* LIGAND DATABASE FILE (OPLS2005)
*
001     119   120    216    310     623
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02031   102.80911   -40.90859
    3     1 S   H    _H1_     3     1.02066    72.64392    64.92546
    4     1 S   H    _H2_     4     1.02127    41.14617  -144.71081
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08610   110.54789    58.78698
   26    24 S   HC   HB22    34     1.08641   109.88695   179.05581
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CT   _C20    36     1.82612    98.01105  -178.18027
   34    33 S   HC   _H10    37     1.09556   107.81279   -36.60315
   35    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   36    35 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   37    35 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   38    33 S   CO4  _C21    38     1.51662   107.29174    80.03016
   39    38 S   O    _O34    39     1.23129   121.70325   -85.66342
   40    38 S   CM   _C22    40     1.49066   118.86573    91.09488
   41    40 S   HC   _H22    41     1.08486   115.46641  -171.57941
   42    40 S   CM   _C23    42     1.34114   123.09466     5.77852
   43    42 S   CO4  _C26    43     1.49599   118.40512     3.49233
   44    43 S   O    _O36    44     1.23106   120.02127  -166.16764
   45    42 S   CT   _C24    76     1.51813   125.90196  -174.44057
   46    45 S   HC   _H11    77     1.09849   106.76476   125.56352
   47    33 S   CT1  _C19    45     1.52166   114.50447  -158.11481
   48    47 S   HC   _H9_    46     1.09803   109.80615   173.99103
   49    45 S   OS   _O35    78     1.42840   111.79364    10.37945
   50    47 S   N    _N4_    47     1.45373   114.59651    51.03457
   51    50 S   H    _H21    48     1.01489   119.55205   -40.11533
   52    49 S   CT   _C25    79     1.41923   111.26811    79.96883
   53    52 S   HC   _H23    80     1.09273   109.50105  -179.94766
   54    52 S   HC   _H24    81     1.09284   109.47734    59.22770
   55    52 S   HC   _H25    82     1.09276   109.00096   -60.34149
   56    50 S   C    _C18    49     1.38789   120.87405   139.96318
   57    56 S   O    _O33    50     1.22781   125.61529   -29.16819
   58    56 S   CM   _C17    51     1.49496   112.13932   144.73820
   59    58 S   CM   _C16    52     1.34527   113.34559  -129.32175
   60    59 S   HC   _H20    53     1.08723   118.80194    -4.00995
   61    58 S   CT   _C27   116     1.49600   119.41730    47.36999
   62    61 S   HC   _H26   117     1.08883   109.75790   -86.17495
   63    61 S   HC   _H27   118     1.08976   109.71768   153.64316
   64    61 S   HC   _H28   119     1.08925   109.71473    34.04003
   65    59 S   CM   _C15    54     1.44504   126.10742   169.75343
   66    65 S   HC   _H19    55     1.08786   116.78315   -12.79581
   67    65 S   CM   _C14    56     1.34194   125.82971   170.99992
   68    67 S   HC   _H18    57     1.09032   116.56681   176.14664
   69    67 S   CT   _C13    58     1.50642   128.02930    -8.14519
   70    69 S   HC   _H8_    59     1.09292   112.35678   -13.48463
   71    69 S   CT   _C12    60     1.54203   113.76082   113.54262
   72    71 S   HC   _H7_    61     1.10476   108.60932    52.93529
   73    69 S   OS   _O37   111     1.43748   106.54361  -128.41385
   74    71 S   CM   _C11    62     1.52415   116.42225   -71.80342
   75    71 S   OS   _O38   105     1.43748   108.85614   166.82472
   76    73 S   CT   _C28   112     1.41634   110.97068    80.00820
   77    76 S   HC   _H29   113     1.09192   109.56574  -180.00000
   78    76 S   HC   _H30   114     1.09334   109.52368    59.19313
   79    76 S   HC   _H31   115     1.09257   108.96465   -60.36178
   80    74 S   CM   _C10    63     1.34965   119.97405   117.87613
   81    80 S   HC   _H17    64     1.08979   117.76437    -5.43711
   82    74 S   CT   _C30   101     1.50677   116.81421   -66.79099
   83    82 S   HC   _H34   102     1.08545   109.13787   -85.20268
   84    82 S   HC   _H35   103     1.08576   109.15568   154.62156
   85    82 S   HC   _H36   104     1.08569   109.13987    35.00218
   86    75 S   CO4  _C29   106     1.36256   115.59216  -146.21052
   87    86 S   O    _O39   107     1.22702   125.44536    -0.00000
   88    80 S   CT   _C9_    65     1.52287   127.31936   168.76442
   89    88 S   HC   _H6_    66     1.09797   108.82833    -8.74777
   90    86 S   N    _N5_   108     1.37283   110.30567  -179.95577
   91    90 S   H    _H32   109     1.01392   119.33172  -179.97202
   92    90 S   H    _H33   110     1.01497   121.34165    -0.06256
   93    88 S   CT   _C8_    67     1.54860   111.25977   110.32301
   94    93 S   HC   _H5_    68     1.10355   107.62155   -55.66406
   95    88 S   CT   _C31    97     1.53432   107.47221  -123.26343
   96    95 S   HC   _H37    98     1.08637   109.46166   -63.67272
   97    95 S   HC   _H38    99     1.08726   109.45874   176.35712
   98    95 S   HC   _H39   100     1.08593   109.50208    56.34660
   99    93 S   CT   _C7_    69     1.54783   116.96865  -177.25291
  100    99 S   HC   _H4_    70     1.09606   108.37086   179.28564
  101    93 S   OS   _O40    92     1.43291   110.13591    59.25470
  102    99 S   CT   _C6_    71     1.54032   115.70511    55.35764
  103   102 S   HC   _H15    72     1.09680   108.48339   -61.37871
  104   102 S   HC   _H16    73     1.09818   108.73933  -173.76961
  105    99 S   OS   _O41    87     1.43064   109.23341   -66.88583
  106   101 S   CT   _C32    93     1.41683   111.12493  -159.96335
  107   106 S   HC   _H40    94     1.09239   109.48524  -179.98022
  108   106 S   HC   _H41    95     1.09240   109.54830    59.17745
  109   106 S   HC   _H42    96     1.09226   108.91709   -60.46317
  110   102 S   CT   _C5_    74     1.54516   115.50663    62.01429
  111   110 S   HC   _H3_    75     1.09622   107.96311   -53.03303
  112   105 S   CT   _C33    88     1.41798   111.20709  -153.29597
  113   112 S   HC   _H43    89     1.09198   109.54287   179.96044
  114   112 S   HC   _H44    90     1.09322   109.49514    59.18188
  115   112 S   HC   _H45    91     1.09254   108.96873   -60.34017
  116   110 S   CT   _C4_    83     1.53662   108.98201  -168.40312
  117   116 S   HC   _H12    84     1.08642   109.36183   -63.75399
  118   116 S   HC   _H13    85     1.08562   109.42440   176.21980
  119   116 S   HC   _H14    86     1.08615   109.36090    56.18517
  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   9   5   4   3
  13   7   2   1   1   9   4   9   3  13  10   4  17   6   6   3
   8   6   3   4   2   1   1   9   3   9  10   4   4   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  18   7   5   2
   1   1  14   7   6  10   5   4   5   3   2   1   1   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    47    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    43    47    48    50  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    44    47    48    50    51    56  
   38    39    40    43    47    48    50  
   36    37  
   37  
    0  
   39    40    41    42    43    47    48    50    45  
   40    41    42    47  
   41    42    43    44    47   110    45    46    49  
   42    43    45  
   43    44    47    48    50   102   110   111    45    46    49    52   116  
   44    47    48    50    51    56   110    45    46    49  
   47    48    50    45  
   46    49    52    53    54    55   116   117   118   119    47    99   102   103   104   110   111  
   49    52   116   102   110   111  
   48    50    51    56    57    58  
   50    51    56  
   52    53    54    55   116   102   110   111  
   51    56    57    58    59    61  
   56    57    58  
   53    54    55   110  
   54    55  
   55  
    0  
   57    58    59    60    65    61    62    63    64  
   58    59    61  
   59    60    65    66    67    61    62    63    64  
   60    65    66    67    68    69    61    62    63    64  
   65    66    67    61  
   62    63    64    65  
   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   102   105   101   106    95    96    97    98  
   93    94    99   101    95    96    97    98  
   91    92  
   92  
    0  
   94    99   100   102   103   104   110   105   112   101   106   107   108   109    95    96    97    98  
   99   100   102   105   101   106    95  
   96    97    98    99   101  
   97    98  
   98  
    0  
  100   102   103   104   110   111   116   105   112   113   114   115   101   106  
  102   103   104   110   105   112   101  
  106   107   108   109   102   105  
  103   104   110   111   116   117   118   119   105   112  
  104   110   111   116   105  
  110   111   116   105  
  112   113   114   115   110  
  107   108   109  
  108   109  
  109  
    0  
  111   116   117   118   119  
  116   117   118   119  
  113   114   115  
  114   115  
  115  
    0  
  117   118   119  
  118   119  
  119  
    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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   39   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   40   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   41   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   43   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   45   3.5000   0.0660   0.239000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   49   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   50   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   51   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   52   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   56   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
   57   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   58   3.5500   0.0760  -0.056700   2.0020   1.7750   0.023028004  -0.852763146
   59   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   60   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5500   0.0760  -0.115000   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   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   94   2.5000   0.0300   0.030000   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   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
  102   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  103   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  104   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
  106   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
  107   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  108   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  109   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  110   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
  111   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  112   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
  113   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  114   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  115   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  116   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  117   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  118   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  119   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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   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    34   340.000  1.090
   33    38   317.000  1.522
   33    47   268.000  1.529
   38    39   570.000  1.229
   38    40   320.000  1.462
   40    41   340.000  1.080
   40    42   549.000  1.340
   42    43   320.000  1.462
   42    45   317.000  1.510
   43    44   570.000  1.229
   43    47   255.000  1.522
   47    48   340.000  1.090
   47    50   337.000  1.449
   50    51   434.000  1.010
   50    56   490.000  1.335
   56    57   570.000  1.229
   56    58   410.000  1.444
   58    59   549.000  1.340
   58    61   317.000  1.510
   59    60   340.000  1.080
   59    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   102   268.000  1.529
   99   105   320.000  1.410
  102   103   340.000  1.090
  102   104   340.000  1.090
  102   110   268.000  1.529
  110   111   340.000  1.090
  110    45   268.000  1.529
  110   116   268.000  1.529
   45    46   340.000  1.090
   45    49   320.000  1.410
   49    52   320.000  1.410
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   340.000  1.090
  116   117   340.000  1.090
  116   118   340.000  1.090
  116   119   340.000  1.090
  105   112   320.000  1.410
  112   113   340.000  1.090
  112   114   340.000  1.090
  112   115   340.000  1.090
  101   106   320.000  1.410
  106   107   340.000  1.090
  106   108   340.000  1.090
  106   109   340.000  1.090
   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
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    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    34    35.00000  109.50000
   29    33    38    75.00000  110.18000
   29    33    47    75.00000  108.68000
   33    38    39    80.00000  120.40000
   33    38    40    65.00000  118.62400
   33    47    43    70.00000  110.61500
   33    47    48    37.50000  110.70000
   33    47    50    80.00000  109.70000
   38    33    34    35.00000  109.50000
   38    40    41    40.00000  117.72500
   38    40    42    65.00000  118.96000
   40    38    39    80.00000  123.72100
   40    42    43    65.00000  118.96000
   40    42    45    70.00000  124.00000
   42    40    41    35.00000  120.00000
   42    43    44    80.00000  123.72100
   42    43    47    65.00000  118.62400
   42    45   110    70.00000  112.02700
   42    45    46    35.00000  109.50000
   42    45    49    85.00000  110.90400
   43    47    48    45.00000  110.09800
   43    47    50    80.00000  110.29000
   47    33    34    37.50000  110.70000
   47    33    38    63.00000  111.10000
   47    43    44    75.00000  123.42600
   47    50    51    38.00000  118.40000
   47    50    56    50.00000  121.90000
   50    47    48    35.00000  109.50000
   50    56    57    80.00000  122.90000
   50    56    58    80.00000  111.56200
   56    50    51    35.00000  119.80000
   56    58    59    70.00000  118.70000
   56    58    61    70.00000  119.70000
   58    56    57    80.00000  125.30000
   58    59    60    35.00000  120.00000
   58    59    65    70.00000  123.01800
   58    61    62    35.00000  109.50000
   58    61    63    35.00000  109.50000
   58    61    64    35.00000  109.50000
   59    65    66    35.00000  120.00000
   59    65    67    70.00000  123.01800
   65    59    60    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   102    58.35000  112.70000
   93    99   105    50.00000  109.50000
   93   101   106    60.00000  109.50000
   99    93    94    37.50000  110.70000
   99   102   103    37.50000  110.70000
   99   102   104    37.50000  110.70000
   99   102   110    58.35000  112.70000
   99   105   112    60.00000  109.50000
  102    99   100    37.50000  110.70000
  102   110   111    37.50000  110.70000
  102   110    45    58.35000  112.70000
  102   110   116    58.35000  112.70000
  104   102   103    33.00000  107.80000
  110   102   103    37.50000  110.70000
  110   102   104    37.50000  110.70000
  110    45    46    37.50000  110.70000
  110    45    49    50.00000  109.50000
  110   116   117    37.50000  110.70000
  110   116   118    37.50000  110.70000
  110   116   119    37.50000  110.70000
   45    42    43    65.00000  116.34900
   45   110   111    37.50000  110.70000
   45    49    52    60.00000  109.50000
   49    45    46    35.00000  109.50000
   49    52    53    35.00000  109.50000
   49    52    54    35.00000  109.50000
   49    52    55    35.00000  109.50000
   54    52    53    33.00000  107.80000
   55    52    53    33.00000  107.80000
   55    52    54    33.00000  107.80000
  116   110   111    37.50000  110.70000
  116   110    45    58.35000  112.70000
  118   116   117    33.00000  107.80000
  119   116   117    33.00000  107.80000
  119   116   118    33.00000  107.80000
  105    99   100    35.00000  109.50000
  105    99   102    50.00000  109.50000
  105   112   113    35.00000  109.50000
  105   112   114    35.00000  109.50000
  105   112   115    35.00000  109.50000
  114   112   113    33.00000  107.80000
  115   112   113    33.00000  107.80000
  115   112   114    33.00000  107.80000
  101    93    94    35.00000  109.50000
  101    93    99    50.00000  109.50000
  101   106   107    35.00000  109.50000
  101   106   108    35.00000  109.50000
  101   106   109    35.00000  109.50000
  108   106   107    33.00000  107.80000
  109   106   107    33.00000  107.80000
  109   106   108    33.00000  107.80000
   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
   61    58    59    70.00000  124.00000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
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
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   45    42    43    44   0.26850 -1.0 2.0
   45    42    43    47   0.25700  1.0 1.0
   45    42    43    47   0.66200 -1.0 2.0
   45    42    43    47   0.04450  1.0 3.0
   45   110   116   117   0.15000  1.0 3.0
   45   110   116   118   0.15000  1.0 3.0
   45   110   116   119   0.15000  1.0 3.0
   45    49    52    53   0.37050  1.0 3.0
   45    49    52    54   0.37050  1.0 3.0
   45    49    52    55   0.37050  1.0 3.0
   46    45    49    52   0.37050  1.0 3.0
  116   110    45    42   0.34400  1.0 1.0
  116   110    45    42   0.09450 -1.0 2.0
  116   110    45    42   0.11100  1.0 3.0
  116   110    45    46   0.15000  1.0 3.0
  116   110    45    49   0.62750  1.0 1.0
  116   110    45    49  -0.30950 -1.0 2.0
  116   110    45    49   0.27300  1.0 3.0
  105    99   102   103   0.23400  1.0 3.0
  105    99   102   104   0.23400  1.0 3.0
  105    99   102   110   0.62750  1.0 1.0
  105    99   102   110  -0.30950 -1.0 2.0
  105    99   102   110   0.27300  1.0 3.0
  101    93    99   100   0.23400  1.0 3.0
  101    93    99   102   0.62750  1.0 1.0
  101    93    99   102  -0.30950 -1.0 2.0
  101    93    99   102   0.27300  1.0 3.0
  101    93    99   105   1.11900  1.0 1.0
  101    93    99   105  -1.16350 -1.0 2.0
  101    93    99   105  -0.34150  1.0 3.0
   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   0.62750  1.0 1.0
   95    88    93   101  -0.30950 -1.0 2.0
   95    88    93   101   0.27300  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
   61    58    59    60   7.00000 -1.0 2.0
   61    58    59    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
   36    30    35    37  10.50000 -1.0 2.0
   33    40    38    39  10.50000 -1.0 2.0
   38    41    40    42   1.10000 -1.0 2.0
   43    45    42    40   1.10000 -1.0 2.0
   42    47    43    44  10.50000 -1.0 2.0
   51    56    50    47   1.00000 -1.0 2.0
   50    58    56    57  10.50000 -1.0 2.0
   56    61    58    59   1.10000 -1.0 2.0
   65    60    59    58   1.10000 -1.0 2.0
   59    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
