* LIGAND DATABASE FILE (OPLS2005)
*
001     106   111    199    329     595
    1     0 S   NP   _N1_     1    28.70117    96.23698   -18.37389
    2     1 S   H    _HN1     2     1.02838    42.65683   138.26151
    3     1 S   H    _H1_     3     1.02787    79.97134   -91.10673
    4     1 S   H    _H2_     4     1.02955    86.52977    18.11860
    5     1 S   CT   _CA1     5     1.50125   153.10048   149.04094
    6     5 S   HC   _HA1     6     1.09602   105.16889    51.58829
    7     5 S   CO3  _C1_     7     1.53790   112.06378   -68.16897
    8     7 S   O2Z  _O11     8     1.26322   115.02375   -53.21060
    9     7 S   O2Z  _O12     9     1.26241   114.91146   125.49251
   10     5 S   CT   _CB1    10     1.53144   107.31233   168.96349
   11    10 S   HC   HB11    11     1.09816   109.15231   -53.33016
   12    10 S   HC   HB12    12     1.09804   110.64573    63.25090
   13    10 S   CT   _CG1    13     1.52885   112.43866  -174.47089
   14    13 S   HC   HG11    14     1.09505   110.00647   -67.57659
   15    13 S   HC   HG12    15     1.09647   109.90245    51.66217
   16    13 S   C    _CD1    16     1.51763   112.72633   172.06514
   17    16 S   O    _OE1    17     1.22723   123.22006     0.43431
   18    16 S   N    _N2_    18     1.38724   111.68822  -179.38962
   19    18 S   H    _HN2    19     1.01670   118.95312     0.01978
   20    18 S   CT1  _CA2    20     1.46395   123.30379   178.84818
   21    20 S   HC   _HA2    21     1.09733   109.33284    -8.05262
   22    20 S   C    _C2_    22     1.53441   108.56232  -123.70708
   23    22 S   O    _O2_    23     1.23030   122.09421  -147.56918
   24    20 S   CT   _CB2    32     1.53535   111.54043   113.99033
   25    24 S   HC   HB21    33     1.09333   108.95929    58.08788
   26    24 S   HC   HB22    34     1.09472   110.56657   176.40882
   27    22 S   N    _N3_    24     1.38466   113.51807    39.84973
   28    27 S   H    _HN3    25     1.01513   118.93134    -0.81901
   29    24 S   S    _SG2    35     1.82979   110.93864   -64.01292
   30    27 S   CT   _CA3    26     1.45459   123.55782   175.09751
   31    30 S   HC   HA31    27     1.09514   109.36702    21.90579
   32    30 S   HC   HA32    28     1.09500   107.09047   138.92828
   33    29 S   CT   _C27    36     1.86861   101.77047   158.83736
   34    30 S   CO3  _C3_    29     1.52925   112.99941  -101.65771
   35    34 S   O2Z  _O31    30     1.26414   115.36049   -45.48789
   36    34 S   O2Z  _O32    31     1.26351   115.01889   135.40553
   37    33 S   CO4  _C26    37     1.53301   107.36736   -57.23769
   38    37 S   O    _O40    38     1.22815   123.11896   112.47252
   39    33 S   CT   _C28    95     1.55505   111.84375    64.48844
   40    39 S   HC   _H5_    96     1.09724   109.13034   -73.22574
   41    37 S   CA   _C24    39     1.48583   117.72574   -65.90671
   42    39 S   CT   _C35    97     1.53410   116.39516    46.66148
   43    42 S   HC   _H23    98     1.09407   112.15776    49.72953
   44    42 S   HC   _H24    99     1.09376   111.71886   -71.57370
   45    42 S   HC   _H25   100     1.09578   110.25005   168.68835
   46    41 S   CA   _C23    40     1.40127   119.28222   -24.20982
   47    46 S   CA   _C22    41     1.40068   118.82666   176.40425
   48    46 S   CO4  _C32    85     1.48965   120.17343    -4.16349
   49    48 S   O    _O42    86     1.22934   120.18400  -175.39844
   50    47 S   CA   _C21    42     1.39675   120.78773    -0.26170
   51    50 S   HA   _H17    43     1.08962   118.90715  -178.80270
   52    47 S   OH   _O45    83     1.36924   123.59404  -179.89532
   53    52 S   HO   _H26    84     0.97354   109.08904    -0.25411
   54    33 S   CT   _C31    87     1.53931   108.64418  -173.00703
   55    54 S   HC   _H7_    88     1.09957   108.72720   -52.90997
   56    50 S   CA   _C20    44     1.40343   121.19690     0.72981
   57    54 S   CT   _C30    89     1.53526   111.74836  -171.89879
   58    57 S   HC   _H19    90     1.09726   110.01636   173.69690
   59    57 S   HC   _H20    91     1.09826   109.51222   -69.74221
   60    56 S   CA   _C16    45     1.47642   119.48214  -179.64834
   61    41 S   CA   _C25    80     1.40967   120.49894   153.35408
   62    57 S   CT   _C29    92     1.52748   111.08430    51.54466
   63    62 S   HC   _H6_    93     1.09545   109.62556    64.88678
   64    60 S   CA   _C15    46     1.40113   119.46061   -64.87275
   65    64 S   HA   _H15    47     1.08903   119.99610    -1.26052
   66    61 S   OH   _O39    81     1.37419   121.82384     4.19353
   67    66 S   HO   _H18    82     0.97325   109.41563     6.26156
   68    62 S   OS   _O41    94     1.42992   109.42982   -55.77367
   69    62 S   CT   _C33   101     1.52855   110.52559  -174.27152
   70    69 S   HC   _H21   102     1.09781   109.62131    69.46380
   71    69 S   HC   _H22   103     1.09714   109.79684   -48.81760
   72    64 S   CA   _C14    48     1.39538   120.97699   178.71854
   73    69 S   CO3  _C34   104     1.53346   115.43469  -168.99998
   74    73 S   O2Z  _O44   105     1.26129   116.76130    14.66354
   75    73 S   O2Z  _O43   106     1.26550   114.01778  -166.17750
   76    72 S   CA   _C13    49     1.40335   120.92262    -0.08847
   77    72 S   OH   _O46    78     1.37012   115.41745   179.90935
   78    77 S   HO   _H27    79     0.97363   109.03093   178.49351
   79    76 S   CA   _C18    50     1.39951   119.21996     0.08623
   80    60 S   CA   _C17    51     1.40965   122.60565   113.89370
   81    79 S   CO4  _C19    54     1.48288   119.71762  -179.35139
   82    81 S   O    _O37    55     1.22670   120.57217   174.84953
   83    80 S   OH   _O38    52     1.37525   116.72813     1.06404
   84    83 S   HO   _H16    53     0.97300   109.20187  -177.29022
   85    81 S   CM   _C6_    56     1.48515   118.86084    -5.04003
   86    85 S   CM   _C7_    57     1.33989   120.78068     5.59752
   87    76 S   CO4  _C12    58     1.47973   120.63222  -179.73312
   88    87 S   O    _O36    59     1.22652   120.77946     3.21461
   89    86 S   CT   _C8_    60     1.50540   121.17255   177.90100
   90    89 S   HC   _H11    61     1.09644   110.81949   138.79491
   91    89 S   HC   _H12    62     1.09771   107.71159  -103.68486
   92    89 S   CT   _C9_    63     1.53277   111.58364    17.37685
   93    92 S   HC   _H4_    64     1.09646   109.74545    71.48171
   94    92 S   OS   _O33    65     1.43218   108.30056   -48.67201
   95    92 S   CT   _C10    72     1.52766   110.79214  -167.26680
   96    95 S   HC   _H13    73     1.09769   109.68074    69.38971
   97    95 S   HC   _H14    74     1.09712   109.72081   -48.94999
   98    85 S   CT   _C5_    66     1.51516   117.51436  -177.29687
   99    98 S   HC   _H3_    67     1.09654   108.74839   -49.17750
  100    95 S   CO3  _C11    75     1.53342   115.37409  -169.16297
  101   100 S   O2Z  _O35    76     1.26127   116.78251    12.59341
  102   100 S   O2Z  _O34    77     1.26549   113.99889  -168.15498
  103    98 S   CT   _C4_    68     1.53017   113.10408    70.79782
  104   103 S   HC   _H8_    69     1.09509   111.88094    54.32239
  105   103 S   HC   _H9_    70     1.09423   111.65359   -66.34122
  106   103 S   HC   _H10    71     1.09547   110.34070   173.18514
  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  12   5   4   3
  20   2   1   1  15   5  14   7  12   6   3   2   1  13  10  10
   3   9   4   2   1   8   4  10   9   5   4  12   4   8   5   9
   4   1   1   4   5   4   3   9   2   1   1  12   3   1  10   6
  10   3   1   1  14  12   6   1  10   5   4  11   6  10   6   4
   3   5   4   2   1   1   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    54    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    48    54    55    57    68    39    40    42  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    46    61    48    49    54    55    57    58    59    62    68    39    40    42    43    44    45  
   35    36  
   36  
    0  
   38    41    46    47    56    61    66    48    54    55    57    68    39    40    42  
   41    46    61    54    39  
   40    42    43    44    45    69    41    48    54    55    57    62    63    68  
   42    43    44    45    54    62    68  
   46    47    50    56    60    61    66    67    52    48    49    54  
   43    44    45    54    62    68  
   44    45    68  
   45    68  
   68  
   47    50    51    56    61    66    52    53    48    49    54    55    57  
   50    51    56    60    61    52    53    48    49    54  
   49    54    55    57    58    59    62    50    52    61  
   54    55    57  
   51    56    60    64    80    61    66    52    53  
   56    60    61    52  
   53    56  
    0  
   55    57    58    59    62    63    68    69  
   57    58    59    62  
   60    64    65    72    79    80    83    61    66    67  
   58    59    62    63    68    69    70    71    73  
   59    62    63    68    69  
   62    63    68    69  
   64    65    72    76    79    80    83    84    81    77    61    66  
   66    67    64    80  
   63    68    69    70    71    73    74    75  
   68    69    70    71    73  
   65    72    76    79    80    83    87    77    78  
   72    76    80    77  
   67  
    0  
   69    70    71    73  
   70    71    73    74    75  
   71    73    74    75  
   73    74    75  
   76    79    80    81    86    87    88    77    78  
   74    75  
   75  
    0  
   79    80    83    81    82    85    86    87    88    89    77    78  
   78    79    87  
    0  
   80    83    84    81    82    85    86    87    88    98  
   83    84    81    82    85    87  
   82    85    86    87    89    94    98    99   103    83  
   85    86    98  
   84  
    0  
   86    87    88    89    90    91    92    94    98    99   103   104   105   106  
   87    88    89    90    91    92    93    94    98    99   103    95  
   88    89    90    91    92    98  
   89  
   90    91    92    93    94    98    95    96    97   100  
   91    92    93    94    95  
   92    93    94    95  
   93    94    98    99   103    95    96    97   100   101   102  
   94    98    95    96    97   100  
   98    99   103   104   105   106    95    96    97   100  
   96    97   100   101   102    98  
   97   100   101   102  
  100   101   102  
   99   103   104   105   106  
  103   104   105   106  
  101   102  
  102  
    0  
  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   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   39   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   42   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   48   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   49   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   50   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   51   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   52   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   53   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   54   3.5000   0.0660  -0.060000   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   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   57   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   61   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   62   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   65   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   66   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   67   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   68   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   69   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   72   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   73   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   74   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   75   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   76   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   77   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   78   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   79   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   80   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   81   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   82   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   83   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   84   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   85   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   86   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   87   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   88   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   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   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   93   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   94   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   95   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   96   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   97   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   98   3.5000   0.0660   0.239000   1.9750   1.7500   0.005000000  -0.741685710
   99   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  100   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
  101   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
  102   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
  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  1.522
   33    54   268.000  1.529
   33    39   268.000  1.529
   37    38   570.000  1.229
   37    41   310.000  1.470
   41    46   469.000  1.400
   41    61   469.000  1.400
   46    47   469.000  1.400
   46    48   310.000  1.470
   47    50   469.000  1.400
   47    52   450.000  1.364
   50    51   367.000  1.080
   50    56   469.000  1.400
   56    60   375.000  1.464
   56    61   469.000  1.400
   60    64   469.000  1.400
   60    80   469.000  1.400
   64    65   367.000  1.080
   64    72   469.000  1.400
   72    76   469.000  1.400
   72    77   450.000  1.364
   76    79   469.000  1.400
   76    87   310.000  1.470
   79    80   469.000  1.400
   79    81   310.000  1.470
   80    83   450.000  1.364
   83    84   553.000  0.945
   81    82   570.000  1.229
   81    85   320.000  1.462
   85    86   549.000  1.340
   85    98   317.000  1.510
   86    87   320.000  1.462
   86    89   317.000  1.510
   87    88   570.000  1.229
   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   320.000  1.410
   92    95   268.000  1.529
   94    98   320.000  1.410
   98    99   340.000  1.090
   98   103   268.000  1.529
  103   104   340.000  1.090
  103   105   340.000  1.090
  103   106   340.000  1.090
   95    96   340.000  1.090
   95    97   340.000  1.090
   95   100   317.000  1.522
  100   101   656.000  1.250
  100   102   656.000  1.250
   77    78   553.000  0.945
   61    66   450.000  1.364
   66    67   553.000  0.945
   52    53   553.000  0.945
   48    49   570.000  1.229
   48    54   317.000  1.522
   54    55   340.000  1.090
   54    57   268.000  1.529
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    62   268.000  1.529
   62    63   340.000  1.090
   62    68   320.000  1.410
   62    69   268.000  1.529
   68    39   320.000  1.410
   39    40   340.000  1.090
   39    42   268.000  1.529
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    45   340.000  1.090
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    73   317.000  1.522
   73    74   656.000  1.250
   73    75   656.000  1.250
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  110.18000
   29    33    54    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    80.00000  120.40000
   33    37    41    65.00000  115.47100
   33    54    48    63.00000  111.10000
   33    54    55    37.50000  110.70000
   33    54    57    58.35000  112.70000
   33    39    68    50.00000  109.50000
   33    39    40    37.50000  110.70000
   33    39    42    58.35000  112.70000
   37    41    46    60.00000  119.52600
   37    41    61    60.00000  119.52600
   41    37    38    75.00000  123.78400
   41    46    47    63.00000  120.00000
   41    46    48    60.00000  119.52600
   41    61    56    63.00000  120.00000
   41    61    66    70.00000  120.00000
   46    47    50    63.00000  120.00000
   46    47    52    70.00000  120.00000
   46    48    49    75.00000  123.78400
   46    48    54    65.00000  115.47100
   47    50    51    35.00000  120.00000
   47    50    56    63.00000  120.00000
   47    52    53    35.00000  113.00000
   50    56    60    60.00000  122.76000
   50    56    61    63.00000  120.00000
   56    50    51    35.00000  120.00000
   56    60    64    60.00000  122.76000
   56    60    80    60.00000  122.76000
   56    61    66    70.00000  120.00000
   60    64    65    35.00000  120.00000
   60    64    72    63.00000  120.00000
   60    80    79    63.00000  120.00000
   60    80    83    70.00000  120.00000
   64    72    76    63.00000  120.00000
   64    72    77    70.00000  120.00000
   72    64    65    35.00000  120.00000
   72    76    79    63.00000  120.00000
   72    76    87    60.00000  119.52600
   72    77    78    35.00000  113.00000
   76    79    80    63.00000  120.00000
   76    79    81    60.00000  119.52600
   76    87    86    65.00000  117.02400
   76    87    88    75.00000  123.78400
   79    80    83    70.00000  120.00000
   79    81    82    75.00000  123.78400
   79    81    85    65.00000  117.02400
   80    60    64    63.00000  120.00000
   80    83    84    35.00000  113.00000
   81    79    80    60.00000  119.52600
   81    85    86    65.00000  118.96000
   81    85    98    65.00000  116.34900
   85    81    82    80.00000  123.72100
   85    86    87    65.00000  118.96000
   85    86    89    70.00000  124.00000
   85    98    94    85.00000  110.90400
   85    98    99    35.00000  109.50000
   85    98   103    70.00000  112.02700
   86    87    88    80.00000  123.72100
   86    89    90    35.00000  109.50000
   86    89    91    35.00000  109.50000
   86    89    92    70.00000  112.02700
   87    76    79    60.00000  119.52600
   89    86    87    65.00000  116.34900
   89    92    93    37.50000  110.70000
   89    92    94    50.00000  109.50000
   89    92    95    58.35000  112.70000
   91    89    90    33.00000  107.80000
   92    89    90    37.50000  110.70000
   92    89    91    37.50000  110.70000
   92    94    98    60.00000  109.50000
   92    95    96    37.50000  110.70000
   92    95    97    37.50000  110.70000
   92    95   100    70.00000  109.69300
   94    92    93    35.00000  109.50000
   94    98    99    35.00000  109.50000
   94    98   103    50.00000  109.50000
   98    85    86    70.00000  124.00000
   98   103   104    37.50000  110.70000
   98   103   105    37.50000  110.70000
   98   103   106    37.50000  110.70000
  103    98    99    37.50000  110.70000
  105   103   104    33.00000  107.80000
  106   103   104    33.00000  107.80000
  106   103   105    33.00000  107.80000
   95    92    93    37.50000  110.70000
   95    92    94    50.00000  109.50000
   95   100   101    70.00000  117.00000
   95   100   102    70.00000  117.00000
   97    95    96    33.00000  107.80000
  100    95    96    35.00000  109.50000
  100    95    97    35.00000  109.50000
  102   100   101    80.00000  126.00000
   77    72    76    70.00000  120.00000
   61    41    46    63.00000  120.00000
   61    56    60    60.00000  122.76000
   61    66    67    35.00000  113.00000
   52    47    50    70.00000  120.00000
   48    46    47    60.00000  119.52600
   48    54    55    35.00000  109.50000
   48    54    57    63.00000  111.10000
   54    33    37    63.00000  111.10000
   54    48    49    80.00000  120.40000
   54    57    58    37.50000  110.70000
   54    57    59    37.50000  110.70000
   54    57    62    58.35000  112.70000
   57    54    55    37.50000  110.70000
   57    62    63    37.50000  110.70000
   57    62    68    50.00000  109.50000
   57    62    69    58.35000  112.70000
   59    57    58    33.00000  107.80000
   62    57    58    37.50000  110.70000
   62    57    59    37.50000  110.70000
   62    68    39    60.00000  109.50000
   62    69    70    37.50000  110.70000
   62    69    71    37.50000  110.70000
   62    69    73    70.00000  109.69300
   68    62    63    35.00000  109.50000
   68    39    40    35.00000  109.50000
   68    39    42    50.00000  109.50000
   39    33    37    63.00000  111.10000
   39    33    54    58.35000  112.70000
   39    42    43    37.50000  110.70000
   39    42    44    37.50000  110.70000
   39    42    45    37.50000  110.70000
   42    39    40    37.50000  110.70000
   44    42    43    33.00000  107.80000
   45    42    43    33.00000  107.80000
   45    42    44    33.00000  107.80000
   69    62    63    37.50000  110.70000
   69    62    68    50.00000  109.50000
   69    73    74    70.00000  117.00000
   69    73    75    70.00000  117.00000
   71    69    70    33.00000  107.80000
   73    69    70    35.00000  109.50000
   73    69    71    35.00000  109.50000
   75    73    74    80.00000  126.00000
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    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    54   0.01700  1.0 1.0
   24    29    33    54  -0.23550 -1.0 2.0
   24    29    33    54   0.21350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.30150 -1.0 2.0
   29    33    37    41   0.65300  1.0 1.0
   29    33    37    41  -0.03850 -1.0 2.0
   29    33    37    41   0.33900  1.0 3.0
   29    33    54    48   0.56750  1.0 1.0
   29    33    54    48  -0.07550 -1.0 2.0
   29    33    54    48   0.20000  1.0 3.0
   29    33    54    55   0.15000  1.0 3.0
   29    33    54    57   0.44750  1.0 1.0
   29    33    54    57  -0.17800 -1.0 2.0
   29    33    54    57   0.20200  1.0 3.0
   29    33    39    68   0.56750  1.0 1.0
   29    33    39    68  -0.07550 -1.0 2.0
   29    33    39    68   0.20000  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    42   0.44750  1.0 1.0
   29    33    39    42  -0.17800 -1.0 2.0
   29    33    39    42   0.20200  1.0 3.0
   33    37    41    46   2.26350  1.0 1.0
   33    37    41    46   0.76750 -1.0 2.0
   33    37    41    46   0.22500  1.0 3.0
   33    37    41    61   2.26350  1.0 1.0
   33    37    41    61   0.76750 -1.0 2.0
   33    37    41    61   0.22500  1.0 3.0
   33    54    57    58   0.15000  1.0 3.0
   33    54    57    59   0.15000  1.0 3.0
   33    54    57    62   0.56750  1.0 1.0
   33    54    57    62  -0.07550 -1.0 2.0
   33    54    57    62   0.20000  1.0 3.0
   33    39    42    43   0.15000  1.0 3.0
   33    39    42    44   0.15000  1.0 3.0
   33    39    42    45   0.15000  1.0 3.0
   37    33    54    48   0.11950  1.0 1.0
   37    33    54    48   0.20300 -1.0 2.0
   37    33    54    48  -0.70800  1.0 3.0
   37    33    54    55  -0.11250  1.0 3.0
   37    33    54    57  -0.95700  1.0 1.0
   37    33    54    57  -0.18200 -1.0 2.0
   37    33    54    57   0.29450  1.0 3.0
   37    33    39    68  -0.09450  1.0 1.0
   37    33    39    68  -1.12950 -1.0 2.0
   37    33    39    68   0.54000  1.0 3.0
   37    33    39    40  -0.11250  1.0 3.0
   37    33    39    42  -0.95700  1.0 1.0
   37    33    39    42  -0.18200 -1.0 2.0
   37    33    39    42   0.29450  1.0 3.0
   37    41    46    47   3.62500 -1.0 2.0
   37    41   -46    48   3.62500 -1.0 2.0
   37    41    61    56   3.62500 -1.0 2.0
   37    41    61    66   3.62500 -1.0 2.0
   38    37    41    46   1.05000 -1.0 2.0
   38    37    41    61   1.05000 -1.0 2.0
   41    46    47    50   3.62500 -1.0 2.0
   41    46    47    52   3.62500 -1.0 2.0
   41    46    48    49   1.05000 -1.0 2.0
   41    46    48    54   2.26350  1.0 1.0
   41    46    48    54   0.76750 -1.0 2.0
   41    46    48    54   0.22500  1.0 3.0
   41    61    66    67   0.84100 -1.0 2.0
   46    41    61    56   3.62500 -1.0 2.0
   46    41    61    66   3.62500 -1.0 2.0
   46    47    50    51   3.62500 -1.0 2.0
   46    47   -50    56   3.62500 -1.0 2.0
   46    47    52    53   0.84100 -1.0 2.0
   46    48   -54    33   0.05850 -1.0 2.0
   46    48   -54    33   0.17250  1.0 3.0
   46    48    54    55   0.00000  1.0 1.0
   46    48    54    57   0.05850 -1.0 2.0
   46    48    54    57   0.17250  1.0 3.0
   47    46    48    49   1.05000 -1.0 2.0
   47    46    48    54   2.26350  1.0 1.0
   47    46    48    54   0.76750 -1.0 2.0
   47    46    48    54   0.22500  1.0 3.0
   47    50    56    60   3.62500 -1.0 2.0
   47    50    56    61   3.62500 -1.0 2.0
   50    47    52    53   0.84100 -1.0 2.0
   50    56    60    64  -0.19450  1.0 1.0
   50    56    60    64   0.63300 -1.0 2.0
   50    56    60    64   0.07450  1.0 3.0
   50    56    60    80  -0.19450  1.0 1.0
   50    56    60    80   0.63300 -1.0 2.0
   50    56    60    80   0.07450  1.0 3.0
   50    56   -61    41   3.62500 -1.0 2.0
   50    56    61    66   3.62500 -1.0 2.0
   51    50    56    60   3.62500 -1.0 2.0
   51    50    56    61   3.62500 -1.0 2.0
   56    60    64    65   3.62500 -1.0 2.0
   56    60    64    72   3.62500 -1.0 2.0
   56    60    80    79   3.62500 -1.0 2.0
   56    60    80    83   3.62500 -1.0 2.0
   56    61    66    67   0.84100 -1.0 2.0
   60    56    61    41   3.62500 -1.0 2.0
   60    56    61    66   3.62500 -1.0 2.0
   60    64    72    76   3.62500 -1.0 2.0
   60    64    72    77   3.62500 -1.0 2.0
   60    80    83    84   0.84100 -1.0 2.0
   64    60    80    79   3.62500 -1.0 2.0
   64    60    80    83   3.62500 -1.0 2.0
   64    72   -76    79   3.62500 -1.0 2.0
   64    72    76    87   3.62500 -1.0 2.0
   64    72    77    78   0.84100 -1.0 2.0
   65    64    72    76   3.62500 -1.0 2.0
   65    64    72    77   3.62500 -1.0 2.0
   72    76    79    80   3.62500 -1.0 2.0
   72    76    79    81   3.62500 -1.0 2.0
   72    76    87    86  -0.11500  1.0 1.0
   72    76    87    86   1.10450 -1.0 2.0
   72    76    87    86  -0.48050  1.0 3.0
   72    76    87    88   1.05000 -1.0 2.0
   76    72    77    78   0.84100 -1.0 2.0
   76    79   -80    60   3.62500 -1.0 2.0
   76    79    80    83   3.62500 -1.0 2.0
   76    79    81    82   1.05000 -1.0 2.0
   76    79    81    85  -0.11500  1.0 1.0
   76    79    81    85   1.10450 -1.0 2.0
   76    79    81    85  -0.48050  1.0 3.0
   79    76    87    86  -0.11500  1.0 1.0
   79    76    87    86   1.10450 -1.0 2.0
   79    76    87    86  -0.48050  1.0 3.0
   79    76    87    88   1.05000 -1.0 2.0
   79    80    83    84   0.84100 -1.0 2.0
   79    81   -85    86  -1.65800  1.0 1.0
   79    81   -85    86   0.77650 -1.0 2.0
   79    81    85    98   1.50000 -1.0 2.0
   80    60    64    65   3.62500 -1.0 2.0
   80    60   -64    72   3.62500 -1.0 2.0
   80    79    81    82   1.05000 -1.0 2.0
   80    79    81    85  -0.11500  1.0 1.0
   80    79    81    85   1.10450 -1.0 2.0
   80    79    81    85  -0.48050  1.0 3.0
   81    79    80    60   3.62500 -1.0 2.0
   81    79    80    83   3.62500 -1.0 2.0
   81    85    86    87   7.00000 -1.0 2.0
   81    85    86    89   7.00000 -1.0 2.0
   81    85    98    94   0.09700  1.0 1.0
   81    85    98    94   0.15600 -1.0 2.0
   81    85    98    94  -0.50800  1.0 3.0
   81    85    98    99   0.15000  1.0 3.0
   81    85    98   103   0.09700  1.0 1.0
   81    85    98   103   0.15600 -1.0 2.0
   81    85    98   103  -0.50800  1.0 3.0
   82    81    85    86   1.00000 -1.0 2.0
   82    81    85    98  -0.64400  1.0 1.0
   82    81    85    98   0.26850 -1.0 2.0
   85    86   -87    76  -1.65800  1.0 1.0
   85    86   -87    76   0.77650 -1.0 2.0
   85    86    87    88   1.00000 -1.0 2.0
   85    86    89    90   0.00000  1.0 1.0
   85    86    89    91   0.00000  1.0 1.0
   85    86    89    92   0.09850  1.0 1.0
   85    86    89    92   0.15250 -1.0 2.0
   85    86    89    92  -0.50650  1.0 3.0
   85    98   103   104   0.15000  1.0 3.0
   85    98   103   105   0.15000  1.0 3.0
   85    98   103   106   0.15000  1.0 3.0
   86    85    98    94   0.39000  1.0 1.0
   86    85    98    94  -0.05800 -1.0 2.0
   86    85    98    94  -0.55150  1.0 3.0
   86    85    98    99   0.00000  1.0 1.0
   86    85    98   103   0.09850  1.0 1.0
   86    85    98   103   0.15250 -1.0 2.0
   86    85    98   103  -0.50650  1.0 3.0
   86    89    92    93   0.15000  1.0 3.0
   86    89   -92    94   0.61850  1.0 1.0
   86    89   -92    94  -0.22750 -1.0 2.0
   86    89   -92    94   0.15300  1.0 3.0
   86    89    92    95   0.34400  1.0 1.0
   86    89    92    95   0.09450 -1.0 2.0
   86    89    92    95   0.11100  1.0 3.0
   87    76    79    80   3.62500 -1.0 2.0
   87    76   -79    81   3.62500 -1.0 2.0
   87    86    89    90   0.15000  1.0 3.0
   87    86    89    91   0.15000  1.0 3.0
   87    86    89    92   0.09700  1.0 1.0
   87    86    89    92   0.15600 -1.0 2.0
   87    86    89    92  -0.50800  1.0 3.0
   89    86    87    76   1.50000 -1.0 2.0
   89    86    87    88  -0.64400  1.0 1.0
   89    86    87    88   0.26850 -1.0 2.0
   89    92    94    98   0.06250  1.0 1.0
   89    92    94    98  -0.01100 -1.0 2.0
   89    92    94    98   0.28050  1.0 3.0
   89    92    95    96   0.15000  1.0 3.0
   89    92    95    97   0.15000  1.0 3.0
   89    92    95   100  -1.63150  1.0 1.0
   89    92    95   100  -0.43550 -1.0 2.0
   89    92    95   100   0.24500  1.0 3.0
   90    89    92    93   0.15000  1.0 3.0
   90    89    92    94   0.23400  1.0 3.0
   90    89    92    95   0.15000  1.0 3.0
   91    89    92    93   0.15000  1.0 3.0
   91    89    92    94   0.23400  1.0 3.0
   91    89    92    95   0.15000  1.0 3.0
   92    94   -98    85  -0.77900  1.0 1.0
   92    94   -98    85  -0.36900 -1.0 2.0
   92    94   -98    85   0.40400  1.0 3.0
   92    94    98    99   0.37050  1.0 3.0
   92    94    98   103   0.06250  1.0 1.0
   92    94    98   103  -0.01100 -1.0 2.0
   92    94    98   103   0.28050  1.0 3.0
   92    95   100   101   0.41150 -1.0 2.0
   92    95   100   102   0.41150 -1.0 2.0
   93    92    94    98   0.37050  1.0 3.0
   93    92    95    96   0.15000  1.0 3.0
   93    92    95    97   0.15000  1.0 3.0
   93    92    95   100  -0.11250  1.0 3.0
   94    92    95    96   0.23400  1.0 3.0
   94    92    95    97   0.23400  1.0 3.0
   94    92    95   100  -3.35100  1.0 1.0
   94    92    95   100  -0.37050 -1.0 2.0
   94    92    95   100   0.22400  1.0 3.0
   94    98   103   104   0.23400  1.0 3.0
   94    98   103   105   0.23400  1.0 3.0
   94    98   103   106   0.23400  1.0 3.0
   98    85    86    87   7.00000 -1.0 2.0
   98    85   -86    89   7.00000 -1.0 2.0
   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
   95    92    94    98   0.06250  1.0 1.0
   95    92    94    98  -0.01100 -1.0 2.0
   95    92    94    98   0.28050  1.0 3.0
   96    95   100   101   0.00000  1.0 1.0
   96    95   100   102   0.00000  1.0 1.0
   97    95   100   101   0.00000  1.0 1.0
   97    95   100   102   0.00000  1.0 1.0
   77    72    76    79   3.62500 -1.0 2.0
   77    72    76    87   3.62500 -1.0 2.0
   61    41   -46    47   3.62500 -1.0 2.0
   61    41    46    48   3.62500 -1.0 2.0
   61    56    60    64  -0.19450  1.0 1.0
   61    56    60    64   0.63300 -1.0 2.0
   61    56    60    64   0.07450  1.0 3.0
   61    56    60    80  -0.19450  1.0 1.0
   61    56    60    80   0.63300 -1.0 2.0
   61    56    60    80   0.07450  1.0 3.0
   52    47    50    51   3.62500 -1.0 2.0
   52    47    50    56   3.62500 -1.0 2.0
   48    46    47    50   3.62500 -1.0 2.0
   48    46    47    52   3.62500 -1.0 2.0
   48    54    57    58  -0.11250  1.0 3.0
   48    54    57    59  -0.11250  1.0 3.0
   48    54    57    62  -0.95700  1.0 1.0
   48    54    57    62  -0.18200 -1.0 2.0
   48    54    57    62   0.29450  1.0 3.0
   49    48    54    33   0.30150 -1.0 2.0
   49    48    54    55   0.00000  1.0 1.0
   49    48    54    57   0.30150 -1.0 2.0
   54    33    37    38   0.30150 -1.0 2.0
   54    33   -37    41   0.05850 -1.0 2.0
   54    33   -37    41   0.17250  1.0 3.0
   54    33    39    68   0.62750  1.0 1.0
   54    33    39    68  -0.30950 -1.0 2.0
   54    33    39    68   0.27300  1.0 3.0
   54    33    39    40   0.15000  1.0 3.0
   54    33    39    42   0.56750  1.0 1.0
   54    33    39    42  -0.07550 -1.0 2.0
   54    33    39    42   0.20000  1.0 3.0
   54    57    62    63   0.15000  1.0 3.0
   54    57   -62    68   0.62750  1.0 1.0
   54    57   -62    68  -0.30950 -1.0 2.0
   54    57   -62    68   0.27300  1.0 3.0
   54    57    62    69   0.56750  1.0 1.0
   54    57    62    69  -0.07550 -1.0 2.0
   54    57    62    69   0.20000  1.0 3.0
   55    54    57    58   0.15000  1.0 3.0
   55    54    57    59   0.15000  1.0 3.0
   55    54    57    62   0.15000  1.0 3.0
   57    62    68    39   0.06250  1.0 1.0
   57    62    68    39  -0.01100 -1.0 2.0
   57    62    68    39   0.28050  1.0 3.0
   57    62    69    70   0.15000  1.0 3.0
   57    62    69    71   0.15000  1.0 3.0
   57    62    69    73  -1.63150  1.0 1.0
   57    62    69    73  -0.43550 -1.0 2.0
   57    62    69    73   0.24500  1.0 3.0
   58    57    62    63   0.15000  1.0 3.0
   58    57    62    68   0.23400  1.0 3.0
   58    57    62    69   0.15000  1.0 3.0
   59    57    62    63   0.15000  1.0 3.0
   59    57    62    68   0.23400  1.0 3.0
   59    57    62    69   0.15000  1.0 3.0
   62    68   -39    33   0.06250  1.0 1.0
   62    68   -39    33  -0.01100 -1.0 2.0
   62    68   -39    33   0.28050  1.0 3.0
   62    68    39    40   0.37050  1.0 3.0
   62    68    39    42   0.06250  1.0 1.0
   62    68    39    42  -0.01100 -1.0 2.0
   62    68    39    42   0.28050  1.0 3.0
   62    69    73    74   0.41150 -1.0 2.0
   62    69    73    75   0.41150 -1.0 2.0
   63    62    68    39   0.37050  1.0 3.0
   63    62    69    70   0.15000  1.0 3.0
   63    62    69    71   0.15000  1.0 3.0
   63    62    69    73  -0.11250  1.0 3.0
   68    62    69    70   0.23400  1.0 3.0
   68    62    69    71   0.23400  1.0 3.0
   68    62    69    73  -3.35100  1.0 1.0
   68    62    69    73  -0.37050 -1.0 2.0
   68    62    69    73   0.22400  1.0 3.0
   68    39    42    43   0.23400  1.0 3.0
   68    39    42    44   0.23400  1.0 3.0
   68    39    42    45   0.23400  1.0 3.0
   39    33    37    38   0.30150 -1.0 2.0
   39    33    37    41   0.05850 -1.0 2.0
   39    33    37    41   0.17250  1.0 3.0
   39    33    54    48  -0.95700  1.0 1.0
   39    33    54    48  -0.18200 -1.0 2.0
   39    33    54    48   0.29450  1.0 3.0
   39    33    54    55   0.15000  1.0 3.0
   39    33   -54    57   0.56750  1.0 1.0
   39    33   -54    57  -0.07550 -1.0 2.0
   39    33   -54    57   0.20000  1.0 3.0
   40    39    42    43   0.15000  1.0 3.0
   40    39    42    44   0.15000  1.0 3.0
   40    39    42    45   0.15000  1.0 3.0
   69    62    68    39   0.06250  1.0 1.0
   69    62    68    39  -0.01100 -1.0 2.0
   69    62    68    39   0.28050  1.0 3.0
   70    69    73    74   0.00000  1.0 1.0
   70    69    73    75   0.00000  1.0 1.0
   71    69    73    74   0.00000  1.0 1.0
   71    69    73    75   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
   35    30    34    36  10.50000 -1.0 2.0
   33    41    37    38  10.50000 -1.0 2.0
   46    61    41    37   4.00000 -1.0 2.0
   47    48    46    41   4.00000 -1.0 2.0
   50    52    47    46   4.00000 -1.0 2.0
   56    51    50    47   1.10000 -1.0 2.0
   60    61    56    50   4.00000 -1.0 2.0
   64    80    60    56   4.00000 -1.0 2.0
   72    65    64    60   1.10000 -1.0 2.0
   76    77    72    64   4.00000 -1.0 2.0
   79    87    76    72   4.00000 -1.0 2.0
   80    81    79    76   4.00000 -1.0 2.0
   79    83    80    60   4.00000 -1.0 2.0
   79    85    81    82  10.50000 -1.0 2.0
   81    98    85    86   1.10000 -1.0 2.0
   87    89    86    85   1.10000 -1.0 2.0
   76    86    87    88  10.50000 -1.0 2.0
  101    95   100   102  10.50000 -1.0 2.0
   56    66    61    41   4.00000 -1.0 2.0
   46    54    48    49  10.50000 -1.0 2.0
   74    69    73    75  10.50000 -1.0 2.0
END
