* LIGAND DATABASE FILE (OPLS2005)
*
001     108   111    218    353     660
    1     0 S   NP   _N1_     1    28.26744    97.46684   -20.38147
    2     1 S   H    _HN1     2     1.02819    43.30816   136.02399
    3     1 S   H    _H1_     3     1.02794    99.87023  -118.29473
    4     1 S   H    _H2_     4     1.02946    69.63691   -12.19041
    5     1 S   CT   _CA1     5     1.50102   145.20466    84.56151
    6     5 S   HC   _HA1     6     1.09513   105.07447    94.40250
    7     5 S   CO3  _C1_     7     1.53815   112.54793   -26.03498
    8     7 S   O2Z  _O11     8     1.26388   114.96621   -38.87262
    9     7 S   O2Z  _O12     9     1.26204   115.07535   140.26207
   10     5 S   CT   _CB1    10     1.53082   107.48477  -147.48278
   11    10 S   HC   HB11    11     1.09836   109.49604   -46.73371
   12    10 S   HC   HB12    12     1.09800   110.49967    70.01317
   13    10 S   CT   _CG1    13     1.52978   112.46115  -167.48220
   14    13 S   HC   HG11    14     1.09545   110.95471   -65.80483
   15    13 S   HC   HG12    15     1.09533   109.24874    53.43910
   16    13 S   C    _CD1    16     1.51773   112.18844   173.54554
   17    16 S   O    _OE1    17     1.22749   123.16810    11.57211
   18    16 S   N    _N2_    18     1.38688   111.83210  -168.33561
   19    18 S   H    _HN2    19     1.01543   119.10568     0.77329
   20    18 S   CT1  _CA2    20     1.46309   123.31519   176.19780
   21    20 S   HC   _HA2    21     1.09689   109.24428     9.27820
   22    20 S   C    _C2_    22     1.53831   109.11218  -106.84174
   23    22 S   O    _O2_    23     1.23114   121.92813  -155.82008
   24    20 S   CT   _CB2    32     1.53640   111.80278   131.44176
   25    24 S   HC   HB21    33     1.09180   108.42458    62.23098
   26    24 S   HC   HB22    34     1.09406   110.02561  -179.46734
   27    22 S   N    _N3_    24     1.38219   114.30791    30.71818
   28    27 S   H    _HN3    25     1.01516   119.54799    -1.32648
   29    24 S   S    _SG2    35     1.82708   111.77766   -58.39609
   30    27 S   CT   _CA3    26     1.45276   123.41344   178.79878
   31    30 S   HC   HA31    27     1.09523   107.64029   -67.13519
   32    30 S   HC   HA32    28     1.09566   107.93086    49.37671
   33    29 S   CT   _C30    36     1.88121   102.52308   177.40542
   34    30 S   CO3  _C3_    29     1.52973   113.74787   171.75412
   35    34 S   O2Z  _O31    30     1.26393   115.92134    16.17102
   36    34 S   O2Z  _O32    31     1.26389   114.56709  -163.84665
   37    33 S   CT   _C24    37     1.54873   103.44506  -171.77787
   38    37 S   HC   _H62    38     1.09584   111.99093    64.72676
   39    37 S   HC   _H63    39     1.09591   111.63152  -174.72003
   40    37 S   HC   _H64    40     1.09747   111.70402   -56.18347
   41    33 S   CT   _C25    41     1.54578   106.27141    73.99620
   42    41 S   HC   _H65    42     1.09526   111.78627   -70.02993
   43    41 S   HC   _H66    43     1.09617   111.26592   170.26524
   44    41 S   HC   _H67    44     1.09673   111.89919    51.30714
   45    33 S   CT   _C29    45     1.59235   113.78522   -48.54542
   46    45 S   OM   _O28    46     1.32801   109.32919  -173.22193
   47    45 S   HC   _H73    47     1.09859   105.13251    60.52013
   48    45 S   CT   _C27    48     1.56316   113.19985   -54.11297
   49    48 S   HC   _H70    49     1.09891   111.27183   -70.24032
   50    48 S   HC   _H71    50     1.09109   109.20375    46.22658
   51    48 S   CT   _C26    51     1.54531   112.88567   166.55403
   52    51 S   HC   _H68    52     1.09587   109.65543   -39.97003
   53    51 S   HC   _H69    53     1.09809   108.65270    74.95640
   54    51 S   CT   _C28    54     1.55399   115.05645  -163.61013
   55    54 S   HC   _H72    55     1.09811   105.77599  -173.64199
   56    54 S   CT   _C17    56     1.55451   112.44103    68.64207
   57    56 S   HC   _H51    57     1.09849   107.73894   -61.08632
   58    54 S   CT   _C23   105     1.53026   109.87786   -58.36411
   59    58 S   HC   _H59   106     1.09469   111.65857    77.81159
   60    58 S   HC   _H60   107     1.09261   111.14643  -160.96288
   61    58 S   HC   _H61   108     1.09565   110.96871   -42.80489
   62    56 S   CT   _C10    58     1.55731   112.08816    56.53602
   63    62 S   HC   _H40    59     1.09602   111.88070    31.69725
   64    62 S   HC   _H41    60     1.09417   110.54177   -87.93940
   65    62 S   CT   _C8_    61     1.53393   107.14972   151.57428
   66    65 S   HC   _H36    62     1.09465   111.28640   128.32352
   67    65 S   HC   _H37    63     1.09564   110.52721  -112.18631
   68    65 S   CT   _C16    64     1.52060   103.77893     7.59228
   69    68 S   HC   _H50    65     1.10133   105.75484    78.52782
   70    68 S   CT   _C14    66     1.53206   118.11566  -162.90144
   71    70 S   HC   _H48    67     1.09595   109.28792    60.88958
   72    70 S   CT   _C6_    68     1.53713   110.50350   -57.71413
   73    72 S   HC   _H32    69     1.09666   109.11600    74.76543
   74    72 S   HC   _H33    70     1.09672   110.43590   -42.35165
   75    70 S   CT   _C15    86     1.55324   109.50107  -178.97264
   76    75 S   HC   _H49    87     1.10133   105.75507    65.37166
   77    72 S   CM   _C4_    71     1.49489   113.80828  -163.59820
   78    77 S   HC   _H31    72     1.08776   115.55239  -166.86678
   79    75 S   CT   _C9_    88     1.54896   112.30344   -49.02785
   80    79 S   HC   _H38    89     1.09388   110.61421   -73.40985
   81    79 S   HC   _H39    90     1.09569   109.76655   169.71616
   82    77 S   CM   _C5_    73     1.34437   124.72154    12.99144
   83    79 S   CT   _C13    91     1.53864   113.73016    48.80235
   84    83 S   HC   _H46    92     1.09769   108.74142    67.94122
   85    83 S   HC   _H47    93     1.09343   108.13217  -176.94623
   86    82 S   CT   _C7_    74     1.51141   119.96913  -178.77603
   87    86 S   HC   _H34    75     1.09783   111.61005    -7.42235
   88    86 S   HC   _H35    76     1.09744   109.57975   108.26197
   89    56 S   CT   _C20    94     1.56018   119.69574   176.91250
   90    86 S   CT   _C18    77     1.52577   111.90253  -129.53718
   91    90 S   HC   _H52    78     1.09703   109.75183    68.35712
   92    89 S   CT   _C22    95     1.54630   111.17216   -46.65922
   93    92 S   HC   _H56    96     1.09447   112.46799   -46.73138
   94    92 S   HC   _H57    97     1.09327   112.65381  -167.34616
   95    92 S   HC   _H58    98     1.09497   110.85315    73.09117
   96    90 S   CT   _C11    79     1.52530   111.11993   -53.54584
   97    96 S   HC   _H42    80     1.09690   110.21383   -66.71945
   98    96 S   HC   _H43    81     1.09706   109.57639   177.80376
   99    90 S   OH   _O29   103     1.42428   108.65086  -174.08126
  100    99 S   HO   _H74   104     0.97239   107.58137   179.26778
  101    96 S   CT   _C12    82     1.52777   111.17098    56.43597
  102   101 S   HC   _H44    83     1.09780   107.64806    66.98396
  103   101 S   HC   _H45    84     1.09646   108.18088  -178.50171
  104    82 S   CT   _C19    85     1.53505   122.84213     1.48359
  105   104 S   CT   _C21    99     1.54733   108.02532  -107.44929
  106   105 S   HC   _H53   100     1.09479   111.67085  -172.00068
  107   105 S   HC   _H54   101     1.09485   111.81237    67.01241
  108   105 S   HC   _H55   102     1.09520   112.31618   -52.93063
  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  13   5   4   3
  15   2   1   1  11   4   3   2   7   3   2   1   9   5   4   9
   5   4  12   5   4  15   8  23   9   5   2   1   1  11   6   5
  11   5   4  19   7  18   9  11   5   4  20   8   9   3  11   6
   5  15   8   3   2  12   6   5   4  10   6   3   2   1   1   9
   6   5   2   1   7   3   2   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    41    45    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    40    41    42    43    44    45    46    47    48  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    40    41    42    43    44    45    46    47    48    49    50    51  
   35    36  
   36  
    0  
   38    39    40    41    42    43    44    45    46    47    48  
   39    40    41    45  
   40    41    45  
   41    45  
   42    43    44    45    46    47    48  
   43    44    45  
   44    45  
   45  
   46    47    48    49    50    51    52    53    54  
   47    48    49    50    51  
   48    49    50    51  
   49    50    51    52    53    54    55    56    58  
   50    51    52    53    54  
   51    52    53    54  
   52    53    54    55    56    57    62    89    58    59    60    61  
   53    54    55    56    58  
   54    55    56    58  
   55    56    57    62    63    64    65    68    83    89    92    58    59    60    61  
   56    57    62    89    58    59    60    61  
   57    62    63    64    65    66    67    68    69    70    79    83    84    85    89    92    93    94    95    58    59    60    61  
   62    63    64    65    68    83    89    92    58  
   59    60    61    62    89  
   60    61  
   61  
    0  
   63    64    65    66    67    68    69    70    83    89    92  
   64    65    66    67    68    89  
   65    66    67    68    89  
   66    67    68    69    70    71    72    75    83    89    92  
   67    68    69    70    89  
   68    69    70    89  
   69    70    71    72    73    74    77   104    75    76    79    83    84    85    89    92    93    94    95  
   70    71    72    75    83    89    92  
   71    72    73    74    77    78    82   101   104    75    76    79    80    81    83    89    92   105  
   72    73    74    77   104    75    76    79    89  
   73    74    77    78    82    86   104    75    76    79    89  
   74    77    78    82    75  
   77    78    82    75  
   76    79    80    81    83    84    85    89   105   106   107   108    77    82    86    96   101   102   103   104  
   79    80    81    83   105    82   101   104  
   78    82    86    87    88    90   101   104   105  
   82    86   104  
   80    81    83    84    85    89    92   105    82   101   104  
   81    83    84    85    89   104  
   83    84    85    89   104  
   86    87    88    90    91    96   101   102   103   104   105   106   107   108    99  
   84    85    89    92    93    94    95   104  
   85    89    92  
   89    92  
   87    88    90    91    96    97    98   101   104   105    99   100  
   88    90    91    96   104    99  
   90    91    96   104    99  
   92    93    94    95  
   91    96    97    98   101   102   103   104    99   100  
   96    97    98   101    99   100  
   93    94    95  
   94    95  
   95  
    0  
   97    98   101   102   103   104   105    99   100  
   98   101   102   103   104    99  
  101   102   103   104    99  
  100   101  
    0  
  102   103   104   105   106   107   108  
  103   104   105  
  104   105  
  105   106   107   108  
  106   107   108  
  107   108  
  108  
    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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   46   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   47   2.5000   0.0500   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   78   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   79   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   83   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   90   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   99   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  100   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  101   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  102   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  103   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  104   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
  105   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  106   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  108   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   268.000  1.529
   33    41   268.000  1.529
   33    45   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    40   340.000  1.090
   41    42   340.000  1.090
   41    43   340.000  1.090
   41    44   340.000  1.090
   45    46   570.000  1.307
   45    47   340.000  1.090
   45    48   268.000  1.529
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   268.000  1.529
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    54   268.000  1.529
   54    55   340.000  1.090
   54    56   268.000  1.529
   54    58   268.000  1.529
   56    57   340.000  1.090
   56    62   268.000  1.529
   56    89   268.000  1.529
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   268.000  1.529
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   268.000  1.529
   68    69   340.000  1.090
   68    70   268.000  1.529
   68    89   268.000  1.529
   70    71   340.000  1.090
   70    72   268.000  1.529
   70    75   268.000  1.529
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    77   317.000  1.510
   77    78   340.000  1.080
   77    82   549.000  1.340
   82    86   317.000  1.510
   82   104   317.000  1.510
   86    87   340.000  1.090
   86    88   340.000  1.090
   86    90   268.000  1.529
   90    91   340.000  1.090
   90    96   268.000  1.529
   90    99   320.000  1.410
   96    97   340.000  1.090
   96    98   340.000  1.090
   96   101   268.000  1.529
  101   102   340.000  1.090
  101   103   340.000  1.090
  101   104   268.000  1.529
  104    75   268.000  1.529
  104   105   268.000  1.529
   75    76   340.000  1.090
   75    79   268.000  1.529
   79    80   340.000  1.090
   79    81   340.000  1.090
   79    83   268.000  1.529
   83    84   340.000  1.090
   83    85   340.000  1.090
   83    89   268.000  1.529
   89    92   268.000  1.529
   92    93   340.000  1.090
   92    94   340.000  1.090
   92    95   340.000  1.090
  105   106   340.000  1.090
  105   107   340.000  1.090
  105   108   340.000  1.090
   99   100   553.000  0.945
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  111.63000
   29    33    41    75.00000  111.63000
   29    33    45    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    40    37.50000  110.70000
   33    41    42    37.50000  110.70000
   33    41    43    37.50000  110.70000
   33    41    44    37.50000  110.70000
   33    45    46    50.00000  109.50000
   33    45    47    37.50000  110.70000
   33    45    48    58.35000  112.70000
   39    37    38    33.00000  107.80000
   40    37    38    33.00000  107.80000
   40    37    39    33.00000  107.80000
   41    33    37    58.35000  112.70000
   43    41    42    33.00000  107.80000
   44    41    42    33.00000  107.80000
   44    41    43    33.00000  107.80000
   45    33    37    58.35000  112.70000
   45    33    41    58.35000  112.70000
   45    48    49    37.50000  110.70000
   45    48    50    37.50000  110.70000
   45    48    51    58.35000  112.70000
   47    45    46    45.00000  125.66300
   48    45    46    50.00000  109.50000
   48    45    47    37.50000  110.70000
   48    51    52    37.50000  110.70000
   48    51    53    37.50000  110.70000
   48    51    54    58.35000  112.70000
   50    48    49    33.00000  107.80000
   51    48    49    37.50000  110.70000
   51    48    50    37.50000  110.70000
   51    54    55    37.50000  110.70000
   51    54    56    58.35000  112.70000
   51    54    58    58.35000  112.70000
   53    51    52    33.00000  107.80000
   54    51    52    37.50000  110.70000
   54    51    53    37.50000  110.70000
   54    56    57    37.50000  110.70000
   54    56    62    58.35000  112.70000
   54    56    89    58.35000  112.70000
   54    58    59    37.50000  110.70000
   54    58    60    37.50000  110.70000
   54    58    61    37.50000  110.70000
   56    54    55    37.50000  110.70000
   56    62    63    37.50000  110.70000
   56    62    64    37.50000  110.70000
   56    62    65    58.35000  112.70000
   56    89    68    58.35000  112.70000
   56    89    83    58.35000  112.70000
   56    89    92    58.35000  112.70000
   62    56    57    37.50000  110.70000
   62    65    66    37.50000  110.70000
   62    65    67    37.50000  110.70000
   62    65    68    58.35000  112.70000
   64    62    63    33.00000  107.80000
   65    62    63    37.50000  110.70000
   65    62    64    37.50000  110.70000
   65    68    69    37.50000  110.70000
   65    68    70    58.35000  112.70000
   65    68    89    58.35000  112.70000
   67    65    66    33.00000  107.80000
   68    65    66    37.50000  110.70000
   68    65    67    37.50000  110.70000
   68    70    71    37.50000  110.70000
   68    70    72    58.35000  112.70000
   68    70    75    58.35000  112.70000
   68    89    83    58.35000  112.70000
   68    89    92    58.35000  112.70000
   70    68    69    37.50000  110.70000
   70    72    73    37.50000  110.70000
   70    72    74    37.50000  110.70000
   70    72    77    70.00000  112.02700
   70    75   104    58.35000  112.70000
   70    75    76    37.50000  110.70000
   70    75    79    58.35000  112.70000
   72    70    71    37.50000  110.70000
   72    77    78    35.00000  117.00000
   72    77    82    70.00000  124.00000
   74    72    73    33.00000  107.80000
   77    72    73    35.00000  109.50000
   77    72    74    35.00000  109.50000
   77    82    86    70.00000  124.00000
   77    82   104    70.00000  124.00000
   82    77    78    35.00000  120.00000
   82    86    87    35.00000  109.50000
   82    86    88    35.00000  109.50000
   82    86    90    70.00000  112.02700
   82   104   101    70.00000  112.02700
   82   104    75    70.00000  112.02700
   82   104   105    70.00000  112.02700
   86    90    91    37.50000  110.70000
   86    90    96    58.35000  112.70000
   86    90    99    50.00000  109.50000
   88    86    87    33.00000  107.80000
   90    86    87    37.50000  110.70000
   90    86    88    37.50000  110.70000
   90    96    97    37.50000  110.70000
   90    96    98    37.50000  110.70000
   90    96   101    58.35000  112.70000
   90    99   100    55.00000  108.50000
   96    90    91    37.50000  110.70000
   96   101   102    37.50000  110.70000
   96   101   103    37.50000  110.70000
   96   101   104    58.35000  112.70000
   98    96    97    33.00000  107.80000
  101    96    97    37.50000  110.70000
  101    96    98    37.50000  110.70000
  101   104    75    58.35000  112.70000
  101   104   105    58.35000  112.70000
  103   101   102    33.00000  107.80000
  104    82    86    65.00000  117.92700
  104   101   102    37.50000  110.70000
  104   101   103    37.50000  110.70000
  104    75    76    37.50000  110.70000
  104    75    79    58.35000  112.70000
  104   105   106    37.50000  110.70000
  104   105   107    37.50000  110.70000
  104   105   108    37.50000  110.70000
   75    70    71    37.50000  110.70000
   75    70    72    58.35000  112.70000
   75    79    80    37.50000  110.70000
   75    79    81    37.50000  110.70000
   75    79    83    58.35000  112.70000
   79    75    76    37.50000  110.70000
   79    83    84    37.50000  110.70000
   79    83    85    37.50000  110.70000
   79    83    89    58.35000  112.70000
   81    79    80    33.00000  107.80000
   83    79    80    37.50000  110.70000
   83    79    81    37.50000  110.70000
   83    89    92    58.35000  112.70000
   85    83    84    33.00000  107.80000
   89    56    57    37.50000  110.70000
   89    56    62    58.35000  112.70000
   89    68    69    37.50000  110.70000
   89    68    70    58.35000  112.70000
   89    83    84    37.50000  110.70000
   89    83    85    37.50000  110.70000
   89    92    93    37.50000  110.70000
   89    92    94    37.50000  110.70000
   89    92    95    37.50000  110.70000
   94    92    93    33.00000  107.80000
   95    92    93    33.00000  107.80000
   95    92    94    33.00000  107.80000
  105   104    75    58.35000  112.70000
  107   105   106    33.00000  107.80000
  108   105   106    33.00000  107.80000
  108   105   107    33.00000  107.80000
   99    90    91    35.00000  109.50000
   99    90    96    50.00000  109.50000
   58    54    55    37.50000  110.70000
   58    54    56    58.35000  112.70000
   60    58    59    33.00000  107.80000
   61    58    59    33.00000  107.80000
   61    58    60    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
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   97    96   101   102   0.15000  1.0 3.0
   97    96   101   103   0.15000  1.0 3.0
   97    96   101   104   0.15000  1.0 3.0
   98    96   101   102   0.15000  1.0 3.0
   98    96   101   103   0.15000  1.0 3.0
   98    96   101   104   0.15000  1.0 3.0
  101   104    75    70   0.56750  1.0 1.0
  101   104    75    70  -0.07550 -1.0 2.0
  101   104    75    70   0.20000  1.0 3.0
  101   104    75    76   0.15000  1.0 3.0
  101   104    75    79   0.56750  1.0 1.0
  101   104    75    79  -0.07550 -1.0 2.0
  101   104    75    79   0.20000  1.0 3.0
  101   104   105   106   0.15000  1.0 3.0
  101   104   105   107   0.15000  1.0 3.0
  101   104   105   108   0.15000  1.0 3.0
  102   101   104    82   0.15000  1.0 3.0
  102   101   104    75   0.15000  1.0 3.0
  102   101   104   105   0.15000  1.0 3.0
  103   101   104    82   0.15000  1.0 3.0
  103   101   104    75   0.15000  1.0 3.0
  103   101   104   105   0.15000  1.0 3.0
  104    82    86    87   0.34800  1.0 3.0
  104    82    86    88   0.34800  1.0 3.0
  104    82   -86    90   0.46850  1.0 1.0
  104    82   -86    90   0.08550 -1.0 2.0
  104    82   -86    90   0.09800  1.0 3.0
  104    75    79    80   0.15000  1.0 3.0
  104    75    79    81   0.15000  1.0 3.0
  104    75    79    83   0.56750  1.0 1.0
  104    75    79    83  -0.07550 -1.0 2.0
  104    75    79    83   0.20000  1.0 3.0
   75    70    72    73   0.15000  1.0 3.0
   75    70    72    74   0.15000  1.0 3.0
   75    70   -72    77   0.34400  1.0 1.0
   75    70   -72    77   0.09450 -1.0 2.0
   75    70   -72    77   0.11100  1.0 3.0
   75   104   105   106   0.15000  1.0 3.0
   75   104   105   107   0.15000  1.0 3.0
   75   104   105   108   0.15000  1.0 3.0
   75    79    83    84   0.15000  1.0 3.0
   75    79    83    85   0.15000  1.0 3.0
   75    79    83    89   0.56750  1.0 1.0
   75    79    83    89  -0.07550 -1.0 2.0
   75    79    83    89   0.20000  1.0 3.0
   76    75    79    80   0.15000  1.0 3.0
   76    75    79    81   0.15000  1.0 3.0
   76    75    79    83   0.15000  1.0 3.0
   79    83    89    56   0.56750  1.0 1.0
   79    83    89    56  -0.07550 -1.0 2.0
   79    83    89    56   0.20000  1.0 3.0
   79    83   -89    68   0.56750  1.0 1.0
   79    83   -89    68  -0.07550 -1.0 2.0
   79    83   -89    68   0.20000  1.0 3.0
   79    83    89    92   0.56750  1.0 1.0
   79    83    89    92  -0.07550 -1.0 2.0
   79    83    89    92   0.20000  1.0 3.0
   80    79    83    84   0.15000  1.0 3.0
   80    79    83    85   0.15000  1.0 3.0
   80    79    83    89   0.15000  1.0 3.0
   81    79    83    84   0.15000  1.0 3.0
   81    79    83    85   0.15000  1.0 3.0
   81    79    83    89   0.15000  1.0 3.0
   83    89    92    93   0.15000  1.0 3.0
   83    89    92    94   0.15000  1.0 3.0
   83    89    92    95   0.15000  1.0 3.0
   84    83    89    56   0.15000  1.0 3.0
   84    83    89    68   0.15000  1.0 3.0
   84    83    89    92   0.15000  1.0 3.0
   85    83    89    56   0.15000  1.0 3.0
   85    83    89    68   0.15000  1.0 3.0
   85    83    89    92   0.15000  1.0 3.0
   89    56    62    63   0.15000  1.0 3.0
   89    56    62    64   0.15000  1.0 3.0
   89    56   -62    65   0.56750  1.0 1.0
   89    56   -62    65  -0.07550 -1.0 2.0
   89    56   -62    65   0.20000  1.0 3.0
   89    68    70    71   0.15000  1.0 3.0
   89    68    70    72   0.56750  1.0 1.0
   89    68    70    72  -0.07550 -1.0 2.0
   89    68    70    72   0.20000  1.0 3.0
   89    68   -70    75   0.56750  1.0 1.0
   89    68   -70    75  -0.07550 -1.0 2.0
   89    68   -70    75   0.20000  1.0 3.0
  105   104    75    70   0.56750  1.0 1.0
  105   104    75    70  -0.07550 -1.0 2.0
  105   104    75    70   0.20000  1.0 3.0
  105   104    75    76   0.15000  1.0 3.0
  105   104    75    79   0.56750  1.0 1.0
  105   104    75    79  -0.07550 -1.0 2.0
  105   104    75    79   0.20000  1.0 3.0
   99    90    96    97   0.23400  1.0 3.0
   99    90    96    98   0.23400  1.0 3.0
   99    90    96   101   0.86500  1.0 1.0
   99    90    96   101  -0.17500 -1.0 2.0
   99    90    96   101   0.20800  1.0 3.0
   58    54    56    57   0.15000  1.0 3.0
   58    54    56    62   0.56750  1.0 1.0
   58    54    56    62  -0.07550 -1.0 2.0
   58    54    56    62   0.20000  1.0 3.0
   58    54    56    89   0.56750  1.0 1.0
   58    54    56    89  -0.07550 -1.0 2.0
   58    54    56    89   0.20000  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
   72    78    77    82   1.10000 -1.0 2.0
   86   104    82    77   1.10000 -1.0 2.0
END
