* LIGAND DATABASE FILE (OPLS2005)
*
001     116   117    210    308     612
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02084   101.88452   -44.03494
    3     1 S   H    _H1_     3     1.02074    74.59797    62.35961
    4     1 S   H    _H2_     4     1.02072    39.67442  -149.06610
    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     1.08519   110.61667    58.74867
   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   _C23    36     1.84568    97.34310  -158.13933
   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   CO4  _C25    37     1.53148   108.98258    60.00960
   38    37 S   O    _O35    38     1.23134   123.10175    20.94395
   39    33 S   CT   _C24    80     1.55896   110.26799  -177.36277
   40    39 S   HC   _H21    81     1.09769   107.04995   156.90809
   41    39 S   HC   _H22    82     1.09975   110.22371    43.59225
   42    37 S   CM   _C19    39     1.50217   117.54121  -163.17025
   43    42 S   CM   _C20    40     1.33773   119.30519    21.07194
   44    43 S   HC   _H20    41     1.08275   123.03155  -178.35956
   45    42 S   N    _N4_    51     1.38179   114.56552  -157.30976
   46    45 S   H    _H19    52     1.01841   115.74777    -4.46116
   47    43 S   CO4  _C21    42     1.48570   122.27891     1.96264
   48    47 S   O    _O34    43     1.22989   119.26023  -176.00169
   49    45 S   C    _C18    53     1.38798   128.47427   175.58501
   50    49 S   O    _O33    54     1.22735   127.37739     4.98881
   51    33 S   CT   _C22    44     1.54153   106.30773   -55.74449
   52    51 S   HC   _H9_    45     1.09971   111.53811    51.23751
   53    49 S   CM   _C17    55     1.50225   113.40300  -177.18638
   54    51 S   OS   _O36    46     1.42005   111.13676   -70.00354
   55    53 S   CM   _C16    56     1.34630   118.21885    47.94547
   56    55 S   HC   _H18    57     1.08731   120.26885    -2.80659
   57    53 S   CT   _C27   113     1.49865   115.20817  -133.20507
   58    57 S   HC   _H26   114     1.08866   109.49567   -88.70259
   59    57 S   HC   _H27   115     1.08840   109.60296   151.17357
   60    57 S   HC   _H28   116     1.08800   109.56637    31.41463
   61    54 S   CT   _C26    47     1.42128   111.54887   157.65273
   62    61 S   HC   _H23    48     1.09325   109.50619   180.00000
   63    61 S   HC   _H24    49     1.09244   109.51305    59.24842
   64    61 S   HC   _H25    50     1.09246   109.02869   -60.38017
   65    55 S   CM   _C15    58     1.44085   126.74992   179.81548
   66    65 S   HC   _H17    59     1.08918   113.58367   112.24780
   67    65 S   CM   _C14    60     1.34040   128.92643   -69.01495
   68    67 S   HC   _H16    61     1.09191   114.99710   178.48638
   69    67 S   CT   _C13    62     1.50717   132.18528    -2.97809
   70    69 S   HC   _H8_    63     1.09977   106.92867  -151.66233
   71    69 S   CT   _C12    64     1.54472   120.60429   -28.81244
   72    71 S   HC   _H7_    65     1.09727   109.46639    75.68914
   73    69 S   OS   _O37   108     1.43417   107.96743    95.28300
   74    71 S   CM   _C11    66     1.52033   116.35629   -51.10919
   75    71 S   OS   _O38   102     1.43685   107.56083  -170.30827
   76    73 S   CT   _C28   109     1.41740   111.08231    79.98324
   77    76 S   HC   _H29   110     1.09220   109.50271  -179.98022
   78    76 S   HC   _H30   111     1.09353   109.49600    59.27013
   79    76 S   HC   _H31   112     1.09211   109.01483   -60.38256
   80    74 S   CM   _C10    67     1.34901   119.39538   136.24562
   81    80 S   HC   _H15    68     1.09022   117.48287     1.01760
   82    74 S   CT   _C30    98     1.50496   116.76974   -46.47772
   83    82 S   HC   _H34    99     1.08607   109.21711   -87.15510
   84    82 S   HC   _H35   100     1.08615   109.26369   152.66363
   85    82 S   HC   _H36   101     1.08647   109.26860    32.99404
   86    75 S   CO4  _C29   103     1.36206   115.52689  -146.75550
   87    86 S   O    _O39   104     1.22700   125.52472     0.01978
   88    80 S   CT   _C9_    69     1.51785   127.68910  -178.75384
   89    88 S   HC   _H6_    70     1.09543   108.27236    25.18233
   90    86 S   N    _N5_   105     1.37360   110.19499  -180.00000
   91    90 S   H    _H32   106     1.01468   119.26320  -179.97202
   92    90 S   H    _H33   107     1.01401   121.34921     0.03426
   93    88 S   CT   _C8_    71     1.55727   109.82469   142.75135
   94    93 S   HC   _H5_    72     1.10530   106.70778   -45.80495
   95    88 S   CT   _C31    94     1.53247   108.87175   -92.69409
   96    95 S   HC   _H37    95     1.08675   109.58926   -62.32571
   97    95 S   HC   _H38    96     1.08699   109.51795   177.65740
   98    95 S   HC   _H39    97     1.08734   109.51356    57.69461
   99    93 S   CT   _C7_    73     1.54524   113.61127  -165.21844
  100    99 S   HC   _H4_    74     1.09804   109.24542   -51.75667
  101    93 S   OH   _O40    92     1.42666   110.33627    70.76715
  102   101 S   HO   _H40    93     0.96942   106.46499   -59.99382
  103    99 S   CT   _C6_    75     1.54393   114.44094  -170.87232
  104   103 S   HC   _H13    76     1.09783   108.44233   177.71073
  105   103 S   HC   _H14    77     1.09653   107.78967    63.95881
  106    99 S   OS   _O41    87     1.42359   108.76680    65.32255
  107   103 S   CT   _C5_    78     1.55493   115.17307   -60.12621
  108   107 S   HC   _H3_    79     1.09203   108.63572    21.27438
  109   106 S   CT   _C32    88     1.42007   111.46708  -153.78748
  110   109 S   HC   _H41    89     1.09179   109.58959  -179.98022
  111   109 S   HC   _H42    90     1.09287   109.49053    59.23036
  112   109 S   HC   _H43    91     1.09304   108.96425   -60.32441
  113   107 S   CT   _C4_    83     1.52953   110.18757   -96.02121
  114   113 S   HC   _H10    84     1.08762   109.72469   -61.86755
  115   113 S   HC   _H11    85     1.08768   109.71212   178.11810
  116   113 S   HC   _H12    86     1.08818   109.67966    58.14274
  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
  18   2   1   1  15   5  17   6   5  10   9   4   7   3   5   3
   9   3   7   2   9   4  10   4   4   2   1   1   3   2   1   1
   7   3   9   4  13   6  15   6   6  12   7   3   2   1   1  15
   5   4   2   1   1   4   3  13   8   2   1   1  15   7   5   2
   1   1  14   7   3   1  10   5   4   5   5   4   3   2   1   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    51    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    42    47    51    52    54   107    39    40    41  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    42    43    47    48    51    52    54    61    45   103   107   108    39    40    41   113  
   35    36  
   36  
    0  
   38    42    43    44    47    51    52    54    45    46    49   107    39    40    41  
   42    43    51    45    39  
   40    41   113   114   115   116    42    47    51    52    54    99   103   104   105   107   108  
   41   113    51   103   107   108  
  113    51   103   107   108  
   43    44    47    48    51    45    46    49    50    53  
   44    47    48    51    52    54    45    46    49  
   47    48    51    45  
   46    49    50    53    55    57    47  
   49    50    53  
   48    51    52    54    61  
   51    52    54  
   50    53    55    56    65    57    58    59    60  
   53    55    57  
   52    54    61    62    63    64   107  
   54    61  
   55    56    65    66    67    57    58    59    60  
   61    62    63    64  
   56    65    66    67    68    69    57    58    59    60  
   65    66    67    57  
   58    59    60    65  
   59    60  
   60  
    0  
   62    63    64  
   63    64  
   64  
    0  
   66    67    68    69    70    71    73  
   67    68    69  
   68    69    70    71    72    74    75    73    76  
   69    70    71    73  
   70    71    72    74    80    82    75    86    73    76    77    78    79  
   71    72    74    75    73    76  
   72    74    80    81    88    82    83    84    85    75    86    87    90    73    76  
   74    80    82    75    86    73  
   76    77    78    79    74    75  
   80    81    88    89    93    95    82    83    84    85    75    86  
   86    87    90    91    92    80    82  
   77    78    79  
   78    79  
   79  
    0  
   81    88    89    93    94    99   101    95    96    97    98    82    83    84    85  
   88    89    93    95    82  
   83    84    85    88  
   84    85  
   85  
    0  
   87    90    91    92  
   90    91    92  
   89    93    94    99   100   103   106   101   102    95    96    97    98  
   93    94    99   101    95    96    97    98  
   91    92  
   92  
    0  
   94    99   100   103   104   105   107   106   109   101   102    95    96    97    98  
   99   100   103   106   101   102    95  
   96    97    98    99   101  
   97    98  
   98  
    0  
  100   103   104   105   107   108   113   106   109   110   111   112   101   102  
  103   104   105   107   106   109   101  
  102   103   106  
    0  
  104   105   107   108   113   114   115   116   106   109  
  105   107   108   113   106  
  107   108   113   106  
  109   110   111   112   107  
  108   113   114   115   116  
  113   114   115   116  
  110   111   112  
  111   112  
  112  
    0  
  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   0.167500   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   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   39   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   0.051300   2.0020   1.7750   0.023028004  -0.852763146
   43   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   44   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   45   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
   46   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   47   3.7500   0.1050   0.422000   2.1120   1.8750   0.001000000  -0.126889456
   48   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   49   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
   50   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   51   3.5000   0.0660   0.218000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.4200   0.0150   0.030000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5500   0.0760  -0.056700   2.0020   1.7750   0.023028004  -0.852763146
   54   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   55   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   56   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   66   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5500   0.0760  -0.184000   2.0020   1.7750   0.023028004  -0.852763146
   68   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660   0.239000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5000   0.0660   0.289000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   73   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   74   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   75   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   76   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   77   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   78   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   79   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   80   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   81   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   82   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   3.7500   0.1050   0.632500   1.9250   1.7000   0.001000000  -0.126889456
   87   2.9600   0.2100  -0.497000   1.8100   1.6000   0.001000000  -1.480495490
   88   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   3.2500   0.1700  -0.883900   1.8100   1.6000   0.054801302  -1.445846770
   91   0.5000   0.0300   0.414200   1.5900   1.4000   0.030040813  -0.651083722
   92   0.5000   0.0300   0.414200   1.5900   1.4000   0.030040813  -0.651083722
   93   3.5000   0.0660   0.205000   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   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
  100   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  101   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  102   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  103   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  104   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
  107   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
  108   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  109   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
  110   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  111   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  112   2.5000   0.0300   0.030000   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  1.522
   33    51   268.000  1.529
   33    39   268.000  1.529
   37    38   570.000  1.229
   37    42   320.000  1.462
   42    43   549.000  1.340
   42    45   400.000  1.384
   43    44   340.000  1.080
   43    47   320.000  1.462
   47    48   570.000  1.229
   47    51   317.000  1.522
   51    52   340.000  1.090
   51    54   320.000  1.410
   54    61   320.000  1.410
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   340.000  1.090
   45    46   434.000  1.010
   45    49   490.000  1.335
   49    50   570.000  1.229
   49    53   410.000  1.444
   53    55   549.000  1.340
   53    57   317.000  1.510
   55    56   340.000  1.080
   55    65   380.000  1.444
   65    66   340.000  1.080
   65    67   549.000  1.340
   67    68   340.000  1.080
   67    69   317.000  1.510
   69    70   340.000  1.090
   69    71   268.000  1.529
   69    73   320.000  1.410
   71    72   340.000  1.090
   71    74   317.000  1.510
   71    75   320.000  1.410
   74    80   549.000  1.340
   74    82   317.000  1.510
   80    81   340.000  1.080
   80    88   317.000  1.510
   88    89   340.000  1.090
   88    93   268.000  1.529
   88    95   268.000  1.529
   93    94   340.000  1.090
   93    99   268.000  1.529
   93   101   320.000  1.410
   99   100   340.000  1.090
   99   103   268.000  1.529
   99   106   320.000  1.410
  103   104   340.000  1.090
  103   105   340.000  1.090
  103   107   268.000  1.529
  107   108   340.000  1.090
  107    39   268.000  1.529
  107   113   268.000  1.529
   39    40   340.000  1.090
   39    41   340.000  1.090
  113   114   340.000  1.090
  113   115   340.000  1.090
  113   116   340.000  1.090
  106   109   320.000  1.410
  109   110   340.000  1.090
  109   111   340.000  1.090
  109   112   340.000  1.090
  101   102   553.000  0.945
   95    96   340.000  1.090
   95    97   340.000  1.090
   95    98   340.000  1.090
   82    83   340.000  1.090
   82    84   340.000  1.090
   82    85   340.000  1.090
   75    86   214.000  1.327
   86    87   570.000  1.229
   86    90   435.000  1.380
   90    91   434.000  1.010
   90    92   434.000  1.010
   73    76   320.000  1.410
   76    77   340.000  1.090
   76    78   340.000  1.090
   76    79   340.000  1.090
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   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  110.18000
   29    33    51    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    80.00000  120.40000
   33    37    42    65.00000  118.62400
   33    51    47    63.00000  111.10000
   33    51    52    37.50000  110.70000
   33    51    54    50.00000  109.50000
   33    39   107    58.35000  112.70000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   37    42    43    65.00000  118.96000
   37    42    45    70.00000  117.92000
   42    37    38    80.00000  123.72100
   42    43    44    35.00000  120.00000
   42    43    47    65.00000  118.96000
   42    45    46    45.00000  117.55000
   42    45    49    70.00000  120.89900
   43    47    48    80.00000  123.72100
   43    47    51    65.00000  118.62400
   47    43    44    40.00000  117.72500
   47    51    52    35.00000  109.50000
   47    51    54    90.00000  108.74100
   51    33    37    63.00000  111.10000
   51    47    48    80.00000  120.40000
   51    54    61    60.00000  109.50000
   54    51    52    35.00000  109.50000
   54    61    62    35.00000  109.50000
   54    61    63    35.00000  109.50000
   54    61    64    35.00000  109.50000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
   45    42    43    75.00000  120.83300
   45    49    50    80.00000  122.90000
   45    49    53    80.00000  111.56200
   49    45    46    35.00000  119.80000
   49    53    55    70.00000  118.70000
   49    53    57    70.00000  119.70000
   53    49    50    80.00000  125.30000
   53    55    56    35.00000  120.00000
   53    55    65    70.00000  123.01800
   53    57    58    35.00000  109.50000
   53    57    59    35.00000  109.50000
   53    57    60    35.00000  109.50000
   55    65    66    35.00000  120.00000
   55    65    67    70.00000  123.01800
   65    55    56    35.00000  120.00000
   65    67    68    35.00000  120.00000
   65    67    69    70.00000  124.00000
   67    65    66    35.00000  120.00000
   67    69    70    35.00000  109.50000
   67    69    71    70.00000  112.02700
   67    69    73    85.00000  110.90400
   69    67    68    35.00000  117.00000
   69    71    72    37.50000  110.70000
   69    71    74    70.00000  112.02700
   69    71    75    50.00000  109.50000
   69    73    76    60.00000  109.50000
   71    69    70    37.50000  110.70000
   71    74    80    70.00000  124.00000
   71    74    82    65.00000  117.92700
   71    75    86    83.00000  116.90000
   74    71    72    35.00000  109.50000
   74    80    81    35.00000  120.00000
   74    80    88    70.00000  124.00000
   74    82    83    35.00000  109.50000
   74    82    84    35.00000  109.50000
   74    82    85    35.00000  109.50000
   80    88    89    35.00000  109.50000
   80    88    93    70.00000  112.02700
   80    88    95    70.00000  112.02700
   88    80    81    35.00000  117.00000
   88    93    94    37.50000  110.70000
   88    93    99    58.35000  112.70000
   88    93   101    50.00000  109.50000
   88    95    96    37.50000  110.70000
   88    95    97    37.50000  110.70000
   88    95    98    37.50000  110.70000
   93    88    89    37.50000  110.70000
   93    99   100    37.50000  110.70000
   93    99   103    58.35000  112.70000
   93    99   106    50.00000  109.50000
   93   101   102    55.00000  108.50000
   99    93    94    37.50000  110.70000
   99   103   104    37.50000  110.70000
   99   103   105    37.50000  110.70000
   99   103   107    58.35000  112.70000
   99   106   109    60.00000  109.50000
  103    99   100    37.50000  110.70000
  103   107   108    37.50000  110.70000
  103   107    39    58.35000  112.70000
  103   107   113    58.35000  112.70000
  105   103   104    33.00000  107.80000
  107   103   104    37.50000  110.70000
  107   103   105    37.50000  110.70000
  107    39    40    37.50000  110.70000
  107    39    41    37.50000  110.70000
  107   113   114    37.50000  110.70000
  107   113   115    37.50000  110.70000
  107   113   116    37.50000  110.70000
   39    33    37    63.00000  111.10000
   39    33    51    58.35000  112.70000
   39   107   108    37.50000  110.70000
   41    39    40    33.00000  107.80000
  113   107   108    37.50000  110.70000
  113   107    39    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
  106    99   100    35.00000  109.50000
  106    99   103    50.00000  109.50000
  106   109   110    35.00000  109.50000
  106   109   111    35.00000  109.50000
  106   109   112    35.00000  109.50000
  111   109   110    33.00000  107.80000
  112   109   110    33.00000  107.80000
  112   109   111    33.00000  107.80000
  101    93    94    35.00000  109.50000
  101    93    99    50.00000  109.50000
   95    88    89    37.50000  110.70000
   95    88    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
   82    74    80    70.00000  124.00000
   84    82    83    33.00000  107.80000
   85    82    83    33.00000  107.80000
   85    82    84    33.00000  107.80000
   75    71    72    35.00000  109.50000
   75    71    74    85.00000  110.90400
   75    86    87    83.00000  123.40000
   75    86    90   110.00000  108.75700
   86    90    91    50.00000  116.34900
   86    90    92    50.00000  116.34900
   90    86    87    85.00000  125.96000
   92    90    91    35.00000  120.00000
   73    69    70    35.00000  109.50000
   73    69    71    50.00000  109.50000
   73    76    77    35.00000  109.50000
   73    76    78    35.00000  109.50000
   73    76    79    35.00000  109.50000
   78    76    77    33.00000  107.80000
   79    76    77    33.00000  107.80000
   79    76    78    33.00000  107.80000
   57    53    55    70.00000  124.00000
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    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
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  106    99   103   107   0.62750  1.0 1.0
  106    99   103   107  -0.30950 -1.0 2.0
  106    99   103   107   0.27300  1.0 3.0
  101    93    99   100   0.23400  1.0 3.0
  101    93    99   103   0.86500  1.0 1.0
  101    93    99   103  -0.17500 -1.0 2.0
  101    93    99   103   0.20800  1.0 3.0
  101    93    99   106   3.69350  1.0 1.0
  101    93    99   106  -1.82950 -1.0 2.0
   95    88    93    94   0.15000  1.0 3.0
   95    88    93    99   0.56750  1.0 1.0
   95    88    93    99  -0.07550 -1.0 2.0
   95    88    93    99   0.20000  1.0 3.0
   95    88    93   101   0.86500  1.0 1.0
   95    88    93   101  -0.17500 -1.0 2.0
   95    88    93   101   0.20800  1.0 3.0
   82    74    80    81   7.00000 -1.0 2.0
   82    74    80    88   7.00000 -1.0 2.0
   75    71    74    80   0.39000  1.0 1.0
   75    71    74    80  -0.05800 -1.0 2.0
   75    71    74    80  -0.55150  1.0 3.0
   75    71    74    82   0.09700  1.0 1.0
   75    71    74    82   0.15600 -1.0 2.0
   75    71    74    82  -0.50800  1.0 3.0
   75    86    90    91   2.56700 -1.0 2.0
   75    86    90    92   2.56700 -1.0 2.0
   87    86    90    91   2.45000 -1.0 2.0
   87    86    90    92   2.45000 -1.0 2.0
   73    69    71    72   0.23400  1.0 3.0
   73    69    71    74   0.61850  1.0 1.0
   73    69    71    74  -0.22750 -1.0 2.0
   73    69    71    74   0.15300  1.0 3.0
   73    69    71    75   1.11900  1.0 1.0
   73    69    71    75  -1.16350 -1.0 2.0
   73    69    71    75  -0.34150  1.0 3.0
   57    53    55    56   7.00000 -1.0 2.0
   57    53    55    65   7.00000 -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    38  10.50000 -1.0 2.0
   37    45    42    43   1.10000 -1.0 2.0
   47    44    43    42   1.10000 -1.0 2.0
   43    51    47    48  10.50000 -1.0 2.0
   46    49    45    42   1.00000 -1.0 2.0
   45    53    49    50  10.50000 -1.0 2.0
   49    57    53    55   1.10000 -1.0 2.0
   65    56    55    53   1.10000 -1.0 2.0
   55    66    65    67   1.10000 -1.0 2.0
   69    68    67    65   1.10000 -1.0 2.0
   71    82    74    80   1.10000 -1.0 2.0
   88    81    80    74   1.10000 -1.0 2.0
   75    90    86    87  10.50000 -1.0 2.0
   92    86    90    91   1.00000 -1.0 2.0
END
