* LIGAND DATABASE FILE (OPLS2005)
*
001     114   116    208    323     604
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1    23     1.02073   102.77110    12.42461
    3     1 S   H    _H1_    24     1.02158    41.07650   116.36055
    4     1 S   H    _H2_    25     1.02137    72.70302   -93.46346
    5     1 S   CT   _CA1     2     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1    26     1.05972   107.41041    47.01581
    7     5 S   CO3  _C1_     3     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     4     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     5     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1     6     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    27     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    28     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1     7     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    29     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    30     1.10493   110.13804    57.98762
   16    13 S   C    _CD1     8     1.52596   114.68728   179.10606
   17    16 S   O    _OE1     9     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    10     1.34015   114.76575   162.47883
   19    18 S   H    _HN2    31     1.04748   118.84952     8.59078
   20    18 S   CT1  _CA2    11     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    32     1.08457   106.27517   -11.11459
   22    20 S   C    _C2_    12     1.54037   112.60135  -130.27230
   23    22 S   O    _O2_    13     1.23085   119.01196  -169.64989
   24    20 S   CT   _CB2    19     1.54652   109.46586   105.32505
   25    24 S   HC   HB21    21     1.08611   110.49349    58.87219
   26    24 S   HC   HB22    22     1.08575   109.90351   179.04879
   27    22 S   N    _N3_    14     1.34263   118.97450    10.45203
   28    27 S   H    _HN3    33     1.03492   120.05970     5.06895
   29    24 S   S    _SG2    20     1.81647   112.43692   -61.22030
   30    27 S   CT   _CA3    15     1.46098   124.53040  -172.10347
   31    30 S   HC   HA31    34     1.12298   109.15732    14.31073
   32    30 S   HC   HA32    35     1.12301   109.23063   127.81991
   33    29 S   CT   _C23    58     1.81643    98.34667   161.82290
   34    30 S   CO3  _C3_    16     1.53166   113.47286  -108.98504
   35    34 S   O2Z  _O31    17     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    18     1.25025   116.29664   179.33914
   37    33 S   CT1  _C20    55     1.53670   111.93023    64.68744
   38    37 S   HC   _H56    90     1.09683   112.93527    39.92981
   39    33 S   OH   _O40    75     1.42573   110.68525   -59.52524
   40    39 S   HO   _H80   114     0.96847   106.48534   -62.61135
   41    37 S   CO4  _C4_    39     1.51533   101.63444   154.58388
   42    41 S   O    _O35    70     1.22500   124.67997   164.77766
   43    37 S   N    _N33    68     1.43176   115.00186   -86.99450
   44    43 S   H    _H78   112     1.01564   116.98777   -21.16628
   45    43 S   C    _C15    50     1.38363   123.10723   158.62375
   46    45 S   O    _O36    71     1.22732   125.71006    -0.05595
   47    52 S   CT   _C17    52     1.53018   104.39069  -162.44456
   48    47 S   HC   _H51    85     1.09348   111.54617   -85.07640
   49    47 S   HC   _H52    86     1.09280   111.72787   150.23344
   50    45 S   CM   _C8_    43     1.48952   111.81811  -179.98022
   51    50 S   HC   _H46    80     1.08540   118.45696    -0.00000
   52    33 S   CT   _C18    53     1.53190   111.66989   179.95154
   53    52 S   HC   _H53    87     1.09581   112.95443    77.74173
   54    52 S   HC   _H54    88     1.09738   111.59546   -44.89273
   55    50 S   CM   _C7_    42     1.34004   120.20416   179.98022
   56    55 S   HC   _H45    79     1.08675   120.59587    -0.05234
   57    55 S   CM   _C5_    40     1.44727   122.70464  -179.96574
   58    57 S   HC   _H43    77     1.08816   116.97206    -0.01978
   59    57 S   CM   _C6_    41     1.34145   123.05700   179.96574
   60    59 S   HC   _H44    78     1.08762   119.96724     0.08393
   61    59 S   CM   _C9_    44     1.44684   123.00500   179.98022
   62    61 S   HC   _H47    81     1.08737   117.29019     0.06853
   63    61 S   CM   _C11    46     1.34123   123.12529   179.94766
   64    63 S   HC   _H49    83     1.08750   120.11389     0.11535
   65    63 S   CT   _C22    57     1.50655   123.62444  -179.94405
   66    65 S   CM   _C32    36     1.51478   108.63672    60.04131
   67    66 S   HC   _H42    76     1.09075   115.85021    59.96329
   68    65 S   OH   _O39    74     1.43448   107.40944   174.91207
   69    68 S   HO   _H79   113     0.96764   105.99148   -56.28128
   70    66 S   CM   _C33    37     1.34130   125.76324  -119.71916
   71    70 S   CO4  _C34    38     1.48808   121.50598    -1.11487
   72    71 S   O    _O34    69     1.22519   122.37864   178.17608
   73    70 S   N    _N32    67     1.36570   121.54816   179.19158
   74    73 S   H    _H77   111     1.01573   118.24973   150.03303
   75    73 S   C    _C16    51     1.38688   123.43897   -29.89289
   76    75 S   O    _O37    72     1.22949   124.67621    -0.06561
   77    71 S   C3T  _C19    54     1.47600   117.40745    -2.51147
   78    77 S   HC   _H55    89     1.08354   116.43893   154.48644
   79    75 S   CM   _C13    48     1.50643   113.95855   179.59410
   80    65 S   C3T  _C21    56     1.50648   111.80881   -67.14437
   81    80 S   HC   _H57    91     1.08169   114.90935   -36.09568
   82    79 S   CM   _C10    45     1.34795   115.73473    60.00682
   83    82 S   HC   _H48    82     1.08814   120.53156     0.80089
   84    79 S   CT   _C24    59     1.50168   119.29952  -122.72639
   85    84 S   HC   _H58    92     1.09336   112.61281   -86.97284
   86    84 S   HC   _H59    93     1.09583   110.50361    31.78348
   87    84 S   HC   _H60    94     1.09340   110.65637   152.23059
   88    77 S   O3T  _O38    73     1.43619   113.04159   -65.10634
   89    82 S   CM   _C14    49     1.45393   126.34744   179.58646
   90    89 S   CM   _C12    47     1.34729   124.44587   -39.94783
   91    90 S   HC   _H50    84     1.08983   117.70584    -1.84218
   92    89 S   CT   _C25    60     1.50383   114.13238   138.12129
   93    92 S   HC   _H61    95     1.09593   112.09911    90.05503
   94    92 S   HC   _H62    96     1.09557   110.64966  -150.03174
   95    92 S   HC   _H63    97     1.09469   110.58604   -29.80162
   96    90 S   CT   _C31    66     1.51612   127.60759  -180.00000
   97    96 S   HC   _H76   110     1.09387   109.89470    -0.08847
   98    96 S   CT   _C27    62     1.53106   108.98799  -117.56608
   99    98 S   HC   _H67   101     1.09539   111.54992   -60.95553
  100    98 S   HC   _H68   102     1.09434   111.16054    59.69968
  101    98 S   HC   _H69   103     1.09591   110.96556   178.74524
  102    96 S   CT   _C30    65     1.54240   109.43462   119.46831
  103   102 S   HC   _H74   108     1.09737   109.28430  -179.98022
  104   102 S   HC   _H75   109     1.09832   109.33912    64.42002
  105   102 S   CT   _C29    64     1.53386   115.67102   -57.44681
  106   105 S   HC   _H72   106     1.09823   107.81461    56.16085
  107   105 S   HC   _H73   107     1.09601   110.20017   -59.27064
  108   105 S   CT   _C28    63     1.52895   113.55168   176.91790
  109   108 S   HC   _H70   104     1.09459   110.47221    59.14214
  110   108 S   HC   _H71   105     1.09606   109.91096   -59.20862
  111   108 S   CT   _C26    61     1.52157   111.37070   179.88809
  112   111 S   HC   _H64    98     1.09434   111.07707    58.18142
  113   111 S   HC   _H65    99     1.09370   110.22656   177.94776
  114   111 S   HC   _H66   100     1.09454   110.94103   -62.34867
  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  11   5   4   3
  15   2   1   1  16   8   7   1  10   5   8   3   6   3   5   4
   3   6   3   2   1   1   6   3   6   3   6   3   7   3  11   4
  12  13   5   6   1  11   9   5   7   3   9   3   4   3   9   2
   1  13   4   4   2   1   1   1  10  15   5   4   2   1   1  12
   8   7   3   2   1   9   5   4   9   5   4   6   5   4   3   2
   1   1
    5     7     8     9    10    13     2     3     4     6    11    12  
    3     4     6     5     7    10  
    4     6     5     7    10  
    6     5     7    10  
    7     8     9    10    13    16     6    11    12    14    15  
   11    12     7     8     9    10    13  
    8     9    10    13    11    12  
    9    10  
   10  
   13    16    17    18    11    12    14    15  
   12    14    15    13    16  
   14    15    13    16  
   16    17    18    20    14    15    19  
   15    16    17    18  
   16    17    18  
   17    18    20    22    24    19    21  
   18    20    19  
   20    22    23    27    24    29    25    26    19    21  
   21    20    22    24  
   22    23    27    30    24    29    25    26    21    28    33  
   22    23    24    25    26    27    29  
   23    27    30    34    24    29    25    26    28    31    32  
   27    30    24    28  
   29    25    26    52    37    33    39    27  
   26    33    29  
   33    29  
   30    34    35    36    28    31    32  
   31    32    30    34  
   41    47    52    37    33    43    39    53    54    38    40  
   34    35    36    31    32  
   32    34    35    36  
   34    35    36  
   43    42    39    48    49    53    54    38    44    40    37    41    45    47    52  
   35    36  
   36  
    0  
   43    42    46    39    48    49    53    54    38    44    40    41    45    47    50    52  
   44    39    41    42    43    45    47    52  
   53    54    40    41    43    47    52  
   52  
   45    47    52    43    42    48    49    53    54    44  
   48    49    43    47    52  
   46    51    44    45    47    50    52    55  
   45    46    50  
   46    56    51    50    55    57  
   51    50    55  
   52    48    49    53    54  
   49    53    54    52  
   53    54    52  
   58    56    51    55    57    59  
   55    56    57  
   53    54  
   54  
    0  
   61    58    60    56    57    59  
   57    58    59  
   59    61    63    58    60    62  
   60    59    61  
   61    63    65    60    62    64  
   62    61    63  
   63    80    65    68    62    64    66  
   64    63    65  
   77    80    65    88    68    67    64    81    69    66    70  
   65    66    68    80  
   73    88    68    67    78    81    69    66    70    71    77    80  
   70    71    75    77    80    73    72    88    68    67    81    74    69  
   68    70    71    73    80  
   81    69    70    77    80    88  
   80  
   71    79    75    77    80    73    72    76    88    78    74  
   75    77    80    73    72    88    78    81    74  
   88    78    73    77    80  
   76    74    75    77    79    82    84  
   75    76    79  
   84    76    83    85    86    87    79    82    89  
   79    82    84  
   80    88    78    81  
   81    80    88  
   89    84    92    83    85    86    87    82    90  
   88    81  
   88  
   90    89    84    92    96    83    91    85    86    87    93    94    95  
   84    89    90    92  
   85    86    87    89  
   86    87  
   87  
    0  
    0  
   92    98   102    96    91    93    94    95    97    90  
   92    98   105   102    96    91    93    94    95    99   100   101   103   104    97  
   97    92    96    98   102  
   96    93    94    95  
   94    95  
   95  
    0  
   99   100   101   106   107   103   104    97    98   102   105   108  
   98    99   100   101   102   103   104   105  
  105   102    99   100   101   103   104  
  100   101   102  
  101   102  
  102  
  109   110   106   107   103   104   105   108   111  
  104   105   106   107   108  
  105   106   107   108  
  112   113   114   109   110   106   107   108   111  
  107   108   109   110   111  
  108   109   110   111  
  112   113   114   109   110   111  
  110   111   112   113   114  
  111   112   113   114  
  112   113   114  
  113   114  
  114  
    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   0.432500   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   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   39   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   40   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   41   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   44   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   45   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   47   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5500   0.0760  -0.171700   2.0020   1.7750   0.023028004  -0.852763146
   51   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   56   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   58   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   60   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   62   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   64   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   66   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   67   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   68   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   69   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   70   3.5500   0.0760   0.051300   2.0020   1.7750   0.023028004  -0.852763146
   71   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   72   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   73   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
   74   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   75   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
   76   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   77   3.5000   0.0660   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   78   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   79   3.5500   0.0760  -0.056700   2.0020   1.7750   0.023028004  -0.852763146
   80   3.5000   0.0660   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   83   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   84   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   2.9000   0.1400  -0.352400   1.5900   1.4000   0.020110767  -0.896042159
   89   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   90   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   91   2.4200   0.0300   0.115000   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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  102   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  103   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  104   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   3.5000   0.0660  -0.120000   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  109   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  110   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  112   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  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
BOND
    1     5   367.000  1.471
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    5     7   317.000  1.522
    5    10   268.000  1.529
    5     6   340.000  1.090
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    13   268.000  1.529
   10    11   340.000  1.090
   10    12   340.000  1.090
   13    16   317.000  1.522
   13    14   340.000  1.090
   13    15   340.000  1.090
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    20   337.000  1.449
   18    19   434.000  1.010
   20    22   317.000  1.522
   20    24   268.000  1.529
   20    21   340.000  1.090
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    30   337.000  1.449
   27    28   434.000  1.010
   30    34   317.000  1.522
   30    31   340.000  1.090
   30    32   340.000  1.090
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    29   222.000  1.810
   24    25   340.000  1.090
   24    26   340.000  1.090
   29    33   222.000  1.810
   66    70   549.000  1.340
   66    65   317.000  1.510
   66    67   340.000  1.080
   70    71   320.000  1.462
   70    73   400.000  1.384
   71    77   290.000  1.496
   71    72   570.000  1.229
   41    47   317.000  1.522
   41    37   255.000  1.522
   41    42   570.000  1.229
   57    59   549.000  1.340
   57    55   380.000  1.444
   57    58   340.000  1.080
   59    61   380.000  1.444
   59    60   340.000  1.080
   55    50   549.000  1.340
   55    56   340.000  1.080
   50    45   410.000  1.444
   50    51   340.000  1.080
   61    63   549.000  1.340
   61    62   340.000  1.080
   82    79   549.000  1.340
   82    89   380.000  1.444
   82    83   340.000  1.080
   63    65   317.000  1.510
   63    64   340.000  1.080
   90    89   549.000  1.340
   90    96   317.000  1.510
   90    91   340.000  1.080
   79    75   410.000  1.444
   79    84   317.000  1.510
   89    92   317.000  1.510
   45    43   490.000  1.335
   45    46   570.000  1.229
   75    73   490.000  1.335
   75    76   570.000  1.229
   47    52   268.000  1.529
   47    48   340.000  1.090
   47    49   340.000  1.090
   52    33   268.000  1.529
   52    53   340.000  1.090
   52    54   340.000  1.090
   77    80   260.000  1.509
   77    88   335.000  1.432
   77    78   340.000  1.088
   37    33   268.000  1.529
   37    43   337.000  1.449
   37    38   340.000  1.090
   80    65   275.000  1.510
   80    88   335.000  1.432
   80    81   340.000  1.088
   65    68   320.000  1.410
   33    39   320.000  1.410
   84    85   340.000  1.090
   84    86   340.000  1.090
   84    87   340.000  1.090
   92    93   340.000  1.090
   92    94   340.000  1.090
   92    95   340.000  1.090
  111   108   268.000  1.529
  111   112   340.000  1.090
  111   113   340.000  1.090
  111   114   340.000  1.090
   98    96   268.000  1.529
   98    99   340.000  1.090
   98   100   340.000  1.090
   98   101   340.000  1.090
  108   105   268.000  1.529
  108   109   340.000  1.090
  108   110   340.000  1.090
  105   102   268.000  1.529
  105   106   340.000  1.090
  105   107   340.000  1.090
  102    96   268.000  1.529
  102   103   340.000  1.090
  102   104   340.000  1.090
   96    97   340.000  1.090
   73    74   434.000  1.010
   43    44   434.000  1.010
   68    69   553.000  0.945
   39    40   553.000  0.945
THET
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    1     5     6    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    13    58.35000  112.70000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    9     7     8    80.00000  126.00000
   10     5     7    70.00000  109.69300
   10    13    16    63.00000  111.10000
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   16    18    20    50.00000  121.90000
   16    18    19    35.00000  119.80000
   18    16    17    80.00000  122.90000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   18    20    21    35.00000  109.50000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    29    75.00000  108.68000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   22    27    30    50.00000  121.90000
   22    27    28    35.00000  119.80000
   27    22    23    80.00000  122.90000
   27    30    34    63.00000  110.10000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   36    34    35    80.00000  126.00000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   29    33    52    75.00000  111.63000
   29    33    37    75.00000  108.68000
   29    33    39    85.00000  114.68000
   25    24    29    35.00000  109.50000
   26    24    29    35.00000  109.50000
   26    24    25    33.00000  107.80000
    2     1     5    35.00000  109.50000
    3     1     5    35.00000  109.50000
    3     1     2    35.00000  109.50000
    4     1     5    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    6     5     7    35.00000  109.50000
    6     5    10    37.50000  110.70000
   11    10    13    37.50000  110.70000
   12    10    13    37.50000  110.70000
   12    10    11    33.00000  107.80000
   14    13    16    35.00000  109.50000
   15    13    16    35.00000  109.50000
   15    13    14    33.00000  107.80000
   19    18    20    38.00000  118.40000
   21    20    22    35.00000  109.50000
   21    20    24    37.50000  110.70000
   28    27    30    38.00000  118.40000
   31    30    34    35.00000  109.50000
   32    30    34    35.00000  109.50000
   32    30    31    33.00000  107.80000
   66    70    71    65.00000  118.96000
   66    70    73    75.00000  120.83300
   66    65    63    70.00000  110.12100
   66    65    80    70.00000  112.02700
   66    65    68    90.00000  110.39200
   70    71    77    65.00000  118.62400
   70    71    72    80.00000  123.72100
   70    73    75    70.00000  120.89900
   70    73    74    45.00000  117.55000
   71    77    80    65.00000  117.18000
   71    77    88    80.00000  114.91000
   71    77    78    40.00000  116.18000
   41    47    52    63.00000  111.10000
   41    47    48    35.00000  109.50000
   41    47    49    35.00000  109.50000
   41    37    33    70.00000  110.61500
   41    37    43    80.00000  110.29000
   41    37    38    45.00000  110.09800
   57    59    61    70.00000  123.01800
   57    59    60    35.00000  120.00000
   57    55    50    70.00000  123.01800
   57    55    56    35.00000  120.00000
   59    61    63    70.00000  123.01800
   59    61    62    35.00000  120.00000
   55    57    59    70.00000  123.01800
   55    50    45    70.00000  118.70000
   55    50    51    35.00000  120.00000
   50    45    43    80.00000  111.56200
   50    45    46    80.00000  125.30000
   61    63    65    70.00000  124.00000
   61    63    64    35.00000  120.00000
   82    79    75    70.00000  118.70000
   82    79    84    70.00000  124.00000
   82    89    90    70.00000  123.01800
   82    89    92    70.00000  124.00000
   63    65    80    70.00000  112.02700
   63    65    68    90.00000  110.39200
   90    89    92    70.00000  124.00000
   90    96    98    70.00000  112.02700
   90    96   102    70.00000  112.02700
   90    96    97    35.00000  109.50000
   79    75    73    80.00000  111.56200
   79    75    76    80.00000  125.30000
   79    84    85    35.00000  109.50000
   79    84    86    35.00000  109.50000
   79    84    87    35.00000  109.50000
   89    82    79    70.00000  123.01800
   89    92    93    35.00000  109.50000
   89    92    94    35.00000  109.50000
   89    92    95    35.00000  109.50000
   45    43    37    50.00000  121.90000
   45    43    44    35.00000  119.80000
   75    73    74    35.00000  119.80000
   47    52    33    58.35000  112.70000
   47    52    53    37.50000  110.70000
   47    52    54    37.50000  110.70000
   52    33    37    58.35000  112.70000
   52    33    39    50.00000  109.50000
   77    80    65    60.00000  120.94000
   77    80    88    15.00000   60.43100
   77    80    81    37.50000  117.20000
   77    88    80    15.00000   59.14900
   37    41    47    65.00000  117.09000
   37    33    39    50.00000  109.50000
   37    43    44    38.00000  118.40000
   80    65    68    50.00000  109.50000
   65    66    70    70.00000  124.00000
   65    68    69    55.00000  108.50000
   33    39    40    55.00000  108.50000
   84    79    75    70.00000  119.70000
  111   108   105    58.35000  112.70000
  111   108   109    37.50000  110.70000
  111   108   110    37.50000  110.70000
   98    96   102    58.35000  112.70000
   98    96    97    37.50000  110.70000
  108   105   102    58.35000  112.70000
  108   105   106    37.50000  110.70000
  108   105   107    37.50000  110.70000
  105   102    96    58.35000  112.70000
  105   102   103    37.50000  110.70000
  105   102   104    37.50000  110.70000
  102    96    97    37.50000  110.70000
   96    90    89    70.00000  124.00000
   73    70    71    70.00000  117.92000
   43    37    33    80.00000  109.70000
   72    71    77    75.00000  121.36600
   42    41    47    80.00000  120.40000
   42    41    37    75.00000  123.42600
   46    45    43    80.00000  122.90000
   76    75    73    80.00000  122.90000
   88    77    80    15.00000   60.43100
   88    80    65    80.00000  116.47100
   67    66    70    35.00000  120.00000
   67    66    65    35.00000  117.00000
   58    57    59    35.00000  120.00000
   58    57    55    35.00000  120.00000
   60    59    61    35.00000  120.00000
   56    55    50    35.00000  120.00000
   51    50    45    35.00000  119.70000
   62    61    63    35.00000  120.00000
   83    82    79    35.00000  120.00000
   83    82    89    35.00000  120.00000
   64    63    65    35.00000  117.00000
   91    90    89    35.00000  120.00000
   91    90    96    35.00000  117.00000
   48    47    52    37.50000  110.70000
   49    47    52    37.50000  110.70000
   49    47    48    33.00000  107.80000
   53    52    33    37.50000  110.70000
   54    52    33    37.50000  110.70000
   54    52    53    33.00000  107.80000
   78    77    80    37.50000  117.20000
   78    77    88    50.00000  114.27700
   38    37    33    37.50000  110.70000
   38    37    43    35.00000  109.50000
   81    80    65    40.00000  115.04500
   81    80    88    50.00000  114.27700
   86    84    85    33.00000  107.80000
   87    84    85    33.00000  107.80000
   87    84    86    33.00000  107.80000
   94    92    93    33.00000  107.80000
   95    92    93    33.00000  107.80000
   95    92    94    33.00000  107.80000
  112   111   108    37.50000  110.70000
  113   111   108    37.50000  110.70000
  113   111   112    33.00000  107.80000
  114   111   108    37.50000  110.70000
  114   111   112    33.00000  107.80000
  114   111   113    33.00000  107.80000
   99    98    96    37.50000  110.70000
  100    98    96    37.50000  110.70000
  100    98    99    33.00000  107.80000
  101    98    96    37.50000  110.70000
  101    98    99    33.00000  107.80000
  101    98   100    33.00000  107.80000
  109   108   105    37.50000  110.70000
  110   108   105    37.50000  110.70000
  110   108   109    33.00000  107.80000
  106   105   102    37.50000  110.70000
  107   105   102    37.50000  110.70000
  107   105   106    33.00000  107.80000
  103   102    96    37.50000  110.70000
  104   102    96    37.50000  110.70000
  104   102   103    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    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
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  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
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  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
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  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
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   13    16    18    19   2.45000 -1.0 2.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   16    18    20    21   0.00000  1.0 1.0
   17    16    18    20   3.04450 -1.0 2.0
   17    16    18    19   2.45000 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
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  113   111   108   110   0.15000  1.0 3.0
  114   111   108   105   0.15000  1.0 3.0
  114   111   108   109   0.15000  1.0 3.0
  114   111   108   110   0.15000  1.0 3.0
   99    98    96    90   0.15000  1.0 3.0
   99    98    96   102   0.15000  1.0 3.0
   99    98    96    97   0.15000  1.0 3.0
  100    98    96    90   0.15000  1.0 3.0
  100    98    96   102   0.15000  1.0 3.0
  100    98    96    97   0.15000  1.0 3.0
  101    98    96    90   0.15000  1.0 3.0
  101    98    96   102   0.15000  1.0 3.0
  101    98    96    97   0.15000  1.0 3.0
  109   108   105   102   0.15000  1.0 3.0
  109   108   105   106   0.15000  1.0 3.0
  109   108   105   107   0.15000  1.0 3.0
  110   108   105   102   0.15000  1.0 3.0
  110   108   105   106   0.15000  1.0 3.0
  110   108   105   107   0.15000  1.0 3.0
  106   105   102    96   0.15000  1.0 3.0
  106   105   102   103   0.15000  1.0 3.0
  106   105   102   104   0.15000  1.0 3.0
  107   105   102    96   0.15000  1.0 3.0
  107   105   102   103   0.15000  1.0 3.0
  107   105   102   104   0.15000  1.0 3.0
  103   102    96    90   0.15000  1.0 3.0
  103   102    96    98   0.15000  1.0 3.0
  103   102    96    97   0.15000  1.0 3.0
  104   102    96    90   0.15000  1.0 3.0
  104   102    96    98   0.15000  1.0 3.0
  104   102    96    97   0.15000  1.0 3.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    34    35  10.50000 -1.0 2.0
   65    67    66    70   1.10000 -1.0 2.0
   71    73    70    66   1.10000 -1.0 2.0
   70    77    71    72  10.50000 -1.0 2.0
   47    37    41    42  10.50000 -1.0 2.0
   55    58    57    59  15.00000 -1.0 2.0
   61    60    59    57  15.00000 -1.0 2.0
   57    56    55    50  15.00000 -1.0 2.0
   45    51    50    55  15.00000 -1.0 2.0
   59    62    61    63  15.00000 -1.0 2.0
   89    83    82    79  15.00000 -1.0 2.0
   65    64    63    61  15.00000 -1.0 2.0
   96    91    90    89  15.00000 -1.0 2.0
   75    84    79    82  15.00000 -1.0 2.0
   82    92    89    90  15.00000 -1.0 2.0
   50    43    45    46  10.50000 -1.0 2.0
   79    73    75    76  10.50000 -1.0 2.0
   74    75    73    70   1.00000 -1.0 2.0
   44    45    43    37   1.00000 -1.0 2.0
END
