* LIGAND DATABASE FILE (OPLS2005)
*
001     115   118    214    324     612
    1     0 S   NP   _N1_     1    29.27082    97.06128   -25.39651
    2     1 S   H    _HN1     2     1.02949    68.88062     5.09816
    3     1 S   H    _H1_     3     1.02828    38.25579  -178.24097
    4     1 S   H    _H2_     4     1.02785   118.25191   -95.03317
    5     1 S   CT   _CA1     5     1.50110   126.80354   105.33739
    6     5 S   HC   _HA1     6     1.09573   105.19662    99.29253
    7     5 S   CO3  _C1_     7     1.53791   112.46899   -20.94848
    8     7 S   O2Z  _O11     8     1.26373   115.00769   -42.43186
    9     7 S   O2Z  _O12     9     1.26241   114.94923   136.71411
   10     5 S   CT   _CB1    10     1.53081   107.42202  -142.71700
   11    10 S   HC   HB11    11     1.09833   109.38092   -49.67003
   12    10 S   HC   HB12    12     1.09812   110.44635    66.94487
   13    10 S   CT   _CG1    13     1.52986   112.59595  -170.64325
   14    13 S   HC   HG11    14     1.09582   110.63013   -65.57745
   15    13 S   HC   HG12    15     1.09672   109.78239    53.64752
   16    13 S   C    _CD1    16     1.51801   112.24004   174.11397
   17    16 S   O    _OE1    17     1.22732   123.28270     6.95539
   18    16 S   N    _N2_    18     1.38633   111.63749  -173.11972
   19    18 S   H    _HN2    19     1.01579   119.00123     1.63183
   20    18 S   CT1  _CA2    20     1.46262   123.48396   177.69922
   21    20 S   HC   _HA2    21     1.09743   109.29692     3.94397
   22    20 S   C    _C2_    22     1.53636   108.91666  -111.47280
   23    22 S   O    _O2_    23     1.23056   122.29246  -151.09066
   24    20 S   CT   _CB2    32     1.53491   111.42104   125.84186
   25    24 S   HC   HB21    33     1.09500   109.31995    55.33085
   26    24 S   HC   HB22    34     1.09228   109.82573   174.05235
   27    22 S   N    _N3_    24     1.38337   113.82732    36.53055
   28    27 S   H    _HN3    25     1.01560   119.56431    -3.53308
   29    24 S   S    _SG2    35     1.83313   110.81478   -65.16722
   30    27 S   CT   _CA3    26     1.45271   123.22328   177.07979
   31    30 S   HC   HA31    27     1.09549   107.53181   -64.26571
   32    30 S   HC   HA32    28     1.09557   107.97131    52.18029
   33    29 S   CT   _C9_    36     1.85712   102.57550  -174.14365
   34    30 S   CO3  _C3_    29     1.52955   114.06455   174.16881
   35    34 S   O2Z  _O31    30     1.26378   116.07520    -0.26095
   36    34 S   O2Z  _O32    31     1.26429   114.41176   179.78971
   37    33 S   CM   _C6_    37     1.53252   110.78780   -45.77791
   38    33 S   CT   _C10   112     1.53558   106.36584  -168.43741
   39    38 S   HC   _H12   113     1.09667   111.25391   -65.12075
   40    38 S   HC   _H13   114     1.09680   111.18282   175.66216
   41    38 S   HC   _H14   115     1.09643   112.25606    55.93331
   42    37 S   CMA  _C7_    38     1.35101   110.17949   111.89942
   43    42 S   OM   _O38    39     1.25228   136.59976  -178.24476
   44    37 S   CT   _C5_   105     1.50155   123.52848   -65.51603
   45    44 S   HC   _H9_   106     1.09536   110.42786    27.43209
   46    44 S   HC   _H10   107     1.09714   109.64420   143.43062
   47    42 S   NE   _N4_    40     1.37525   109.80111     2.74894
   48    47 S   H    _H11    41     1.01192   119.65082   170.44768
   49    44 S   CT   _C4_   108     1.52195   112.76405   -95.35070
   50    49 S   HC   _H6_   109     1.09509   111.33641   -58.73606
   51    49 S   HC   _H7_   110     1.09490   109.99727  -178.18900
   52    49 S   HC   _H8_   111     1.09384   111.74030    62.24560
   53    33 S   CT   _C8_    42     1.57533   116.10855    69.97764
   54    53 S   HC   _H3_    43     1.09913   108.88760   143.57010
   55    53 S   CT   _C11    44     1.52597   118.33324    18.55390
   56    55 S   HC   _H15    45     1.09462   110.62459    43.83052
   57    55 S   HC   _H16    46     1.09501   112.18294   -76.45364
   58    55 S   CD   _C12    47     1.50748   110.72874   163.42957
   59    58 S   CM   _C32    48     1.46775   122.51251   -90.65201
   60    59 S   CM   _C31    49     1.34300   101.80448  -179.77883
   61    59 S   CT   _C33   101     1.47887   125.45719     1.20837
   62    61 S   HC   _H33   102     1.09445   110.46861   -61.37199
   63    61 S   HC   _H34   103     1.09347   112.27392   178.89589
   64    61 S   HC   _H35   104     1.09431   110.57512    58.66450
   65    60 S   CM   _C13    50     1.45794   109.76903     0.14265
   66    60 S   CT   _C34    92     1.49952   123.91799  -176.49496
   67    66 S   HC   _H36    93     1.09830   109.32211    31.74576
   68    66 S   HC   _H37    94     1.09441   110.89570   145.50996
   69    58 S   NI   _N5_    51     1.30070   122.52753    88.55489
   70    65 S   CM   _C14    52     1.34408   132.16349   178.60886
   71    70 S   HC   _H17    53     1.09196   115.55603   177.43662
   72    66 S   CT   _C35    95     1.52726   112.26198   -88.93516
   73    72 S   HC   _H38    96     1.09620   110.35924   -57.04687
   74    72 S   HC   _H39    97     1.09785   109.57379    60.22956
   75    70 S   CT   _C15    54     1.50200   130.48111    -4.15713
   76    75 S   HC   _H4_    55     1.09084   112.39432   -22.77470
   77    72 S   CO3  _C36    98     1.53188   114.86982  -179.11840
   78    77 S   O2Z  _O37    99     1.26513   114.06124   178.80663
   79    77 S   O2Z  _O36   100     1.26128   116.71686    -1.58918
   80    75 S   CM   _C16    56     1.50737   113.17983  -145.50120
   81    80 S   CM   _C17    57     1.33892   111.26295  -119.03018
   82    80 S   CT   _C28    83     1.50122   121.42128    61.28797
   83    82 S   HC   _H29    84     1.09608   110.27845  -162.36062
   84    82 S   HC   _H30    85     1.09679   109.50131   -47.07372
   85    81 S   CD   _C18    58     1.47688   102.49382     0.25179
   86    81 S   CT   _C27    79     1.48117   131.33687   179.96574
   87    86 S   HC   _H26    80     1.09457   110.57274   117.04107
   88    86 S   HC   _H27    81     1.09323   112.36917    -2.74488
   89    86 S   HC   _H28    82     1.09465   110.55498  -122.70089
   90    82 S   CT   _C29    86     1.52571   112.27534    75.48481
   91    90 S   HC   _H31    87     1.09659   110.09175   -63.31452
   92    90 S   HC   _H32    88     1.09772   109.65707    54.46250
   93    75 S   NI   _N6_    59     1.47874   109.35141    98.45784
   94    85 S   CM   _C19    60     1.48353   117.74582  -177.71398
   95    94 S   HC   _H18    61     1.08342   116.25440    28.86885
   96    90 S   CO3  _C30    89     1.53256   114.47911   175.67346
   97    96 S   O2Z  _O35    90     1.26505   114.14602  -169.90229
   98    96 S   O2Z  _O34    91     1.26165   116.64667    10.19377
   99    94 S   CM   _C20    62     1.34165   122.99873  -149.73353
  100    99 S   CM   _C23    63     1.44980   125.82816   178.03039
  101   100 S   CT   _C22    64     1.50391   105.92849  -154.39971
  102   101 S   HC   _H5_    65     1.09720   111.52349  -133.84725
  103   100 S   CM   _C24    73     1.34405   131.05379    31.90740
  104   103 S   HC   _H19    74     1.08957   117.26813   178.23010
  105   101 S   CD   _C21    66     1.53577    98.79368   -18.06746
  106   105 S   OM   _O33    67     1.24773   119.08598  -167.38107
  107   101 S   CT   _C26    69     1.52604   112.56016   100.51773
  108   107 S   HC   _H23    70     1.09626   111.86513   -58.58049
  109   107 S   HC   _H24    71     1.09538   110.70664  -178.10163
  110   107 S   HC   _H25    72     1.09523   111.02170    62.21273
  111   103 S   CT   _C25    75     1.49331   128.60163     0.99268
  112   111 S   HC   _H20    76     1.09375   110.30793  -100.78005
  113   111 S   HC   _H21    77     1.09529   109.31014   140.60767
  114   111 S   HC   _H22    78     1.09241   113.03151    22.08521
  115    99 S   NI   _N7_    68     1.37322   124.52864     5.30840
  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
  19   2   1   1  18   9   3   2   1  10   4   8   5   4   7   3
   3   2   1   1   7   4   8   4   3  10  12  16   6   2   1   1
  11  10   5   4   3   8   4   5   4   3  11   5   2   1   1  15
  13  11   5   4  10   5   2   1   1   5   4   3   3   7   3   2
   1   1  10  15  11   8   8   4   6   2   4   2   1   1   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    53    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    42    47    53    54    55    44    38    39    40    41  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    42    43    47    48    53    54    55    56    57    58    44    45    46    49    38    39    40    41  
   35    36  
   36  
    0  
   42    43    47    48    53    54    55    44    45    46    49    50    51    52    38    39    40    41  
   39    40    41    42    44    47    53    54    55  
   40    41    53  
   41    53  
   53  
   43    47    48    53    54    55    44    45    46    49  
   47    48    53    44  
   45    46    49    50    51    52    47    53  
   46    49    50    51    52  
   49    50    51    52  
   48    53    54    55    56    57    58  
   53    54    55  
   50    51    52  
   51    52  
   52  
    0  
   54    55    56    57    58    59    69  
   55    56    57    58  
   56    57    58    59    60    65    69    61  
   57    58    59    69  
   58    59    69  
   59    60    65    69    70    66    61    62    63    64  
   60    65    69    70    66    67    68    72    61    62    63    64  
   65    69    70    71    75    66    67    68    72    73    74    77    61    62    63    64  
   62    63    64    65    66    69  
   63    64  
   64  
    0  
   69    70    71    75    76    80    93    66    67    68    72  
   67    68    72    73    74    77    78    79    69    70  
   68    72    73    74    77  
   72    73    74    77  
   70    71    75  
   71    75    76    80    81    85    93    82  
   75    76    80    93  
   73    74    77    78    79  
   74    77    78    79  
   77    78    79  
   76    80    81    85    93    94    86    82    83    84    90  
   80    81    85    93    82  
   78    79  
   79  
    0  
   81    85    93    94    86    87    88    89    82    83    84    90    91    92    96  
   85    93    94    95    99    86    87    88    89    82    83    84    90  
   83    84    90    91    92    96    97    98    85    86    93  
   84    90    91    92    96  
   90    91    92    96  
   93    94    95    99   100   115    86    87    88    89  
   87    88    89    93    94  
   88    89  
   89  
    0  
   91    92    96    97    98  
   92    96    97    98  
   96    97    98  
   94    95    99  
   95    99   100   101   105   115   103  
   99   100   115  
   97    98  
   98  
    0  
  100   101   102   105   106   115   107   103   104   111  
  101   102   105   106   115   107   108   109   110   103   104   111   112   113   114  
  102   105   106   115   107   108   109   110   103   104   111  
  105   106   115   107   108   109   110   103  
  104   111   112   113   114   105   107   115  
  111   112   113   114  
  106   115   107   108   109   110  
  115   107  
  108   109   110   115  
  109   110  
  110  
    0  
  112   113   114  
  113   114  
  114  
    0  
    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  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760   0.497600   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   44   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.2500   0.1700  -1.111500   1.8650   1.6500   0.051222218  -2.220205820
   48   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   49   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660   0.175300   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.083900   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   3.7500   0.1050   0.356900   2.0020   1.7750   0.023028004  -0.852763146
   59   3.5500   0.0760  -0.003300   2.0020   1.7750   0.023028004  -0.852763146
   60   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   61   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5500   0.0760   0.122500   2.0020   1.7750   0.023028004  -0.852763146
   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   3.2800   0.1700  -0.512200   1.8540   1.6400   0.005000000   0.000000000
   70   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   71   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   72   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   75   3.5000   0.0660   0.160200   1.9750   1.7500   0.005000000  -0.741685710
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   78   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   79   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   80   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   81   3.5500   0.0760  -0.003300   2.0020   1.7750   0.023028004  -0.852763146
   82   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   3.7500   0.1050   0.396300   2.0020   1.7750   0.023028004  -0.852763146
   86   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   92   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   93   3.2800   0.1700  -0.609900   1.8540   1.6400   0.005000000   0.000000000
   94   3.5500   0.0760  -0.118300   2.0020   1.7750   0.023028004  -0.852763146
   95   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   96   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   97   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   98   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   99   3.5500   0.0760   0.122500   2.0020   1.7750   0.023028004  -0.852763146
  100   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
  101   3.5000   0.0660  -0.023900   1.9750   1.7500   0.005000000  -0.741685710
  102   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  103   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
  104   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  105   3.7500   0.1050   0.438600   2.0020   1.7750   0.023028004  -0.852763146
  106   3.1500   0.2500  -0.685000   1.7825   1.5750   0.001000000  -0.126889456
  107   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  108   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  109   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  110   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  112   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  113   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  114   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  115   3.2800   0.1700  -0.912200   1.8540   1.6400   0.005000000   0.000000000
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    53   268.000  1.529
   33    38   268.000  1.529
   37    42   465.000  1.376
   37    44   317.000  1.510
   42    43   745.000  1.250
   42    47   415.000  1.382
   47    48   434.000  1.010
   47    53   382.000  1.448
   53    54   340.000  1.090
   53    55   268.000  1.529
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   270.000  1.508
   58    59   320.000  1.464
   58    69   500.000  1.261
   59    60   549.000  1.340
   59    61   317.000  1.510
   60    65   380.000  1.444
   60    66   317.000  1.510
   65    69   405.000  1.380
   65    70   549.000  1.340
   70    71   340.000  1.080
   70    75   317.000  1.510
   75    76   340.000  1.090
   75    80   317.000  1.510
   75    93   315.000  1.435
   80    81   549.000  1.340
   80    82   317.000  1.510
   81    85   320.000  1.464
   81    86   317.000  1.510
   85    93   500.000  1.261
   85    94   320.000  1.464
   94    95   340.000  1.080
   94    99   549.000  1.340
   99   100   380.000  1.444
   99   115   405.000  1.380
  100   101   317.000  1.510
  100   103   549.000  1.340
  101   102   340.000  1.090
  101   105   270.000  1.508
  101   107   268.000  1.529
  105   106   795.000  1.237
  105   115   500.000  1.261
  107   108   340.000  1.090
  107   109   340.000  1.090
  107   110   340.000  1.090
  103   104   340.000  1.080
  103   111   317.000  1.510
  111   112   340.000  1.090
  111   113   340.000  1.090
  111   114   340.000  1.090
   86    87   340.000  1.090
   86    88   340.000  1.090
   86    89   340.000  1.090
   82    83   340.000  1.090
   82    84   340.000  1.090
   82    90   268.000  1.529
   90    91   340.000  1.090
   90    92   340.000  1.090
   90    96   317.000  1.522
   96    97   656.000  1.250
   96    98   656.000  1.250
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    72   268.000  1.529
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    77   317.000  1.522
   77    78   656.000  1.250
   77    79   656.000  1.250
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   340.000  1.090
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    49   268.000  1.529
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   340.000  1.090
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    41   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    53    75.00000  111.63000
   29    33    38    75.00000  111.63000
   33    37    42    70.00000  124.00000
   33    37    44    65.00000  117.92700
   33    53    47    80.00000  111.61500
   33    53    54    37.50000  110.70000
   33    53    55    58.35000  112.70000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    41    37.50000  110.70000
   37    42    43    65.00000  137.10300
   37    42    47    75.00000  114.40000
   37    44    45    35.00000  109.50000
   37    44    46    35.00000  109.50000
   37    44    49    70.00000  112.02700
   42    47    48    50.00000  121.48000
   42    47    53    50.00000  121.00000
   47    42    43   105.00000  113.92000
   47    53    54    35.00000  109.50000
   47    53    55    80.00000  111.61500
   53    33    37    70.00000  112.02700
   53    47    48    35.00000  112.50000
   53    55    56    37.50000  110.70000
   53    55    57    37.50000  110.70000
   53    55    58    70.00000  111.76100
   55    53    54    37.50000  110.70000
   55    58    59    65.00000  117.24000
   55    58    69    65.00000  122.10100
   57    55    56    33.00000  107.80000
   58    55    56    45.00000  109.49600
   58    55    57    45.00000  109.49600
   58    59    60    60.00000  120.31500
   58    59    61    65.00000  117.22000
   58    69    65    75.00000  115.77100
   59    60    65    70.00000  123.01800
   59    60    66    70.00000  124.00000
   59    61    62    35.00000  109.50000
   59    61    63    35.00000  109.50000
   59    61    64    35.00000  109.50000
   60    65    69    70.00000  120.83400
   60    65    70    70.00000  123.01800
   60    66    67    35.00000  109.50000
   60    66    68    35.00000  109.50000
   60    66    72    70.00000  112.02700
   65    70    71    35.00000  120.00000
   65    70    75    70.00000  124.00000
   69    58    59    70.00000  121.86000
   70    65    69    70.00000  120.83400
   70    75    76    35.00000  109.50000
   70    75    80    70.00000  110.12100
   70    75    93    75.00000  110.00000
   75    70    71    35.00000  117.00000
   75    80    81    70.00000  124.00000
   75    80    82    65.00000  117.92700
   75    93    85    70.00000  113.48600
   80    75    76    35.00000  109.50000
   80    81    85    60.00000  120.31500
   80    81    86    70.00000  124.00000
   80    82    83    35.00000  109.50000
   80    82    84    35.00000  109.50000
   80    82    90    70.00000  112.02700
   81    85    93    70.00000  121.86000
   81    85    94    65.00000  123.36000
   81    86    87    35.00000  109.50000
   81    86    88    35.00000  109.50000
   81    86    89    35.00000  109.50000
   85    94    95    40.00000  114.85300
   85    94    99    60.00000  120.31500
   93    75    76    50.00000  110.29200
   93    75    80    75.00000  110.00000
   94    85    93    70.00000  121.86000
   94    99   100    70.00000  123.01800
   94    99   115    70.00000  120.83400
   99    94    95    35.00000  120.00000
   99   100   101    70.00000  124.00000
   99   100   103    70.00000  123.01800
   99   115   105    75.00000  115.77100
  100   101   102    35.00000  109.50000
  100   101   105    70.00000  110.51600
  100   101   107    70.00000  112.02700
  100   103   104    35.00000  120.00000
  100   103   111    70.00000  124.00000
  101   105   106    75.00000  122.80800
  101   105   115    65.00000  122.10100
  101   107   108    37.50000  110.70000
  101   107   109    37.50000  110.70000
  101   107   110    37.50000  110.70000
  105   101   102    45.00000  109.49600
  115    99   100    70.00000  120.83400
  115   105   106    75.00000  134.47000
  107   101   102    37.50000  110.70000
  107   101   105    70.00000  111.76100
  109   107   108    33.00000  107.80000
  110   107   108    33.00000  107.80000
  110   107   109    33.00000  107.80000
  103   100   101    70.00000  124.00000
  103   111   112    35.00000  109.50000
  103   111   113    35.00000  109.50000
  103   111   114    35.00000  109.50000
  111   103   104    35.00000  117.00000
  113   111   112    33.00000  107.80000
  114   111   112    33.00000  107.80000
  114   111   113    33.00000  107.80000
   86    81    85    65.00000  117.22000
   88    86    87    33.00000  107.80000
   89    86    87    33.00000  107.80000
   89    86    88    33.00000  107.80000
   82    80    81    70.00000  124.00000
   82    90    91    37.50000  110.70000
   82    90    92    37.50000  110.70000
   82    90    96    70.00000  109.69300
   84    82    83    33.00000  107.80000
   90    82    83    37.50000  110.70000
   90    82    84    37.50000  110.70000
   90    96    97    70.00000  117.00000
   90    96    98    70.00000  117.00000
   92    90    91    33.00000  107.80000
   96    90    91    35.00000  109.50000
   96    90    92    35.00000  109.50000
   98    96    97    80.00000  126.00000
   66    60    65    70.00000  124.00000
   66    72    73    37.50000  110.70000
   66    72    74    37.50000  110.70000
   66    72    77    70.00000  109.69300
   68    66    67    33.00000  107.80000
   72    66    67    37.50000  110.70000
   72    66    68    37.50000  110.70000
   72    77    78    70.00000  117.00000
   72    77    79    70.00000  117.00000
   74    72    73    33.00000  107.80000
   77    72    73    35.00000  109.50000
   77    72    74    35.00000  109.50000
   79    77    78    80.00000  126.00000
   61    59    60    70.00000  124.00000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
   44    37    42    70.00000  124.00000
   44    49    50    37.50000  110.70000
   44    49    51    37.50000  110.70000
   44    49    52    37.50000  110.70000
   46    44    45    33.00000  107.80000
   49    44    45    37.50000  110.70000
   49    44    46    37.50000  110.70000
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    33.00000  107.80000
   38    33    37    70.00000  112.02700
   38    33    53    58.35000  112.70000
   40    38    39    33.00000  107.80000
   41    38    39    33.00000  107.80000
   41    38    40    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
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   46    44    49    52   0.15000  1.0 3.0
   38    33    37    42   0.09850  1.0 1.0
   38    33    37    42   0.15250 -1.0 2.0
   38    33    37    42  -0.50650  1.0 3.0
   38    33    37    44   0.46850  1.0 1.0
   38    33    37    44   0.08550 -1.0 2.0
   38    33    37    44   0.09800  1.0 3.0
   38    33    53    47   1.26750  1.0 1.0
   38    33    53    47  -0.00950 -1.0 2.0
   38    33    53    47   0.30600  1.0 3.0
   38    33    53    54   0.15000  1.0 3.0
   38    33    53    55   0.56750  1.0 1.0
   38    33    53    55  -0.07550 -1.0 2.0
   38    33    53    55   0.20000  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   33    44    37    42   1.10000 -1.0 2.0
   47    43    42    37   1.10000 -1.0 2.0
   48    42    47    53   1.00000 -1.0 2.0
   55    59    58    69  10.50000 -1.0 2.0
   58    61    59    60   1.10000 -1.0 2.0
   65    66    60    59   1.10000 -1.0 2.0
   60    69    65    70   1.10000 -1.0 2.0
   75    71    70    65   1.10000 -1.0 2.0
   75    82    80    81   1.10000 -1.0 2.0
   85    86    81    80   1.10000 -1.0 2.0
   81    94    85    93  10.50000 -1.0 2.0
   85    95    94    99   1.10000 -1.0 2.0
  100   115    99    94   1.10000 -1.0 2.0
   99   101   100   103   1.10000 -1.0 2.0
  101   106   105   115  10.50000 -1.0 2.0
  111   104   103   100   1.10000 -1.0 2.0
   97    90    96    98  10.50000 -1.0 2.0
   78    72    77    79  10.50000 -1.0 2.0
END
