* LIGAND DATABASE FILE (OPLS2005)
*
001     116   119    215    337     637
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02120   104.17999   -35.63980
    3     1 S   H    _H1_     3     1.02057    69.24897    69.31246
    4     1 S   H    _H2_     4     1.02147    43.87689  -137.95701
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.05972   107.41041    47.01581
    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     1.34015   114.76575   162.47883
   19    18 S   H    _HN2    19     1.04748   118.84952     8.59078
   20    18 S   CT1  _CA2    20     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    21     1.08457   106.27517   -11.11459
   22    20 S   C    _C2_    22     1.54037   112.60135  -130.27230
   23    22 S   O    _O2_    23     1.23085   119.01196  -169.64989
   24    20 S   CT   _CB2    32     1.54652   109.46586   105.32505
   25    24 S   HC   HB21    33     1.08519   110.61667    58.77943
   26    24 S   HC   HB22    34     1.08612   109.94660   179.13182
   27    22 S   N    _N3_    24     1.34263   118.97450    10.45203
   28    27 S   H    _HN3    25     1.03492   120.05970     5.06895
   29    24 S   S    _SG2    35     1.81647   112.43692   -61.22030
   30    27 S   CT   _CA3    26     1.46098   124.53040  -172.10347
   31    30 S   HC   HA31    27     1.12298   109.15732    14.31073
   32    30 S   HC   HA32    28     1.12301   109.23063   127.81991
   33    29 S   CT   _C22    36     1.84831    97.33872   161.86543
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   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   _C12    37     1.51547   109.49644   -60.01568
   38    33 S   OH   _O41   115     1.43235   110.30451  -176.34280
   39    38 S   HO   _H81   116     0.96757   106.15512   178.50093
   40    37 S   CMA  _C13    38     1.35921   126.40573   127.50779
   41    40 S   OM   _O35    39     1.26831   129.66416   177.41517
   42    37 S   C    _C15   110     1.48742   116.38242   -56.82719
   43    42 S   O    _O37   111     1.21763   120.82345   -56.11008
   44    40 S   CT   _C23    40     1.56790   118.88082     1.08805
   45    42 S   N    _N30   112     1.36636   112.59725   123.97752
   46    45 S   H    _H75   113     1.01437   118.28525    -0.08156
   47    45 S   H    _H76   114     1.01546   123.46206  -179.98022
   48    44 S   CM   _C14    41     1.53954   113.80709  -103.91476
   49    44 S   CT   _C20    93     1.56196   111.43587    22.01288
   50    49 S   HC   _H50    94     1.10227   108.33182    65.88369
   51    44 S   OH   _O42   108     1.44793   109.22376   137.44899
   52    51 S   HO   _H82   109     0.96395   105.26809    59.92929
   53    48 S   CM   _C11    42     1.35129   122.24678   152.53750
   54    33 S   CT   _C21    95     1.55168   107.90972    64.26090
   55    54 S   HC   _H51    96     1.09653   109.04040   -40.38747
   56    48 S   OH   _O40   106     1.38369   114.58133   -27.04838
   57    56 S   HO   _H80   107     0.96116   109.57996   179.60634
   58    53 S   CO4  _C10    43     1.50017   121.23511   179.46881
   59    58 S   O    _O36    44     1.22514   122.50400   -24.09057
   60    54 S   NTH0 _N34    97     1.46889   111.28450    77.88817
   61    58 S   CA   _C5_    45     1.48548   117.09923   156.69603
   62    60 S   CT   _C29    98     1.46016   110.22312    83.20486
   63    62 S   HC   _H67    99     1.09284   110.07454   179.96044
   64    62 S   HC   _H68   100     1.09271   110.19596    59.98507
   65    62 S   HC   _H69   101     1.09335   110.17563   -60.05543
   66    60 S   CT   _C30   102     1.46010   110.21158   -39.34853
   67    66 S   HC   _H70   103     1.09316   110.12873  -179.95577
   68    66 S   HC   _H71   104     1.09353   110.21444    60.03499
   69    66 S   HC   _H72   105     1.09277   110.26566   -59.94648
   70    61 S   CA   _C6_    46     1.40308   120.82731    -2.89022
   71    70 S   CA   _C7_    47     1.40181   119.21455  -177.94491
   72    70 S   CT   _C17    85     1.50683   121.15310    -0.10087
   73    72 S   HC   _H45    86     1.09673   110.40358   148.95685
   74    72 S   HC   _H46    87     1.09505   107.96331   -93.60044
   75    71 S   CA   _C4_    48     1.39471   120.54123    -1.18597
   76    75 S   HA   _H44    49     1.08780   120.07387  -179.77883
   77    71 S   NE   _N33    76     1.41484   121.38906   178.29808
   78    53 S   CT   _C19    88     1.50912   123.86130     1.05758
   79    78 S   HC   _H49    89     1.10109   107.00279   116.15710
   80    75 S   CA   _C8_    50     1.39378   119.98752     0.46562
   81    77 S   CT   _C27    77     1.44740   120.23720   -89.48570
   82    81 S   HC   _H61    78     1.09272   110.09717   179.96044
   83    81 S   HC   _H62    79     1.09359   110.25917    60.00509
   84    81 S   HC   _H63    80     1.09287   110.21946   -60.02454
   85    77 S   CT   _C28    81     1.44616   120.28887    89.81170
   86    85 S   HC   _H64    82     1.09341   110.13223   180.00000
   87    85 S   HC   _H65    83     1.09403   110.21603    60.00601
   88    85 S   HC   _H66    84     1.09305   110.27363   -59.94385
   89    78 S   CT   _C18    90     1.53766   114.51949    -1.05573
   90    89 S   HC   _H47    91     1.09971   107.45391    92.35095
   91    89 S   HC   _H48    92     1.09618   110.91243  -154.34068
   92    61 S   CA   _C9_    51     1.40110   119.08234   177.97011
   93    80 S   N    _N31    54     1.39722   119.02606  -179.97202
   94    93 S   H    _H77    55     1.02577   116.07524   179.96044
   95    92 S   OH   _O39    52     1.36550   121.98661    -1.24678
   96    95 S   HO   _H79    53     0.96933   109.99677    -0.07913
   97    93 S   C    _C16    56     1.40330   128.17861     0.06256
   98    97 S   O    _O38    57     1.22692   126.70063     0.50860
   99    97 S   CT1  _C31    58     1.51617   111.04801   180.00000
  100    99 S   HC   _H73    59     1.09463   109.75495    59.94869
  101    99 S   HC   _H74    60     1.09439   108.96914   -59.10364
  102    99 S   NT   _N32    61     1.44050   109.90918  -179.55194
  103   102 S   H    _H78    62     1.02532   110.09606   -59.96810
  104   102 S   CT   _C32    63     1.46209   111.56866   179.54072
  105   104 S   CT   _C24    64     1.53304   109.33705  -178.65550
  106   105 S   HC   _H52    65     1.09546   111.18614   -60.33632
  107   105 S   HC   _H53    66     1.09552   111.28262    59.99277
  108   105 S   HC   _H54    67     1.09614   111.08171  -179.71607
  109   104 S   CT   _C25    68     1.53244   109.07791   -58.55186
  110   109 S   HC   _H55    69     1.09616   111.15904    60.22062
  111   109 S   HC   _H56    70     1.09572   111.13289   -59.06879
  112   109 S   HC   _H57    71     1.09573   111.35565  -179.40455
  113   104 S   CT   _C26    72     1.53362   109.27459    61.42561
  114   113 S   HC   _H58    73     1.09547   111.16487   -60.20597
  115   113 S   HC   _H59    74     1.09589   111.30740    60.17445
  116   113 S   HC   _H60    75     1.09662   111.17062  -179.57342
  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
  17   2   1   1  16   7   1  14   5   6   3  16   2   1   1  15
  16   8   5   1  15  14   4   3   1  11   4   9  13   7   3   2
   1   3   2   1   1  15  18  10   4   3  10   4   9   4   3   8
   7   3   2   1   3   2   1   1   2   1   1   5   8   3   1   1
   7   4   8   4   3  14   4  12  11   4   3   2   7   3   2   1
   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    54    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    49    54    55    60    42    38    39  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    41    44    89    49    50    54    55    60    62    66    42    43    45    38    39  
   35    36  
   36  
    0  
   40    41    44    48    49    54    55    60    51    42    43    45    46    47    38    39  
   39    40    42    49    54    55    60  
   54  
   41    44    48    53    89    49    50    54    56    51    52    42    43    45  
   44    48    49    51    42  
   43    45    46    47    44    54  
   45    46    47  
   48    53    58    78    89    90    91    49    50    54    55    60    56    57    51    52  
   46    47  
   47  
    0  
   53    58    59    61    72    78    79    89    49    50    54    56    57    51    52  
   50    54    55    60    62    66    56    51    52    53    72    78    79    89    90    91  
   54    55    60    51    78    89    90    91  
   52    53    54    56    89  
    0  
   58    59    61    70    92    72    73    74    78    79    89    90    91    56    57  
   55    60    62    63    64    65    66    67    68    69    78    89    90    91  
   60    62    66    89  
   57    58    78  
    0  
   59    61    70    71    80    92    95    72    78    79    89  
   61    70    92    78  
   62    63    64    65    66    67    68    69    89  
   70    71    75    80    92    95    96    93    77    72    73    74    78  
   63    64    65    66    67    68    69  
   64    65    66  
   65    66  
   66  
   67    68    69  
   68    69  
   69  
    0  
   71    75    76    80    92    95    77    81    85    72    73    74    78    79    89  
   75    76    80    92    93    77    81    82    83    84    85    86    87    88    72    73    74    78  
   73    74    78    79    89    90    91    75    77    92  
   74    78    79    89  
   78    79    89  
   76    80    92    95    93    94    97    77    81    85  
   80    92    93    77  
   81    82    83    84    85    86    87    88    80  
   79    89    90    91  
   89    90    91  
   92    95    96    93    94    97    98    99  
   82    83    84    85    86    87    88  
   83    84    85  
   84    85  
   85  
   86    87    88  
   87    88  
   88  
    0  
   90    91  
   91  
    0  
   95    96    93    94    97  
   94    97    98    99   100   101   102    95  
   97    98    99  
   96  
    0  
   98    99   100   101   102   103   104  
   99   100   101   102  
  100   101   102   103   104   105   109   113  
  101   102   103   104  
  102   103   104  
  103   104   105   106   107   108   109   110   111   112   113   114   115   116  
  104   105   109   113  
  105   106   107   108   109   110   111   112   113   114   115   116  
  106   107   108   109   110   111   112   113   114   115   116  
  107   108   109   113  
  108   109   113  
  109   113  
  110   111   112   113   114   115   116  
  111   112   113  
  112   113  
  113  
  114   115   116  
  115   116  
  116  
    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   1.8100   1.6000   0.001000000  -1.480495490
   44   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   45   3.2500   0.1700  -0.760000   1.8100   1.6000   0.054801302  -1.445846770
   46   0.5000   0.0300   0.380000   1.5900   1.4000   0.030040813  -0.651083722
   47   0.5000   0.0300   0.380000   1.5900   1.4000   0.030040813  -0.651083722
   48   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   49   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   52   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   53   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   54   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   57   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   58   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   59   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   60   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
   61   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   62   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   71   3.5500   0.0700   0.210000   2.5000   1.7750   0.001000000  -0.843144165
   72   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   76   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   77   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
   78   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   81   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   86   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   93   3.2500   0.1700  -0.385000   1.8100   1.6000   0.054801302  -1.445846770
   94   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   95   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   96   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   97   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   98   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   99   3.5000   0.0660   0.002500   1.9750   1.7500   0.005000000  -0.741685710
  100   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  101   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  102   3.3000   0.1700  -0.702500   1.8650   1.6500   0.051222218  -2.220205820
  103   0.5000   0.0300   0.380000   0.9960   0.8600   0.030040813  -0.651083722
  104   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
  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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  110   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  112   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  113   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  114   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  115   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  116   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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    54   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    48   317.000  1.510
   44    49   268.000  1.529
   44    51   320.000  1.410
   48    53   549.000  1.340
   48    56   510.000  1.338
   53    58   320.000  1.462
   53    78   317.000  1.510
   58    59   570.000  1.229
   58    61   310.000  1.470
   61    70   469.000  1.400
   61    92   469.000  1.400
   70    71   469.000  1.400
   70    72   317.000  1.510
   71    75   469.000  1.400
   71    77   481.000  1.340
   75    76   367.000  1.080
   75    80   469.000  1.400
   80    92   469.000  1.400
   80    93   360.000  1.404
   92    95   450.000  1.364
   95    96   553.000  0.945
   93    94   434.000  1.010
   93    97   490.000  1.335
   97    98   570.000  1.229
   97    99   317.000  1.522
   99   100   340.000  1.090
   99   101   340.000  1.090
   99   102   305.000  1.457
  102   103   434.000  1.010
  102   104   382.000  1.448
  104   105   268.000  1.529
  104   109   268.000  1.529
  104   113   268.000  1.529
  105   106   340.000  1.090
  105   107   340.000  1.090
  105   108   340.000  1.090
  109   110   340.000  1.090
  109   111   340.000  1.090
  109   112   340.000  1.090
  113   114   340.000  1.090
  113   115   340.000  1.090
  113   116   340.000  1.090
   77    81   382.000  1.448
   77    85   382.000  1.448
   81    82   340.000  1.090
   81    83   340.000  1.090
   81    84   340.000  1.090
   85    86   340.000  1.090
   85    87   340.000  1.090
   85    88   340.000  1.090
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    78   268.000  1.529
   78    79   340.000  1.090
   78    89   268.000  1.529
   89    90   340.000  1.090
   89    91   340.000  1.090
   89    49   268.000  1.529
   49    50   340.000  1.090
   49    54   268.000  1.529
   54    55   340.000  1.090
   54    60   310.000  1.447
   60    62   310.000  1.447
   60    66   310.000  1.447
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   340.000  1.090
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    69   340.000  1.090
   56    57   553.000  0.945
   51    52   553.000  0.945
   42    43   570.000  1.229
   42    45   490.000  1.335
   45    46   434.000  1.010
   45    47   434.000  1.010
   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    54    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    54    49    58.35000  112.70000
   33    54    55    37.50000  110.70000
   33    54    60    75.00000  113.73300
   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    48    70.00000  110.12100
   40    44    49    70.00000  112.02700
   40    44    51    90.00000  110.39200
   44    40    41    85.00000  112.85300
   44    48    53    70.00000  124.00000
   44    48    56    90.00000  109.34000
   44    49    89    58.35000  112.70000
   44    49    50    37.50000  110.70000
   44    49    54    58.35000  112.70000
   44    51    52    55.00000  108.50000
   48    53    58    65.00000  118.96000
   48    53    78    70.00000  124.00000
   48    56    57    70.00000  107.45700
   53    58    59    80.00000  123.72100
   53    58    61    65.00000  117.02400
   53    78    72    70.00000  112.02700
   53    78    79    35.00000  109.50000
   53    78    89    70.00000  112.02700
   58    61    70    60.00000  119.52600
   58    61    92    60.00000  119.52600
   61    58    59    75.00000  123.78400
   61    70    71    63.00000  120.00000
   61    70    72    70.00000  120.00000
   61    92    80    63.00000  120.00000
   61    92    95    70.00000  120.00000
   70    71    75    63.00000  120.00000
   70    71    77    70.00000  120.10000
   70    72    73    35.00000  109.50000
   70    72    74    35.00000  109.50000
   70    72    78    70.00000  112.17500
   71    75    76    35.00000  120.00000
   71    75    80    63.00000  120.00000
   71    77    81    50.00000  120.00000
   71    77    85    50.00000  120.00000
   75    80    92    63.00000  120.00000
   75    80    93    70.00000  119.01900
   80    75    76    35.00000  120.00000
   80    92    95    70.00000  120.00000
   80    93    94    45.00000  118.23600
   80    93    97    65.00000  121.96500
   92    61    70    63.00000  120.00000
   92    95    96    35.00000  113.00000
   93    80    92    70.00000  119.01900
   93    97    98    80.00000  122.90000
   93    97    99    70.00000  116.60000
   97    93    94    35.00000  119.80000
   97    99   100    35.00000  109.50000
   97    99   101    35.00000  109.50000
   97    99   102    75.00000  111.54000
   99    97    98    80.00000  120.40000
   99   102   103    50.00000  111.55300
   99   102   104    51.80000  107.20000
  101    99   100    33.00000  107.80000
  102    99   100    50.00000  109.55000
  102    99   101    50.00000  109.55000
  102   104   105    56.20000  109.47000
  102   104   109    56.20000  109.47000
  102   104   113    56.20000  109.47000
  104   102   103    35.00000  109.50000
  104   105   106    37.50000  110.70000
  104   105   107    37.50000  110.70000
  104   105   108    37.50000  110.70000
  104   109   110    37.50000  110.70000
  104   109   111    37.50000  110.70000
  104   109   112    37.50000  110.70000
  104   113   114    37.50000  110.70000
  104   113   115    37.50000  110.70000
  104   113   116    37.50000  110.70000
  107   105   106    33.00000  107.80000
  108   105   106    33.00000  107.80000
  108   105   107    33.00000  107.80000
  109   104   105    58.35000  112.70000
  111   109   110    33.00000  107.80000
  112   109   110    33.00000  107.80000
  112   109   111    33.00000  107.80000
  113   104   105    58.35000  112.70000
  113   104   109    58.35000  112.70000
  115   113   114    33.00000  107.80000
  116   113   114    33.00000  107.80000
  116   113   115    33.00000  107.80000
   77    71    75    70.00000  120.10000
   77    81    82    35.00000  109.50000
   77    81    83    35.00000  109.50000
   77    81    84    35.00000  109.50000
   77    85    86    35.00000  109.50000
   77    85    87    35.00000  109.50000
   77    85    88    35.00000  109.50000
   83    81    82    33.00000  107.80000
   84    81    82    33.00000  107.80000
   84    81    83    33.00000  107.80000
   85    77    81    50.00000  115.00000
   87    85    86    33.00000  107.80000
   88    85    86    33.00000  107.80000
   88    85    87    33.00000  107.80000
   72    70    71    70.00000  120.00000
   72    78    79    37.50000  110.70000
   72    78    89    58.35000  112.70000
   74    72    73    33.00000  107.80000
   78    53    58    65.00000  116.34900
   78    72    73    37.50000  110.70000
   78    72    74    37.50000  110.70000
   78    89    90    37.50000  110.70000
   78    89    91    37.50000  110.70000
   78    89    49    58.35000  112.70000
   89    78    79    37.50000  110.70000
   89    49    50    37.50000  110.70000
   89    49    54    58.35000  112.70000
   91    89    90    33.00000  107.80000
   49    44    48    70.00000  112.02700
   49    89    90    37.50000  110.70000
   49    89    91    37.50000  110.70000
   49    54    55    37.50000  110.70000
   49    54    60    75.00000  113.73300
   54    33    37    70.00000  112.02700
   54    49    50    37.50000  110.70000
   54    60    62    80.00000  110.40700
   54    60    66    80.00000  110.40700
   60    54    55    50.00000  110.15500
   60    62    63    50.00000  110.15500
   60    62    64    50.00000  110.15500
   60    62    65    50.00000  110.15500
   60    66    67    50.00000  110.15500
   60    66    68    50.00000  110.15500
   60    66    69    50.00000  110.15500
   64    62    63    33.00000  107.80000
   65    62    63    33.00000  107.80000
   65    62    64    33.00000  107.80000
   66    60    62    80.00000  110.40700
   68    66    67    33.00000  107.80000
   69    66    67    33.00000  107.80000
   69    66    68    33.00000  107.80000
   56    48    53    80.00000  121.38400
   51    44    48    90.00000  110.39200
   51    44    49    50.00000  109.50000
   42    37    40    60.00000  120.04000
   42    45    46    35.00000  119.80000
   42    45    47    35.00000  119.80000
   45    42    43    80.00000  122.90000
   47    45    46    35.00000  120.00000
   38    33    37    90.00000  110.39200
   38    33    54    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
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   78    89   -49    44   0.56750  1.0 1.0
   78    89   -49    44  -0.07550 -1.0 2.0
   78    89   -49    44   0.20000  1.0 3.0
   78    89    49    50   0.15000  1.0 3.0
   78    89    49    54   0.56750  1.0 1.0
   78    89    49    54  -0.07550 -1.0 2.0
   78    89    49    54   0.20000  1.0 3.0
   79    78    89    90   0.15000  1.0 3.0
   79    78    89    91   0.15000  1.0 3.0
   79    78    89    49   0.15000  1.0 3.0
   89    49    54    33   0.56750  1.0 1.0
   89    49    54    33  -0.07550 -1.0 2.0
   89    49    54    33   0.20000  1.0 3.0
   89    49    54    55   0.15000  1.0 3.0
   89    49    54    60   1.85550  1.0 1.0
   89    49    54    60  -0.84100 -1.0 2.0
   90    89    49    44   0.15000  1.0 3.0
   90    89    49    50   0.15000  1.0 3.0
   90    89    49    54   0.15000  1.0 3.0
   91    89    49    44   0.15000  1.0 3.0
   91    89    49    50   0.15000  1.0 3.0
   91    89    49    54   0.15000  1.0 3.0
   49    44   -48    53   0.09850  1.0 1.0
   49    44   -48    53   0.15250 -1.0 2.0
   49    44   -48    53  -0.50650  1.0 3.0
   49    44    48    56   0.09700  1.0 1.0
   49    44    48    56   0.15600 -1.0 2.0
   49    44    48    56  -0.50800  1.0 3.0
   49    44    51    52  -0.11600  1.0 1.0
   49    44    51    52  -0.09450 -1.0 2.0
   49    44    51    52   0.21250  1.0 3.0
   49    54    60    62   1.99000  1.0 1.0
   49    54    60    62   0.18800 -1.0 2.0
   49    54    60    62   0.81350  1.0 3.0
   49    54    60    66   1.99000  1.0 1.0
   49    54    60    66   0.18800 -1.0 2.0
   49    54    60    66   0.81350  1.0 3.0
   50    49    54    33   0.15000  1.0 3.0
   50    49    54    55   0.15000  1.0 3.0
   50    49    54    60   0.15000  1.0 3.0
   54    33   -37    40   0.09850  1.0 1.0
   54    33   -37    40   0.15250 -1.0 2.0
   54    33   -37    40  -0.50650  1.0 3.0
   54    33    37    42   0.09700  1.0 1.0
   54    33    37    42   0.15600 -1.0 2.0
   54    33    37    42  -0.50800  1.0 3.0
   54    33    38    39  -0.11600  1.0 1.0
   54    33    38    39  -0.09450 -1.0 2.0
   54    33    38    39   0.21250  1.0 3.0
   54    60    62    63   0.28000  1.0 3.0
   54    60    62    64   0.28000  1.0 3.0
   54    60    62    65   0.28000  1.0 3.0
   54    60    66    67   0.28000  1.0 3.0
   54    60    66    68   0.28000  1.0 3.0
   54    60    66    69   0.28000  1.0 3.0
   55    54    60    62   0.28000  1.0 3.0
   55    54    60    66   0.28000  1.0 3.0
   62    60    66    67   0.28000  1.0 3.0
   62    60    66    68   0.28000  1.0 3.0
   62    60    66    69   0.28000  1.0 3.0
   66    60    62    63   0.28000  1.0 3.0
   66    60    62    64   0.28000  1.0 3.0
   66    60    62    65   0.28000  1.0 3.0
   56    48    53    58   7.00000 -1.0 2.0
   56    48    53    78   7.00000 -1.0 2.0
   51    44    48    53   0.67800  1.0 1.0
   51    44    48    53   0.47050 -1.0 2.0
   51    44    48    53  -0.62500  1.0 3.0
   51    44    48    56   0.09700  1.0 1.0
   51    44    48    56   0.15600 -1.0 2.0
   51    44    48    56  -0.50800  1.0 3.0
   51    44    49    89   0.86500  1.0 1.0
   51    44    49    89  -0.17500 -1.0 2.0
   51    44    49    89   0.20800  1.0 3.0
   51    44    49    50   0.23400  1.0 3.0
   51    44    49    54   0.86500  1.0 1.0
   51    44    49    54  -0.17500 -1.0 2.0
   51    44    49    54   0.20800  1.0 3.0
   42    37    40    41   7.00000 -1.0 2.0
   42    37    40    44   7.00000 -1.0 2.0
   43    42    45    46   2.45000 -1.0 2.0
   43    42    45    47   2.45000 -1.0 2.0
   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    54    49   0.86500  1.0 1.0
   38    33    54    49  -0.17500 -1.0 2.0
   38    33    54    49   0.20800  1.0 3.0
   38    33    54    55   0.23400  1.0 3.0
   38    33    54    60   3.18500  1.0 1.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    34    35  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    56    48    53   1.10000 -1.0 2.0
   58    78    53    48   1.10000 -1.0 2.0
   53    61    58    59  10.50000 -1.0 2.0
   70    92    61    58   4.00000 -1.0 2.0
   71    72    70    61   4.00000 -1.0 2.0
   75    77    71    70   4.00000 -1.0 2.0
   80    76    75    71   1.10000 -1.0 2.0
   92    93    80    75   4.00000 -1.0 2.0
   80    95    92    61   4.00000 -1.0 2.0
   94    97    93    80   1.00000 -1.0 2.0
   93    99    97    98  10.50000 -1.0 2.0
   85    71    77    81   1.00000 -1.0 2.0
   37    45    42    43  10.50000 -1.0 2.0
   47    42    45    46   1.00000 -1.0 2.0
END
