* LIGAND DATABASE FILE (OPLS2005)
*
001     116   117    218    333     646
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02036   100.79838    18.42095
    3     1 S   H    _H1_     3     1.02154    38.27151   124.99228
    4     1 S   H    _H2_     4     1.02116    76.56209   -88.43504
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    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     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08519   110.61667    58.74867
   26    24 S   HC   HB22    34     1.08547   109.95733   179.14202
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CT   _C17    36     1.85743    97.06571   161.83320
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   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   CO4  _C18    37     1.53187   105.06820    40.03162
   38    37 S   O    _O33    38     1.22909   122.43037   -93.20447
   39    33 S   CT   _C26    51     1.54755   111.58995   159.95717
   40    33 S   CT   _C16    58     1.53711   106.35239   -76.97422
   41    40 S   HC   _H24    59     1.09628   109.28483   173.42174
   42    40 S   HC   _H25    60     1.09335   108.75986    57.53019
   43    37 S   CA   _C19    39     1.48745   118.12670    84.24095
   44    39 S   CT   _C27    52     1.53670   113.48441   173.84805
   45    44 S   HC   _H30    53     1.08469   109.32884   -56.21561
   46    44 S   HC   _H31    54     1.08521   109.27280  -176.21431
   47    44 S   HC   _H32    55     1.08506   109.27684    63.79237
   48    39 S   OH   _O35    56     1.42634   110.90165    55.39532
   49    48 S   HO   _H33    57     0.96906   106.37733   177.78503
   50    40 S   CM   _C15    61     1.50175   111.12837   -66.86641
   51    50 S   HC   _H23    62     1.08915   114.27203    30.23684
   52    43 S   CA   _C20    40     1.40034   119.10952  -169.75508
   53    52 S   HA   _H26    41     1.08634   121.40211    -1.08137
   54    50 S   CM   _C14    63     1.34779   127.67180  -150.17876
   55    52 S   CA   _C21    42     1.39637   120.07294   178.29372
   56    55 S   HA   _H27    43     1.08567   119.87273  -179.83331
   57    54 S   CT   _C28    64     1.50633   120.32546     0.01978
   58    57 S   HC   _H34    65     1.09492   110.23682    89.96152
   59    57 S   HC   _H35    66     1.09535   110.44877   -29.98815
   60    57 S   HC   _H36    67     1.09466   112.36511  -150.03119
   61    54 S   CT   _C13    68     1.51332   124.53562  -179.48871
   62    61 S   HC   _H21    69     1.09375   110.38461     0.01978
   63    61 S   HC   _H22    70     1.09756   109.11671   114.96074
   64    55 S   CA   _C22    44     1.39307   120.10252    -0.13848
   65    64 S   HA   _H28    45     1.08638   119.92981  -179.87967
   66    61 S   CT   _C12    71     1.53181   111.79357  -123.42171
   67    66 S   HC   _H19    72     1.09604   110.29997   -60.05862
   68    66 S   HC   _H20    73     1.09837   109.27407  -175.96192
   69    64 S   CA   _C23    46     1.39500   120.11114     0.33220
   70    69 S   HA   _H29    47     1.08674   118.69862   179.42699
   71    66 S   CT   _C11    74     1.53495   113.34103    64.05659
   72    71 S   HC   _H17    75     1.09587   107.47711   -60.03153
   73    71 S   HC   _H18    76     1.09769   107.95589    54.33510
   74    43 S   CA   _C24    48     1.39872   121.20160     8.91055
   75    71 S   CT   _C9_    77     1.54380   116.08272   176.97457
   76    75 S   HC   _H4_    78     1.09712   109.04191    61.00422
   77    74 S   CO4  _C25    49     1.48041   120.73820     2.83800
   78    77 S   O    _O34    50     1.22718   120.24002  -166.43788
   79    75 S   CT   _C10    79     1.53311   111.72232   -58.06322
   80    79 S   HC   _H14    80     1.09547   110.86216   -60.24162
   81    79 S   HC   _H15    81     1.09419   111.50546  -179.16023
   82    79 S   HC   _H16    82     1.09495   111.22414    59.88353
   83    75 S   CT   _C8_    83     1.54567   111.62389   179.79347
   84    83 S   HC   _H12    84     1.09800   108.65760   163.75572
   85    83 S   HC   _H13    85     1.09691   109.75178    47.62695
   86    83 S   CT   _C7_    86     1.53345   113.75780   -75.39784
   87    86 S   HC   _H10    87     1.09452   109.16136   -59.51429
   88    86 S   HC   _H11    88     1.09382   109.56541    58.17663
   89    86 S   CT   _C6_    89     1.53420   110.95475   178.99946
   90    89 S   HC   _H8_    90     1.09709   108.97629    60.01324
   91    89 S   HC   _H9_    91     1.09808   108.94670   -55.32379
   92    89 S   CT   _C5_    92     1.54494   115.27561  -177.70706
   93    92 S   HC   _H3_    93     1.09847   106.37356    54.12594
   94    92 S   CT   _C4_    94     1.53117   111.57607   -62.50558
   95    94 S   HC   _H5_    95     1.09459   110.88123   -63.90407
   96    94 S   HC   _H6_    96     1.09418   111.73154    56.93108
   97    94 S   HC   _H7_    97     1.09513   110.98427   177.16538
   98    92 S   CT   _C29    98     1.54193   111.25172   171.41739
   99    98 S   HC   _H37    99     1.09767   108.95064   165.78190
  100    98 S   HC   _H38   100     1.09606   109.57414    48.96475
  101    98 S   CT   _C30   101     1.53255   113.11562   -73.18523
  102   101 S   HC   _H39   102     1.09406   110.42827    55.52334
  103   101 S   HC   _H40   103     1.09734   109.05396   -61.02457
  104   101 S   CT   _C31   104     1.53449   113.33788   178.90621
  105   104 S   HC   _H41   105     1.09824   108.36205   -60.06561
  106   104 S   HC   _H42   106     1.09781   108.03217    54.49591
  107   104 S   CT   _C32   107     1.54031   115.85952   177.31671
  108   107 S   HC   _H43   108     1.09660   109.20228   -57.32030
  109   107 S   CT   _C33   109     1.53183   109.69870    59.95068
  110   109 S   HC   _H44   110     1.09541   111.25947    61.56441
  111   109 S   HC   _H45   111     1.09494   110.80329  -178.30165
  112   109 S   HC   _H46   112     1.09460   110.79012   -58.77683
  113   107 S   CT   _C34   113     1.52922   112.48392  -177.61550
  114   113 S   HC   _H47   114     1.09421   111.35853   -59.21349
  115   113 S   HC   _H48   115     1.09563   110.73664    59.90965
  116   113 S   HC   _H49   116     1.09458   111.25116   179.97202
  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  15  11   4   3  10   8   4   3   2   4
   1  10   3   8   4  11   6   3   7   3   2   1   9   5   4   5
   3   9   5   4   4   2  12   5   4   2  12   8   1   1   7   3
   2   1   9   5   4   9   5   4  12   5   4  12   8   7   3   2
   1   9   5   4   9   5   4  12   5   4   9   8   7   3   2   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    39    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    43    77    39    44    48    40    41    42    50  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    43    52    74    77    78    39    44    45    46    47    48    49    40    41    42    50    51    54  
   35    36  
   36  
    0  
   38    43    52    53    55    69    74    77    39    44    48    40    41    42    50  
   43    52    74    39    40  
   44    45    46    47    48    49    40    41    42    50    43    69    74    77    78  
   41    42    50    51    54    57    61    43    44    48    77  
   42    50    51    54  
   50    51    54  
   52    53    55    56    64    69    70    74    77    78  
   45    46    47    48    49    74    77    78  
   46    47    48    77  
   47    48    77  
   48    77  
   49    74    77    78  
   77  
   51    54    57    58    59    60    61    62    63    66  
   54    57    61  
   53    55    56    64    65    69    74    77  
   55    56    64    74  
   57    58    59    60    61    62    63    66    67    68    71  
   56    64    65    69    70    74  
   64    65    69  
   58    59    60    61    62    63    66  
   59    60    61  
   60    61  
   61  
   62    63    66    67    68    71    72    73    75  
   63    66    67    68    71  
   66    67    68    71  
   65    69    70    74    77  
   69    70    74  
   67    68    71    72    73    75    76    79    83  
   68    71    72    73    75  
   71    72    73    75  
   70    74    77    78  
   74    77  
   72    73    75    76    79    80    81    82    83    84    85    86  
   73    75    76    79    83  
   75    76    79    83  
   77    78  
   76    79    80    81    82    83    84    85    86    87    88    89  
   79    80    81    82    83    84    85    86  
   78  
    0  
   80    81    82    83    84    85    86  
   81    82    83  
   82    83  
   83  
   84    85    86    87    88    89    90    91    92  
   85    86    87    88    89  
   86    87    88    89  
   87    88    89    90    91    92    93    94    98  
   88    89    90    91    92  
   89    90    91    92  
   90    91    92    93    94    95    96    97    98    99   100   101  
   91    92    93    94    98  
   92    93    94    98  
   93    94    95    96    97    98    99   100   101   102   103   104  
   94    95    96    97    98    99   100   101  
   95    96    97    98    99   100   101  
   96    97    98  
   97    98  
   98  
   99   100   101   102   103   104   105   106   107  
  100   101   102   103   104  
  101   102   103   104  
  102   103   104   105   106   107   108   109   113  
  103   104   105   106   107  
  104   105   106   107  
  105   106   107   108   109   110   111   112   113   114   115   116  
  106   107   108   109   113  
  107   108   109   113  
  108   109   110   111   112   113   114   115   116  
  109   110   111   112   113   114   115   116  
  110   111   112   113   114   115   116  
  111   112   113  
  112   113  
  113  
  114   115   116  
  115   116  
  116  
    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   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   40   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   44   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   49   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   50   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   51   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   53   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   54   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   55   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   56   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   57   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5500   0.0700  -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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   70   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   71   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   75   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   78   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   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   3.5000   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  -0.120000   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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  100   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  101   3.5000   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  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
  107   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
  108   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  109   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  110   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  112   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  113   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  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
  116   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    39   268.000  1.529
   33    40   268.000  1.529
   37    38   570.000  1.229
   37    43   310.000  1.470
   43    52   469.000  1.400
   43    74   469.000  1.400
   52    53   367.000  1.080
   52    55   469.000  1.400
   55    56   367.000  1.080
   55    64   469.000  1.400
   64    65   367.000  1.080
   64    69   469.000  1.400
   69    70   367.000  1.080
   69    74   469.000  1.400
   74    77   310.000  1.470
   77    78   570.000  1.229
   77    39   317.000  1.522
   39    44   268.000  1.529
   39    48   320.000  1.410
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   340.000  1.090
   48    49   553.000  0.945
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    50   317.000  1.510
   50    51   340.000  1.080
   50    54   549.000  1.340
   54    57   317.000  1.510
   54    61   317.000  1.510
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   340.000  1.090
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    66   268.000  1.529
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    71   268.000  1.529
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    75   268.000  1.529
   75    76   340.000  1.090
   75    79   268.000  1.529
   75    83   268.000  1.529
   79    80   340.000  1.090
   79    81   340.000  1.090
   79    82   340.000  1.090
   83    84   340.000  1.090
   83    85   340.000  1.090
   83    86   268.000  1.529
   86    87   340.000  1.090
   86    88   340.000  1.090
   86    89   268.000  1.529
   89    90   340.000  1.090
   89    91   340.000  1.090
   89    92   268.000  1.529
   92    93   340.000  1.090
   92    94   268.000  1.529
   92    98   268.000  1.529
   94    95   340.000  1.090
   94    96   340.000  1.090
   94    97   340.000  1.090
   98    99   340.000  1.090
   98   100   340.000  1.090
   98   101   268.000  1.529
  101   102   340.000  1.090
  101   103   340.000  1.090
  101   104   268.000  1.529
  104   105   340.000  1.090
  104   106   340.000  1.090
  104   107   268.000  1.529
  107   108   340.000  1.090
  107   109   268.000  1.529
  107   113   268.000  1.529
  109   110   340.000  1.090
  109   111   340.000  1.090
  109   112   340.000  1.090
  113   114   340.000  1.090
  113   115   340.000  1.090
  113   116   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  110.18000
   29    33    39    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    37    38    80.00000  120.40000
   33    37    43    65.00000  115.47100
   33    39    77    63.00000  111.10000
   33    39    44    58.35000  112.70000
   33    39    48    50.00000  109.50000
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   33    40    50    70.00000  112.02700
   37    43    52    60.00000  119.52600
   37    43    74    60.00000  119.52600
   43    37    38    75.00000  123.78400
   43    52    53    35.00000  120.00000
   43    52    55    63.00000  120.00000
   43    74    69    63.00000  120.00000
   43    74    77    60.00000  119.52600
   52    55    56    35.00000  120.00000
   52    55    64    63.00000  120.00000
   55    52    53    35.00000  120.00000
   55    64    65    35.00000  120.00000
   55    64    69    63.00000  120.00000
   64    55    56    35.00000  120.00000
   64    69    70    35.00000  120.00000
   64    69    74    63.00000  120.00000
   69    64    65    35.00000  120.00000
   69    74    77    60.00000  119.52600
   74    43    52    63.00000  120.00000
   74    69    70    35.00000  120.00000
   74    77    78    75.00000  123.78400
   74    77    39    65.00000  115.47100
   77    39    44    63.00000  111.10000
   77    39    48    90.00000  109.61100
   39    33    37    63.00000  111.10000
   39    77    78    80.00000  120.40000
   39    44    45    37.50000  110.70000
   39    44    46    37.50000  110.70000
   39    44    47    37.50000  110.70000
   39    48    49    55.00000  108.50000
   46    44    45    33.00000  107.80000
   47    44    45    33.00000  107.80000
   47    44    46    33.00000  107.80000
   48    39    44    50.00000  109.50000
   40    33    37    63.00000  111.10000
   40    33    39    58.35000  112.70000
   40    50    51    35.00000  117.00000
   40    50    54    70.00000  124.00000
   42    40    41    33.00000  107.80000
   50    40    41    35.00000  109.50000
   50    40    42    35.00000  109.50000
   50    54    57    70.00000  124.00000
   50    54    61    70.00000  124.00000
   54    50    51    35.00000  120.00000
   54    57    58    35.00000  109.50000
   54    57    59    35.00000  109.50000
   54    57    60    35.00000  109.50000
   54    61    62    35.00000  109.50000
   54    61    63    35.00000  109.50000
   54    61    66    70.00000  112.02700
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    33.00000  107.80000
   61    54    57    65.00000  117.92700
   61    66    67    37.50000  110.70000
   61    66    68    37.50000  110.70000
   61    66    71    58.35000  112.70000
   63    61    62    33.00000  107.80000
   66    61    62    37.50000  110.70000
   66    61    63    37.50000  110.70000
   66    71    72    37.50000  110.70000
   66    71    73    37.50000  110.70000
   66    71    75    58.35000  112.70000
   68    66    67    33.00000  107.80000
   71    66    67    37.50000  110.70000
   71    66    68    37.50000  110.70000
   71    75    76    37.50000  110.70000
   71    75    79    58.35000  112.70000
   71    75    83    58.35000  112.70000
   73    71    72    33.00000  107.80000
   75    71    72    37.50000  110.70000
   75    71    73    37.50000  110.70000
   75    79    80    37.50000  110.70000
   75    79    81    37.50000  110.70000
   75    79    82    37.50000  110.70000
   75    83    84    37.50000  110.70000
   75    83    85    37.50000  110.70000
   75    83    86    58.35000  112.70000
   79    75    76    37.50000  110.70000
   81    79    80    33.00000  107.80000
   82    79    80    33.00000  107.80000
   82    79    81    33.00000  107.80000
   83    75    76    37.50000  110.70000
   83    75    79    58.35000  112.70000
   83    86    87    37.50000  110.70000
   83    86    88    37.50000  110.70000
   83    86    89    58.35000  112.70000
   85    83    84    33.00000  107.80000
   86    83    84    37.50000  110.70000
   86    83    85    37.50000  110.70000
   86    89    90    37.50000  110.70000
   86    89    91    37.50000  110.70000
   86    89    92    58.35000  112.70000
   88    86    87    33.00000  107.80000
   89    86    87    37.50000  110.70000
   89    86    88    37.50000  110.70000
   89    92    93    37.50000  110.70000
   89    92    94    58.35000  112.70000
   89    92    98    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    95    37.50000  110.70000
   92    94    96    37.50000  110.70000
   92    94    97    37.50000  110.70000
   92    98    99    37.50000  110.70000
   92    98   100    37.50000  110.70000
   92    98   101    58.35000  112.70000
   94    92    93    37.50000  110.70000
   96    94    95    33.00000  107.80000
   97    94    95    33.00000  107.80000
   97    94    96    33.00000  107.80000
   98    92    93    37.50000  110.70000
   98    92    94    58.35000  112.70000
   98   101   102    37.50000  110.70000
   98   101   103    37.50000  110.70000
   98   101   104    58.35000  112.70000
  100    98    99    33.00000  107.80000
  101    98    99    37.50000  110.70000
  101    98   100    37.50000  110.70000
  101   104   105    37.50000  110.70000
  101   104   106    37.50000  110.70000
  101   104   107    58.35000  112.70000
  103   101   102    33.00000  107.80000
  104   101   102    37.50000  110.70000
  104   101   103    37.50000  110.70000
  104   107   108    37.50000  110.70000
  104   107   109    58.35000  112.70000
  104   107   113    58.35000  112.70000
  106   104   105    33.00000  107.80000
  107   104   105    37.50000  110.70000
  107   104   106    37.50000  110.70000
  107   109   110    37.50000  110.70000
  107   109   111    37.50000  110.70000
  107   109   112    37.50000  110.70000
  107   113   114    37.50000  110.70000
  107   113   115    37.50000  110.70000
  107   113   116    37.50000  110.70000
  109   107   108    37.50000  110.70000
  111   109   110    33.00000  107.80000
  112   109   110    33.00000  107.80000
  112   109   111    33.00000  107.80000
  113   107   108    37.50000  110.70000
  113   107   109    58.35000  112.70000
  115   113   114    33.00000  107.80000
  116   113   114    33.00000  107.80000
  116   113   115    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
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   99    98   101   104   0.15000  1.0 3.0
  100    98   101   102   0.15000  1.0 3.0
  100    98   101   103   0.15000  1.0 3.0
  100    98   101   104   0.15000  1.0 3.0
  101   104   107   108   0.15000  1.0 3.0
  101   104   107   109   0.56750  1.0 1.0
  101   104   107   109  -0.07550 -1.0 2.0
  101   104   107   109   0.20000  1.0 3.0
  101   104   107   113   0.56750  1.0 1.0
  101   104   107   113  -0.07550 -1.0 2.0
  101   104   107   113   0.20000  1.0 3.0
  102   101   104   105   0.15000  1.0 3.0
  102   101   104   106   0.15000  1.0 3.0
  102   101   104   107   0.15000  1.0 3.0
  103   101   104   105   0.15000  1.0 3.0
  103   101   104   106   0.15000  1.0 3.0
  103   101   104   107   0.15000  1.0 3.0
  104   107   109   110   0.15000  1.0 3.0
  104   107   109   111   0.15000  1.0 3.0
  104   107   109   112   0.15000  1.0 3.0
  104   107   113   114   0.15000  1.0 3.0
  104   107   113   115   0.15000  1.0 3.0
  104   107   113   116   0.15000  1.0 3.0
  105   104   107   108   0.15000  1.0 3.0
  105   104   107   109   0.15000  1.0 3.0
  105   104   107   113   0.15000  1.0 3.0
  106   104   107   108   0.15000  1.0 3.0
  106   104   107   109   0.15000  1.0 3.0
  106   104   107   113   0.15000  1.0 3.0
  108   107   109   110   0.15000  1.0 3.0
  108   107   109   111   0.15000  1.0 3.0
  108   107   109   112   0.15000  1.0 3.0
  108   107   113   114   0.15000  1.0 3.0
  108   107   113   115   0.15000  1.0 3.0
  108   107   113   116   0.15000  1.0 3.0
  109   107   113   114   0.15000  1.0 3.0
  109   107   113   115   0.15000  1.0 3.0
  109   107   113   116   0.15000  1.0 3.0
  113   107   109   110   0.15000  1.0 3.0
  113   107   109   111   0.15000  1.0 3.0
  113   107   109   112   0.15000  1.0 3.0
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    43    37    38  10.50000 -1.0 2.0
   52    74    43    37   4.00000 -1.0 2.0
   55    53    52    43   1.10000 -1.0 2.0
   64    56    55    52   1.10000 -1.0 2.0
   69    65    64    55   1.10000 -1.0 2.0
   74    70    69    64   1.10000 -1.0 2.0
   69    77    74    43   4.00000 -1.0 2.0
   74    39    77    78  10.50000 -1.0 2.0
   40    51    50    54  15.00000 -1.0 2.0
   57    61    54    50  15.00000 -1.0 2.0
END
