* LIGAND DATABASE FILE (OPLS2005)
*
001     110   113    220    362     673
    1     0 S   NP   _N1_     1    28.74835    94.33851   -19.08392
    2     1 S   H    _HN1     2     1.02959    98.95829    18.27252
    3     1 S   H    _H1_     3     1.02838    37.38950   124.72198
    4     1 S   H    _H2_     4     1.02778    76.42337   -88.53723
    5     1 S   CT   _CA1     5     1.50115   143.61710   162.30198
    6     5 S   HC   _HA1     6     1.09576   105.25019    35.94325
    7     5 S   CO3  _C1_     7     1.53804   112.24445   -84.26521
    8     7 S   O2Z  _O11     8     1.26355   115.00879   -46.98582
    9     7 S   O2Z  _O12     9     1.26228   114.86967   132.04646
   10     5 S   CT   _CB1    10     1.53073   107.41919   153.78806
   11    10 S   HC   HB11    11     1.09821   109.37627   -50.96716
   12    10 S   HC   HB12    12     1.09824   110.41349    65.58511
   13    10 S   CT   _CG1    13     1.52999   112.65036  -172.09709
   14    13 S   HC   HG11    14     1.09602   110.33320   -61.83018
   15    13 S   HC   HG12    15     1.09632   110.13452    57.39795
   16    13 S   C    _CD1    16     1.51805   112.18108   177.69981
   17    16 S   O    _OE1    17     1.22735   123.23271    -7.84015
   18    16 S   N    _N2_    18     1.38574   111.65343   172.40774
   19    18 S   H    _HN2    19     1.01597   119.05779     1.39241
   20    18 S   CT1  _CA2    20     1.46314   123.45350  -176.76197
   21    20 S   HC   _HA2    21     1.09734   109.39701   -12.94109
   22    20 S   C    _C2_    22     1.53397   108.61550  -128.75564
   23    22 S   O    _O2_    23     1.23020   122.23768  -147.77155
   24    20 S   CT   _CB2    32     1.53672   111.01637   109.03215
   25    24 S   HC   HB21    33     1.09458   108.37554    54.13977
   26    24 S   HC   HB22    34     1.09307   110.36572   173.13187
   27    22 S   N    _N3_    24     1.38512   113.40761    39.85962
   28    27 S   H    _HN3    25     1.01520   118.88060    -0.79648
   29    24 S   S    _SG2    35     1.83135   110.77367   -66.39528
   30    27 S   CT   _CA3    26     1.45430   123.38614   174.89838
   31    30 S   HC   HA31    27     1.09528   109.15388    26.17281
   32    30 S   HC   HA32    28     1.09493   107.15178   143.17457
   33    29 S   CT   _C20    36     1.91426   104.14875   175.85405
   34    30 S   CO3  _C3_    29     1.52927   113.14311   -97.23305
   35    34 S   O2Z  _O31    30     1.26400   115.42106   -44.06610
   36    34 S   O2Z  _O32    31     1.26357   114.97088   136.86155
   37    33 S   CM   _C21    37     1.51064   108.72524   -28.44766
   38    37 S   HC   _H32    38     1.09053   115.16962    73.36707
   39    33 S   CT   _C19    55     1.58287   108.35228  -148.10637
   40    39 S   HC   _H5_    56     1.10041   107.95843   -37.73969
   41    37 S   CMA  _C22    39     1.35286   129.16433  -109.10635
   42    41 S   OM   _O35    40     1.26355   126.88733  -175.80535
   43    39 S   CT   _C18    57     1.57126   112.87187  -153.12739
   44    43 S   HC   _H30    58     1.09371   110.26615   -83.28595
   45    43 S   HC   _H31    59     1.09719   108.61732   161.47277
   46    41 S   CT   _C23    41     1.55400   120.51826     0.60909
   47    46 S   HC   _H6_    42     1.10087   104.99810   -99.34242
   48    43 S   CT   _C17    60     1.53088   118.14949    40.69635
   49    48 S   HC   _H28    61     1.09692   108.95359    73.20691
   50    48 S   HC   _H29    62     1.09337   107.62963  -172.98977
   51    46 S   CT   _C28    43     1.56081   115.67415   146.17737
   52    51 S   HC   _H37    44     1.09743   111.66256    50.51712
   53    51 S   HC   _H38    45     1.09821   109.44513   164.02533
   54    48 S   CT   _C16    63     1.53434   112.08066   -50.28722
   55    51 S   CT   _C27    46     1.52519   113.54223   -73.93000
   56    55 S   HC   _H7_    47     1.09598   110.49664    65.14906
   57    54 S   CT   _C12    64     1.57104   114.50906   167.29626
   58    57 S   HC   _H4_    65     1.10023   108.07006   -39.96868
   59    54 S   CT   _C30   101     1.54591   110.36627   -68.17269
   60    59 S   HC   _H43   102     1.09427   112.39607   176.15005
   61    59 S   HC   _H44   103     1.09001   112.98526    54.32603
   62    59 S   HC   _H45   104     1.09409   111.29233   -63.77339
   63    55 S   CT   _C26    48     1.52260   111.10421   -56.78837
   64    63 S   HC   _H35    49     1.09552   110.78122   -70.36298
   65    63 S   HC   _H36    50     1.09758   109.20226   174.80265
   66    57 S   CT   _C13    66     1.55375   102.57707  -153.08065
   67    66 S   HC   _H24    67     1.09621   111.90228  -100.94698
   68    66 S   HC   _H25    68     1.09611   110.23752   139.49710
   69    57 S   CT   _C5_    75     1.56140   120.41411    82.00829
   70    69 S   HC   _H3_    76     1.09727   108.82080    61.49101
   71    55 S   OH   _O34   109     1.42494   109.51292  -176.63827
   72    71 S   HO   _H39   110     0.97245   107.21700   -59.85307
   73    63 S   CT   _C25    51     1.52801   110.76599    54.06835
   74    73 S   HC   _H33    52     1.08866   103.88225    66.35690
   75    73 S   HC   _H34    53     1.09663   109.38117  -179.17885
   76    66 S   CT   _C14    69     1.53701   107.73031    19.07912
   77    76 S   HC   _H26    70     1.09513   109.27679   130.75030
   78    76 S   HC   _H27    71     1.09362   108.97507  -111.50339
   79    69 S   CT   _C4_    77     1.53251   112.18527   -58.03244
   80    79 S   HC   _H8_    78     1.09488   111.22079   -54.69431
   81    79 S   HC   _H9_    79     1.09315   112.00620  -175.61948
   82    79 S   HC   _H10    80     1.09110   111.54744    66.72193
   83    69 S   CT   _C6_    81     1.55453   110.17129   178.94297
   84    83 S   HC   _H11    82     1.09539   109.55652   -51.87863
   85    83 S   HC   _H12    83     1.09756   109.52587    64.66508
   86    46 S   CT   _C24    54     1.57459   113.19227    18.07400
   87    33 S   CT   _C15    72     1.57670   104.39026    95.02755
   88    83 S   CT   _C7_    84     1.53592   114.20284  -172.34624
   89    88 S   HC   _H13    85     1.09509   109.05616    50.96805
   90    88 S   HC   _H14    86     1.09318   109.79454   -66.95141
   91    87 S   OH   _O36    73     1.45944   106.76946    52.07750
   92    91 S   HO   _H46    74     0.97347   107.01513   -54.42316
   93    88 S   CT   _C8_    87     1.53319   110.93804   172.32259
   94    93 S   HC   _H15    88     1.09883   109.22434   -57.56475
   95    93 S   HC   _H16    89     1.09884   109.16112    56.55500
   96    86 S   CT   _C29   105     1.55854   109.91940  -163.90635
   97    96 S   HC   _H40   106     1.09479   111.95579    50.63826
   98    96 S   HC   _H41   107     1.09239   113.37664   -68.65720
   99    96 S   HC   _H42   108     1.09606   110.58318   171.43721
  100    93 S   CT   _C9_    90     1.54167   115.60429   179.55854
  101   100 S   CT   _C10    91     1.53014   112.21274    62.31269
  102   101 S   HC   _H17    92     1.09586   110.76444    54.46891
  103   101 S   HC   _H18    93     1.09627   110.81854   172.21399
  104   101 S   HC   _H19    94     1.09407   112.15589   -67.06002
  105   100 S   CT   _C11    95     1.53020   112.25574   -62.94915
  106   105 S   HC   _H20    96     1.09585   110.76389   -54.35406
  107   105 S   HC   _H21    97     1.09404   112.18159    67.19276
  108   105 S   HC   _H22    98     1.09629   110.81227  -172.09021
  109   100 S   OH   _O33    99     1.43437   106.20668   179.68721
  110   109 S   HO   _H23   100     0.97249   108.07953  -179.94405
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  12   5   4   3
  24   2   1   1  14   5  24   9  11   4  13   6   5  16   7  15
   5   4  12   6   5  19  10   6  23  10   8   3   2   1   9   6
   5  11   6   5  14   8   2   1   7   3   2   5   3   2   7   3
   2   1   9   5   4   5   2   9   5   4   1   1  13   5   4   3
   2   1   1  10   9   4   3   2   5   3   2   1   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    39    87    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    86    39    40    43    54    76    87    91  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    42    46    73    86    39    40    43    44    45    48    54    57    66    76    77    78    87    91    92    59    96  
   35    36  
   36  
    0  
   38    41    42    46    47    51    86    39    40    43    54    76    87    91  
   41    42    46    39    87  
   40    43    44    45    48    49    50    54    76    87    91    96    97    98    99    41    46    47    51    63    73    74    75    86  
   43    44    45    48    87    96    46    73    86  
   42    46    47    51    52    53    55    73    86    87    96  
   46    47    51    86  
   44    45    48    49    50    54    57    87    59    96    46    73    86  
   45    48    49    50    54    86  
   48    49    50    54    86  
   47    51    52    53    55    56    63    73    74    75    86    96    97    98    99    71  
   51    52    53    55    73    86    96  
   49    50    54    57    58    66    76    87    91    69    59    60    61    62    86  
   50    54    57    87    59  
   54    57    87    59  
   52    53    55    56    63    64    65    73    86    96    71    72  
   53    55    56    63    86    71  
   55    56    63    86    71  
   57    58    66    67    68    76    77    78    87    91    92    69    70    79    83    59    60    61    62  
   56    63    64    65    73    74    75    86    71    72  
   63    64    65    73    71    72  
   58    66    67    68    76    77    78    87    91    69    70    79    80    81    82    83    84    85    88    59    60    61    62  
   66    67    68    76    87    69    70    79    83    59  
   60    61    62    66    69    76    87    91  
   61    62    87  
   62    87  
   87  
   64    65    73    74    75    86    96    71    72  
   65    73    74    75    86    71  
   73    74    75    86    71  
   67    68    76    77    78    87    91    69    70    79    83  
   68    76    77    78    87    69  
   76    77    78    87    69  
   70    79    80    81    82    83    84    85    88    89    90    93    76    87  
   79    80    81    82    83    84    85    88  
   72    73  
    0  
   74    75    86    96    97    98    99  
   75    86    96  
   86    96  
   77    78    87    91    92  
   78    87    91  
   87    91  
   80    81    82    83    84    85    88  
   81    82    83  
   82    83  
   83  
   84    85    88    89    90    93    94    95   100  
   85    88    89    90    93  
   88    89    90    93  
   87    96    97    98    99  
   91    92  
   89    90    93    94    95   100   101   105   109  
   90    93    94    95   100  
   93    94    95   100  
   92  
    0  
   94    95   100   101   102   103   104   105   106   107   108   109   110  
   95   100   101   105   109  
  100   101   105   109  
   97    98    99  
   98    99  
   99  
    0  
  101   102   103   104   105   106   107   108   109   110  
  102   103   104   105   106   107   108   109   110  
  103   104   105   109  
  104   105   109  
  105   109  
  106   107   108   109   110  
  107   108   109  
  108   109  
  109  
  110  
    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  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   55   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   72   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   73   3.5000   0.0660  -0.120000   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   77   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   87   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   88   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   92   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   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  -0.180000   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   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
  101   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  102   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  103   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  104   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  106   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  108   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  109   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  110   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
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    39   268.000  1.529
   33    87   268.000  1.529
   37    38   340.000  1.080
   37    41   465.000  1.376
   41    42   745.000  1.250
   41    46   270.000  1.512
   46    47   340.000  1.090
   46    51   268.000  1.529
   46    86   268.000  1.529
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    55   268.000  1.529
   55    56   340.000  1.090
   55    63   268.000  1.529
   55    71   320.000  1.410
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    73   268.000  1.529
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    86   268.000  1.529
   86    39   268.000  1.529
   86    96   268.000  1.529
   39    40   340.000  1.090
   39    43   268.000  1.529
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    48   268.000  1.529
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    54   268.000  1.529
   54    57   268.000  1.529
   54    87   268.000  1.529
   54    59   268.000  1.529
   57    58   340.000  1.090
   57    66   268.000  1.529
   57    69   268.000  1.529
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    76   268.000  1.529
   76    77   340.000  1.090
   76    78   340.000  1.090
   76    87   268.000  1.529
   87    91   320.000  1.410
   91    92   553.000  0.945
   69    70   340.000  1.090
   69    79   268.000  1.529
   69    83   268.000  1.529
   79    80   340.000  1.090
   79    81   340.000  1.090
   79    82   340.000  1.090
   83    84   340.000  1.090
   83    85   340.000  1.090
   83    88   268.000  1.529
   88    89   340.000  1.090
   88    90   340.000  1.090
   88    93   268.000  1.529
   93    94   340.000  1.090
   93    95   340.000  1.090
   93   100   268.000  1.529
  100   101   268.000  1.529
  100   105   268.000  1.529
  100   109   320.000  1.410
  101   102   340.000  1.090
  101   103   340.000  1.090
  101   104   340.000  1.090
  105   106   340.000  1.090
  105   107   340.000  1.090
  105   108   340.000  1.090
  109   110   553.000  0.945
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   340.000  1.090
   96    97   340.000  1.090
   96    98   340.000  1.090
   96    99   340.000  1.090
   71    72   553.000  0.945
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    39    75.00000  111.63000
   29    33    87    75.00000  111.63000
   33    37    38    35.00000  117.00000
   33    37    41    70.00000  124.00000
   33    39    86    58.35000  112.70000
   33    39    40    37.50000  110.70000
   33    39    43    58.35000  112.70000
   33    87    54    58.35000  112.70000
   33    87    76    58.35000  112.70000
   33    87    91    50.00000  109.50000
   37    41    42    65.00000  137.10300
   37    41    46    65.00000  122.18000
   41    37    38    40.00000  120.50800
   41    46    47    45.00000  110.52000
   41    46    51    70.00000  112.02700
   41    46    86    70.00000  112.02700
   46    41    42    85.00000  112.85300
   46    51    52    37.50000  110.70000
   46    51    53    37.50000  110.70000
   46    51    55    58.35000  112.70000
   46    86    73    58.35000  112.70000
   46    86    39    58.35000  112.70000
   46    86    96    58.35000  112.70000
   51    46    47    37.50000  110.70000
   51    55    56    37.50000  110.70000
   51    55    63    58.35000  112.70000
   51    55    71    50.00000  109.50000
   53    51    52    33.00000  107.80000
   55    51    52    37.50000  110.70000
   55    51    53    37.50000  110.70000
   55    63    64    37.50000  110.70000
   55    63    65    37.50000  110.70000
   55    63    73    58.35000  112.70000
   55    71    72    55.00000  108.50000
   63    55    56    37.50000  110.70000
   63    73    74    37.50000  110.70000
   63    73    75    37.50000  110.70000
   63    73    86    58.35000  112.70000
   65    63    64    33.00000  107.80000
   73    63    64    37.50000  110.70000
   73    63    65    37.50000  110.70000
   73    86    39    58.35000  112.70000
   73    86    96    58.35000  112.70000
   75    73    74    33.00000  107.80000
   86    46    47    37.50000  110.70000
   86    46    51    58.35000  112.70000
   86    73    74    37.50000  110.70000
   86    73    75    37.50000  110.70000
   86    39    40    37.50000  110.70000
   86    39    43    58.35000  112.70000
   86    96    97    37.50000  110.70000
   86    96    98    37.50000  110.70000
   86    96    99    37.50000  110.70000
   39    33    37    70.00000  112.02700
   39    43    44    37.50000  110.70000
   39    43    45    37.50000  110.70000
   39    43    48    58.35000  112.70000
   43    39    40    37.50000  110.70000
   43    48    49    37.50000  110.70000
   43    48    50    37.50000  110.70000
   43    48    54    58.35000  112.70000
   45    43    44    33.00000  107.80000
   48    43    44    37.50000  110.70000
   48    43    45    37.50000  110.70000
   48    54    57    58.35000  112.70000
   48    54    87    58.35000  112.70000
   48    54    59    58.35000  112.70000
   50    48    49    33.00000  107.80000
   54    48    49    37.50000  110.70000
   54    48    50    37.50000  110.70000
   54    57    58    37.50000  110.70000
   54    57    66    58.35000  112.70000
   54    57    69    58.35000  112.70000
   54    87    76    58.35000  112.70000
   54    87    91    50.00000  109.50000
   54    59    60    37.50000  110.70000
   54    59    61    37.50000  110.70000
   54    59    62    37.50000  110.70000
   57    66    67    37.50000  110.70000
   57    66    68    37.50000  110.70000
   57    66    76    58.35000  112.70000
   57    69    70    37.50000  110.70000
   57    69    79    58.35000  112.70000
   57    69    83    58.35000  112.70000
   66    57    58    37.50000  110.70000
   66    76    77    37.50000  110.70000
   66    76    78    37.50000  110.70000
   66    76    87    58.35000  112.70000
   68    66    67    33.00000  107.80000
   76    66    67    37.50000  110.70000
   76    66    68    37.50000  110.70000
   76    87    91    50.00000  109.50000
   78    76    77    33.00000  107.80000
   87    33    37    70.00000  112.02700
   87    33    39    58.35000  112.70000
   87    54    57    58.35000  112.70000
   87    76    77    37.50000  110.70000
   87    76    78    37.50000  110.70000
   87    91    92    55.00000  108.50000
   69    57    58    37.50000  110.70000
   69    57    66    58.35000  112.70000
   69    79    80    37.50000  110.70000
   69    79    81    37.50000  110.70000
   69    79    82    37.50000  110.70000
   69    83    84    37.50000  110.70000
   69    83    85    37.50000  110.70000
   69    83    88    58.35000  112.70000
   79    69    70    37.50000  110.70000
   81    79    80    33.00000  107.80000
   82    79    80    33.00000  107.80000
   82    79    81    33.00000  107.80000
   83    69    70    37.50000  110.70000
   83    69    79    58.35000  112.70000
   83    88    89    37.50000  110.70000
   83    88    90    37.50000  110.70000
   83    88    93    58.35000  112.70000
   85    83    84    33.00000  107.80000
   88    83    84    37.50000  110.70000
   88    83    85    37.50000  110.70000
   88    93    94    37.50000  110.70000
   88    93    95    37.50000  110.70000
   88    93   100    58.35000  112.70000
   90    88    89    33.00000  107.80000
   93    88    89    37.50000  110.70000
   93    88    90    37.50000  110.70000
   93   100   101    58.35000  112.70000
   93   100   105    58.35000  112.70000
   93   100   109    50.00000  109.50000
   95    93    94    33.00000  107.80000
  100    93    94    37.50000  110.70000
  100    93    95    37.50000  110.70000
  100   101   102    37.50000  110.70000
  100   101   103    37.50000  110.70000
  100   101   104    37.50000  110.70000
  100   105   106    37.50000  110.70000
  100   105   107    37.50000  110.70000
  100   105   108    37.50000  110.70000
  100   109   110    55.00000  108.50000
  103   101   102    33.00000  107.80000
  104   101   102    33.00000  107.80000
  104   101   103    33.00000  107.80000
  105   100   101    58.35000  112.70000
  107   105   106    33.00000  107.80000
  108   105   106    33.00000  107.80000
  108   105   107    33.00000  107.80000
  109   100   101    50.00000  109.50000
  109   100   105    50.00000  109.50000
   59    54    57    58.35000  112.70000
   59    54    87    58.35000  112.70000
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    33.00000  107.80000
   96    86    39    58.35000  112.70000
   98    96    97    33.00000  107.80000
   99    96    97    33.00000  107.80000
   99    96    98    33.00000  107.80000
   71    55    56    35.00000  109.50000
   71    55    63    50.00000  109.50000
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
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   66    57    69    79   0.20000  1.0 3.0
   66    57    69    83   0.56750  1.0 1.0
   66    57    69    83  -0.07550 -1.0 2.0
   66    57    69    83   0.20000  1.0 3.0
   66    76    87    33   0.56750  1.0 1.0
   66    76    87    33  -0.07550 -1.0 2.0
   66    76    87    33   0.20000  1.0 3.0
   66    76   -87    54   0.56750  1.0 1.0
   66    76   -87    54  -0.07550 -1.0 2.0
   66    76   -87    54   0.20000  1.0 3.0
   66    76    87    91   0.86500  1.0 1.0
   66    76    87    91  -0.17500 -1.0 2.0
   66    76    87    91   0.20800  1.0 3.0
   67    66    76    77   0.15000  1.0 3.0
   67    66    76    78   0.15000  1.0 3.0
   67    66    76    87   0.15000  1.0 3.0
   68    66    76    77   0.15000  1.0 3.0
   68    66    76    78   0.15000  1.0 3.0
   68    66    76    87   0.15000  1.0 3.0
   76    87    91    92  -0.11600  1.0 1.0
   76    87    91    92  -0.09450 -1.0 2.0
   76    87    91    92   0.21250  1.0 3.0
   77    76    87    33   0.15000  1.0 3.0
   77    76    87    54   0.15000  1.0 3.0
   77    76    87    91   0.23400  1.0 3.0
   78    76    87    33   0.15000  1.0 3.0
   78    76    87    54   0.15000  1.0 3.0
   78    76    87    91   0.23400  1.0 3.0
   87    33    37    38   0.00000  1.0 1.0
   87    33    37    41   0.09850  1.0 1.0
   87    33    37    41   0.15250 -1.0 2.0
   87    33    37    41  -0.50650  1.0 3.0
   87    33    39    86   0.56750  1.0 1.0
   87    33    39    86  -0.07550 -1.0 2.0
   87    33    39    86   0.20000  1.0 3.0
   87    33    39    40   0.15000  1.0 3.0
   87    33   -39    43   0.56750  1.0 1.0
   87    33   -39    43  -0.07550 -1.0 2.0
   87    33   -39    43   0.20000  1.0 3.0
   87    54    57    58   0.15000  1.0 3.0
   87    54   -57    66   0.56750  1.0 1.0
   87    54   -57    66  -0.07550 -1.0 2.0
   87    54   -57    66   0.20000  1.0 3.0
   87    54    57    69   0.56750  1.0 1.0
   87    54    57    69  -0.07550 -1.0 2.0
   87    54    57    69   0.20000  1.0 3.0
   87    54    59    60   0.15000  1.0 3.0
   87    54    59    61   0.15000  1.0 3.0
   87    54    59    62   0.15000  1.0 3.0
   69    57    66    67   0.15000  1.0 3.0
   69    57    66    68   0.15000  1.0 3.0
   69    57    66    76   0.56750  1.0 1.0
   69    57    66    76  -0.07550 -1.0 2.0
   69    57    66    76   0.20000  1.0 3.0
   69    83    88    89   0.15000  1.0 3.0
   69    83    88    90   0.15000  1.0 3.0
   69    83    88    93   0.56750  1.0 1.0
   69    83    88    93  -0.07550 -1.0 2.0
   69    83    88    93   0.20000  1.0 3.0
   70    69    79    80   0.15000  1.0 3.0
   70    69    79    81   0.15000  1.0 3.0
   70    69    79    82   0.15000  1.0 3.0
   70    69    83    84   0.15000  1.0 3.0
   70    69    83    85   0.15000  1.0 3.0
   70    69    83    88   0.15000  1.0 3.0
   79    69    83    84   0.15000  1.0 3.0
   79    69    83    85   0.15000  1.0 3.0
   79    69    83    88   0.56750  1.0 1.0
   79    69    83    88  -0.07550 -1.0 2.0
   79    69    83    88   0.20000  1.0 3.0
   83    69    79    80   0.15000  1.0 3.0
   83    69    79    81   0.15000  1.0 3.0
   83    69    79    82   0.15000  1.0 3.0
   83    88    93    94   0.15000  1.0 3.0
   83    88    93    95   0.15000  1.0 3.0
   83    88    93   100   0.56750  1.0 1.0
   83    88    93   100  -0.07550 -1.0 2.0
   83    88    93   100   0.20000  1.0 3.0
   84    83    88    89   0.15000  1.0 3.0
   84    83    88    90   0.15000  1.0 3.0
   84    83    88    93   0.15000  1.0 3.0
   85    83    88    89   0.15000  1.0 3.0
   85    83    88    90   0.15000  1.0 3.0
   85    83    88    93   0.15000  1.0 3.0
   88    93   100   101   0.56750  1.0 1.0
   88    93   100   101  -0.07550 -1.0 2.0
   88    93   100   101   0.20000  1.0 3.0
   88    93   100   105   0.56750  1.0 1.0
   88    93   100   105  -0.07550 -1.0 2.0
   88    93   100   105   0.20000  1.0 3.0
   88    93   100   109   0.86500  1.0 1.0
   88    93   100   109  -0.17500 -1.0 2.0
   88    93   100   109   0.20800  1.0 3.0
   89    88    93    94   0.15000  1.0 3.0
   89    88    93    95   0.15000  1.0 3.0
   89    88    93   100   0.15000  1.0 3.0
   90    88    93    94   0.15000  1.0 3.0
   90    88    93    95   0.15000  1.0 3.0
   90    88    93   100   0.15000  1.0 3.0
   93   100   101   102   0.15000  1.0 3.0
   93   100   101   103   0.15000  1.0 3.0
   93   100   101   104   0.15000  1.0 3.0
   93   100   105   106   0.15000  1.0 3.0
   93   100   105   107   0.15000  1.0 3.0
   93   100   105   108   0.15000  1.0 3.0
   93   100   109   110  -0.11600  1.0 1.0
   93   100   109   110  -0.09450 -1.0 2.0
   93   100   109   110   0.21250  1.0 3.0
   94    93   100   101   0.15000  1.0 3.0
   94    93   100   105   0.15000  1.0 3.0
   94    93   100   109   0.23400  1.0 3.0
   95    93   100   101   0.15000  1.0 3.0
   95    93   100   105   0.15000  1.0 3.0
   95    93   100   109   0.23400  1.0 3.0
  101   100   105   106   0.15000  1.0 3.0
  101   100   105   107   0.15000  1.0 3.0
  101   100   105   108   0.15000  1.0 3.0
  101   100   109   110  -0.11600  1.0 1.0
  101   100   109   110  -0.09450 -1.0 2.0
  101   100   109   110   0.21250  1.0 3.0
  105   100   101   102   0.15000  1.0 3.0
  105   100   101   103   0.15000  1.0 3.0
  105   100   101   104   0.15000  1.0 3.0
  105   100   109   110  -0.11600  1.0 1.0
  105   100   109   110  -0.09450 -1.0 2.0
  105   100   109   110   0.21250  1.0 3.0
  109   100   101   102   0.23400  1.0 3.0
  109   100   101   103   0.23400  1.0 3.0
  109   100   101   104   0.23400  1.0 3.0
  109   100   105   106   0.23400  1.0 3.0
  109   100   105   107   0.23400  1.0 3.0
  109   100   105   108   0.23400  1.0 3.0
   59    54    57    58   0.15000  1.0 3.0
   59    54    57    66   0.56750  1.0 1.0
   59    54    57    66  -0.07550 -1.0 2.0
   59    54    57    66   0.20000  1.0 3.0
   59    54    57    69   0.56750  1.0 1.0
   59    54    57    69  -0.07550 -1.0 2.0
   59    54    57    69   0.20000  1.0 3.0
   59    54    87    33   0.56750  1.0 1.0
   59    54    87    33  -0.07550 -1.0 2.0
   59    54    87    33   0.20000  1.0 3.0
   59    54    87    76   0.56750  1.0 1.0
   59    54    87    76  -0.07550 -1.0 2.0
   59    54    87    76   0.20000  1.0 3.0
   59    54    87    91   0.86500  1.0 1.0
   59    54    87    91  -0.17500 -1.0 2.0
   59    54    87    91   0.20800  1.0 3.0
   96    86    39    33   0.56750  1.0 1.0
   96    86    39    33  -0.07550 -1.0 2.0
   96    86    39    33   0.20000  1.0 3.0
   96    86    39    40   0.15000  1.0 3.0
   96    86    39    43   0.56750  1.0 1.0
   96    86    39    43  -0.07550 -1.0 2.0
   96    86    39    43   0.20000  1.0 3.0
   71    55    63    64   0.23400  1.0 3.0
   71    55    63    65   0.23400  1.0 3.0
   71    55    63    73   0.86500  1.0 1.0
   71    55    63    73  -0.17500 -1.0 2.0
   71    55    63    73   0.20800  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
   46    42    41    37   1.10000 -1.0 2.0
END
