* LIGAND DATABASE FILE (OPLS2005)
*
001     111   112    207    310     611
    1     0 S   NP   _N1_     1    28.73226    94.23852   -21.08283
    2     1 S   H    _HN1     2     1.02939    89.89691     6.30397
    3     1 S   H    _H1_     3     1.02844    32.95530   129.56977
    4     1 S   H    _H2_     4     1.02794    87.74876  -101.93195
    5     1 S   CT   _CA1     5     1.50113   143.67444   132.57372
    6     5 S   HC   _HA1     6     1.09592   105.22445    58.18557
    7     5 S   CO3  _C1_     7     1.53923   111.77986   -61.68185
    8     7 S   O2Z  _O11     8     1.26342   115.21155   -59.91528
    9     7 S   O2Z  _O12     9     1.26230   114.82984   118.71847
   10     5 S   CT   _CB1    10     1.53089   107.31899   175.64580
   11    10 S   HC   HB11    11     1.09829   109.61773   -50.78091
   12    10 S   HC   HB12    12     1.09806   110.42599    65.81821
   13    10 S   CT   _CG1    13     1.52957   112.39762  -171.70492
   14    13 S   HC   HG11    14     1.09466   110.31057   -59.57559
   15    13 S   HC   HG12    15     1.09631   110.04600    59.65325
   16    13 S   C    _CD1    16     1.51729   112.20858  -179.51503
   17    16 S   O    _OE1    17     1.22752   123.18197     0.82306
   18    16 S   N    _N2_    18     1.38690   111.79560  -179.57479
   19    18 S   H    _HN2    19     1.01572   119.13012     3.55286
   20    18 S   CT1  _CA2    20     1.46311   123.12162  -177.78831
   21    20 S   HC   _HA2    21     1.09738   109.09407     2.12173
   22    20 S   C    _C2_    22     1.53483   109.19445  -113.61774
   23    22 S   O    _O2_    23     1.23064   122.21999  -151.02485
   24    20 S   CT   _CB2    32     1.53696   111.77674   123.49454
   25    24 S   HC   HB21    33     1.09340   109.49235    64.49884
   26    24 S   HC   HB22    34     1.09388   109.28938  -177.28372
   27    22 S   N    _N3_    24     1.38310   113.83369    36.37408
   28    27 S   H    _HN3    25     1.01589   119.53611    -3.34627
   29    24 S   S    _SG2    35     1.82928   110.96818   -57.46324
   30    27 S   CT   _CA3    26     1.45278   123.13864   177.10085
   31    30 S   HC   HA31    27     1.09549   107.50008   -64.89185
   32    30 S   HC   HA32    28     1.09558   107.98756    51.52878
   33    29 S   CT   _C13    36     1.86697   102.36407   164.23190
   34    33 S   HC   _H4_    37     1.09134    99.85299  -168.33100
   35    30 S   CO3  _C3_    29     1.52929   114.13966   173.55728
   36    35 S   O2Z  _O31    30     1.26363   116.07889    -0.00000
   37    35 S   O2Z  _O32    31     1.26432   114.40375  -179.94766
   38    33 S   CT   _C12    38     1.55721   114.09568   -57.27301
   39    38 S   HC   _H17    39     1.09554   106.44649  -161.30762
   40    38 S   HC   _H18    40     1.09729   110.21940    84.39357
   41    33 S   CT   _C14    69     1.58961   115.51099    79.28598
   42    41 S   OM   _O38    70     1.32620   108.88806   -70.77617
   43    38 S   CT   _C11    41     1.54744   118.06829   -40.51536
   44    43 S   HC   _H3_    42     1.09607   108.25144    70.40236
   45    41 S   CT   _C30    71     1.54738   111.75049    47.06546
   46    45 S   HC   _H41    72     1.09754   113.21143   -66.87274
   47    45 S   HC   _H42    73     1.09867   111.60621   173.35577
   48    45 S   HC   _H43    74     1.09585   111.03908    53.76978
   49    43 S   OS   _O35    43     1.44506   110.15239   -46.98873
   50    43 S   CM   _C9_    95     1.53144   110.22907  -169.18220
   51    49 S   CO4  _C25    44     1.36619   116.99279   165.84939
   52    51 S   O    _O34    45     1.22536   125.57996     0.29541
   53    50 S   CM   _C8_    96     1.35050   119.35034  -113.33178
   54    53 S   HC   _H13    97     1.08987   116.70537    -1.67398
   55    50 S   CT   _C10   108     1.50809   116.37723    67.65977
   56    55 S   HC   _H14   109     1.09445   110.34221   -93.75555
   57    55 S   HC   _H15   110     1.09381   112.12513   144.27811
   58    55 S   HC   _H16   111     1.09477   111.43571    25.94573
   59    51 S   CT   _C24    46     1.51403   111.47366  -176.17833
   60    59 S   HC   _H25    47     1.09267   105.89966    81.24102
   61    59 S   HC   _H26    48     1.09675   106.97743  -164.87449
   62    53 S   C5B  _C6_    98     1.42953   128.78210   178.01831
   63    59 S   CT   _C23    49     1.53988   113.41377   -43.50752
   64    63 S   HC   _H8_    50     1.09118   109.91621     2.41298
   65    62 S   C5A  _C7_    99     1.38048   123.40031   162.40171
   66    65 S   HA   _H12   100     1.08123   129.07897    -1.45360
   67    63 S   CT   _C22    51     1.55899   114.82574   126.91054
   68    63 S   OH   _O36    93     1.43439   108.50529  -111.15249
   69    68 S   HO   _H27    94     0.97284   107.71207    56.61820
   70    65 S   SA   _S1_   101     1.71447   109.71526   178.87221
   71    67 S   CO4  _C21    52     1.55340   109.86314  -171.74790
   72    71 S   O    _O33    53     1.23526   121.47419  -122.89092
   73    67 S   CT   _C26    85     1.54450   110.58549    68.18532
   74    73 S   HC   _H28    86     1.09516   111.60278   -58.69587
   75    73 S   HC   _H29    87     1.09669   111.04420  -178.50695
   76    73 S   HC   _H30    88     1.09572   111.80376    62.15393
   77    67 S   CT   _C27    89     1.53833   112.41037   -52.40633
   78    77 S   HC   _H31    90     1.09441   112.43975    73.36765
   79    77 S   HC   _H32    91     1.09123   111.11007   -47.29555
   80    77 S   HC   _H33    92     1.09610   111.20866  -167.02378
   81    70 S   CRA  _C5_   102     1.71911    89.47786    -0.70221
   82    71 S   CT   _C20    54     1.53995   118.98404    59.14983
   83    82 S   HC   _H7_    55     1.09012   107.91011    -7.68962
   84    62 S   N5B  _N4_   103     1.38024   121.14295   -20.12939
   85    81 S   CT   _C4_   104     1.48676   120.03054  -179.83214
   86    85 S   HC   _H9_   105     1.09460   110.85813   -60.25637
   87    85 S   HC   _H10   106     1.09460   110.84893    60.66830
   88    85 S   HC   _H11   107     1.09479   110.44743  -179.78878
   89    82 S   CT   _C19    56     1.54783   108.95204   110.21288
   90    89 S   HC   _H6_    57     1.09731   108.71486   -34.00971
   91    82 S   CT   _C28    81     1.52957   107.60010  -123.95029
   92    91 S   HC   _H34    82     1.09510   112.11213   -63.97176
   93    91 S   HC   _H35    83     1.09121   111.95373   174.34948
   94    91 S   HC   _H36    84     1.09617   110.33906    55.02121
   95    89 S   CT   _C18    58     1.55587   116.54098  -153.80663
   96    95 S   HC   _H5_    59     1.09950   105.95284   176.30112
   97    89 S   OH   _O37    79     1.42940   110.69777    81.34559
   98    97 S   HO   _H37    80     0.97363   107.40153   -55.36020
   99    95 S   CT   _C17    60     1.54629   111.63184    58.74842
  100    99 S   HC   _H23    61     1.09367   108.07056    41.30278
  101    99 S   HC   _H24    62     1.09500   109.52945   -76.13096
  102    95 S   CT   _C29    75     1.53311   113.30699   -67.84057
  103   102 S   HC   _H38    76     1.09381   111.56828    77.66628
  104   102 S   HC   _H39    77     1.09427   111.77307   -44.07402
  105   102 S   HC   _H40    78     1.09469   110.84802  -163.00894
  106    99 S   CT   _C16    63     1.52789   113.93240   161.04545
  107   106 S   HC   _H21    64     1.09639   109.30201   -71.95179
  108   106 S   HC   _H22    65     1.09589   109.53989    43.21754
  109   106 S   CT   _C15    66     1.54205   115.64214   163.29357
  110   109 S   HC   _H19    67     1.10363   104.26456  -176.03592
  111   109 S   HC   _H20    68     1.09767   108.30611   -65.88567
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  10   5   4   3
  18   8   2   1   1  13   6   5  13   8  13   5   7   3   2   1
   9  10   8   4  11   4   4   2   1   1  10   5   4   6  15   6
   5   3  16   4   1   6  19   6   8   3   2   1   4   2   1   1
   5  13   8   4   3   2   1   1  17   7   5   2   1   1  14   9
   3   1  12   6   5   4   2   1   1   5   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    41    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    43   109    41    42    45  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    43    44    49   106   109   110   111    41    42    45    46    47    48    50  
   38    39    40    43   109    41    42    45  
   36    37  
   37  
    0  
   39    40    43    44    49    51   109    41    42    45    50    53    55  
   40    43    44    49    41    50  
   43    44    49    41    50  
   42    45    46    47    48    43    99   106   107   108   109   110   111  
   45    46    47    48   106   109   110   111  
   44    49    51    52    59    50    53    54    62    55    56    57    58  
   49    51    50    53    55  
   46    47    48   106   109   110   111  
   47    48   109  
   48   109  
  109  
   51    52    59    60    61    63    50    53    55  
   53    54    62    65    84    55    56    57    58    51  
   52    59    60    61    63    64    67    68  
   59    60    61    63  
   54    62    65    66    70    81    84    55    56    57    58  
   62    65    84    55  
   56    57    58    62  
   57    58  
   58  
    0  
   60    61    63    64    67    71    73    77    68    69  
   61    63    64    67    68  
   63    64    67    68  
   65    66    70    81    84    85  
   64    67    71    72    82    73    74    75    76    77    78    79    80    68    69  
   67    71    73    77    68    69  
   66    70    81    84    85  
   70    81    84  
   71    72    82    83    89    91    73    74    75    76    77    78    79    80    68    69  
   69    71    73    77  
    0  
   81    84    85    86    87    88  
   72    82    83    89    90    95    97    91    92    93    94    73    74    75    76    77    78    79    80  
   82    83    89    91    73    77  
   74    75    76    77    78    79    80    82  
   75    76    77  
   76    77  
   77  
   78    79    80    82  
   79    80  
   80  
    0  
   84    85    86    87    88  
   83    89    90    95    96    99   102    97    98    91    92    93    94  
   89    90    95    97    91    92    93    94  
   85    86    87    88  
   86    87    88  
   87    88  
   88  
    0  
   90    95    96    99   100   101   106   102   103   104   105    97    98    91    92    93    94  
   95    96    99   102    97    98    91  
   92    93    94    95    97  
   93    94  
   94  
    0  
   96    99   100   101   106   107   108   109   102   103   104   105    97    98  
   99   100   101   106   102   103   104   105    97  
   98    99   102  
    0  
  100   101   106   107   108   109   110   111   102   103   104   105  
  101   106   107   108   109   102  
  106   107   108   109   102  
  103   104   105   106  
  104   105  
  105  
    0  
  107   108   109   110   111  
  108   109   110   111  
  109   110   111  
  110   111  
  111  
    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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   4.2000   0.3000  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   42   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   43   3.5000   0.0660   0.289000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   45   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   50   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   51   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   52   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   53   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   54   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   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   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   61   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   62   3.5500   0.0700   0.284300   2.0020   1.7750   0.001000000  -0.843144165
   63   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5500   0.0700  -0.337600   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.231700   1.3810   1.2100   0.030040813   0.268726247
   67   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.5600   0.3950   0.001000   2.0080   1.7800   0.025682759  -1.666211680
   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   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   3.5500   0.0700   0.185900   2.0020   1.7750   0.001000000  -0.843144165
   82   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   84   3.2800   0.1700  -0.480300   1.8650   1.6500   0.001000000  -0.511443539
   85   3.5000   0.0660  -0.065000   2.4950   1.7500   0.005000000  -0.741685710
   86   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   87   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   88   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   89   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   98   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   99   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  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
  106   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  107   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  108   2.5000   0.0300   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
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   268.000  1.529
   33    41   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    43   268.000  1.529
   43    44   340.000  1.090
   43    49   320.000  1.410
   43    50   317.000  1.510
   49    51   214.000  1.327
   51    52   570.000  1.229
   51    59   317.000  1.522
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    63   268.000  1.529
   63    64   340.000  1.090
   63    67   268.000  1.529
   63    68   320.000  1.410
   67    71   317.000  1.522
   67    73   268.000  1.529
   67    77   268.000  1.529
   71    72   570.000  1.229
   71    82   317.000  1.522
   82    83   340.000  1.090
   82    89   268.000  1.529
   82    91   268.000  1.529
   89    90   340.000  1.090
   89    95   268.000  1.529
   89    97   320.000  1.410
   95    96   340.000  1.090
   95    99   268.000  1.529
   95   102   268.000  1.529
   99   100   340.000  1.090
   99   101   340.000  1.090
   99   106   268.000  1.529
  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    41   268.000  1.529
   41    42   570.000  1.307
   41    45   268.000  1.529
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   340.000  1.090
  102   103   340.000  1.090
  102   104   340.000  1.090
  102   105   340.000  1.090
   97    98   553.000  0.945
   91    92   340.000  1.090
   91    93   340.000  1.090
   91    94   340.000  1.090
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    76   340.000  1.090
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    80   340.000  1.090
   68    69   553.000  0.945
   50    53   549.000  1.340
   50    55   317.000  1.510
   53    54   340.000  1.080
   53    62   320.000  1.460
   62    65   520.000  1.370
   62    84   410.000  1.394
   65    66   367.000  1.080
   65    70   265.000  1.745
   70    81   250.000  1.765
   81    84   488.000  1.335
   81    85   295.000  1.488
   85    86   340.000  1.090
   85    87   340.000  1.090
   85    88   340.000  1.090
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   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  111.63000
   29    33    41    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    43    58.35000  112.70000
   33    41   109    58.35000  112.70000
   33    41    42    50.00000  109.50000
   33    41    45    58.35000  112.70000
   38    33    34    37.50000  110.70000
   38    43    44    37.50000  110.70000
   38    43    49    50.00000  109.50000
   38    43    50    70.00000  112.02700
   40    38    39    33.00000  107.80000
   43    38    39    37.50000  110.70000
   43    38    40    37.50000  110.70000
   43    49    51    83.00000  116.90000
   43    50    53    70.00000  124.00000
   43    50    55    65.00000  117.92700
   49    43    44    35.00000  109.50000
   49    51    52    83.00000  123.40000
   49    51    59    81.00000  111.40000
   51    59    60    35.00000  109.50000
   51    59    61    35.00000  109.50000
   51    59    63    63.00000  111.10000
   59    51    52    80.00000  120.40000
   59    63    64    37.50000  110.70000
   59    63    67    58.35000  112.70000
   59    63    68    50.00000  109.50000
   61    59    60    33.00000  107.80000
   63    59    60    37.50000  110.70000
   63    59    61    37.50000  110.70000
   63    67    71    63.00000  111.10000
   63    67    73    58.35000  112.70000
   63    67    77    58.35000  112.70000
   63    68    69    55.00000  108.50000
   67    63    64    37.50000  110.70000
   67    71    72    80.00000  120.40000
   67    71    82    70.00000  116.00000
   67    73    74    37.50000  110.70000
   67    73    75    37.50000  110.70000
   67    73    76    37.50000  110.70000
   67    77    78    37.50000  110.70000
   67    77    79    37.50000  110.70000
   67    77    80    37.50000  110.70000
   71    82    83    35.00000  109.50000
   71    82    89    63.00000  111.10000
   71    82    91    63.00000  111.10000
   82    71    72    80.00000  120.40000
   82    89    90    37.50000  110.70000
   82    89    95    58.35000  112.70000
   82    89    97    50.00000  109.50000
   82    91    92    37.50000  110.70000
   82    91    93    37.50000  110.70000
   82    91    94    37.50000  110.70000
   89    82    83    37.50000  110.70000
   89    95    96    37.50000  110.70000
   89    95    99    58.35000  112.70000
   89    95   102    58.35000  112.70000
   89    97    98    55.00000  108.50000
   95    89    90    37.50000  110.70000
   95    99   100    37.50000  110.70000
   95    99   101    37.50000  110.70000
   95    99   106    58.35000  112.70000
   95   102   103    37.50000  110.70000
   95   102   104    37.50000  110.70000
   95   102   105    37.50000  110.70000
   99    95    96    37.50000  110.70000
   99   106   107    37.50000  110.70000
   99   106   108    37.50000  110.70000
   99   106   109    58.35000  112.70000
  101    99   100    33.00000  107.80000
  106    99   100    37.50000  110.70000
  106    99   101    37.50000  110.70000
  106   109   110    37.50000  110.70000
  106   109   111    37.50000  110.70000
  106   109    41    58.35000  112.70000
  108   106   107    33.00000  107.80000
  109   106   107    37.50000  110.70000
  109   106   108    37.50000  110.70000
  109    41    42    50.00000  109.50000
  109    41    45    58.35000  112.70000
  111   109   110    33.00000  107.80000
   41    33    34    37.50000  110.70000
   41    33    38    58.35000  112.70000
   41   109   110    37.50000  110.70000
   41   109   111    37.50000  110.70000
   41    45    46    37.50000  110.70000
   41    45    47    37.50000  110.70000
   41    45    48    37.50000  110.70000
   45    41    42    50.00000  109.50000
   47    45    46    33.00000  107.80000
   48    45    46    33.00000  107.80000
   48    45    47    33.00000  107.80000
  102    95    96    37.50000  110.70000
  102    95    99    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
   97    89    90    35.00000  109.50000
   97    89    95    50.00000  109.50000
   91    82    83    37.50000  110.70000
   91    82    89    58.35000  112.70000
   93    91    92    33.00000  107.80000
   94    91    92    33.00000  107.80000
   94    91    93    33.00000  107.80000
   73    67    71    63.00000  111.10000
   75    73    74    33.00000  107.80000
   76    73    74    33.00000  107.80000
   76    73    75    33.00000  107.80000
   77    67    71    63.00000  111.10000
   77    67    73    58.35000  112.70000
   79    77    78    33.00000  107.80000
   80    77    78    33.00000  107.80000
   80    77    79    33.00000  107.80000
   68    63    64    35.00000  109.50000
   68    63    67    50.00000  109.50000
   50    43    44    35.00000  109.50000
   50    43    49    85.00000  110.90400
   50    53    54    35.00000  120.00000
   50    53    62    60.00000  123.20500
   50    55    56    35.00000  109.50000
   50    55    57    35.00000  109.50000
   50    55    58    35.00000  109.50000
   53    62    65    60.00000  120.93500
   53    62    84    70.00000  118.40000
   62    53    54    40.00000  117.26300
   62    65    66    35.00000  130.70000
   62    65    70    80.00000  111.29200
   62    84    81    70.00000  110.00000
   65    70    81   120.00000   89.04400
   70    65    66    40.00000  122.38200
   70    81    84    80.00000  114.57700
   70    81    85    65.00000  125.49400
   81    85    86    45.00000  109.19200
   81    85    87    45.00000  109.19200
   81    85    88    45.00000  109.19200
   84    62    65    70.00000  111.00000
   85    81    84    65.00000  125.57700
   87    85    86    33.00000  107.80000
   88    85    86    33.00000  107.80000
   88    85    87    33.00000  107.80000
   55    50    53    70.00000  124.00000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    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
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   84    62    65    66   3.62500 -1.0 2.0
   84    62   -65    70   3.62500 -1.0 2.0
   84    81    85    86   0.00000  1.0 1.0
   84    81    85    87   0.00000  1.0 1.0
   84    81    85    88   0.00000  1.0 1.0
   85    81    84    62   3.62500 -1.0 2.0
   55    50    53    54   7.00000 -1.0 2.0
   55    50    53    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
   49    59    51    52  10.50000 -1.0 2.0
   67    82    71    72  10.50000 -1.0 2.0
   43    55    50    53  15.00000 -1.0 2.0
   62    54    53    50  15.00000 -1.0 2.0
   65    84    62    53   4.00000 -1.0 2.0
   70    66    65    62   1.10000 -1.0 2.0
   85    84    81    70   4.00000 -1.0 2.0
END
