* LIGAND DATABASE FILE (OPLS2005)
*
001     110   113    220    362     673
    1     0 S   NP   _N1_     1    28.74468    96.70834   -21.12691
    2     1 S   H    _HN1     2     1.02778    85.81424   -76.10718
    3     1 S   H    _H1_     3     1.02954    79.50236    33.48035
    4     1 S   H    _H2_     4     1.02830    43.55921   162.28366
    5     1 S   CT   _CA1     5     1.50161   153.73561   148.60878
    6     5 S   HC   _HA1     6     1.09554   105.21901    69.32989
    7     5 S   CO3  _C1_     7     1.53914   112.35019   -51.02800
    8     7 S   O2Z  _O11     8     1.26397   114.91339   -39.13925
    9     7 S   O2Z  _O12     9     1.26224   115.07987   139.93302
   10     5 S   CT   _CB1    10     1.53124   107.42470  -172.37813
   11    10 S   HC   HB11    11     1.09819   109.75551   -45.52887
   12    10 S   HC   HB12    12     1.09823   110.29146    71.22661
   13    10 S   CT   _CG1    13     1.52962   112.53212  -166.40231
   14    13 S   HC   HG11    14     1.09534   110.56357   -58.74265
   15    13 S   HC   HG12    15     1.09652   109.95675    60.24640
   16    13 S   C    _CD1    16     1.51888   112.30058  -179.49720
   17    16 S   O    _OE1    17     1.22706   123.33154    -6.31143
   18    16 S   N    _N2_    18     1.38524   111.49818   174.02886
   19    18 S   H    _HN2    19     1.01595   118.83572     1.53812
   20    18 S   CT1  _CA2    20     1.46255   123.80877  -179.69804
   21    20 S   HC   _HA2    21     1.09731   109.41885   -10.21985
   22    20 S   C    _C2_    22     1.53464   108.10189  -125.57796
   23    22 S   O    _O2_    23     1.23009   122.52447  -148.12487
   24    20 S   CT   _CB2    32     1.53527   111.19006   112.14258
   25    24 S   HC   HB21    33     1.09382   109.45252    52.04390
   26    24 S   HC   HB22    34     1.09496   110.24559   170.62336
   27    22 S   N    _N3_    24     1.38420   113.42286    39.46210
   28    27 S   H    _HN3    25     1.01638   119.45287    -3.63986
   29    24 S   S    _SG2    35     1.83379   111.07237   -70.83074
   30    27 S   CT   _CA3    26     1.45282   123.12986   176.94732
   31    30 S   HC   HA31    27     1.09552   107.51539   -64.06727
   32    30 S   HC   HA32    28     1.09558   107.96055    52.34338
   33    29 S   CT   _C20    36     1.87085   103.34673   153.87427
   34    30 S   CO3  _C3_    29     1.52932   114.13388   174.32277
   35    34 S   O2Z  _O31    30     1.26366   116.05341    -1.15589
   36    34 S   O2Z  _O32    31     1.26429   114.41435   178.91394
   37    33 S   CM   _C21    37     1.52432   108.02726    36.87998
   38    37 S   HC   _H32    38     1.08893   117.21430  -102.17781
   39    33 S   CT   _C19    55     1.57798   112.57186   152.15930
   40    39 S   HC   _H5_    56     1.10202   103.80781  -177.47524
   41    37 S   CMA  _C22    39     1.35227   124.84781    80.24698
   42    41 S   OM   _O35    40     1.26025   128.65611   176.99222
   43    39 S   CT   _C18    57     1.54804   113.65114    72.08809
   44    43 S   HC   _H30    58     1.09449   110.53045   -69.70404
   45    43 S   HC   _H31    59     1.09665   109.53037   173.58818
   46    41 S   CT   _C23    41     1.54995   116.31551    -8.28878
   47    46 S   HC   _H6_    42     1.10165   103.52174   -69.45189
   48    43 S   CT   _C17    60     1.54217   113.32669    53.83119
   49    48 S   HC   _H28    61     1.09706   108.87604    67.81349
   50    48 S   HC   _H29    62     1.09348   107.65830  -177.78804
   51    46 S   CT   _C28    43     1.55762   117.94109   178.75275
   52    51 S   HC   _H37    44     1.09774   111.52941    43.73245
   53    51 S   HC   _H38    45     1.09858   109.18959   157.07323
   54    48 S   CT   _C16    63     1.54203   112.32131   -54.86013
   55    51 S   CT   _C27    46     1.52309   113.84138   -81.42586
   56    55 S   HC   _H7_    47     1.09535   110.97506    65.75732
   57    54 S   CT   _C12    64     1.57532   115.69193   164.93871
   58    57 S   HC   _H4_    65     1.09997   108.15412   -41.73149
   59    54 S   CT   _C30   101     1.54914   108.57905   -72.62019
   60    59 S   HC   _H43   102     1.09198   112.47467   174.74558
   61    59 S   HC   _H44   103     1.08985   113.39785    51.75670
   62    59 S   HC   _H45   104     1.09436   111.29559   -65.48400
   63    55 S   CT   _C26    48     1.51999   110.57918   -56.33824
   64    63 S   HC   _H35    49     1.09668   110.49739   -66.48533
   65    63 S   HC   _H36    50     1.09722   109.44757   178.14048
   66    57 S   CT   _C13    66     1.55994   102.43731  -155.00112
   67    66 S   HC   _H24    67     1.09625   111.95073  -102.08037
   68    66 S   HC   _H25    68     1.09613   110.03636   138.33659
   69    57 S   CT   _C5_    75     1.56021   120.49428    80.14778
   70    69 S   HC   _H3_    76     1.09594   108.67375    60.22482
   71    55 S   OH   _O34   109     1.42535   109.47707  -175.76464
   72    71 S   HO   _H39   110     0.97263   107.13579   -59.94484
   73    63 S   CT   _C25    51     1.52280   110.89285    56.93321
   74    73 S   HC   _H33    52     1.09848   107.09154    65.72604
   75    73 S   HC   _H34    53     1.09695   108.68821  -179.96044
   76    66 S   CT   _C14    69     1.53959   107.91285    18.02569
   77    76 S   HC   _H26    70     1.09500   110.11760   133.72569
   78    76 S   HC   _H27    71     1.09141   108.61007  -108.30912
   79    69 S   CT   _C4_    77     1.53279   112.03235   -59.31233
   80    79 S   HC   _H8_    78     1.09494   111.19275   -53.97975
   81    79 S   HC   _H9_    79     1.09315   112.01017  -174.78718
   82    79 S   HC   _H10    80     1.09097   111.56940    67.31516
   83    69 S   CT   _C6_    81     1.55372   110.67643   177.63123
   84    83 S   HC   _H11    82     1.09499   109.81493   -48.54673
   85    83 S   HC   _H12    83     1.09737   109.71651    68.23614
   86    46 S   CT   _C24    54     1.58130   112.77377    45.82658
   87    33 S   CT   _C15    72     1.57905   112.41519   -87.88420
   88    83 S   CT   _C7_    84     1.53603   113.61972  -168.70424
   89    88 S   HC   _H13    85     1.09454   108.96200    50.82328
   90    88 S   HC   _H14    86     1.09330   109.87922   -66.93425
   91    87 S   OH   _O36    73     1.46170   106.24463   174.33268
   92    91 S   HO   _H46    74     0.97153   108.64739   -70.47922
   93    88 S   CT   _C8_    87     1.53255   111.08958   172.10290
   94    93 S   HC   _H15    88     1.09879   109.33978   -55.26113
   95    93 S   HC   _H16    89     1.09876   109.12307    58.93071
   96    86 S   CT   _C29   105     1.55054   108.84042  -152.84434
   97    96 S   HC   _H40   106     1.09355   111.57726    66.95113
   98    96 S   HC   _H41   107     1.09356   112.42334   -52.99577
   99    96 S   HC   _H42   108     1.09509   111.75255  -172.28752
  100    93 S   CT   _C9_    90     1.54163   115.45749  -178.02375
  101   100 S   CT   _C10    91     1.53068   112.15080    63.33090
  102   101 S   HC   _H17    92     1.09588   110.76833    54.35562
  103   101 S   HC   _H18    93     1.09626   110.81126   172.10012
  104   101 S   HC   _H19    94     1.09408   112.20598   -67.16968
  105   100 S   CT   _C11    95     1.53005   112.28611   -61.90597
  106   105 S   HC   _H20    96     1.09585   110.75796   -54.36576
  107   105 S   HC   _H21    97     1.09410   112.16268    67.16878
  108   105 S   HC   _H22    98     1.09627   110.81532  -172.11250
  109   100 S   OH   _O33    99     1.43455   106.24176  -179.29835
  110   109 S   HO   _H23   100     0.97242   108.03254  -179.36388
  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
