* LIGAND DATABASE FILE (OPLS2005)
*
001     111   114    208    330     619
    1     0 S   NP   _N1_     1    28.81260    95.50235   -19.25151
    2     1 S   H    _HN1     2     1.02959    93.34759    41.07419
    3     1 S   H    _H1_     3     1.02839    38.84819   154.32951
    4     1 S   H    _H2_     4     1.02782    78.51366   -66.95288
    5     1 S   CT   _CA1     5     1.50084   147.67370   179.38994
    6     5 S   HC   _HA1     6     1.09576   105.25371    42.59245
    7     5 S   CO3  _C1_     7     1.53721   112.47469   -77.63408
    8     7 S   O2Z  _O11     8     1.26334   115.02734   -43.51492
    9     7 S   O2Z  _O12     9     1.26239   114.89438   135.80483
   10     5 S   CT   _CB1    10     1.53079   107.46307   160.48893
   11    10 S   HC   HB11    11     1.09815   109.22864   -51.70375
   12    10 S   HC   HB12    12     1.09830   110.45492    64.82570
   13    10 S   CT   _CG1    13     1.52996   112.68703  -172.92443
   14    13 S   HC   HG11    14     1.09591   110.29022   -63.98430
   15    13 S   HC   HG12    15     1.09638   110.14224    55.22951
   16    13 S   C    _CD1    16     1.51771   112.28513   175.41332
   17    16 S   O    _OE1    17     1.22717   123.22315    -8.83869
   18    16 S   N    _N2_    18     1.38590   111.63173   171.71186
   19    18 S   H    _HN2    19     1.01593   119.01693     0.77582
   20    18 S   CT1  _CA2    20     1.46276   123.43909  -178.79277
   21    20 S   HC   _HA2    21     1.09735   109.33491   -16.48146
   22    20 S   C    _C2_    22     1.53425   108.19799  -132.14440
   23    22 S   O    _O2_    23     1.22998   122.30116  -145.70698
   24    20 S   CT   _CB2    32     1.53430   111.25224   105.73036
   25    24 S   HC   HB21    33     1.09433   109.47471    54.69610
   26    24 S   HC   HB22    34     1.09513   110.62758   172.99171
   27    22 S   N    _N3_    24     1.38530   113.29125    41.63545
   28    27 S   H    _HN3    25     1.01534   118.90377    -0.58215
   29    24 S   S    _SG2    35     1.83001   111.46080   -68.08812
   30    27 S   CT   _CA3    26     1.45464   123.53268   175.18505
   31    30 S   HC   HA31    27     1.09515   109.33631    22.08216
   32    30 S   HC   HA32    28     1.09497   107.08340   139.10693
   33    29 S   CT   _C25    36     1.89547   100.98577   149.68915
   34    30 S   CO3  _C3_    29     1.52927   113.10236  -101.46873
   35    34 S   O2Z  _O31    30     1.26406   115.41354   -43.78423
   36    34 S   O2Z  _O32    31     1.26357   114.97767   137.15927
   37    33 S   CT   _C15    37     1.56101   107.84779   -76.85155
   38    37 S   HC   _H3_    38     1.09901   108.91886    53.28803
   39    33 S   CT   _C24    93     1.57287   108.10644   160.98809
   40    33 S   OH   _O37   110     1.42977   105.88590    42.43172
   41    40 S   HO   _H23   111     0.97400   108.21645   179.59895
   42    37 S   CO4  _C14    39     1.53374   113.65928   167.22833
   43    42 S   O    _O35    40     1.22945   121.49555   -28.08190
   44    39 S   OH   _O38    94     1.44292   108.02353   -51.99012
   45    44 S   HO   _H24    95     0.97388   107.39367   -47.70575
   46    42 S   CA   _C12    41     1.49639   119.68030   155.76534
   47    46 S   CA   _C11    42     1.40712   119.85965    -2.85595
   48    47 S   CA   _C10    43     1.41946   119.78002  -179.82529
   49    47 S   CT   _C17    76     1.51041   120.52291     1.33721
   50    49 S   HC   _H19    77     1.09747   107.80398    93.88903
   51    49 S   HC   _H20    78     1.09638   110.75500  -149.09109
   52    48 S   CA   _C9_    44     1.40936   119.24143     1.43913
   53    52 S   HA   _H17    45     1.08428   117.80996  -179.34419
   54    48 S   NE   _N8_    67     1.40295   120.48845  -177.64782
   55    37 S   CT   _C16    79     1.53402   111.24807   -66.63220
   56    55 S   HC   _H4_    80     1.09733   109.52586    62.95610
   57    52 S   CA   _C8_    46     1.39354   121.45411    -1.01549
   58    54 S   CT   _C29    68     1.45607   117.74488  -129.85375
   59    58 S   HC   _H33    69     1.09545   109.99237   163.40909
   60    58 S   HC   _H34    70     1.09581   111.12939    44.90238
   61    58 S   HC   _H35    71     1.09520   111.57792   -76.98428
   62    54 S   CT   _C30    72     1.45780   115.01894    85.56489
   63    62 S   HC   _H36    73     1.09509   110.29573  -169.09297
   64    62 S   HC   _H37    74     1.09583   110.73777    71.42997
   65    62 S   HC   _H38    75     1.09482   111.85580   -49.61776
   66    55 S   CT   _C18    81     1.53523   111.89206   -55.34398
   67    66 S   HC   _H21    82     1.09817   108.86706   175.88234
   68    66 S   HC   _H22    83     1.09413   109.40218   -69.08808
   69    46 S   CA   _C13    47     1.40842   120.75342   177.82076
   70    57 S   N    _N5_    50     1.41753   123.88588  -179.67857
   71    70 S   H    _H16    51     1.01832   113.92427   179.10256
   72    66 S   CT   _C19    84     1.55148   113.07126    55.19487
   73    72 S   HC   _H5_    85     1.09560   105.30005    66.82215
   74    69 S   OH   _O34    48     1.37585   122.61069    -2.10059
   75    74 S   HO   _H18    49     0.97336   108.98522    -6.20229
   76    70 S   C    _C7_    52     1.38714   127.97462    -1.75435
   77    76 S   O    _O33    53     1.22786   127.58037    -1.30776
   78    72 S   CT   _C20    86     1.56813   110.40298  -177.12574
   79    78 S   HC   _H6_    87     1.10333   105.63581   -52.18719
   80    76 S   CT1  _C6_    54     1.51814   111.69776   179.61539
   81    80 S   HC   _H14    55     1.09529   107.80644    91.79120
   82    80 S   HC   _H15    56     1.09476   112.42500   -29.33356
   83    78 S   CMA  _C21    88     1.55732   107.69615    64.72558
   84    83 S   OM   _O40    89     1.26755   110.55951  -136.01515
   85    78 S   NT   _N7_   101     1.50071   113.38994  -168.99772
   86    80 S   NP   _N4_    57     1.51744   111.73146  -150.28436
   87    86 S   H    _H10    58     1.03018   106.66599   -46.05149
   88    83 S   CM   _C22    90     1.35796   118.89809    40.69408
   89    85 S   CT   _C27   102     1.46833   112.96736  -176.80255
   90    89 S   HC   _H27   103     1.09680   110.64446  -177.16552
   91    89 S   HC   _H28   104     1.09441   111.55088    66.41644
   92    89 S   HC   _H29   105     1.09588   112.16858   -56.60584
   93    85 S   CT   _C28   106     1.46942   112.00091    60.91621
   94    93 S   HC   _H30   107     1.09670   110.70391   176.76070
   95    93 S   HC   _H31   108     1.09584   112.01501    56.12526
   96    93 S   HC   _H32   109     1.09313   111.99629   -66.47631
   97    86 S   CT   _C4_    59     1.50508   112.70857    71.01472
   98    97 S   HC   _H7_    60     1.09327   108.58159    62.96704
   99    97 S   HC   _H8_    61     1.09324   107.99114  -176.66628
  100    97 S   HC   _H9_    62     1.09249   108.57707   -57.79687
  101    86 S   CT   _C5_    63     1.50313   111.79415  -162.52653
  102   101 S   HC   _H11    64     1.09325   108.58086   -62.48106
  103   101 S   HC   _H12    65     1.09313   108.10289    58.10588
  104   101 S   HC   _H13    66     1.09318   108.12399   176.90642
  105    88 S   CO4  _C23    91     1.50036   121.13052    -2.16456
  106   105 S   O    _O36    92     1.23455   118.72889   159.70222
  107    88 S   C    _C26    96     1.50605   118.85770   177.77780
  108   107 S   O    _O39    97     1.22732   123.48128   -39.77800
  109   107 S   N    _N6_    98     1.37385   113.87540   140.72280
  110   109 S   H    _H25    99     1.01395   122.84027     1.51955
  111   109 S   H    _H26   100     1.01337   120.14808   179.94766
  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  11   5   4   3
  20   2   1   1  20   9  19   6   1  11   4   8   2  13  15  18
  11   4   3  10   4   9   7   4   8   7   3   2   1   3   2   1
   1   9   4   3   5   8   3  11   5   1   1   8   4  15   6  12
   5   4  10   4   9   9   8   7   7   3   2   1   3   2   1   1
   7   3   2   1   3   2   1   1   4   1   4   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    39    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    42    55    72   105    39    44    40    41  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    42    43    46    49    55    56    66    72    73    78    88   105   106    39    44    45    40    41  
   35    36  
   36  
    0  
   38    42    43    46    47    69    49    50    51    55    56    66    67    68    72   105    39    44    40    41  
   42    43    46    49    55    56    66    39    40  
   44    45   107    85    40    41    42    55    66    67    68    72    73    78    79    83    88   105   106  
   41    42    44    55    72   105  
    0  
   43    46    47    48    57    69    74    49    55    56    66  
   46    47    69    55  
   45    66    72    73    78    88   105   106  
   72   105  
   47    48    52    57    69    74    75    70    54    49    50    51    55  
   48    52    53    57    69    74    54    58    62    49    50    51    55    56    66  
   52    53    57    69    70    54    58    59    60    61    62    63    64    65    49    50    51    55  
   50    51    55    56    66    67    68    72    52    54    69  
   51    55    56    66  
   55    56    66  
   53    57    69    74    70    71    76    54    58    62  
   57    69    70    54  
   58    59    60    61    62    63    64    65    57  
   56    66    67    68    72    73    78  
   66    67    68    72  
   69    74    75    70    71    76    77    80  
   59    60    61    62    63    64    65  
   60    61    62  
   61    62  
   62  
   63    64    65  
   64    65  
   65  
    0  
   67    68    72    73    78    79    83   105    85  
   68    72    73    78  
   72    73    78  
   74    75    70    71    76  
   71    76    77    80    81    82    86    74  
   76    77    80  
   73    78    79    83    84    88   105   106    85    89    93  
   78    79    83   105    85  
   75  
    0  
   77    80    81    82    86    87    97   101  
   80    81    82    86  
   79    83    84    88   105   107    85    89    90    91    92    93    94    95    96  
   83    84    88    85    89    93  
   81    82    86    87    97    98    99   100   101   102   103   104  
   82    86    87    97   101  
   86    87    97   101  
   84    88   105   106   107   108   109    85    89    93  
   88   105   107    85  
   89    90    91    92    93    94    95    96    88  
   87    97    98    99   100   101   102   103   104  
   97    98    99   100   101   102   103   104  
  105   106   107   108   109   110   111  
   90    91    92    93    94    95    96  
   91    92    93  
   92    93  
   93  
   94    95    96  
   95    96  
   96  
    0  
   98    99   100   101   102   103   104  
   99   100   101  
  100   101  
  101  
  102   103   104  
  103   104  
  104  
    0  
  106   107   108   109  
  107  
  108   109   110   111  
  109   110   111  
  110   111  
  111  
    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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   39   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   40   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   41   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   42   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   44   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   45   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   46   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0700   0.210000   2.5000   1.7750   0.001000000  -0.843144165
   49   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   53   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   54   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
   55   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   58   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   70   3.2500   0.1700  -0.385000   1.8100   1.6000   0.054801302  -1.445846770
   71   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   72   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   75   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   76   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   77   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   78   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   79   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   3.5000   0.0660   0.002500   1.9750   1.7500   0.005000000  -0.741685710
   81   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   82   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   83   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   84   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   85   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
   86   3.2500   0.1700   0.047500   2.1950   1.9500   0.003973653   1.685851020
   87   0.5000   0.0300   0.290000   0.9960   0.8600   0.030040813  -0.651083722
   88   3.5500   0.0760  -0.657900   2.0020   1.7750   0.023028004  -0.852763146
   89   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   90   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   94   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
   98   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   99   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  100   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  101   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
  102   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  103   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  104   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  105   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
  106   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
  107   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
  108   2.9600   0.2100  -0.500000   1.8100   1.6000   0.001000000  -1.480495490
  109   3.2500   0.1700  -0.760000   1.8100   1.6000   0.054801302  -1.445846770
  110   0.5000   0.0300   0.380000   1.5900   1.4000   0.030040813  -0.651083722
  111   0.5000   0.0300   0.380000   1.5900   1.4000   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   268.000  1.529
   33    39   268.000  1.529
   33    40   320.000  1.410
   37    38   340.000  1.090
   37    42   317.000  1.522
   37    55   268.000  1.529
   42    43   570.000  1.229
   42    46   310.000  1.470
   46    47   469.000  1.400
   46    69   469.000  1.400
   47    48   469.000  1.400
   47    49   317.000  1.510
   48    52   469.000  1.400
   48    54   481.000  1.340
   52    53   367.000  1.080
   52    57   469.000  1.400
   57    69   469.000  1.400
   57    70   360.000  1.404
   69    74   450.000  1.364
   74    75   553.000  0.945
   70    71   434.000  1.010
   70    76   490.000  1.335
   76    77   570.000  1.229
   76    80   317.000  1.522
   80    81   340.000  1.090
   80    82   340.000  1.090
   80    86   367.000  1.471
   86    87   434.000  1.010
   86    97   367.000  1.471
   86   101   367.000  1.471
   97    98   340.000  1.090
   97    99   340.000  1.090
   97   100   340.000  1.090
  101   102   340.000  1.090
  101   103   340.000  1.090
  101   104   340.000  1.090
   54    58   382.000  1.448
   54    62   382.000  1.448
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   340.000  1.090
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   340.000  1.090
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    55   268.000  1.529
   55    56   340.000  1.090
   55    66   268.000  1.529
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    72   268.000  1.529
   72    73   340.000  1.090
   72    78   268.000  1.529
   72    39   268.000  1.529
   78    79   340.000  1.090
   78    83   270.000  1.512
   78    85   382.000  1.448
   83    84   745.000  1.250
   83    88   465.000  1.376
   88   105   320.000  1.462
   88   107   410.000  1.444
  105   106   570.000  1.229
  105    39   317.000  1.522
   39    44   320.000  1.410
   44    45   553.000  0.945
  107   108   570.000  1.229
  107   109   490.000  1.335
  109   110   434.000  1.010
  109   111   434.000  1.010
   85    89   382.000  1.448
   85    93   382.000  1.448
   89    90   340.000  1.090
   89    91   340.000  1.090
   89    92   340.000  1.090
   93    94   340.000  1.090
   93    95   340.000  1.090
   93    96   340.000  1.090
   40    41   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  111.63000
   29    33    39    75.00000  111.63000
   29    33    40    85.00000  114.68000
   33    37    38    37.50000  110.70000
   33    37    42    63.00000  111.10000
   33    37    55    58.35000  112.70000
   33    39    72    58.35000  112.70000
   33    39   105    63.00000  111.10000
   33    39    44    50.00000  109.50000
   33    40    41    55.00000  108.50000
   37    42    43    80.00000  120.40000
   37    42    46    65.00000  115.47100
   37    55    49    58.35000  112.70000
   37    55    56    37.50000  110.70000
   37    55    66    58.35000  112.70000
   42    37    38    35.00000  109.50000
   42    46    47    60.00000  119.52600
   42    46    69    60.00000  119.52600
   46    42    43    75.00000  123.78400
   46    47    48    63.00000  120.00000
   46    47    49    70.00000  120.00000
   46    69    57    63.00000  120.00000
   46    69    74    70.00000  120.00000
   47    48    52    63.00000  120.00000
   47    48    54    70.00000  120.10000
   47    49    50    35.00000  109.50000
   47    49    51    35.00000  109.50000
   47    49    55    70.00000  112.17500
   48    52    53    35.00000  120.00000
   48    52    57    63.00000  120.00000
   48    54    58    50.00000  120.00000
   48    54    62    50.00000  120.00000
   52    57    69    63.00000  120.00000
   52    57    70    70.00000  119.01900
   57    52    53    35.00000  120.00000
   57    69    74    70.00000  120.00000
   57    70    71    45.00000  118.23600
   57    70    76    65.00000  121.96500
   69    46    47    63.00000  120.00000
   69    74    75    35.00000  113.00000
   70    57    69    70.00000  119.01900
   70    76    77    80.00000  122.90000
   70    76    80    70.00000  116.60000
   76    70    71    35.00000  119.80000
   76    80    81    35.00000  109.50000
   76    80    82    35.00000  109.50000
   76    80    86    80.00000  111.20000
   80    76    77    80.00000  120.40000
   80    86    87    35.00000  109.50000
   80    86    97    75.00000  113.01200
   80    86   101    75.00000  113.01200
   82    80    81    33.00000  107.80000
   86    80    81    35.00000  109.50000
   86    80    82    35.00000  109.50000
   86    97    98    35.00000  109.50000
   86    97    99    35.00000  109.50000
   86    97   100    35.00000  109.50000
   86   101   102    35.00000  109.50000
   86   101   103    35.00000  109.50000
   86   101   104    35.00000  109.50000
   97    86    87    35.00000  109.50000
   99    97    98    33.00000  107.80000
  100    97    98    33.00000  107.80000
  100    97    99    33.00000  107.80000
  101    86    87    35.00000  109.50000
  101    86    97    75.00000  113.01200
  103   101   102    33.00000  107.80000
  104   101   102    33.00000  107.80000
  104   101   103    33.00000  107.80000
   54    48    52    70.00000  120.10000
   54    58    59    35.00000  109.50000
   54    58    60    35.00000  109.50000
   54    58    61    35.00000  109.50000
   54    62    63    35.00000  109.50000
   54    62    64    35.00000  109.50000
   54    62    65    35.00000  109.50000
   60    58    59    33.00000  107.80000
   61    58    59    33.00000  107.80000
   61    58    60    33.00000  107.80000
   62    54    58    50.00000  115.00000
   64    62    63    33.00000  107.80000
   65    62    63    33.00000  107.80000
   65    62    64    33.00000  107.80000
   49    47    48    70.00000  120.00000
   49    55    56    37.50000  110.70000
   49    55    66    58.35000  112.70000
   51    49    50    33.00000  107.80000
   55    37    38    37.50000  110.70000
   55    37    42    63.00000  111.10000
   55    49    50    37.50000  110.70000
   55    49    51    37.50000  110.70000
   55    66    67    37.50000  110.70000
   55    66    68    37.50000  110.70000
   55    66    72    58.35000  112.70000
   66    55    56    37.50000  110.70000
   66    72    73    37.50000  110.70000
   66    72    78    58.35000  112.70000
   66    72    39    58.35000  112.70000
   68    66    67    33.00000  107.80000
   72    66    67    37.50000  110.70000
   72    66    68    37.50000  110.70000
   72    78    79    37.50000  110.70000
   72    78    83    70.00000  112.02700
   72    78    85    56.20000  109.47000
   72    39   105    63.00000  111.10000
   72    39    44    50.00000  109.50000
   78    72    73    37.50000  110.70000
   78    83    84    85.00000  112.85300
   78    83    88    65.00000  122.18000
   78    85    89    51.80000  107.20000
   78    85    93    51.80000  107.20000
   83    78    79    45.00000  110.52000
   83    88   105    60.00000  125.92000
   83    88   107    60.00000  120.04000
   88    83    84    65.00000  137.10300
   88   105   106    80.00000  123.72100
   88   105    39    65.00000  118.62400
   88   107   108    80.00000  125.30000
   88   107   109    80.00000  111.56200
  105    39    44    90.00000  109.61100
   39    33    37    58.35000  112.70000
   39    72    73    37.50000  110.70000
   39    72    78    58.35000  112.70000
   39   105   106    80.00000  120.40000
   39    44    45    55.00000  108.50000
  107    88   105    55.00000  123.68000
  107   109   110    35.00000  119.80000
  107   109   111    35.00000  119.80000
  109   107   108    80.00000  122.90000
  111   109   110    35.00000  120.00000
   85    78    79    35.00000  109.50000
   85    78    83    75.00000  110.70900
   85    89    90    35.00000  109.50000
   85    89    91    35.00000  109.50000
   85    89    92    35.00000  109.50000
   85    93    94    35.00000  109.50000
   85    93    95    35.00000  109.50000
   85    93    96    35.00000  109.50000
   91    89    90    33.00000  107.80000
   92    89    90    33.00000  107.80000
   92    89    91    33.00000  107.80000
   93    85    89    51.80000  107.20000
   95    93    94    33.00000  107.80000
   96    93    94    33.00000  107.80000
   96    93    95    33.00000  107.80000
   40    33    37    50.00000  109.50000
   40    33    39    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
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   39    33    40    41  -0.09450 -1.0 2.0
   39    33    40    41   0.21250  1.0 3.0
   39    72    78    79   0.15000  1.0 3.0
   39    72   -78    83   0.34400  1.0 1.0
   39    72   -78    83   0.09450 -1.0 2.0
   39    72   -78    83   0.11100  1.0 3.0
   39    72    78    85   1.85550  1.0 1.0
   39    72    78    85  -0.84100 -1.0 2.0
  107    88   105   106   2.50000 -1.0 2.0
  107    88   105    39   1.50000 -1.0 2.0
  108   107   109   110   2.45000 -1.0 2.0
  108   107   109   111   2.45000 -1.0 2.0
   85    78    83    84   0.09700  1.0 1.0
   85    78    83    84   0.15600 -1.0 2.0
   85    78    83    84  -0.50800  1.0 3.0
   85    78    83    88   0.90200  1.0 1.0
   85    78    83    88   0.57900 -1.0 2.0
   85    78    83    88  -0.62100  1.0 3.0
   89    85    93    94   0.28000  1.0 3.0
   89    85    93    95   0.28000  1.0 3.0
   89    85    93    96   0.28000  1.0 3.0
   93    85    89    90   0.28000  1.0 3.0
   93    85    89    91   0.28000  1.0 3.0
   93    85    89    92   0.28000  1.0 3.0
   40    33    37    38   0.23400  1.0 3.0
   40    33    37    42  -0.09450  1.0 1.0
   40    33    37    42  -1.12950 -1.0 2.0
   40    33    37    42   0.54000  1.0 3.0
   40    33    37    55   0.86500  1.0 1.0
   40    33    37    55  -0.17500 -1.0 2.0
   40    33    37    55   0.20800  1.0 3.0
   40    33    39    72   0.86500  1.0 1.0
   40    33    39    72  -0.17500 -1.0 2.0
   40    33    39    72   0.20800  1.0 3.0
   40    33    39   105  -0.09450  1.0 1.0
   40    33    39   105  -1.12950 -1.0 2.0
   40    33    39   105   0.54000  1.0 3.0
   40    33    39    44   3.75450  1.0 1.0
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
   37    46    42    43  10.50000 -1.0 2.0
   47    69    46    42   4.00000 -1.0 2.0
   48    49    47    46   4.00000 -1.0 2.0
   52    54    48    47   4.00000 -1.0 2.0
   57    53    52    48   1.10000 -1.0 2.0
   69    70    57    52   4.00000 -1.0 2.0
   57    74    69    46   4.00000 -1.0 2.0
   71    76    70    57   1.00000 -1.0 2.0
   70    80    76    77  10.50000 -1.0 2.0
   62    48    54    58   1.00000 -1.0 2.0
   78    84    83    88   1.10000 -1.0 2.0
  105   107    88    83   1.10000 -1.0 2.0
   88    39   105   106  10.50000 -1.0 2.0
   88   109   107   108  10.50000 -1.0 2.0
  111   107   109   110   1.00000 -1.0 2.0
END
