* LIGAND DATABASE FILE (OPLS2005)
*
001     105   108    211    344     639
    1     0 S   NP   _N1_     1    29.15868    93.65578   -26.79405
    2     1 S   H    _HN1     2     1.02795   122.17843   -97.10676
    3     1 S   H    _H1_     3     1.02948    83.61080    10.59517
    4     1 S   H    _H2_     4     1.02827    24.16319  -156.00675
    5     1 S   CT   _CA1     5     1.50123   115.60315   120.22137
    6     5 S   HC   _HA1     6     1.09574   105.17167    85.06529
    7     5 S   CO3  _C1_     7     1.53757   112.41377   -35.15085
    8     7 S   O2Z  _O11     8     1.26373   115.00914   -43.92782
    9     7 S   O2Z  _O12     9     1.26229   114.92852   135.06529
   10     5 S   CT   _CB1    10     1.53055   107.40586  -156.99846
   11    10 S   HC   HB11    11     1.09842   109.31157   -49.66267
   12    10 S   HC   HB12    12     1.09810   110.48737    66.91343
   13    10 S   CT   _CG1    13     1.53031   112.65290  -170.60481
   14    13 S   HC   HG11    14     1.09571   110.73102   -67.21858
   15    13 S   HC   HG12    15     1.09669   109.71221    52.04472
   16    13 S   C    _CD1    16     1.51814   111.95584   172.50386
   17    16 S   O    _OE1    17     1.22762   123.16443    11.96667
   18    16 S   N    _N2_    18     1.38654   111.86962  -168.04098
   19    18 S   H    _HN2    19     1.01582   119.00533     1.01722
   20    18 S   CT1  _CA2    20     1.46230   123.30579   176.37539
   21    20 S   HC   _HA2    21     1.09742   109.29110     6.95920
   22    20 S   C    _C2_    22     1.53686   108.82537  -108.51325
   23    22 S   O    _O2_    23     1.23080   122.23329  -148.92939
   24    20 S   CT   _CB2    32     1.53494   111.69461   128.97442
   25    24 S   HC   HB21    33     1.09386   109.56504    57.80850
   26    24 S   HC   HB22    34     1.09458   109.37610   176.43575
   27    22 S   N    _N3_    24     1.38307   113.85957    38.55284
   28    27 S   H    _HN3    25     1.01546   119.60667    -3.22707
   29    24 S   S    _SG2    35     1.83275   111.02156   -64.28362
   30    27 S   CT   _CA3    26     1.45282   123.30220   177.22992
   31    30 S   HC   HA31    27     1.09546   107.50197   -65.12906
   32    30 S   HC   HA32    28     1.09555   108.01626    51.34034
   33    29 S   CT   _C23    36     1.89915   103.16074   170.89001
   34    30 S   CO3  _C3_    29     1.52979   114.01758   173.33988
   35    34 S   O2Z  _O31    30     1.26386   116.06407    -0.67984
   36    34 S   O2Z  _O32    31     1.26421   114.42335   179.38547
   37    33 S   CM   _C28    37     1.52226   106.93366    46.06218
   38    37 S   HC   _H38    38     1.08850   117.97860   -78.40970
   39    33 S   CM   _C22    96     1.51542   107.10117   -71.76235
   40    39 S   HC   _H32    97     1.09048   116.16973    41.29385
   41    37 S   CM   _C27    39     1.34053   124.41432   102.57153
   42    41 S   HC   _H37    40     1.08642   119.08128   178.78872
   43    41 S   CT   _C26    41     1.49478   123.57619    -0.37325
   44    43 S   HC   _H35    42     1.09581   108.43268   112.48912
   45    43 S   HC   _H36    43     1.09620   109.22844  -131.74782
   46    43 S   CT   _C25    44     1.53020   113.35912   -10.15650
   47    46 S   HC   _H33    45     1.09633   109.41390   165.32947
   48    46 S   HC   _H34    46     1.09852   107.93793   -81.48302
   49    33 S   CT   _C24    47     1.59243   110.43842   167.57998
   50    49 S   CT   _C19    48     1.57933   107.18183   165.11348
   51    50 S   HC   _H6_    49     1.09975   107.02263    53.05126
   52    49 S   CT   _C29   102     1.55544   113.28383    44.34579
   53    52 S   HC   _H39   103     1.09394   112.53560    50.63330
   54    52 S   HC   _H40   104     1.09533   111.98329   -70.32397
   55    52 S   HC   _H41   105     1.09423   111.51448   171.62075
   56    50 S   CT   _C18    50     1.54674   114.57779   168.60157
   57    56 S   HC   _H30    51     1.09393   110.79102    61.88413
   58    56 S   HC   _H31    52     1.09422   110.58952   -55.71343
   59    56 S   CT   _C17    53     1.53369   112.56910  -175.04916
   60    59 S   HC   _H28    54     1.09772   108.68571    66.81832
   61    59 S   HC   _H29    55     1.09320   107.95038  -178.22216
   62    59 S   CT   _C16    56     1.53533   112.18108   -55.02644
   63    62 S   CT   _C15    57     1.56262   107.70672    55.19577
   64    63 S   HC   _H5_    58     1.10319   108.15336    56.41591
   65    62 S   CT   _C30    98     1.54900   109.72162   -68.88910
   66    65 S   HC   _H42    99     1.09432   112.51471  -176.74045
   67    65 S   HC   _H43   100     1.09277   112.82518    62.29958
   68    65 S   HC   _H44   101     1.09518   110.85640   -56.92379
   69    63 S   CT   _C14    59     1.52823   102.39681   167.39320
   70    69 S   HC   _H26    60     1.09459   112.37481  -154.09388
   71    69 S   HC   _H27    61     1.09576   111.67780    84.21935
   72    50 S   CT   _C20    92     1.57704   112.40456   -62.89488
   73    72 S   HC   _H7_    93     1.09847   108.08475   -71.41520
   74    69 S   CT   _C13    62     1.53302   104.96192   -34.84260
   75    74 S   HC   _H24    63     1.09607   109.21003   130.35754
   76    74 S   HC   _H25    64     1.09586   110.70992  -111.62173
   77    72 S   CMA  _C21    94     1.55126   111.70251    44.47505
   78    77 S   OM   _O33    95     1.26154   112.94490   172.73623
   79    62 S   CT   _C12    65     1.56210   114.78732   165.59104
   80    79 S   HC   _H4_    66     1.09939   106.96289   -43.26031
   81    79 S   CT   _C5_    67     1.55427   119.60381    79.26412
   82    81 S   HC   _H3_    68     1.09801   108.32959    58.32088
   83    81 S   CT   _C4_    69     1.53155   113.00861   -59.96007
   84    83 S   HC   _H8_    70     1.09454   111.72007   -47.00763
   85    83 S   HC   _H9_    71     1.09263   111.05386    74.24497
   86    83 S   HC   _H10    72     1.09562   111.14030  -167.72444
   87    81 S   CT   _C6_    73     1.55235   112.97245   174.78831
   88    87 S   HC   _H11    74     1.09831   108.32933  -176.02576
   89    87 S   HC   _H12    75     1.09656   109.57221   -61.53336
   90    87 S   CT   _C7_    76     1.53390   115.22403    61.88278
   91    90 S   HC   _H13    77     1.09535   110.11042    57.51101
   92    90 S   HC   _H14    78     1.09370   109.56518   -60.62465
   93    90 S   CT   _C8_    79     1.53336   110.96203   178.48251
   94    93 S   HC   _H15    80     1.09757   109.35051    61.92090
   95    93 S   HC   _H16    81     1.09770   108.66666   -54.10741
   96    93 S   CT   _C9_    82     1.54009   113.47951  -175.17822
   97    96 S   HC   _H17    83     1.09738   108.70629    56.32497
   98    96 S   CT   _C10    84     1.52942   112.49362   -63.52350
   99    98 S   HC   _H18    85     1.09522   111.25803   -55.82878
  100    98 S   HC   _H19    86     1.09546   110.75252  -175.89559
  101    98 S   HC   _H20    87     1.09409   111.38574    64.99373
  102    96 S   CT   _C11    88     1.53076   109.78989   174.02568
  103   102 S   HC   _H21    89     1.09539   111.28419    61.95572
  104   102 S   HC   _H22    90     1.09521   110.83625  -177.79096
  105   102 S   HC   _H23    91     1.09516   110.83647   -58.32224
  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
  21   2   1   1  13   5  11   4   8   4   8   5   4  11   4   3
  14  19   9   5   2   1   1  12   6   5  15   5   4  21  18   9
   9   3   2   1  11   6   5   5   2   8   4   3   1   1  11   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    49    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    46    49    50    77    39    40    52  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    42    43    46    47    48    49    50    51    56    72    77    78    39    40    52    53    54    55  
   35    36  
   36  
    0  
   38    41    42    43    44    45    46    49    50    77    39    40    52  
   41    42    43    49    39  
   40    52    41    46    49    50    63    72    73    77    78  
   49    72    77    78  
   42    43    44    45    46    47    48    49  
   43    44    45    46  
   44    45    46    47    48    49    50    52  
   45    46    47    48    49  
   46    47    48    49  
   47    48    49    50    51    56    72    52    53    54    55  
   48    49    50    52  
   49    50    52  
   50    51    56    57    58    59    63    72    73    77    52    53    54    55  
   51    56    57    58    59    60    61    62    63    64    69    72    73    77    78    52    53    54    55  
   56    57    58    59    63    72    73    77    52  
   53    54    55    56    72  
   54    55  
   55  
    0  
   57    58    59    60    61    62    63    79    72    73    77    65  
   58    59    60    61    62    72  
   59    60    61    62    72  
   60    61    62    63    64    69    74    79    80    81    72    65    66    67    68  
   61    62    63    79    65  
   62    63    79    65  
   63    64    69    70    71    74    75    76    79    80    81    82    83    87    72    73    77    65    66    67    68  
   64    69    70    71    74    75    76    79    80    81    72    73    77    78    65    66    67    68  
   69    70    71    74    79    72    73    77    65  
   66    67    68    69    72    74    79    80    81  
   67    68    79  
   68    79  
   79  
   70    71    74    75    76    79    80    81    72    73    77  
   71    74    75    76    79    72  
   74    75    76    79    72  
   73    77    78    74    79  
   77    78  
   75    76    79    80    81    82    83    87  
   76    79    80    81  
   79    80    81  
   78  
    0  
   80    81    82    83    84    85    86    87    88    89    90  
   81    82    83    87  
   82    83    84    85    86    87    88    89    90    91    92    93  
   83    84    85    86    87    88    89    90  
   84    85    86    87    88    89    90  
   85    86    87  
   86    87  
   87  
   88    89    90    91    92    93    94    95    96  
   89    90    91    92    93  
   90    91    92    93  
   91    92    93    94    95    96    97    98   102  
   92    93    94    95    96  
   93    94    95    96  
   94    95    96    97    98    99   100   101   102   103   104   105  
   95    96    97    98   102  
   96    97    98   102  
   97    98    99   100   101   102   103   104   105  
   98    99   100   101   102   103   104   105  
   99   100   101   102   103   104   105  
  100   101   102  
  101   102  
  102  
  103   104   105  
  104   105  
  105  
    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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   40   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   42   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   50   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   63   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   78   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   79   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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  -0.180000   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   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    49   268.000  1.529
   33    39   317.000  1.510
   37    38   340.000  1.080
   37    41   549.000  1.340
   41    42   340.000  1.080
   41    43   317.000  1.510
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    46   268.000  1.529
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    49   268.000  1.529
   49    50   268.000  1.529
   49    52   268.000  1.529
   50    51   340.000  1.090
   50    56   268.000  1.529
   50    72   268.000  1.529
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    59   268.000  1.529
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   268.000  1.529
   62    63   268.000  1.529
   62    79   268.000  1.529
   62    65   268.000  1.529
   63    64   340.000  1.090
   63    69   268.000  1.529
   63    72   268.000  1.529
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    74   268.000  1.529
   74    75   340.000  1.090
   74    76   340.000  1.090
   74    79   268.000  1.529
   79    80   340.000  1.090
   79    81   268.000  1.529
   81    82   340.000  1.090
   81    83   268.000  1.529
   81    87   268.000  1.529
   83    84   340.000  1.090
   83    85   340.000  1.090
   83    86   340.000  1.090
   87    88   340.000  1.090
   87    89   340.000  1.090
   87    90   268.000  1.529
   90    91   340.000  1.090
   90    92   340.000  1.090
   90    93   268.000  1.529
   93    94   340.000  1.090
   93    95   340.000  1.090
   93    96   268.000  1.529
   96    97   340.000  1.090
   96    98   268.000  1.529
   96   102   268.000  1.529
   98    99   340.000  1.090
   98   100   340.000  1.090
   98   101   340.000  1.090
  102   103   340.000  1.090
  102   104   340.000  1.090
  102   105   340.000  1.090
   72    73   340.000  1.090
   72    77   270.000  1.512
   77    78   745.000  1.250
   77    39   465.000  1.376
   39    40   340.000  1.080
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   340.000  1.090
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   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    49    75.00000  111.63000
   29    33    39    75.00000  112.20000
   33    37    38    35.00000  117.00000
   33    37    41    70.00000  124.00000
   33    49    46    58.35000  112.70000
   33    49    50    58.35000  112.70000
   33    49    52    58.35000  112.70000
   33    39    77    70.00000  124.00000
   33    39    40    35.00000  117.00000
   37    41    42    35.00000  120.00000
   37    41    43    70.00000  124.00000
   41    37    38    35.00000  120.00000
   41    43    44    35.00000  109.50000
   41    43    45    35.00000  109.50000
   41    43    46    70.00000  112.02700
   43    41    42    35.00000  117.00000
   43    46    47    37.50000  110.70000
   43    46    48    37.50000  110.70000
   43    46    49    58.35000  112.70000
   45    43    44    33.00000  107.80000
   46    43    44    37.50000  110.70000
   46    43    45    37.50000  110.70000
   46    49    50    58.35000  112.70000
   46    49    52    58.35000  112.70000
   48    46    47    33.00000  107.80000
   49    33    37    70.00000  112.02700
   49    46    47    37.50000  110.70000
   49    46    48    37.50000  110.70000
   49    50    51    37.50000  110.70000
   49    50    56    58.35000  112.70000
   49    50    72    58.35000  112.70000
   49    52    53    37.50000  110.70000
   49    52    54    37.50000  110.70000
   49    52    55    37.50000  110.70000
   50    56    57    37.50000  110.70000
   50    56    58    37.50000  110.70000
   50    56    59    58.35000  112.70000
   50    72    63    58.35000  112.70000
   50    72    73    37.50000  110.70000
   50    72    77    70.00000  112.02700
   56    50    51    37.50000  110.70000
   56    59    60    37.50000  110.70000
   56    59    61    37.50000  110.70000
   56    59    62    58.35000  112.70000
   58    56    57    33.00000  107.80000
   59    56    57    37.50000  110.70000
   59    56    58    37.50000  110.70000
   59    62    63    58.35000  112.70000
   59    62    79    58.35000  112.70000
   59    62    65    58.35000  112.70000
   61    59    60    33.00000  107.80000
   62    59    60    37.50000  110.70000
   62    59    61    37.50000  110.70000
   62    63    64    37.50000  110.70000
   62    63    69    58.35000  112.70000
   62    63    72    58.35000  112.70000
   62    79    74    58.35000  112.70000
   62    79    80    37.50000  110.70000
   62    79    81    58.35000  112.70000
   62    65    66    37.50000  110.70000
   62    65    67    37.50000  110.70000
   62    65    68    37.50000  110.70000
   63    69    70    37.50000  110.70000
   63    69    71    37.50000  110.70000
   63    69    74    58.35000  112.70000
   63    72    73    37.50000  110.70000
   63    72    77    70.00000  112.02700
   69    63    64    37.50000  110.70000
   69    74    75    37.50000  110.70000
   69    74    76    37.50000  110.70000
   69    74    79    58.35000  112.70000
   71    69    70    33.00000  107.80000
   74    69    70    37.50000  110.70000
   74    69    71    37.50000  110.70000
   74    79    80    37.50000  110.70000
   74    79    81    58.35000  112.70000
   76    74    75    33.00000  107.80000
   79    62    63    58.35000  112.70000
   79    74    75    37.50000  110.70000
   79    74    76    37.50000  110.70000
   79    81    82    37.50000  110.70000
   79    81    83    58.35000  112.70000
   79    81    87    58.35000  112.70000
   81    79    80    37.50000  110.70000
   81    83    84    37.50000  110.70000
   81    83    85    37.50000  110.70000
   81    83    86    37.50000  110.70000
   81    87    88    37.50000  110.70000
   81    87    89    37.50000  110.70000
   81    87    90    58.35000  112.70000
   83    81    82    37.50000  110.70000
   85    83    84    33.00000  107.80000
   86    83    84    33.00000  107.80000
   86    83    85    33.00000  107.80000
   87    81    82    37.50000  110.70000
   87    81    83    58.35000  112.70000
   87    90    91    37.50000  110.70000
   87    90    92    37.50000  110.70000
   87    90    93    58.35000  112.70000
   89    87    88    33.00000  107.80000
   90    87    88    37.50000  110.70000
   90    87    89    37.50000  110.70000
   90    93    94    37.50000  110.70000
   90    93    95    37.50000  110.70000
   90    93    96    58.35000  112.70000
   92    90    91    33.00000  107.80000
   93    90    91    37.50000  110.70000
   93    90    92    37.50000  110.70000
   93    96    97    37.50000  110.70000
   93    96    98    58.35000  112.70000
   93    96   102    58.35000  112.70000
   95    93    94    33.00000  107.80000
   96    93    94    37.50000  110.70000
   96    93    95    37.50000  110.70000
   96    98    99    37.50000  110.70000
   96    98   100    37.50000  110.70000
   96    98   101    37.50000  110.70000
   96   102   103    37.50000  110.70000
   96   102   104    37.50000  110.70000
   96   102   105    37.50000  110.70000
   98    96    97    37.50000  110.70000
  100    98    99    33.00000  107.80000
  101    98    99    33.00000  107.80000
  101    98   100    33.00000  107.80000
  102    96    97    37.50000  110.70000
  102    96    98    58.35000  112.70000
  104   102   103    33.00000  107.80000
  105   102   103    33.00000  107.80000
  105   102   104    33.00000  107.80000
   72    50    51    37.50000  110.70000
   72    50    56    58.35000  112.70000
   72    63    64    37.50000  110.70000
   72    63    69    58.35000  112.70000
   72    77    78    85.00000  112.85300
   72    77    39    65.00000  122.18000
   77    72    73    45.00000  110.52000
   77    39    40    40.00000  120.50800
   39    33    37    70.00000  110.12100
   39    33    49    70.00000  112.02700
   39    77    78    65.00000  137.10300
   65    62    63    58.35000  112.70000
   65    62    79    58.35000  112.70000
   67    65    66    33.00000  107.80000
   68    65    66    33.00000  107.80000
   68    65    67    33.00000  107.80000
   52    49    50    58.35000  112.70000
   54    52    53    33.00000  107.80000
   55    52    53    33.00000  107.80000
   55    52    54    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
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   93    96   102   104   0.15000  1.0 3.0
   93    96   102   105   0.15000  1.0 3.0
   94    93    96    97   0.15000  1.0 3.0
   94    93    96    98   0.15000  1.0 3.0
   94    93    96   102   0.15000  1.0 3.0
   95    93    96    97   0.15000  1.0 3.0
   95    93    96    98   0.15000  1.0 3.0
   95    93    96   102   0.15000  1.0 3.0
   97    96    98    99   0.15000  1.0 3.0
   97    96    98   100   0.15000  1.0 3.0
   97    96    98   101   0.15000  1.0 3.0
   97    96   102   103   0.15000  1.0 3.0
   97    96   102   104   0.15000  1.0 3.0
   97    96   102   105   0.15000  1.0 3.0
   98    96   102   103   0.15000  1.0 3.0
   98    96   102   104   0.15000  1.0 3.0
   98    96   102   105   0.15000  1.0 3.0
  102    96    98    99   0.15000  1.0 3.0
  102    96    98   100   0.15000  1.0 3.0
  102    96    98   101   0.15000  1.0 3.0
   72    50    56    57   0.15000  1.0 3.0
   72    50    56    58   0.15000  1.0 3.0
   72    50   -56    59   0.56750  1.0 1.0
   72    50   -56    59  -0.07550 -1.0 2.0
   72    50   -56    59   0.20000  1.0 3.0
   72    63    69    70   0.15000  1.0 3.0
   72    63    69    71   0.15000  1.0 3.0
   72    63    69    74   0.56750  1.0 1.0
   72    63    69    74  -0.07550 -1.0 2.0
   72    63    69    74   0.20000  1.0 3.0
   72    77   -39    33   7.00000 -1.0 2.0
   72    77    39    40   7.00000 -1.0 2.0
   73    72    77    78   0.00000  1.0 1.0
   73    72    77    39   0.00000  1.0 1.0
   78    77    39    33   7.00000 -1.0 2.0
   78    77    39    40   7.00000 -1.0 2.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    41  -0.28300  1.0 1.0
   39    33    37    41   0.26700 -1.0 2.0
   39    33    37    41  -0.63300  1.0 3.0
   39    33    49    46   0.34400  1.0 1.0
   39    33    49    46   0.09450 -1.0 2.0
   39    33    49    46   0.11100  1.0 3.0
   39    33   -49    50   0.34400  1.0 1.0
   39    33   -49    50   0.09450 -1.0 2.0
   39    33   -49    50   0.11100  1.0 3.0
   39    33    49    52   0.34400  1.0 1.0
   39    33    49    52   0.09450 -1.0 2.0
   39    33    49    52   0.11100  1.0 3.0
   65    62    63    64   0.15000  1.0 3.0
   65    62    63    69   0.56750  1.0 1.0
   65    62    63    69  -0.07550 -1.0 2.0
   65    62    63    69   0.20000  1.0 3.0
   65    62    63    72   0.56750  1.0 1.0
   65    62    63    72  -0.07550 -1.0 2.0
   65    62    63    72   0.20000  1.0 3.0
   65    62    79    74   0.56750  1.0 1.0
   65    62    79    74  -0.07550 -1.0 2.0
   65    62    79    74   0.20000  1.0 3.0
   65    62    79    80   0.15000  1.0 3.0
   65    62    79    81   0.56750  1.0 1.0
   65    62    79    81  -0.07550 -1.0 2.0
   65    62    79    81   0.20000  1.0 3.0
   52    49    50    51   0.15000  1.0 3.0
   52    49    50    56   0.56750  1.0 1.0
   52    49    50    56  -0.07550 -1.0 2.0
   52    49    50    56   0.20000  1.0 3.0
   52    49    50    72   0.56750  1.0 1.0
   52    49    50    72  -0.07550 -1.0 2.0
   52    49    50    72   0.20000  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    38    37    41   1.10000 -1.0 2.0
   43    42    41    37   1.10000 -1.0 2.0
   72    78    77    39   1.10000 -1.0 2.0
   33    40    39    77   1.10000 -1.0 2.0
END
