* LIGAND DATABASE FILE (OPLS2005)
*
001     108   112    207    346     629
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02140    58.67407  -112.14362
    3     1 S   H    _H1_     3     1.02107   106.59060   -10.01905
    4     1 S   H    _H2_     4     1.02067    53.44847    91.25517
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08610   110.54789    58.78698
   26    24 S   HC   HB22    34     1.08612   109.94660   179.10082
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CT   _C20    36     1.85759    97.43835   161.83905
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CM   _C21    37     1.51143   106.43926   -59.96918
   38    33 S   OH   _O36   107     1.43377   107.55724    58.07403
   39    38 S   HO   _H26   108     0.96839   106.10141   -55.62098
   40    37 S   CMA  _C28    38     1.49905   116.36763   -73.94942
   41    40 S   OM   _O35    39     1.23027   120.63840   145.97717
   42    37 S   C    _C22    86     1.34097   126.96066   107.73875
   43    42 S   O    _O34    87     1.26532   128.88926    -1.71006
   44    40 S   CT   _C15    40     1.53553   116.71655   -31.56257
   45    42 S   N    _N4_    88     1.39116   122.40260   178.33035
   46    45 S   H    _H14    89     1.01574   114.53900    -0.04846
   47    44 S   CM   _C14    41     1.51488   108.98014  -145.46433
   48    44 S   CT   _C16    62     1.53974   112.05233   -21.20250
   49    48 S   HC   _H3_    63     1.09500   108.94298   169.80634
   50    44 S   OH   _O37    84     1.42616   106.43516    96.47186
   51    50 S   HO   _H34    85     0.96917   106.25160   177.71458
   52    45 S   CT   _C23    90     1.44179   127.60936  -179.89721
   53    52 S   HC   _H15    91     1.09387   111.64852   -60.05684
   54    52 S   HC   _H16    92     1.09348   111.72187    63.97567
   55    47 S   CM   _C13    42     1.35060   122.85290   104.23459
   56    33 S   CT   _C19    64     1.55721   115.98021   176.38578
   57    56 S   HC   _H5_    65     1.11613   109.11921  -137.75038
   58    47 S   OH   _O38    82     1.38566   113.07354   -76.92042
   59    58 S   HO   _H35    83     0.96113   109.56772  -178.87691
   60    52 S   NP   _N5_    93     1.49518   109.83583  -177.99885
   61    60 S   H    _H17    94     1.03077   107.28881    58.97074
   62    55 S   CO4  _C12    43     1.49392   120.41025   174.68220
   63    62 S   O    _O33    44     1.22592   122.34156   -19.07922
   64    56 S   NP   _N6_    66     1.49641   110.54662   -23.97463
   65    64 S   H    _H27    67     1.03020   106.90813    48.73364
   66    60 S   CT   _C24    95     1.51370   113.73058   -58.91247
   67    66 S   HC   _H18    96     1.09193   108.73528    87.84305
   68    66 S   HC   _H19    97     1.09409   107.88269   -32.56820
   69    62 S   CA   _C11    45     1.48249   117.70443   162.20160
   70    64 S   CT   _C29    68     1.50286   112.03604   165.27729
   71    70 S   HC   _H28    69     1.09234   107.74823    63.29513
   72    70 S   HC   _H29    70     1.09170   107.84212  -176.77505
   73    70 S   HC   _H30    71     1.09132   107.88253   -56.66786
   74    64 S   CT   _C30    72     1.50250   112.07489   -67.94346
   75    74 S   HC   _H31    73     1.09142   107.80654   -63.28931
   76    74 S   HC   _H32    74     1.09187   107.81013    56.76585
   77    74 S   HC   _H33    75     1.09176   107.80195   176.71920
   78    66 S   CT   _C25    98     1.51397   103.31524  -150.89005
   79    78 S   HC   _H20    99     1.09645   110.55047   -78.40373
   80    78 S   HC   _H21   100     1.09300   112.29559   160.49174
   81    69 S   CA   _C6_    46     1.40644   121.56894    -5.86327
   82    78 S   CT   _C26   101     1.51487   102.58064    39.34745
   83    82 S   HC   _H22   102     1.09654   110.14600    76.76550
   84    82 S   HC   _H23   103     1.09398   112.60550  -162.82954
   85    81 S   CA   _C7_    47     1.40802   117.45117  -177.01456
   86    85 S   HA   _H9_    48     1.08625   121.43668   178.00551
   87    81 S   CT   _C5_    56     1.52649   120.81315     0.73648
   88    60 S   CT   _C27   104     1.51747   114.37066   177.06455
   89    88 S   HC   _H24   105     1.09301   109.65693     3.97976
   90    88 S   HC   _H25   106     1.09428   106.89372  -115.60414
   91    85 S   CA   _C8_    49     1.39735   121.67583    -1.63650
   92    91 S   HA   _H10    50     1.08507   119.95167  -179.57342
   93    55 S   CT   _C18    57     1.51484   123.78356    -2.19035
   94    93 S   HC   _H4_    58     1.10774   106.19113   110.36683
   95    87 S   CT   _C4_    76     1.54312   112.96026   152.64812
   96    95 S   HC   _H6_    77     1.08374   109.06530  -179.98022
   97    95 S   HC   _H7_    78     1.08345   109.07567    60.01206
   98    95 S   HC   _H8_    79     1.08376   109.04250   -60.01739
   99    87 S   OH   _O40    80     1.43536   107.94993   -89.68664
  100    99 S   HO   _H37    81     0.96722   106.00020   -59.91045
  101    91 S   CA   _C9_    51     1.38778   119.96017     0.56614
  102   101 S   HA   _H11    52     1.08709   119.65582  -179.77619
  103    93 S   CT   _C17    59     1.54710   112.70682    -6.01819
  104   103 S   HC   _H12    60     1.09917   109.30149   157.10821
  105   103 S   HC   _H13    61     1.09515   109.66873   -86.27748
  106    69 S   CA   _C10    53     1.40571   117.64493   175.47940
  107   106 S   OH   _O39    54     1.36403   123.13884    -2.61756
  108   107 S   HO   _H36    55     0.96972   110.06332     0.66293
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  10   5   4   3
  18   2   1   1  16   7   1  14   5   9   3  16   8   4  15  17
   8   5   1  12   5   4  15  15   5   3   1  13   8  11   4  10
   8  11   6   5  13   7   3   2   1   3   2   1   1   8   5   4
  17   5   4   3  10   4  13   2   1   1   5   3  10   5   6   3
   2   1   2   1   4   2   2   1   1   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    56    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    48    56    57    64    42    38    39  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    41    44   103    48    49    56    57    64    65    70    74    42    43    45    38    39  
   35    36  
   36  
    0  
   40    41    44    47    48    56    57    64    50    42    43    45    46    52    38    39  
   39    40    42    48    56    57    64  
   56  
   41    44    47    55   103    48    49    56    58    50    51    42    43    45  
   44    47    48    50    42  
   43    45    46    52    53    54    60    44    56  
   45    46    52  
   47    55    62    93   103   104   105    48    49    56    57    64    58    59    50    51  
   46    52    53    54    60    61    66    88  
   52    53    54    60  
   55    62    63    69    87    93    94   103    48    49    56    58    59    50    51  
   49    56    57    64    65    70    74    58    50    51    55    87    93    94   103   104   105  
   56    57    64    50    93   103   104   105  
   51    55    56    58   103  
    0  
   53    54    60    61    66    67    68    78    82    88    89    90  
   54    60    61    66    88  
   60    61    66    88  
   62    63    69    81   106    87    93    94   103   104   105    95    99    58    59  
   57    64    65    70    71    72    73    74    75    76    77    93   103   104   105  
   64    65    70    74   103  
   59    62    93  
    0  
   61    66    67    68    78    79    80    82    83    84    88    89    90  
   66    67    68    78    82    88    89    90  
   63    69    81    85   101   106   107    87    93    94   103  
   69    81   106    93  
   65    70    71    72    73    74    75    76    77   103  
   70    71    72    73    74    75    76    77  
   67    68    78    79    80    82    83    84    88    89    90  
   68    78    79    80    82    88  
   78    79    80    82    88  
   81    85    86    91   101   102   106   107   108    87    93    95    99  
   71    72    73    74    75    76    77  
   72    73    74  
   73    74  
   74  
   75    76    77  
   76    77  
   77  
    0  
   79    80    82    83    84    88    89    90  
   80    82    83    84    88  
   82    83    84    88  
   85    86    91    92   101   106   107    87    93    94   103    95    96    97    98    99   100  
   83    84    88    89    90  
   84    88    89    90  
   88    89    90  
   86    91    92   101   102   106    87    93    95    99  
   91    92   101    87  
   93    94   103   104   105    95    96    97    98    99   100    91   106  
   89    90  
   90  
    0  
   92   101   102   106   107  
  101   102   106  
   94   103   104   105    95    96    97    98    99   100  
  103   104   105    95    99  
   96    97    98    99   100   103  
   97    98    99  
   98    99  
   99  
  100   103  
    0  
  102   106   107   108  
  106   107  
  104   105  
  105  
    0  
  107   108  
  108  
    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   0.432500   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  -0.657900   2.0020   1.7750   0.023028004  -0.852763146
   38   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   39   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   40   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   44   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   45   3.2500   0.1700  -0.422500   1.8100   1.6000   0.054801302  -1.445846770
   46   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   47   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   48   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   50   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   51   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   52   3.5000   0.0660   0.272500   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   55   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   56   3.5000   0.0660   0.210000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   58   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   59   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   60   3.2500   0.1700  -0.100000   2.2900   2.0360   0.003973653   1.685851020
   61   0.5000   0.0300   0.290000   0.9960   0.8600   0.030040813  -0.651083722
   62   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   63   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   64   3.2500   0.1700  -0.100000   2.1950   1.9500   0.003973653   1.685851020
   65   0.5000   0.0300   0.290000   0.9960   0.8600   0.030040813  -0.651083722
   66   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   69   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   70   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   74   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
   75   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   76   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   77   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   78   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   79   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   80   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   81   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   82   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   84   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   85   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   86   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   87   3.5000   0.0660   0.380000   1.9750   1.7500   0.005000000  -0.741685710
   88   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   89   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   90   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   91   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   92   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   93   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   94   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  100   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  101   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
  102   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
  103   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  104   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  105   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  106   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
  107   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
  108   0.5000   0.0300   0.435000   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    56   268.000  1.529
   33    38   320.000  1.410
   37    40   465.000  1.376
   37    42   410.000  1.444
   40    41   745.000  1.250
   40    44   270.000  1.512
   44    47   317.000  1.510
   44    48   268.000  1.529
   44    50   320.000  1.410
   47    55   549.000  1.340
   47    58   510.000  1.338
   55    62   320.000  1.462
   55    93   317.000  1.510
   62    63   570.000  1.229
   62    69   310.000  1.470
   69    81   469.000  1.400
   69   106   469.000  1.400
   81    85   469.000  1.400
   81    87   317.000  1.510
   85    86   367.000  1.080
   85    91   469.000  1.400
   91    92   367.000  1.080
   91   101   469.000  1.400
  101   102   367.000  1.080
  101   106   469.000  1.400
  106   107   450.000  1.364
  107   108   553.000  0.945
   87    93   268.000  1.529
   87    95   268.000  1.529
   87    99   320.000  1.410
   93    94   340.000  1.090
   93   103   268.000  1.529
  103   104   340.000  1.090
  103   105   340.000  1.090
  103    48   268.000  1.529
   48    49   340.000  1.090
   48    56   268.000  1.529
   56    57   340.000  1.090
   56    64   367.000  1.471
   64    65   434.000  1.010
   64    70   367.000  1.471
   64    74   367.000  1.471
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   340.000  1.090
   74    75   340.000  1.090
   74    76   340.000  1.090
   74    77   340.000  1.090
   95    96   340.000  1.090
   95    97   340.000  1.090
   95    98   340.000  1.090
   99   100   553.000  0.945
   58    59   553.000  0.945
   50    51   553.000  0.945
   42    43   570.000  1.229
   42    45   490.000  1.335
   45    46   434.000  1.010
   45    52   337.000  1.449
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    60   367.000  1.471
   60    61   434.000  1.010
   60    66   367.000  1.471
   60    88   367.000  1.471
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    78   268.000  1.529
   78    79   340.000  1.090
   78    80   340.000  1.090
   78    82   268.000  1.529
   82    83   340.000  1.090
   82    84   340.000  1.090
   82    88   268.000  1.529
   88    89   340.000  1.090
   88    90   340.000  1.090
   38    39   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    56    75.00000  111.63000
   29    33    38    85.00000  114.68000
   33    37    40    70.00000  124.00000
   33    37    42    70.00000  119.70000
   33    56    48    58.35000  112.70000
   33    56    57    37.50000  110.70000
   33    56    64    80.00000  111.20000
   33    38    39    55.00000  108.50000
   37    40    41    65.00000  137.10300
   37    40    44    65.00000  122.18000
   37    42    43    80.00000  125.30000
   37    42    45    80.00000  111.56200
   40    44    47    70.00000  110.12100
   40    44    48    70.00000  112.02700
   40    44    50    90.00000  110.39200
   44    40    41    85.00000  112.85300
   44    47    55    70.00000  124.00000
   44    47    58    90.00000  109.34000
   44    48   103    58.35000  112.70000
   44    48    49    37.50000  110.70000
   44    48    56    58.35000  112.70000
   44    50    51    55.00000  108.50000
   47    55    62    65.00000  118.96000
   47    55    93    70.00000  124.00000
   47    58    59    70.00000  107.45700
   55    62    63    80.00000  123.72100
   55    62    69    65.00000  117.02400
   55    93    87    70.00000  112.02700
   55    93    94    35.00000  109.50000
   55    93   103    70.00000  112.02700
   62    69    81    60.00000  119.52600
   62    69   106    60.00000  119.52600
   69    62    63    75.00000  123.78400
   69    81    85    63.00000  120.00000
   69    81    87    70.00000  120.00000
   69   106   101    63.00000  120.00000
   69   106   107    70.00000  120.00000
   81    85    86    35.00000  120.00000
   81    85    91    63.00000  120.00000
   81    87    93    70.00000  112.17500
   81    87    95    70.00000  112.17500
   81    87    99    90.00000  112.51600
   85    91    92    35.00000  120.00000
   85    91   101    63.00000  120.00000
   91    85    86    35.00000  120.00000
   91   101   102    35.00000  120.00000
   91   101   106    63.00000  120.00000
  101    91    92    35.00000  120.00000
  101   106   107    70.00000  120.00000
  106    69    81    63.00000  120.00000
  106   101   102    35.00000  120.00000
  106   107   108    35.00000  113.00000
   87    81    85    70.00000  120.00000
   87    93    94    37.50000  110.70000
   87    93   103    58.35000  112.70000
   87    95    96    37.50000  110.70000
   87    95    97    37.50000  110.70000
   87    95    98    37.50000  110.70000
   87    99   100    55.00000  108.50000
   93    55    62    65.00000  116.34900
   93   103   104    37.50000  110.70000
   93   103   105    37.50000  110.70000
   93   103    48    58.35000  112.70000
  103    93    94    37.50000  110.70000
  103    48    49    37.50000  110.70000
  103    48    56    58.35000  112.70000
  105   103   104    33.00000  107.80000
   48    44    47    70.00000  112.02700
   48   103   104    37.50000  110.70000
   48   103   105    37.50000  110.70000
   48    56    57    37.50000  110.70000
   48    56    64    80.00000  111.20000
   56    33    37    70.00000  112.02700
   56    48    49    37.50000  110.70000
   56    64    65    35.00000  109.50000
   56    64    70    75.00000  113.01200
   56    64    74    75.00000  113.01200
   64    56    57    35.00000  109.50000
   64    70    71    35.00000  109.50000
   64    70    72    35.00000  109.50000
   64    70    73    35.00000  109.50000
   64    74    75    35.00000  109.50000
   64    74    76    35.00000  109.50000
   64    74    77    35.00000  109.50000
   70    64    65    35.00000  109.50000
   72    70    71    33.00000  107.80000
   73    70    71    33.00000  107.80000
   73    70    72    33.00000  107.80000
   74    64    65    35.00000  109.50000
   74    64    70    75.00000  113.01200
   76    74    75    33.00000  107.80000
   77    74    75    33.00000  107.80000
   77    74    76    33.00000  107.80000
   95    87    93    58.35000  112.70000
   97    95    96    33.00000  107.80000
   98    95    96    33.00000  107.80000
   98    95    97    33.00000  107.80000
   99    87    93    50.00000  109.50000
   99    87    95    50.00000  109.50000
   58    47    55    80.00000  121.38400
   50    44    47    90.00000  110.39200
   50    44    48    50.00000  109.50000
   42    37    40    60.00000  120.04000
   42    45    46    35.00000  119.80000
   42    45    52    50.00000  121.90000
   45    42    43    80.00000  122.90000
   45    52    53    35.00000  109.50000
   45    52    54    35.00000  109.50000
   45    52    60    80.00000  116.76000
   52    45    46    38.00000  118.40000
   52    60    61    35.00000  109.50000
   52    60    66    75.00000  113.01200
   52    60    88    75.00000  113.01200
   54    52    53    33.00000  107.80000
   60    52    53    35.00000  109.50000
   60    52    54    35.00000  109.50000
   60    66    67    35.00000  109.50000
   60    66    68    35.00000  109.50000
   60    66    78    80.00000  111.20000
   60    88    82    80.00000  111.20000
   60    88    89    35.00000  109.50000
   60    88    90    35.00000  109.50000
   66    60    61    35.00000  109.50000
   66    78    79    37.50000  110.70000
   66    78    80    37.50000  110.70000
   66    78    82    58.35000  112.70000
   68    66    67    33.00000  107.80000
   78    66    67    37.50000  110.70000
   78    66    68    37.50000  110.70000
   78    82    83    37.50000  110.70000
   78    82    84    37.50000  110.70000
   78    82    88    58.35000  112.70000
   80    78    79    33.00000  107.80000
   82    78    79    37.50000  110.70000
   82    78    80    37.50000  110.70000
   82    88    89    37.50000  110.70000
   82    88    90    37.50000  110.70000
   84    82    83    33.00000  107.80000
   88    60    61    35.00000  109.50000
   88    60    66    75.00000  113.01200
   88    82    83    37.50000  110.70000
   88    82    84    37.50000  110.70000
   90    88    89    33.00000  107.80000
   38    33    37    90.00000  110.39200
   38    33    56    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
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
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   52    60    88    82   0.47100  1.0 1.0
   52    60    88    89   0.15000  1.0 3.0
   52    60    88    90   0.15000  1.0 3.0
   53    52    60    61   0.13050  1.0 3.0
   53    52    60    66   0.15000  1.0 3.0
   53    52    60    88   0.15000  1.0 3.0
   54    52    60    61   0.13050  1.0 3.0
   54    52    60    66   0.15000  1.0 3.0
   54    52    60    88   0.15000  1.0 3.0
   60    66    78    79   0.19200  1.0 3.0
   60    66    78    80   0.19200  1.0 3.0
   60    66   -78    82   1.36600  1.0 1.0
   60    66   -78    82  -0.11450 -1.0 2.0
   60    66   -78    82   0.24250  1.0 3.0
   61    60    66    67   0.13050  1.0 3.0
   61    60    66    68   0.13050  1.0 3.0
   61    60    66    78   0.17350  1.0 3.0
   61    60    88    82   0.17350  1.0 3.0
   61    60    88    89   0.13050  1.0 3.0
   61    60    88    90   0.13050  1.0 3.0
   66    60   -88    82   0.47100  1.0 1.0
   66    60    88    89   0.15000  1.0 3.0
   66    60    88    90   0.15000  1.0 3.0
   66    78    82    83   0.15000  1.0 3.0
   66    78    82    84   0.15000  1.0 3.0
   66    78   -82    88   0.56750  1.0 1.0
   66    78   -82    88  -0.07550 -1.0 2.0
   66    78   -82    88   0.20000  1.0 3.0
   67    66    78    79   0.15000  1.0 3.0
   67    66    78    80   0.15000  1.0 3.0
   67    66    78    82   0.15000  1.0 3.0
   68    66    78    79   0.15000  1.0 3.0
   68    66    78    80   0.15000  1.0 3.0
   68    66    78    82   0.15000  1.0 3.0
   78    82   -88    60   1.36600  1.0 1.0
   78    82   -88    60  -0.11450 -1.0 2.0
   78    82   -88    60   0.24250  1.0 3.0
   78    82    88    89   0.15000  1.0 3.0
   78    82    88    90   0.15000  1.0 3.0
   79    78    82    83   0.15000  1.0 3.0
   79    78    82    84   0.15000  1.0 3.0
   79    78    82    88   0.15000  1.0 3.0
   80    78    82    83   0.15000  1.0 3.0
   80    78    82    84   0.15000  1.0 3.0
   80    78    82    88   0.15000  1.0 3.0
   83    82    88    60   0.19200  1.0 3.0
   83    82    88    89   0.15000  1.0 3.0
   83    82    88    90   0.15000  1.0 3.0
   84    82    88    60   0.19200  1.0 3.0
   84    82    88    89   0.15000  1.0 3.0
   84    82    88    90   0.15000  1.0 3.0
   88    60    66    67   0.15000  1.0 3.0
   88    60    66    68   0.15000  1.0 3.0
   88    60   -66    78   0.47100  1.0 1.0
   38    33    37    40   0.67800  1.0 1.0
   38    33    37    40   0.47050 -1.0 2.0
   38    33    37    40  -0.62500  1.0 3.0
   38    33    37    42   0.09700  1.0 1.0
   38    33    37    42   0.15600 -1.0 2.0
   38    33    37    42  -0.50800  1.0 3.0
   38    33    56    48   0.86500  1.0 1.0
   38    33    56    48  -0.17500 -1.0 2.0
   38    33    56    48   0.20800  1.0 3.0
   38    33    56    57   0.23400  1.0 3.0
   38    33    56    64   1.69300  1.0 1.0
   38    33    56    64  -0.48450 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   33    42    37    40   1.10000 -1.0 2.0
   44    41    40    37   1.10000 -1.0 2.0
   44    58    47    55   1.10000 -1.0 2.0
   62    93    55    47   1.10000 -1.0 2.0
   55    69    62    63  10.50000 -1.0 2.0
   81   106    69    62   4.00000 -1.0 2.0
   85    87    81    69   4.00000 -1.0 2.0
   91    86    85    81   1.10000 -1.0 2.0
  101    92    91    85   1.10000 -1.0 2.0
  106   102   101    91   1.10000 -1.0 2.0
  101   107   106    69   4.00000 -1.0 2.0
   37    45    42    43  10.50000 -1.0 2.0
   46    42    45    52   1.00000 -1.0 2.0
END
