* LIGAND DATABASE FILE (OPLS2005)
*
001     113   115    207    319     598
    1     0 S   NP   _N1_     1    29.61548    95.25167   -26.90939
    2     1 S   H    _HN1     2     1.02787   123.39740   -77.81485
    3     1 S   H    _H1_     3     1.02950    69.50131    21.18871
    4     1 S   H    _H2_     4     1.02827    37.73947  -153.30280
    5     1 S   CT   _CA1     5     1.50118   121.47010   123.15763
    6     5 S   HC   _HA1     6     1.09573   105.18928    99.80701
    7     5 S   CO3  _C1_     7     1.53790   112.46120   -20.41797
    8     7 S   O2Z  _O11     8     1.26373   115.00740   -42.45685
    9     7 S   O2Z  _O12     9     1.26240   114.94809   136.65187
   10     5 S   CT   _CB1    10     1.53076   107.41462  -142.21468
   11    10 S   HC   HB11    11     1.09833   109.36999   -49.64253
   12    10 S   HC   HB12    12     1.09812   110.44981    66.96791
   13    10 S   CT   _CG1    13     1.52989   112.60616  -170.61485
   14    13 S   HC   HG11    14     1.09582   110.63105   -65.74236
   15    13 S   HC   HG12    15     1.09671   109.78085    53.48645
   16    13 S   C    _CD1    16     1.51805   112.22073   173.93783
   17    16 S   O    _OE1    17     1.22732   123.26992     7.01023
   18    16 S   N    _N2_    18     1.38630   111.66079  -172.97881
   19    18 S   H    _HN2    19     1.01572   118.95983     1.83984
   20    18 S   CT1  _CA2    20     1.46133   123.44400   177.77331
   21    20 S   HC   _HA2    21     1.09720   109.38299     6.05168
   22    20 S   C    _C2_    22     1.53741   109.08717  -109.79308
   23    22 S   O    _O2_    23     1.23113   122.25642  -149.43742
   24    20 S   CT   _CB2    32     1.53307   111.49684   128.20263
   25    24 S   HC   HB21    33     1.09454   109.53893    55.66580
   26    24 S   HC   HB22    34     1.09303   109.15732   174.91034
   27    22 S   N    _N3_    24     1.38279   114.00883    37.97886
   28    27 S   H    _HN3    25     1.01560   119.71755    -3.31771
   29    24 S   S    _SG2    35     1.82453   112.25584   -65.41296
   30    27 S   CT   _CA3    26     1.45269   122.93306   177.44381
   31    30 S   HC   HA31    27     1.09553   107.56855   -64.00632
   32    30 S   HC   HA32    28     1.09518   107.82567    52.32815
   33    29 S   CT   _C22    36     1.87684   100.91919   172.44568
   34    33 S   HC   _H6_    37     1.09048   104.00222   -52.00892
   35    30 S   CO3  _C3_    29     1.52898   114.19275   174.22922
   36    35 S   O2Z  _O31    30     1.26372   116.07745    -2.09172
   37    35 S   O2Z  _O32    31     1.26427   114.41471   177.96337
   38    33 S   CM   _C17    38     1.52777   108.94684    69.12216
   39    38 S   CMA  _C18    39     1.36875   121.50235    88.63006
   40    39 S   OM   _O39    40     1.26722   128.03065  -178.29670
   41    38 S   N    _N4_    77     1.39312   120.89866   -90.97970
   42    41 S   H    _H27    78     1.01726   112.40643   168.13911
   43    39 S   C3T  _C19    41     1.50011   119.77041     3.02834
   44    43 S   HC   _H4_    42     1.08892   115.06429   161.63300
   45    41 S   C    _C16    79     1.38505   129.38058   -13.18156
   46    45 S   O    _O33    80     1.22798   126.40425   -11.74340
   47    43 S   C3T  _C20    43     1.50808   118.03032    20.14304
   48    47 S   HC   _H5_    44     1.08215   118.85502   140.33824
   49    45 S   CM   _C14    81     1.50560   113.36599   168.34007
   50    33 S   CT   _C21    45     1.56952   112.29107  -166.25893
   51    43 S   O3T  _O34    76     1.44238   123.07538   -48.05400
   52    49 S   CM   _C13    82     1.34790   114.98468  -149.53716
   53    52 S   HC   _H23    83     1.08963   120.25112    -1.83558
   54    49 S   CT   _C15   110     1.50007   119.72127    31.36012
   55    54 S   HC   _H24   111     1.09462   110.66332   -79.61328
   56    54 S   HC   _H25   112     1.09543   110.57132    40.97156
   57    54 S   HC   _H26   113     1.09446   112.38916   159.59501
   58    50 S   CM   _C23    46     1.53216   107.89065   160.45673
   59    58 S   HC   _H28    47     1.09021   115.03018    69.20829
   60    50 S   OH   _O38    74     1.43415   109.10820    42.54732
   61    60 S   HO   _H40    75     0.97221   108.02934  -172.04377
   62    52 S   CM   _C11    84     1.45743   126.64237   176.86344
   63    58 S   CM   _C24    48     1.34315   126.59474  -110.49501
   64    63 S   HC   _H29    49     1.08655   120.19502     0.37325
   65    62 S   CM   _C10    85     1.34769   120.03861   -63.44226
   66    65 S   HC   _H19    86     1.09157   117.83176     0.47929
   67    62 S   CT   _C12   106     1.50184   113.80625   119.79098
   68    67 S   HC   _H20   107     1.09602   110.56174    53.95207
   69    67 S   HC   _H21   108     1.09183   113.50061   173.84416
   70    67 S   HC   _H22   109     1.09564   110.21037   -65.66093
   71    63 S   CM   _C25    50     1.44674   122.92120   179.82529
   72    71 S   HC   _H30    51     1.08792   117.04012     0.22381
   73    65 S   CT   _C8_    87     1.51091   128.13933  -178.57894
   74    73 S   HC   _H3_    88     1.09412   111.24049    -6.59246
   75    71 S   CM   _C26    52     1.34171   122.98864  -179.69226
   76    75 S   HC   _H31    53     1.08788   119.93953    -0.00000
   77    73 S   CT   _C9_    89     1.53214   109.02904  -124.11439
   78    77 S   HC   _H16    90     1.09602   111.62270   -62.19060
   79    77 S   HC   _H17    91     1.09589   110.97344    58.26852
   80    77 S   HC   _H18    92     1.09543   110.67671   177.71767
   81    73 S   CT   _C7_    93     1.54179   111.35928   114.24248
   82    81 S   HC   _H14    94     1.09777   108.86681   172.94790
   83    81 S   HC   _H15    95     1.09805   110.12918    56.44860
   84    75 S   CM   _C27    54     1.44703   122.97980   179.94405
   85    84 S   HC   _H32    55     1.08755   116.86529     0.05595
   86    81 S   CT   _C6_    96     1.53366   113.00269   -66.23471
   87    86 S   HC   _H12    97     1.09612   110.23952    62.11036
   88    86 S   HC   _H13    98     1.09679   109.42275   -55.59497
   89    84 S   CM   _C28    56     1.34049   122.74009  -179.93744
   90    89 S   HC   _H33    57     1.08487   121.44816    -0.00000
   91    86 S   CT   _C5_    99     1.52921   111.26858  -176.78034
   92    91 S   HC   _H10   100     1.09618   109.94830    56.94426
   93    91 S   HC   _H11   101     1.09619   109.79393   -60.80371
   94    89 S   C    _C29    58     1.48831   120.04218   179.97202
   95    94 S   O    _O35    59     1.22620   122.66753    -0.27268
   96    91 S   CT   _C4_   102     1.52048   111.48302   177.98375
   97    96 S   HC   _H7_   103     1.09437   111.12700    59.38664
   98    96 S   HC   _H8_   104     1.09444   110.25838   179.24723
   99    96 S   HC   _H9_   105     1.09470   110.94621   -61.07463
  100    94 S   N    _N5_    60     1.38318   112.05781   179.80517
  101   100 S   H    _H34    61     1.01571   119.86162    -0.32984
  102   100 S   CT1  _C30    62     1.44278   121.93082  -179.23998
  103   102 S   HC   _H35    63     1.09353   112.60517   -30.57199
  104   102 S   CO4  _C31    64     1.51024   110.76780  -154.40924
  105   104 S   O    _O36    65     1.22389   124.77166    50.48001
  106   104 S   CT   _C32    66     1.50866   111.25666  -131.53282
  107   106 S   HC   _H36    67     1.09281   110.91996   140.36065
  108   106 S   HC   _H37    68     1.09426   108.59028   -98.69808
  109   106 S   CT   _C33    69     1.52912   104.93877    19.91369
  110   109 S   HC   _H38    70     1.09281   111.41283  -137.76023
  111   109 S   HC   _H39    71     1.09444   110.57136    99.61612
  112   102 S   CO4  _C34    72     1.51308   110.32591    92.27993
  113   112 S   O    _O37    73     1.22437   124.82277   -56.80293
  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   9   5   4   3
  17   7   2   1   1  14  10   5   8   3   7   4   9   3   8   4
   9   8   2  13   4   4   2   1   1   8   4   2   1  10   6   3
  15   5   4   2   1   1   6   3  12   8   6   3   7   3   2   1
   9   5   4   6   3   9   5   4   6   3   6   5   4   7   3   3
   2   1   1   9   4  11   6   9   5   7   5   4   4   3   2   1
   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    50    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    47    50    58    60    41  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    43    47    48    50    58    59    63    60    61    51    41    42    45  
   38    39    47    50    58    60    41  
   36    37  
   37  
    0  
   39    40    43    44    47    50    58    60    51    41    42    45    46    49  
   40    43    44    47    48    50    51    41    42    45  
   43    44    47    51    41  
   42    45    46    49    52    54    43    50  
   45    46    49  
   44    47    48    50    58    60    51  
   47    48    50    51  
   46    49    52    53    62    54    55    56    57  
   49    52    54  
   48    50    58    59    63    60    61    51  
   50    58    60    51  
   52    53    62    65    67    54    55    56    57  
   58    59    63    64    71    60    61    51  
   58    60  
   53    62    65    66    73    67    68    69    70    54    55    56    57  
   62    65    67    54  
   55    56    57    62  
   56    57  
   57  
    0  
   59    63    64    71    72    75    60    61  
   63    64    71    60  
   61    63  
    0  
   65    66    73    74    77    81    67    68    69    70  
   64    71    72    75    76    84  
   71    72    75  
   66    73    74    77    78    79    80    81    82    83    86    67    68    69    70  
   73    74    77    81    67  
   68    69    70    73  
   69    70  
   70  
    0  
   72    75    76    84    85    89  
   75    76    84  
   74    77    78    79    80    81    82    83    86    87    88    91  
   77    78    79    80    81    82    83    86  
   76    84    85    89    90    94  
   84    85    89  
   78    79    80    81    82    83    86  
   79    80    81  
   80    81  
   81  
   82    83    86    87    88    91    92    93    96  
   83    86    87    88    91  
   86    87    88    91  
   85    89    90    94    95   100  
   89    90    94  
   87    88    91    92    93    96    97    98    99  
   88    91    92    93    96  
   91    92    93    96  
   90    94    95   100   101   102  
   94    95   100  
   92    93    96    97    98    99  
   93    96    97    98    99  
   96    97    98    99  
   95   100   101   102   103   104   112  
  100   101   102  
   97    98    99  
   98    99  
   99  
    0  
  101   102   103   104   105   106   109   112   113  
  102   103   104   112  
  103   104   105   106   107   108   109   110   111   112   113  
  104   105   106   109   112   113  
  105   106   107   108   109   110   111   112   113  
  106   107   108   109   112  
  107   108   109   110   111   112   113  
  108   109   110   111   112  
  109   110   111   112  
  110   111   112   113  
  111   112   113  
  112   113  
  113  
    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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.549900   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   40   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   41   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
   42   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   43   3.5000   0.0660   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5500   0.0760  -0.056700   2.0020   1.7750   0.023028004  -0.852763146
   50   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.9000   0.1400  -0.352400   1.5900   1.4000   0.020110767  -0.896042159
   52   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   53   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   59   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   60   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   61   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   62   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   66   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   72   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   73   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   76   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   77   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   85   2.4200   0.0300   0.115000   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   3.5500   0.0760  -0.171700   2.0020   1.7750   0.023028004  -0.852763146
   90   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   91   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
   95   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   96   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  100   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
  101   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
  102   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
  103   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
  104   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
  105   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
  106   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  107   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  108   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  109   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  110   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  112   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
  113   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   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    34   340.000  1.090
   33    38   317.000  1.510
   33    50   268.000  1.529
   38    39   465.000  1.376
   38    41   400.000  1.384
   39    40   745.000  1.250
   39    43   305.000  1.480
   43    44   340.000  1.088
   43    47   260.000  1.509
   43    51   335.000  1.432
   47    48   340.000  1.088
   47    50   275.000  1.510
   47    51   335.000  1.432
   50    58   317.000  1.510
   50    60   320.000  1.410
   58    59   340.000  1.080
   58    63   549.000  1.340
   63    64   340.000  1.080
   63    71   380.000  1.444
   71    72   340.000  1.080
   71    75   549.000  1.340
   75    76   340.000  1.080
   75    84   380.000  1.444
   84    85   340.000  1.080
   84    89   549.000  1.340
   89    90   340.000  1.080
   89    94   410.000  1.444
   94    95   570.000  1.229
   94   100   490.000  1.335
  100   101   434.000  1.010
  100   102   337.000  1.449
  102   103   340.000  1.090
  102   104   255.000  1.522
  102   112   255.000  1.522
  104   105   570.000  1.229
  104   106   317.000  1.522
  106   107   340.000  1.090
  106   108   340.000  1.090
  106   109   268.000  1.529
  109   110   340.000  1.090
  109   111   340.000  1.090
  109   112   317.000  1.522
  112   113   570.000  1.229
   60    61   553.000  0.945
   41    42   434.000  1.010
   41    45   490.000  1.335
   45    46   570.000  1.229
   45    49   410.000  1.444
   49    52   549.000  1.340
   49    54   317.000  1.510
   52    53   340.000  1.080
   52    62   380.000  1.444
   62    65   549.000  1.340
   62    67   317.000  1.510
   65    66   340.000  1.080
   65    73   317.000  1.510
   73    74   340.000  1.090
   73    77   268.000  1.529
   73    81   268.000  1.529
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    80   340.000  1.090
   81    82   340.000  1.090
   81    83   340.000  1.090
   81    86   268.000  1.529
   86    87   340.000  1.090
   86    88   340.000  1.090
   86    91   268.000  1.529
   91    92   340.000  1.090
   91    93   340.000  1.090
   91    96   268.000  1.529
   96    97   340.000  1.090
   96    98   340.000  1.090
   96    99   340.000  1.090
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   340.000  1.090
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    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    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    50    75.00000  111.63000
   33    38    39    70.00000  124.00000
   33    38    41    70.00000  113.82800
   33    50    47    70.00000  112.37300
   33    50    58    70.00000  112.02700
   33    50    60    50.00000  109.50000
   38    33    34    35.00000  109.50000
   38    39    40    65.00000  137.10300
   38    39    43    65.00000  122.18000
   38    41    42    45.00000  117.55000
   38    41    45    70.00000  120.89900
   39    43    44    40.00000  112.45000
   39    43    47    60.00000  120.58800
   39    43    51    85.00000  114.23300
   43    39    40    85.00000  112.85300
   43    47    48    37.50000  117.20000
   43    47    50    60.00000  120.94000
   43    47    51    15.00000   60.43100
   43    51    47    15.00000   59.14900
   47    43    44    37.50000  117.20000
   47    50    58    70.00000  112.02700
   47    50    60    50.00000  109.50000
   50    33    34    37.50000  110.70000
   50    33    38    70.00000  112.02700
   50    47    48    40.00000  115.04500
   50    58    59    35.00000  117.00000
   50    58    63    70.00000  124.00000
   50    60    61    55.00000  108.50000
   58    63    64    35.00000  120.00000
   58    63    71    70.00000  123.01800
   63    58    59    35.00000  120.00000
   63    71    72    35.00000  120.00000
   63    71    75    70.00000  123.01800
   71    63    64    35.00000  120.00000
   71    75    76    35.00000  120.00000
   71    75    84    70.00000  123.01800
   75    71    72    35.00000  120.00000
   75    84    85    35.00000  120.00000
   75    84    89    70.00000  123.01800
   84    75    76    35.00000  120.00000
   84    89    90    35.00000  120.00000
   84    89    94    70.00000  118.70000
   89    84    85    35.00000  120.00000
   89    94    95    80.00000  125.30000
   89    94   100    80.00000  111.56200
   94    89    90    35.00000  119.70000
   94   100   101    35.00000  119.80000
   94   100   102    50.00000  121.90000
  100    94    95    80.00000  122.90000
  100   102   103    35.00000  109.50000
  100   102   104    80.00000  110.29000
  100   102   112    80.00000  110.29000
  102   100   101    38.00000  118.40000
  102   104   105    75.00000  123.42600
  102   104   106    65.00000  117.09000
  102   112   109    65.00000  117.09000
  102   112   113    75.00000  123.42600
  104   102   103    45.00000  110.09800
  104   106   107    35.00000  109.50000
  104   106   108    35.00000  109.50000
  104   106   109    63.00000  111.10000
  106   104   105    80.00000  120.40000
  106   109   110    37.50000  110.70000
  106   109   111    37.50000  110.70000
  106   109   112    63.00000  111.10000
  108   106   107    33.00000  107.80000
  109   106   107    37.50000  110.70000
  109   106   108    37.50000  110.70000
  109   112   113    80.00000  120.40000
  111   109   110    33.00000  107.80000
  112   102   103    45.00000  110.09800
  112   102   104    65.00000  112.16000
  112   109   110    35.00000  109.50000
  112   109   111    35.00000  109.50000
   60    50    58    90.00000  110.39200
   51    43    44    50.00000  114.27700
   51    43    47    15.00000   60.43100
   51    47    48    50.00000  114.27700
   51    47    50    80.00000  116.47100
   41    38    39    75.00000  120.83300
   41    45    46    80.00000  122.90000
   41    45    49    80.00000  111.56200
   45    41    42    35.00000  119.80000
   45    49    52    70.00000  118.70000
   45    49    54    70.00000  119.70000
   49    45    46    80.00000  125.30000
   49    52    53    35.00000  120.00000
   49    52    62    70.00000  123.01800
   49    54    55    35.00000  109.50000
   49    54    56    35.00000  109.50000
   49    54    57    35.00000  109.50000
   52    62    65    70.00000  123.01800
   52    62    67    70.00000  124.00000
   62    52    53    35.00000  120.00000
   62    65    66    35.00000  120.00000
   62    65    73    70.00000  124.00000
   62    67    68    35.00000  109.50000
   62    67    69    35.00000  109.50000
   62    67    70    35.00000  109.50000
   65    73    74    35.00000  109.50000
   65    73    77    70.00000  112.02700
   65    73    81    70.00000  112.02700
   73    65    66    35.00000  117.00000
   73    77    78    37.50000  110.70000
   73    77    79    37.50000  110.70000
   73    77    80    37.50000  110.70000
   73    81    82    37.50000  110.70000
   73    81    83    37.50000  110.70000
   73    81    86    58.35000  112.70000
   77    73    74    37.50000  110.70000
   79    77    78    33.00000  107.80000
   80    77    78    33.00000  107.80000
   80    77    79    33.00000  107.80000
   81    73    74    37.50000  110.70000
   81    73    77    58.35000  112.70000
   81    86    87    37.50000  110.70000
   81    86    88    37.50000  110.70000
   81    86    91    58.35000  112.70000
   83    81    82    33.00000  107.80000
   86    81    82    37.50000  110.70000
   86    81    83    37.50000  110.70000
   86    91    92    37.50000  110.70000
   86    91    93    37.50000  110.70000
   86    91    96    58.35000  112.70000
   88    86    87    33.00000  107.80000
   91    86    87    37.50000  110.70000
   91    86    88    37.50000  110.70000
   91    96    97    37.50000  110.70000
   91    96    98    37.50000  110.70000
   91    96    99    37.50000  110.70000
   93    91    92    33.00000  107.80000
   96    91    92    37.50000  110.70000
   96    91    93    37.50000  110.70000
   98    96    97    33.00000  107.80000
   99    96    97    33.00000  107.80000
   99    96    98    33.00000  107.80000
   67    62    65    70.00000  124.00000
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    33.00000  107.80000
   54    49    52    70.00000  124.00000
   56    54    55    33.00000  107.80000
   57    54    55    33.00000  107.80000
   57    54    56    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
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   86    91    96    98   0.15000  1.0 3.0
   86    91    96    99   0.15000  1.0 3.0
   87    86    91    92   0.15000  1.0 3.0
   87    86    91    93   0.15000  1.0 3.0
   87    86    91    96   0.15000  1.0 3.0
   88    86    91    92   0.15000  1.0 3.0
   88    86    91    93   0.15000  1.0 3.0
   88    86    91    96   0.15000  1.0 3.0
   92    91    96    97   0.15000  1.0 3.0
   92    91    96    98   0.15000  1.0 3.0
   92    91    96    99   0.15000  1.0 3.0
   93    91    96    97   0.15000  1.0 3.0
   93    91    96    98   0.15000  1.0 3.0
   93    91    96    99   0.15000  1.0 3.0
   67    62    65    66   7.00000 -1.0 2.0
   67    62    65    73   7.00000 -1.0 2.0
   54    49    52    53   7.00000 -1.0 2.0
   54    49    52    62   7.00000 -1.0 2.0
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
   36    30    35    37  10.50000 -1.0 2.0
   33    41    38    39   1.10000 -1.0 2.0
   43    40    39    38   1.10000 -1.0 2.0
   50    59    58    63  15.00000 -1.0 2.0
   71    64    63    58  15.00000 -1.0 2.0
   63    72    71    75  15.00000 -1.0 2.0
   84    76    75    71  15.00000 -1.0 2.0
   75    85    84    89  15.00000 -1.0 2.0
   94    90    89    84  15.00000 -1.0 2.0
   89   100    94    95  10.50000 -1.0 2.0
  101    94   100   102   1.00000 -1.0 2.0
  102   106   104   105  10.50000 -1.0 2.0
  102   109   112   113  10.50000 -1.0 2.0
   42    45    41    38   1.00000 -1.0 2.0
   41    49    45    46  10.50000 -1.0 2.0
   45    54    49    52  15.00000 -1.0 2.0
   62    53    52    49  15.00000 -1.0 2.0
   52    67    62    65  15.00000 -1.0 2.0
   73    66    65    62  15.00000 -1.0 2.0
END
