* LIGAND DATABASE FILE (OPLS2005)
*
001     115   116    207    302     601
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02073    78.78556   -85.49811
    3     1 S   H    _H1_     3     1.02057    99.48229    21.88019
    4     1 S   H    _H2_     4     1.02131    36.84344   130.43719
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.05972   107.41041    47.01581
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34015   114.76575   162.47883
   19    18 S   H    _HN2    19     1.04748   118.84952     8.59078
   20    18 S   CT1  _CA2    20     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    21     1.08457   106.27517   -11.11459
   22    20 S   C    _C2_    22     1.54037   112.60135  -130.27230
   23    22 S   O    _O2_    23     1.23085   119.01196  -169.64989
   24    20 S   CT   _CB2    32     1.54652   109.46586   105.32505
   25    24 S   HC   HB21    33     1.08610   110.54789    58.81774
   26    24 S   HC   HB22    34     1.08575   109.89770   179.12800
   27    22 S   N    _N3_    24     1.34263   118.97450    10.45203
   28    27 S   H    _HN3    25     1.03492   120.05970     5.06895
   29    24 S   S    _SG2    35     1.81647   112.43692   -61.22030
   30    27 S   CT   _CA3    26     1.46098   124.53040  -172.10347
   31    30 S   HC   HA31    27     1.12298   109.15732    14.31073
   32    30 S   HC   HA32    28     1.12301   109.23063   127.81991
   33    29 S   CT   _C25    36     1.82563    97.95332  -178.14470
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CM   _C7_    37     1.49451   110.09418   -60.01745
   38    37 S   HC   _H45    38     1.10057   115.92032   -56.46556
   39    33 S   N    _N30    75     1.46625   112.56423   177.55479
   40    39 S   H    _H78    76     1.02261   116.85570  -118.58252
   41    37 S   CMA  _C11    39     1.34663   125.91931   123.62444
   42    41 S   OM   _O33    40     1.26299   128.55487   179.74207
   43    41 S   CM   _C12    41     1.47581   118.05383    -0.30132
   44    43 S   CM   _C9_    42     1.35174   123.90031    -2.04890
   45    43 S   OS   _O38   111     1.39442   114.85413   177.80724
   46    33 S   CO4  _C14    43     1.53057   106.90824    63.44016
   47    46 S   O    _O34    44     1.23363   120.87834    56.94374
   48    44 S   CT   _C17    45     1.51497   124.09384  -177.63322
   49    48 S   HC   _H47    46     1.08515   109.31990    45.13132
   50    48 S   HC   _H48    47     1.08974   109.30890   158.66813
   51    45 S   CT   _C30   112     1.40052   112.06248    90.09205
   52    51 S   HC   _H69   113     1.09313   109.56115   179.95577
   53    51 S   HC   _H70   114     1.09358   109.53552    59.22774
   54    51 S   HC   _H71   115     1.09212   109.00147   -60.38248
   55    48 S   CT   _C22    48     1.55116   115.63080   -79.85960
   56    55 S   HC   _H54    49     1.06232   108.48383    44.49966
   57    55 S   CT   _C18    50     1.54457   113.49460   -77.48883
   58    57 S   HC   _H49    51     1.10362   108.09622  -156.79589
   59    57 S   HC   _H50    52     1.10073   109.18280   -43.69924
   60    55 S   CT   _C29   107     1.53718   108.23590   161.99102
   61    60 S   HC   _H66   108     1.08658   109.37570    62.51149
   62    60 S   HC   _H67   109     1.08562   109.36039   -57.46608
   63    60 S   HC   _H68   110     1.08576   109.40067  -177.51131
   64    57 S   CT   _C23    53     1.53845   117.16836    82.29624
   65    64 S   HC   _H55    54     1.07563   109.89503   -44.23402
   66    64 S   CT   _C24    55     1.54447   117.34048    83.70395
   67    66 S   HC   _H56    56     1.12239   108.35511   160.66601
   68    64 S   OS   _O41   102     1.43854   106.75557  -157.92942
   69    66 S   CT   _C19    57     1.55126   114.00010   -80.24291
   70    69 S   HC   _H51    58     1.15361   104.67123    -3.36267
   71    66 S   OH   _O37   100     1.42762   109.97884    45.32718
   72    71 S   HO   _H81   101     0.96862   106.26819   172.83549
   73    68 S   CT   _C32   103     1.42211   111.72214   -60.05238
   74    73 S   HC   _H75   104     1.09246   109.53782   180.00000
   75    73 S   HC   _H76   105     1.09323   109.51108    59.23329
   76    73 S   HC   _H77   106     1.09296   109.01637   -60.39255
   77    69 S   CM   _C8_    59     1.51850   112.95916  -120.59553
   78    77 S   HC   _H46    60     1.10340   113.07887   120.66452
   79    69 S   CT   _C28    96     1.53143   115.17085   110.51792
   80    79 S   HC   _H63    97     1.08598   109.36174    65.91452
   81    79 S   HC   _H64    98     1.08521   109.39402   -54.10314
   82    79 S   HC   _H65    99     1.08613   109.38564  -174.12023
   83    77 S   CM   _C13    61     1.35032   130.38981   -58.19940
   84    83 S   CT   _C21    62     1.52163   120.73001   178.99361
   85    84 S   HC   _H53    63     1.09020   109.61994   174.53288
   86    83 S   CT   _C27    92     1.50234   125.15366    -1.87847
   87    86 S   HC   _H60    93     1.08567   109.24792    90.01394
   88    86 S   HC   _H61    94     1.08691   109.28080   -30.15733
   89    86 S   HC   _H62    95     1.08658   109.26829  -149.75441
   90    84 S   CT   _C20    64     1.54316   114.89940   -62.69681
   91    90 S   HC   _H52    65     1.09457   109.58252    68.78894
   92    84 S   OS   _O39    86     1.43297   107.97121    59.06221
   93    90 S   CM   _C6_    66     1.50661   113.40567   -56.60237
   94    93 S   HC   _H44    67     1.09227   115.36821   -57.77020
   95    90 S   OS   _O40    81     1.43474   108.12530  -175.62350
   96    92 S   CO4  _C16    87     1.36553   115.82719    87.70337
   97    96 S   O    _O36    88     1.22653   125.22904    -0.05234
   98    93 S   CM   _C4_    68     1.34366   128.47420   122.86503
   99    98 S   HC   _H42    69     1.09146   116.53268   179.03571
  100    95 S   CT   _C31    82     1.41920   111.25844  -157.24213
  101   100 S   HC   _H72    83     1.09275   109.46158   179.97202
  102   100 S   HC   _H73    84     1.09274   109.52644    59.20008
  103   100 S   HC   _H74    85     1.09190   108.98751   -60.43610
  104    96 S   N    _N31    89     1.37316   110.51043   179.96044
  105   104 S   H    _H79    90     1.01454   119.32958   179.95154
  106   104 S   H    _H80    91     1.01499   121.39016    -0.02798
  107    98 S   CM   _C5_    70     1.44659   126.65909    -2.02304
  108   107 S   HC   _H43    71     1.07859   115.53354   -10.06042
  109   107 S   CM   _C10    72     1.34476   126.01109   170.19911
  110   109 S   C    _C15    73     1.49083   114.67885   179.63631
  111   110 S   O    _O35    74     1.22542   120.74966   100.85825
  112   109 S   CT   _C26    77     1.49322   129.30625    -3.22404
  113   112 S   HC   _H57    78     1.09036   109.89618    89.99744
  114   112 S   HC   _H58    79     1.09030   109.94224   -30.23052
  115   112 S   HC   _H59    80     1.09034   109.84851  -149.84478
  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
  14   2   1   1  11   5  10   4   7   3  12  11   6   6   1  12
   5   4   3   2   1   1  12   8  14   6   5   4   2   1   1  14
   6  14   7   6  12   8   3   1   3   2   1   1  14   4   4   2
   1   1  12  16   7   5   2   1   1  13   6   7   8   4   5   4
   3   6   3   3   2   1   1   2   1   1   8   3   6   5   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    46    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    44    46    47   110    39    40  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    42    43    44    46    47    48   109   110   111    39    40  
   35    36  
   36  
    0  
   38    41    42    43    44    46    47   110    39    40    45  
   41    42    43    46    39  
   40   112    41    44    46    47   107   109   110   111  
   46   109   110   111  
   42    43    44    46    48    45    51  
   43    44    45  
   44    46    47    48    49    50    55    45    51    52    53    54  
   46    47    48    49    50    55    56    57    60    45    51  
   51    52    53    54    46    48  
   47    48    49    50    55   110  
   48  
   49    50    55    56    57    58    59    64    60    61    62    63  
   50    55    56    57    60  
   55    56    57    60  
   52    53    54  
   53    54  
   54  
    0  
   56    57    58    59    64    65    66    68    60    61    62    63  
   57    58    59    64    60    61    62    63  
   58    59    64    65    66    67    69    71    68    73    60    61    62    63  
   59    64    65    66    68    60  
   64    65    66    68    60  
   61    62    63    64  
   62    63  
   63  
    0  
   65    66    67    69    70    77    79    71    72    68    73    74    75    76  
   66    67    69    71    68    73  
   67    69    70    77    78    83    79    80    81    82    71    72    68    73  
   69    70    77    79    71    72    68  
   73    74    75    76    69    71  
   70    77    78    83    84    86    79    80    81    82    71    72  
   77    78    83    79    80    81    82    71  
   72    77    79  
    0  
   74    75    76  
   75    76  
   76  
    0  
   78    83    84    85    90    92    86    87    88    89    79    80    81    82  
   83    84    86    79  
   80    81    82    83  
   81    82  
   82  
    0  
   84    85    90    91    93    95    92    96    86    87    88    89  
   85    90    91    93    94    98    95   100    92    96    97   104    86    87    88    89  
   90    91    93    95    92    96    86  
   87    88    89    90    92  
   88    89  
   89  
    0  
   91    93    94    98    99   107    95   100   101   102   103    92    96  
   93    94    98    95   100    92  
   96    97   104   105   106    93    95  
   94    98    99   107   108   109    95   100  
   98    99   107    95  
  100   101   102   103    98  
   97   104   105   106  
  104   105   106  
   99   107   108   109   110   112  
  107   108   109  
  101   102   103  
  102   103  
  103  
    0  
  105   106  
  106  
    0  
  108   109   110   111   112   113   114   115  
  109   110   112  
  110   111   112   113   114   115  
  111   112   113   114   115  
  112  
  113   114   115  
  114   115  
  115  
    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   0.367500   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   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   40   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   41   3.5500   0.0760   0.976300   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   43   3.5500   0.0760  -0.516200   2.0020   1.7750   0.023028004  -0.852763146
   44   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   45   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   46   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   47   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   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   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   69   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   72   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   73   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   75   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   76   2.5000   0.0300   0.030000   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  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   84   3.5000   0.0660   0.289000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   86   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   3.5000   0.0660   0.239000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   92   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   93   3.5500   0.0760  -0.184000   2.0020   1.7750   0.023028004  -0.852763146
   94   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   95   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   96   3.7500   0.1050   0.632500   1.9250   1.7000   0.001000000  -0.126889456
   97   2.9600   0.2100  -0.497000   1.8100   1.6000   0.001000000  -1.480495490
   98   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   99   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  100   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
  101   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  102   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  103   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  104   3.2500   0.1700  -0.883900   1.8100   1.6000   0.054801302  -1.445846770
  105   0.5000   0.0300   0.414200   1.5900   1.4000   0.030040813  -0.651083722
  106   0.5000   0.0300   0.414200   1.5900   1.4000   0.030040813  -0.651083722
  107   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
  108   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  109   3.5500   0.0760  -0.056700   2.0020   1.7750   0.023028004  -0.852763146
  110   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
  111   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
  112   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  113   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  114   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  115   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    46   317.000  1.522
   33    39   337.000  1.449
   37    38   340.000  1.080
   37    41   465.000  1.376
   41    42   745.000  1.250
   41    43   465.000  1.376
   43    44   549.000  1.340
   43    45   440.000  1.360
   44    46   320.000  1.462
   44    48   317.000  1.510
   46    47   570.000  1.229
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    55   268.000  1.529
   55    56   340.000  1.090
   55    57   268.000  1.529
   55    60   268.000  1.529
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    64   268.000  1.529
   64    65   340.000  1.090
   64    66   268.000  1.529
   64    68   320.000  1.410
   66    67   340.000  1.090
   66    69   268.000  1.529
   66    71   320.000  1.410
   69    70   340.000  1.090
   69    77   317.000  1.510
   69    79   268.000  1.529
   77    78   340.000  1.080
   77    83   549.000  1.340
   83    84   317.000  1.510
   83    86   317.000  1.510
   84    85   340.000  1.090
   84    90   268.000  1.529
   84    92   320.000  1.410
   90    91   340.000  1.090
   90    93   317.000  1.510
   90    95   320.000  1.410
   93    94   340.000  1.080
   93    98   549.000  1.340
   98    99   340.000  1.080
   98   107   380.000  1.444
  107   108   340.000  1.080
  107   109   549.000  1.340
  109   110   410.000  1.444
  109   112   317.000  1.510
  110   111   570.000  1.229
  110    39   490.000  1.335
   39    40   434.000  1.010
  112   113   340.000  1.090
  112   114   340.000  1.090
  112   115   340.000  1.090
   95   100   320.000  1.410
  100   101   340.000  1.090
  100   102   340.000  1.090
  100   103   340.000  1.090
   92    96   214.000  1.327
   96    97   570.000  1.229
   96   104   435.000  1.380
  104   105   434.000  1.010
  104   106   434.000  1.010
   86    87   340.000  1.090
   86    88   340.000  1.090
   86    89   340.000  1.090
   79    80   340.000  1.090
   79    81   340.000  1.090
   79    82   340.000  1.090
   71    72   553.000  0.945
   68    73   320.000  1.410
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    76   340.000  1.090
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   340.000  1.090
   45    51   320.000  1.410
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    54   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  112.20000
   29    33    46    75.00000  110.18000
   29    33    39    80.00000  108.62000
   33    37    38    35.00000  117.00000
   33    37    41    70.00000  124.00000
   33    46    44    65.00000  118.62400
   33    46    47    80.00000  120.40000
   33    39   110    50.00000  121.90000
   33    39    40    38.00000  118.40000
   37    41    42    65.00000  137.10300
   37    41    43    70.00000  123.01800
   41    37    38    40.00000  120.50800
   41    43    44    70.00000  117.34000
   41    43    45    80.00000  120.01400
   43    41    42    65.00000  137.10300
   43    44    46    65.00000  118.96000
   43    44    48    70.00000  124.00000
   43    45    51    90.00000  111.18400
   44    46    47    80.00000  123.72100
   44    48    49    35.00000  109.50000
   44    48    50    35.00000  109.50000
   44    48    55    70.00000  112.02700
   46    33    37    70.00000  109.06800
   48    44    46    65.00000  116.34900
   48    55    56    37.50000  110.70000
   48    55    57    58.35000  112.70000
   48    55    60    58.35000  112.70000
   50    48    49    33.00000  107.80000
   55    48    49    37.50000  110.70000
   55    48    50    37.50000  110.70000
   55    57    58    37.50000  110.70000
   55    57    59    37.50000  110.70000
   55    57    64    58.35000  112.70000
   55    60    61    37.50000  110.70000
   55    60    62    37.50000  110.70000
   55    60    63    37.50000  110.70000
   57    55    56    37.50000  110.70000
   57    64    65    37.50000  110.70000
   57    64    66    58.35000  112.70000
   57    64    68    50.00000  109.50000
   59    57    58    33.00000  107.80000
   64    57    58    37.50000  110.70000
   64    57    59    37.50000  110.70000
   64    66    67    37.50000  110.70000
   64    66    69    58.35000  112.70000
   64    66    71    50.00000  109.50000
   64    68    73    60.00000  109.50000
   66    64    65    37.50000  110.70000
   66    69    70    37.50000  110.70000
   66    69    77    70.00000  112.02700
   66    69    79    58.35000  112.70000
   66    71    72    55.00000  108.50000
   69    66    67    37.50000  110.70000
   69    77    78    35.00000  117.00000
   69    77    83    70.00000  124.00000
   69    79    80    37.50000  110.70000
   69    79    81    37.50000  110.70000
   69    79    82    37.50000  110.70000
   77    69    70    35.00000  109.50000
   77    83    84    70.00000  124.00000
   77    83    86    70.00000  124.00000
   83    77    78    35.00000  120.00000
   83    84    85    35.00000  109.50000
   83    84    90    70.00000  112.02700
   83    84    92    85.00000  110.90400
   83    86    87    35.00000  109.50000
   83    86    88    35.00000  109.50000
   83    86    89    35.00000  109.50000
   84    90    91    37.50000  110.70000
   84    90    93    70.00000  112.02700
   84    90    95    50.00000  109.50000
   84    92    96    83.00000  116.90000
   90    84    85    37.50000  110.70000
   90    93    94    35.00000  117.00000
   90    93    98    70.00000  124.00000
   90    95   100    60.00000  109.50000
   93    90    91    35.00000  109.50000
   93    98    99    35.00000  120.00000
   93    98   107    70.00000  123.01800
   98    93    94    35.00000  120.00000
   98   107   108    35.00000  120.00000
   98   107   109    70.00000  123.01800
  107    98    99    35.00000  120.00000
  107   109   110    70.00000  118.70000
  107   109   112    70.00000  124.00000
  109   107   108    35.00000  120.00000
  109   110   111    80.00000  125.30000
  109   110    39    80.00000  111.56200
  109   112   113    35.00000  109.50000
  109   112   114    35.00000  109.50000
  109   112   115    35.00000  109.50000
  110    39    40    35.00000  119.80000
   39    33    37    75.00000  110.78400
   39    33    46    80.00000  109.34500
   39   110   111    80.00000  122.90000
  112   109   110    70.00000  119.70000
  114   112   113    33.00000  107.80000
  115   112   113    33.00000  107.80000
  115   112   114    33.00000  107.80000
   95    90    91    35.00000  109.50000
   95    90    93    85.00000  110.90400
   95   100   101    35.00000  109.50000
   95   100   102    35.00000  109.50000
   95   100   103    35.00000  109.50000
  102   100   101    33.00000  107.80000
  103   100   101    33.00000  107.80000
  103   100   102    33.00000  107.80000
   92    84    85    35.00000  109.50000
   92    84    90    50.00000  109.50000
   92    96    97    83.00000  123.40000
   92    96   104   110.00000  108.75700
   96   104   105    50.00000  116.34900
   96   104   106    50.00000  116.34900
  104    96    97    85.00000  125.96000
  106   104   105    35.00000  120.00000
   86    83    84    65.00000  117.92700
   88    86    87    33.00000  107.80000
   89    86    87    33.00000  107.80000
   89    86    88    33.00000  107.80000
   79    69    70    37.50000  110.70000
   79    69    77    70.00000  112.02700
   81    79    80    33.00000  107.80000
   82    79    80    33.00000  107.80000
   82    79    81    33.00000  107.80000
   71    66    67    35.00000  109.50000
   71    66    69    50.00000  109.50000
   68    64    65    35.00000  109.50000
   68    64    66    50.00000  109.50000
   68    73    74    35.00000  109.50000
   68    73    75    35.00000  109.50000
   68    73    76    35.00000  109.50000
   75    73    74    33.00000  107.80000
   76    73    74    33.00000  107.80000
   76    73    75    33.00000  107.80000
   60    55    56    37.50000  110.70000
   60    55    57    58.35000  112.70000
   62    60    61    33.00000  107.80000
   63    60    61    33.00000  107.80000
   63    60    62    33.00000  107.80000
   45    43    44    80.00000  120.01400
   45    51    52    35.00000  109.50000
   45    51    53    35.00000  109.50000
   45    51    54    35.00000  109.50000
   53    51    52    33.00000  107.80000
   54    51    52    33.00000  107.80000
   54    51    53    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
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   68    64    66    71   3.69350  1.0 1.0
   68    64    66    71  -1.82950 -1.0 2.0
   60    55    57    58   0.15000  1.0 3.0
   60    55    57    59   0.15000  1.0 3.0
   60    55    57    64   0.56750  1.0 1.0
   60    55    57    64  -0.07550 -1.0 2.0
   60    55    57    64   0.20000  1.0 3.0
   45    43    44    46   7.00000 -1.0 2.0
   45    43    44    48   7.00000 -1.0 2.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    34    35  10.50000 -1.0 2.0
   33    38    37    41   1.10000 -1.0 2.0
   43    42    41    37   1.10000 -1.0 2.0
   41    45    43    44   1.10000 -1.0 2.0
   46    48    44    43   1.10000 -1.0 2.0
   33    44    46    47  10.50000 -1.0 2.0
   69    78    77    83   1.10000 -1.0 2.0
   84    86    83    77   1.10000 -1.0 2.0
   90    94    93    98   1.10000 -1.0 2.0
  107    99    98    93   1.10000 -1.0 2.0
   98   108   107   109   1.10000 -1.0 2.0
  110   112   109   107   1.10000 -1.0 2.0
  109    39   110   111  10.50000 -1.0 2.0
   40   110    39    33   1.00000 -1.0 2.0
   92   104    96    97  10.50000 -1.0 2.0
  106    96   104   105   1.00000 -1.0 2.0
END
