102   103   104   105   106   100   101    96    97  
   98    99   102   103   100   101    96  
   97    98   100  
    0  
   99   102   103   104   105   106   100   101  
  102   103   104   105   106   100  
  101   102   103  
    0  
  103   104   105   106  
  104   105   106  
  105   106  
  106  
    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   0.282500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   38   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   39   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   40   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   41   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   42   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   43   3.5000   0.0660   0.360000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.100000   1.3810   1.2100   0.008598240   0.268726247
   45   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   46   3.2500   0.1700  -0.263000   1.9050   1.6860   0.051222218  -2.220205820
   47   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   48   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   49   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5500   0.0760  -0.583200   2.0020   1.7750   0.023028004  -0.852763146
   54   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
   55   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   56   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   57   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   58   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   59   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   60   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   61   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   64   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   65   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   66   3.0000   0.1700  -0.302500   1.7660   1.5600   0.020110767  -0.896042159
   67   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.120000   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   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   75   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   80   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   81   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   82   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   83   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   84   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   85   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   86   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   87   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   88   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   89   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   97   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   98   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   99   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  100   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  101   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  102   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
  103   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  104   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   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    53   317.000  1.510
   33    38   317.000  1.522
   37    40   469.000  1.400
   37    56   469.000  1.400
   40    41   469.000  1.400
   40    43   270.000  1.504
   41    42   367.000  1.080
   41    45   469.000  1.400
   45    47   469.000  1.400
   45    49   317.000  1.510
   47    48   367.000  1.080
   47    56   469.000  1.400
   56    63   450.000  1.364
   63    64   553.000  0.945
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   340.000  1.090
   43    44   340.000  1.090
   43    46   320.000  1.442
   43    66   320.000  1.380
   46    53   425.000  1.378
   46    54   382.000  1.448
   53    57   465.000  1.376
   57    58   745.000  1.250
   57    65   320.000  1.460
   65    74   469.000  1.400
   65    85   469.000  1.400
   74    79   469.000  1.400
   74    38   310.000  1.470
   79    80   367.000  1.080
   79    81   469.000  1.400
   81    82   367.000  1.080
   81    83   469.000  1.400
   83    84   367.000  1.080
   83    85   469.000  1.400
   85    86   450.000  1.364
   86    87   320.000  1.380
   87    88   340.000  1.090
   87    89   250.000  1.527
   87   102   320.000  1.380
   89    90   340.000  1.090
   89    91   340.000  1.090
   89    92   268.000  1.529
   92    93   340.000  1.090
   92    94   268.000  1.529
   92    96   320.000  1.410
   94    95   340.000  1.090
   94    98   268.000  1.529
   94   100   320.000  1.410
   98    99   340.000  1.090
   98   102   320.000  1.410
   98   103   268.000  1.529
  103   104   340.000  1.090
  103   105   340.000  1.090
  103   106   340.000  1.090
  100   101   553.000  0.945
   96    97   553.000  0.945
   38    39   570.000  1.229
   54    55   340.000  1.090
   54    59   255.000  1.522
   54    61   268.000  1.529
   59    60   570.000  1.229
   59    66   214.000  1.327
   61    62   340.000  1.090
   61    67   268.000  1.529
   61    71   268.000  1.529
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   340.000  1.090
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    75   268.000  1.529
   75    76   340.000  1.090
   75    77   340.000  1.090
   75    78   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    80.00000  109.48900
   29    33    53    75.00000  112.20000
   29    33    38    75.00000  110.18000
   33    37    40    70.00000  120.00000
   33    37    56    70.00000  120.00000
   33    53    46    75.00000  116.24600
   33    53    57    70.00000  124.00000
   33    38    74    65.00000  115.47100
   33    38    39    80.00000  120.40000
   37    40    41    63.00000  120.00000
   37    40    43    60.00000  120.68000
   37    56    47    63.00000  120.00000
   37    56    63    70.00000  120.00000
   40    41    42    35.00000  120.00000
   40    41    45    63.00000  120.00000
   40    43    44    45.00000  112.15300
   40    43    46    75.00000  111.80000
   40    43    66    90.00000  107.97000
   41    45    47    63.00000  120.00000
   41    45    49    70.00000  120.00000
   45    41    42    35.00000  120.00000
   45    47    48    35.00000  120.00000
   45    47    56    63.00000  120.00000
   45    49    50    35.00000  109.50000
   45    49    51    35.00000  109.50000
   45    49    52    35.00000  109.50000
   47    56    63    70.00000  120.00000
   56    37    40    63.00000  120.00000
   56    47    48    35.00000  120.00000
   56    63    64    35.00000  113.00000
   49    45    47    70.00000  120.00000
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    33.00000  107.80000
   43    40    41    60.00000  120.68000
   43    46    53    50.00000  121.00000
   43    46    54    50.00000  115.00000
   43    66    59    95.00000  111.08000
   46    43    44    50.00000  108.16000
   46    53    57    70.00000  124.03900
   46    54    55    35.00000  109.50000
   46    54    59    80.00000  111.64100
   46    54    61    80.00000  109.70000
   53    33    37    70.00000  112.99600
   53    57    58    65.00000  137.10300
   53    57    65    60.00000  123.20500
   57    65    74    60.00000  120.93500
   57    65    85    60.00000  120.93500
   65    57    58    85.00000  114.86500
   65    74    79    63.00000  120.00000
   65    74    38    60.00000  119.52600
   65    85    83    63.00000  120.00000
   65    85    86    70.00000  120.00000
   74    79    80    35.00000  120.00000
   74    79    81    63.00000  120.00000
   74    38    39    75.00000  123.78400
   79    81    82    35.00000  120.00000
   79    81    83    63.00000  120.00000
   81    79    80    35.00000  120.00000
   81    83    84    35.00000  120.00000
   81    83    85    63.00000  120.00000
   83    81    82    35.00000  120.00000
   83    85    86    70.00000  120.00000
   85    65    74    63.00000  120.00000
   85    83    84    35.00000  120.00000
   85    86    87   100.00000  112.36700
   86    87    88    35.00000  109.50000
   86    87    89    90.00000  108.56700
   86    87   102    92.60000  111.55000
   87    89    90    45.00000  108.72000
   87    89    91    45.00000  108.72000
   87    89    92    75.00000  109.43000
   87   102    98    60.00000  109.50000
   89    87    88    45.00000  112.01100
   89    92    93    37.50000  110.70000
   89    92    94    58.35000  112.70000
   89    92    96    50.00000  109.50000
   91    89    90    33.00000  107.80000
   92    89    90    37.50000  110.70000
   92    89    91    37.50000  110.70000
   92    94    95    37.50000  110.70000
   92    94    98    58.35000  112.70000
   92    94   100    50.00000  109.50000
   92    96    97    55.00000  108.50000
   94    92    93    37.50000  110.70000
   94    98    99    37.50000  110.70000
   94    98   102    50.00000  109.50000
   94    98   103    58.35000  112.70000
   94   100   101    55.00000  108.50000
   98    94    95    37.50000  110.70000
   98   103   104    37.50000  110.70000
   98   103   105    37.50000  110.70000
   98   103   106    37.50000  110.70000
  102    87    88    35.00000  109.50000
  102    87    89    90.00000  108.56700
  102    98    99    35.00000  109.50000
  103    98    99    37.50000  110.70000
  103    98   102    50.00000  109.50000
  105   103   104    33.00000  107.80000
  106   103   104    33.00000  107.80000
  106   103   105    33.00000  107.80000
  100    94    95    35.00000  109.50000
  100    94    98    50.00000  109.50000
   96    92    93    35.00000  109.50000
   96    92    94    50.00000  109.50000
   38    33    37    70.00000  110.93000
   38    33    53    70.00000  109.06800
   38    74    79    60.00000  119.52600
   54    46    53    50.00000  121.00000
   54    59    60    75.00000  123.42600
   54    59    66    90.00000  109.72300
   54    61    62    37.50000  110.70000
   54    61    67    58.35000  112.70000
   54    61    71    58.35000  112.70000
   59    54    55    45.00000  110.09800
   66    43    44    35.00000  109.50000
   66    43    46    95.00000  112.71300
   66    59    60    83.00000  123.40000
   61    54    55    37.50000  110.70000
   61    54    59    63.00000  111.10000
   61    67    68    37.50000  110.70000
   61    67    69    37.50000  110.70000
   61    67    70    37.50000  110.70000
   61    71    72    37.50000  110.70000
   61    71    73    37.50000  110.70000
   61    71    75    58.35000  112.70000
   67    61    62    37.50000  110.70000
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    33.00000  107.80000
   71    61    62    37.50000  110.70000
   71    61    67    58.35000  112.70000
   71    75    76    37.50000  110.70000
   71    75    77    37.50000  110.70000
   71    75    78    37.50000  110.70000
   73    71    72    33.00000  107.80000
   75    71    72    37.50000  110.70000
   75    71    73    37.50000  110.70000
   77    75    76    33.00000  107.80000
   78    75    76    33.00000  107.80000
   78    75    77    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  -0.23050  1.0 1.0
   24    29    33    37   0.06200 -1.0 2.0
   24    29    33    37   0.47200  1.0 3.0
   24    29    33    53  -0.62250  1.0 1.0
   24    29    33    53  -0.38450 -1.0 2.0
   24    29    33    53   0.81900  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    40  -0.16000  1.0 1.0
   29    33    37    40  -0.03200 -1.0 2.0
   29    33    37    40   0.04500  1.0 3.0
   29    33    37    56  -0.16000  1.0 1.0
   29    33    37    56  -0.03200 -1.0 2.0
   29    33    37    56   0.04500  1.0 3.0
   29    33    53    46   0.09700  1.0 1.0
   29    33    53    46   0.15600 -1.0 2.0
   29    33    53    46  -0.50800  1.0 3.0
   29    33    53    57   0.42700  1.0 1.0
   29    33    53    57  -0.70350 -1.0 2.0
   29    33    53    57  -0.43150  1.0 3.0
   29    33    38    74   0.65300  1.0 1.0
   29    33    38    74  -0.03850 -1.0 2.0
   29    33    38    74   0.33900  1.0 3.0
   29    33    38    39   0.30150 -1.0 2.0
   33    37    40    41   3.62500 -1.0 2.0
   33    37    40    43   3.62500 -1.0 2.0
   33    37    56    47   3.62500 -1.0 2.0
   33    37    56    63   3.62500 -1.0 2.0
   33    53    57    58   7.00000 -1.0 2.0
   33    53    57    65   7.00000 -1.0 2.0
   37    33    53    46  -0.22650  1.0 1.0
   37    33    53    46   0.16900 -1.0 2.0
   37    33    53    46   1.14250  1.0 3.0
   37    33    53    57   1.44450  1.0 1.0
   37    33    53    57   0.06600 -1.0 2.0
   37    33    53    57   0.29250  1.0 3.0
   37    33    38    74   0.65300  1.0 1.0
   37    33    38    74  -0.03850 -1.0 2.0
   37    33    38    74   0.33900  1.0 3.0
   37    33    38    39   0.30150 -1.0 2.0
   37    40    41    42   3.62500 -1.0 2.0
   37    40    41    45   3.62500 -1.0 2.0
   37    40    43    44   0.00000  1.0 1.0
   37    40   -43    46  -0.06000  1.0 1.0
   37    40   -43    46   0.30500 -1.0 2.0
   37    40   -43    46   0.09200  1.0 3.0
   37    40    43    66   0.64500  1.0 1.0
   37    40    43    66   0.14800 -1.0 2.0
   37    40    43    66   0.20650  1.0 3.0
   37    56    63    64   0.84100 -1.0 2.0
   40    37    56    47   3.62500 -1.0 2.0
   40    37    56    63   3.62500 -1.0 2.0
   40    41   -45    47   3.62500 -1.0 2.0
   40    41    45    49   3.62500 -1.0 2.0
   40    43    46    53  -0.12500  1.0 1.0
   40    43    46    53  -0.12500 -1.0 2.0
   40    43    46    53   0.25000  1.0 3.0
   40    43    46    54   0.00000  1.0 1.0
   40    43    66    59  -0.43900 -1.0 2.0
   40    43    66    59   0.14100  1.0 3.0
   41    40    43    44   0.00000  1.0 1.0
   41    40    43    46  -0.06000  1.0 1.0
   41    40    43    46   0.30500 -1.0 2.0
   41    40    43    46   0.09200  1.0 3.0
   41    40    43    66   0.64500  1.0 1.0
   41    40    43    66   0.14800 -1.0 2.0
   41    40    43    66   0.20650  1.0 3.0
   41    45    47    48   3.62500 -1.0 2.0
   41    45    47    56   3.62500 -1.0 2.0
   41    45    49    50   0.00000  1.0 1.0
   41    45    49    51   0.00000  1.0 1.0
   41    45    49    52   0.00000  1.0 1.0
   42    41    45    47   3.62500 -1.0 2.0
   42    41    45    49   3.62500 -1.0 2.0
   45    47   -56    37   3.62500 -1.0 2.0
   45    47    56    63   3.62500 -1.0 2.0
   47    45    49    50   0.00000  1.0 1.0
   47    45    49    51   0.00000  1.0 1.0
   47    45    49    52   0.00000  1.0 1.0
   47    56    63    64   0.84100 -1.0 2.0
   48    47    56    37   3.62500 -1.0 2.0
   48    47    56    63   3.62500 -1.0 2.0
   56    37   -40    41   3.62500 -1.0 2.0
   56    37    40    43   3.62500 -1.0 2.0
   49    45    47    48   3.62500 -1.0 2.0
   49    45    47    56   3.62500 -1.0 2.0
   43    40    41    42   3.62500 -1.0 2.0
   43    40    41    45   3.62500 -1.0 2.0
   43    46   -53    33   1.00000 -1.0 2.0
   43    46    53    57  -0.54700  1.0 1.0
   43    46    53    57   1.23000 -1.0 2.0
   43    46    54    55   0.00000  1.0 1.0
   43    46   -54    59   0.00000  1.0 1.0
   43    46    54    61   0.00000  1.0 1.0
   44    43    46    53   0.00000  1.0 1.0
   44    43    46    54   0.00000  1.0 1.0
   44    43    66    59   0.08050  1.0 3.0
   46    43   -66    59  -0.24150  1.0 1.0
   46    43   -66    59  -0.46200 -1.0 2.0
   46    43   -66    59   0.11700  1.0 3.0
   46    53    57    58   7.00000 -1.0 2.0
   46    53    57    65   7.00000 -1.0 2.0
   46    54    59    60   0.00000  1.0 1.0
   46    54   -59    66   0.40000  1.0 3.0
   46    54    61    62   0.23200  1.0 3.0
   46    54    61    67   1.32350  1.0 1.0
   46    54    61    67   0.47700 -1.0 2.0
   46    54    61    67   0.26100  1.0 3.0
   46    54    61    71   1.32350  1.0 1.0
   46    54    61    71   0.47700 -1.0 2.0
   46    54    61    71   0.26100  1.0 3.0
   53    33   -37    40   0.18050 -1.0 2.0
   53    33    37    56   0.18050 -1.0 2.0
   53    33    38    74   0.65300  1.0 1.0
   53    33    38    74  -0.03850 -1.0 2.0
   53    33    38    74   0.33900  1.0 3.0
   53    33    38    39   0.30150 -1.0 2.0
   53    46    54    55   0.00000  1.0 1.0
   53    46    54    59  -0.12500  1.0 1.0
   53    46    54    59  -0.12500 -1.0 2.0
   53    46    54    59   0.25000  1.0 3.0
   53    46    54    61   0.25450  1.0 1.0
   53    46    54    61  -0.61700 -1.0 2.0
   53    46    54    61  -0.23550  1.0 3.0
   53    57   -65    74   0.15800  1.0 1.0
   53    57   -65    74   1.85350 -1.0 2.0
   53    57   -65    74  -0.48700  1.0 3.0
   53    57    65    85   0.15800  1.0 1.0
   53    57    65    85   1.85350 -1.0 2.0
   53    57    65    85  -0.48700  1.0 3.0
   57    65    74    79   3.62500 -1.0 2.0
   57    65    74    38   3.62500 -1.0 2.0
   57    65    85    83   3.62500 -1.0 2.0
   57    65    85    86   3.62500 -1.0 2.0
   58    57    65    74  -0.01750  1.0 1.0
   58    57    65    74  -0.32000 -1.0 2.0
   58    57    65    74   0.00600  1.0 3.0
   58    57    65    85  -0.01750  1.0 1.0
   58    57    65    85  -0.32000 -1.0 2.0
   58    57    65    85   0.00600  1.0 3.0
   65    74    79    80   3.62500 -1.0 2.0
   65    74    79    81   3.62500 -1.0 2.0
   65    74   -38    33   2.26350  1.0 1.0
   65    74   -38    33   0.76750 -1.0 2.0
   65    74   -38    33   0.22500  1.0 3.0
   65    74    38    39   1.05000 -1.0 2.0
   65    85    86    87   1.63200 -1.0 2.0
   74    65    85    83   3.62500 -1.0 2.0
   74    65    85    86   3.62500 -1.0 2.0
   74    79    81    82   3.62500 -1.0 2.0
   74    79   -81    83   3.62500 -1.0 2.0
   79    74    38    33   2.26350  1.0 1.0
   79    74    38    33   0.76750 -1.0 2.0
   79    74    38    33   0.22500  1.0 3.0
   79    74    38    39   1.05000 -1.0 2.0
   79    81    83    84   3.62500 -1.0 2.0
   79    81    83    85   3.62500 -1.0 2.0
   80    79    81    82   3.62500 -1.0 2.0
   80    79    81    83   3.62500 -1.0 2.0
   81    83   -85    65   3.62500 -1.0 2.0
   81    83    85    86   3.62500 -1.0 2.0
   82    81    83    84   3.62500 -1.0 2.0
   82    81    83    85   3.62500 -1.0 2.0
   83    85    86    87   1.63200 -1.0 2.0
   84    83    85    65   3.62500 -1.0 2.0
   84    83    85    86   3.62500 -1.0 2.0
   85    65   -74    79   3.62500 -1.0 2.0
   85    65    74    38   3.62500 -1.0 2.0
   85    86    87    88   0.08050  1.0 3.0
   85    86    87    89  -0.32850  1.0 1.0
   85    86    87    89  -0.35800 -1.0 2.0
   85    86    87    89   0.33950  1.0 3.0
   85    86    87   102  -0.25600  1.0 1.0
   85    86    87   102  -0.40050 -1.0 2.0
   85    86    87   102   0.34700  1.0 3.0
   86    87    89    90   0.23400  1.0 3.0
   86    87    89    91   0.23400  1.0 3.0
   86    87    89    92   0.62750  1.0 1.0
   86    87    89    92  -0.30950 -1.0 2.0
   86    87    89    92   0.27300  1.0 3.0
   86    87   102    98  -0.81800  1.0 1.0
   87    89    92    93   0.15000  1.0 3.0
   87    89    92    94   3.97050  1.0 1.0
   87    89    92    96   0.86500  1.0 1.0
   87    89    92    96  -0.17500 -1.0 2.0
   87    89    92    96   0.20800  1.0 3.0
   88    87    89    90   0.15000  1.0 3.0
   88    87    89    91   0.15000  1.0 3.0
   88    87    89    92   0.15000  1.0 3.0
   88    87   102    98   0.37050  1.0 3.0
   89    87   102    98   0.06250  1.0 1.0
   89    87   102    98  -0.01100 -1.0 2.0
   89    87   102    98   0.28050  1.0 3.0
   89    92    94    95   0.15000  1.0 3.0
   89    92   -94    98   0.56750  1.0 1.0
   89    92   -94    98  -0.07550 -1.0 2.0
   89    92   -94    98   0.20000  1.0 3.0
   89    92    94   100   0.86500  1.0 1.0
   89    92    94   100  -0.17500 -1.0 2.0
   89    92    94   100   0.20800  1.0 3.0
   89    92    96    97  -0.11600  1.0 1.0
   89    92    96    97  -0.09450 -1.0 2.0
   89    92    96    97   0.21250  1.0 3.0
   90    89    92    93   0.15000  1.0 3.0
   90    89    92    94   0.15000  1.0 3.0
   90    89    92    96   0.23400  1.0 3.0
   91    89    92    93   0.15000  1.0 3.0
   91    89    92    94   0.15000  1.0 3.0
   91    89    92    96   0.23400  1.0 3.0
   92    94    98    99   0.15000  1.0 3.0
   92    94    98   102   0.62750  1.0 1.0
   92    94    98   102  -0.30950 -1.0 2.0
   92    94    98   102   0.27300  1.0 3.0
   92    94    98   103   0.56750  1.0 1.0
   92    94    98   103  -0.07550 -1.0 2.0
   92    94    98   103   0.20000  1.0 3.0
   92    94   100   101  -0.11600  1.0 1.0
   92    94   100   101  -0.09450 -1.0 2.0
   92    94   100   101   0.21250  1.0 3.0
   93    92    94    95   0.15000  1.0 3.0
   93    92    94    98   0.15000  1.0 3.0
   93    92    94   100   0.23400  1.0 3.0
   93    92    96    97   0.19450  1.0 3.0
   94    92    96    97  -0.11600  1.0 1.0
   94    92    96    97  -0.09450 -1.0 2.0
   94    92    96    97   0.21250  1.0 3.0
   94    98  -102    87   0.06250  1.0 1.0
   94    98  -102    87  -0.01100 -1.0 2.0
   94    98  -102    87   0.28050  1.0 3.0
   94    98   103   104   0.15000  1.0 3.0
   94    98   103   105   0.15000  1.0 3.0
   94    98   103   106   0.15000  1.0 3.0
   95    94    98    99   0.15000  1.0 3.0
   95    94    98   102   0.23400  1.0 3.0
   95    94    98   103   0.15000  1.0 3.0
   95    94   100   101   0.19450  1.0 3.0
   98    94   100   101  -0.11600  1.0 1.0
   98    94   100   101  -0.09450 -1.0 2.0
   98    94   100   101   0.21250  1.0 3.0
   99    98   102    87   0.37050  1.0 3.0
   99    98   103   104   0.15000  1.0 3.0
   99    98   103   105   0.15000  1.0 3.0
   99    98   103   106   0.15000  1.0 3.0
  102    87    89    90   0.23400  1.0 3.0
  102    87    89    91   0.23400  1.0 3.0
  102    87   -89    92   0.62750  1.0 1.0
  102    87   -89    92  -0.30950 -1.0 2.0
  102    87   -89    92   0.27300  1.0 3.0
  102    98   103   104   0.23400  1.0 3.0
  102    98   103   105   0.23400  1.0 3.0
  102    98   103   106   0.23400  1.0 3.0
  103    98   102    87   0.06250  1.0 1.0
  103    98   102    87  -0.01100 -1.0 2.0
  103    98   102    87   0.28050  1.0 3.0
  100    94    98    99   0.23400  1.0 3.0
  100    94    98   102   3.69350  1.0 1.0
  100    94    98   102  -1.82950 -1.0 2.0
  100    94    98   103   0.86500  1.0 1.0
  100    94    98   103  -0.17500 -1.0 2.0
  100    94    98   103   0.20800  1.0 3.0
   96    92    94    95   0.23400  1.0 3.0
   96    92    94    98   0.86500  1.0 1.0
   96    92    94    98  -0.17500 -1.0 2.0
   96    92    94    98   0.20800  1.0 3.0
   96    92    94   100   3.75450  1.0 1.0
   38    33    37    40   0.04300 -1.0 2.0
   38    33    37    56   0.04300 -1.0 2.0
   38    33    53    46   0.09700  1.0 1.0
   38    33    53    46   0.15600 -1.0 2.0
   38    33    53    46  -0.50800  1.0 3.0
   38    33   -53    57  -0.51250  1.0 1.0
   38    33   -53    57  -0.88800 -1.0 2.0
   38    33   -53    57   0.08850  1.0 3.0
   38    74    79    80   3.62500 -1.0 2.0
   38    74    79    81   3.62500 -1.0 2.0
   54    46    53    33   1.00000 -1.0 2.0
   54    46    53    57  -0.54700  1.0 1.0
   54    46    53    57   1.23000 -1.0 2.0
   54    59   -66    43   1.63150  1.0 1.0
   54    59   -66    43   2.92000 -1.0 2.0
   54    61    67    68   0.15000  1.0 3.0
   54    61    67    69   0.15000  1.0 3.0
   54    61    67    70   0.15000  1.0 3.0
   54    61    71    72   0.15000  1.0 3.0
   54    61    71    73   0.15000  1.0 3.0
   54    61    71    75   0.65000  1.0 1.0
   54    61    71    75  -0.02500 -1.0 2.0
   54    61    71    75   0.10000  1.0 3.0
   55    54    59    60   0.00000  1.0 1.0
   55    54    59    66   0.00000  1.0 1.0
   55    54    61    62   0.15000  1.0 3.0
   55    54    61    67   0.15000  1.0 3.0
   55    54    61    71   0.15000  1.0 3.0
   59    54    61    62  -0.03800  1.0 3.0
   59    54    61    67   0.33900  1.0 1.0
   59    54    61    67   0.63800 -1.0 2.0
   59    54    61    71   0.33900  1.0 1.0
   59    54    61    71   0.63800 -1.0 2.0
   60    59    66    43   3.00000 -1.0 2.0
   66    43    46    53   0.75000  1.0 1.0
   66    43    46    53  -0.75000 -1.0 2.0
   66    43   -46    54   0.00000  1.0 1.0
   61    54    59    60   0.00000  1.0 1.0
   61    54    59    66   0.36750  1.0 3.0
   61    71    75    76   0.15000  1.0 3.0
   61    71    75    77   0.15000  1.0 3.0
   61    71    75    78   0.15000  1.0 3.0
   62    61    67    68   0.15000  1.0 3.0
   62    61    67    69   0.15000  1.0 3.0
   62    61    67    70   0.15000  1.0 3.0
   62    61    71    72   0.15000  1.0 3.0
   62    61    71    73   0.15000  1.0 3.0
   62    61    71    75   0.15000  1.0 3.0
   67    61    71    72   0.15000  1.0 3.0
   67    61    71    73   0.15000  1.0 3.0
   67    61    71    75   0.65000  1.0 1.0
   67    61    71    75  -0.02500 -1.0 2.0
   67    61    71    75   0.10000  1.0 3.0
   71    61    67    68   0.15000  1.0 3.0
   71    61    67    69   0.15000  1.0 3.0
   71    61    67    70   0.15000  1.0 3.0
   72    71    75    76   0.15000  1.0 3.0
   72    71    75    77   0.15000  1.0 3.0
   72    71    75    78   0.15000  1.0 3.0
   73    71    75    76   0.15000  1.0 3.0
   73    71    75    77   0.15000  1.0 3.0
   73    71    75    78   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
   40    56    37    33   4.00000 -1.0 2.0
   41    43    40    37   4.00000 -1.0 2.0
   45    42    41    40   1.10000 -1.0 2.0
   47    49    45    41   4.00000 -1.0 2.0
   56    48    47    45   1.10000 -1.0 2.0
   47    63    56    37   4.00000 -1.0 2.0
   54    53    46    43   1.00000 -1.0 2.0
   33    46    53    57   1.10000 -1.0 2.0
   65    58    57    53   1.10000 -1.0 2.0
   74    85    65    57   4.00000 -1.0 2.0
   79    38    74    65   4.00000 -1.0 2.0
   81    80    79    74   1.10000 -1.0 2.0
   83    82    81    79   1.10000 -1.0 2.0
   85    84    83    81   1.10000 -1.0 2.0
   83    86    85    65   4.00000 -1.0 2.0
   33    74    38    39  10.50000 -1.0 2.0
   54    66    59    60  10.50000 -1.0 2.0
END
