* LIGAND DATABASE FILE (OPLS2005)
*
001     119   123    222    345     639
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02028    75.18108    61.53527
    3     1 S   H    _H1_     3     1.02072    39.19719  -150.50393
    4     1 S   H    _H2_     4     1.02124   101.53676   -45.01330
    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   _C35    36     1.82887    97.94155  -178.15740
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CM   _C32    37     1.53943   108.80408   -40.00828
   38    33 S   OH   _O38   118     1.42644   110.39275  -160.03840
   39    38 S   HO   _H33   119     0.96883   106.50769   -60.31986
   40    37 S   CM   _C15    38     1.45505   107.89581   101.93621
   41    37 S   CO4  _C33   111     1.33958   125.74568   -81.96581
   42    41 S   O    _O36   112     1.27348   124.53992  -175.34230
   43    40 S   CD   _C16    39     1.33838   130.53144  -171.19839
   44    40 S   CD   _C14    76     1.47314   107.45690     7.83556
   45    41 S   OS   _O37   113     1.42324   110.20658     4.72049
   46    43 S   CT   _C17    40     1.50928   124.43370     0.02798
   47    46 S   HC   _H6_    41     1.06171   108.76624    41.62456
   48    33 S   CT   _C13    77     1.54647   115.78647    76.79543
   49    48 S   HC   _H5_    78     1.09966   110.22844   152.84088
   50    45 S   CT   _C34   114     1.42664   116.31261   150.00501
   51    50 S   HC   _H30   115     1.09235   109.54588  -180.00000
   52    50 S   HC   _H31   116     1.09291   109.48981    59.19096
   53    50 S   HC   _H32   117     1.09191   108.97824   -60.37275
   54    46 S   CT   _C18    42     1.53921   100.89667   158.17086
   55    54 S   HC   _H7_    43     1.13225   107.95690   -95.37768
   56    46 S   CT   _C29    67     1.52854   110.71387   -78.85195
   57    56 S   HC   _H26    68     1.08748   108.08820   -60.03206
   58    56 S   HC   _H27    69     1.08887   106.95791    56.03796
   59    48 S   CT   _C12    79     1.51913   124.93948    17.10270
   60    59 S   HC   _H4_    80     1.09649   111.26271   -32.36847
   61    54 S   CM   _C19    44     1.51593   100.26254    18.19292
   62    54 S   CT   _C28    63     1.51953   116.09430   142.64734
   63    62 S   HC   _H23    64     1.08925   109.90285   -58.31317
   64    62 S   HC   _H24    65     1.08913   109.89222  -178.32544
   65    62 S   HC   _H25    66     1.08917   109.88297    61.68760
   66    56 S   CT   _C30    70     1.51497   111.72591   176.32646
   67    66 S   HC   _H28    71     1.09808   107.58055   -59.42081
   68    66 S   HC   _H29    72     1.09729   110.16854    56.91449
   69    59 S   CT   _C11    81     1.54800   101.19554  -145.55041
   70    69 S   HC   _H3_    82     1.09647   109.18792   150.79409
   71    59 S   CT   _C36   107     1.51925   112.99247    89.91388
   72    71 S   HC   _H34   108     1.09112   110.21055    56.12656
   73    71 S   HC   _H35   109     1.09211   110.17658   -63.87247
   74    71 S   HC   _H36   110     1.09177   110.19966   176.13984
   75    43 S   NI   _N6_    45     1.37345   123.30439   177.87082
   76    61 S   CM   _C20    46     1.46836   121.46083   169.08689
   77    76 S   HC   _H16    47     1.07623   117.93138   -29.88941
   78    66 S   CO3  _C31    73     1.53338   116.93023  -178.58142
   79    78 S   O2Z  _O35    74     1.26233   116.46297   179.95154
   80    78 S   O2Z  _O34    75     1.26461   114.22988    -0.71327
   81    44 S   NI   _N5_    83     1.28969   131.88434  -167.13316
   82    69 S   CT   _C10    84     1.52500   116.49200   -85.42063
   83    82 S   HC   _H14    85     1.09609   109.53538    54.17873
   84    82 S   HC   _H15    86     1.09508   109.55534   -61.96327
   85    76 S   CD   _C21    48     1.45012   122.60772   150.03679
   86    82 S   C5A  _C9_    87     1.50501   111.69718   176.07704
   87    85 S   CM   _C24    49     1.46685   120.70683  -179.98022
   88    86 S   C5BC _C6_    88     1.37747   131.07178    90.04909
   89    87 S   CM   _C23    50     1.33906   103.35204  -179.95577
   90    87 S   CT   _C25    59     1.48304   125.62135    -0.02798
   91    90 S   HC   _H17    60     1.09365   110.35049   -89.95615
   92    90 S   HC   _H18    61     1.09382   110.37682   149.87670
   93    90 S   HC   _H19    62     1.09408   110.35424    30.22177
   94    88 S   C5BC _C7_    89     1.41739   107.36107  -180.00000
   95    88 S   CT   _C5_   100     1.47766   126.18388    -0.14671
   96    95 S   HC   _H11   101     1.10598   111.06970  -134.90439
   97    95 S   HC   _H12   102     1.10663   111.06231   -18.81658
   98    89 S   C    _C22    51     1.48481   107.92895    -0.02798
   99    98 S   O    _O33    52     1.22083   124.78572  -180.00000
  100    89 S   CM   _C26    54     1.42944   128.96413   179.94766
  101   100 S   HC   _H20    55     1.09720   120.26259   140.00443
  102    94 S   C5A  _C8_    90     1.37714   107.37541    -0.03426
  103    94 S   CT   _C38    96     1.47763   126.24715   179.95154
  104   103 S   HC   _H38    97     1.10120   111.05969    89.98074
  105   103 S   HC   _H39    98     1.10329   111.90538  -149.53562
  106   103 S   HC   _H40    99     1.10345   111.93566   -30.57413
  107    95 S   CT   _C4_   103     1.53192   112.77580   103.13904
  108   107 S   HC   _H8_   104     1.09544   110.76575   -56.57734
  109   107 S   HC   _H9_   105     1.09493   111.16377  -176.70069
  110   107 S   HC   _H10   106     1.09510   110.81704    63.16766
  111    85 S   NI   _N7_    53     1.29581   124.83634     0.04423
  112   100 S   CM   _C27    56     1.34998   119.99960   -39.97847
  113   112 S   HC   _H21    57     1.08571   121.07880   179.98022
  114   112 S   HC   _H22    58     1.08453   121.30780    -0.03956
  115    86 S   NA   _N4_    91     1.37121   121.07369   -90.01133
  116   115 S   H    _H13    92     1.01093   125.19655    -0.01978
  117   102 S   CO4  _C37    93     1.42938   128.81588  -179.97202
  118   117 S   O    _O39    94     1.24781   124.07857   179.96574
  119   117 S   HC   _H37    95     1.12350   118.47188     0.01978
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  10   5   4   3
  16   2   1   1  15   7   1  16   9   2  15  11   4  17   9  11
   5   3   2   1   1  14   8  11   5   4  12   8  10   5   2   1
   1   5   4   3  12   6   5   2   1   1   3   7   3   2   1   1
   4   9   4   3  10  11  11  16  12   6   2   1   1  14   9   5
   4   5   2   5   3   9   5   2   1   1   3   2   1   1   1   2
   1   1   4   1   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    48    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    44    48    49    59    41    38    39  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    43    44    48    49    59    60    69    81    71    41    42    45    38    39  
   35    36  
   36  
    0  
   40    43    46    75    44    48    49    59    81    41    42    45    50    38    39  
   39    40    41    44    48    49    59  
   48  
   43    46    47    54    61    75    56    44    48    49    59    69    81    41    42    45  
   42    45    50    51    52    53    43    44    48  
   45    50  
   46    47    54    55    61    75    76    62    56    57    58    66    44    48    81  
   48    49    59    60    69    70    81    82    71    46    75  
   50    51    52    53  
   47    54    55    61    75    76    62    63    64    65    56    57    58    66    67    68    78  
   54    55    61    75    62    56    57    58    66  
   49    59    60    69    70    81    82    71    72    73    74  
   59    60    69    81    71  
   51    52    53  
   52    53  
   53  
    0  
   55    61    75    76    77    85    62    63    64    65    56    57    58    66  
   61    75    76    62    63    64    65    56  
   57    58    66    67    68    78    79    80    61    62    75  
   58    66    67    68    78  
   66    67    68    78  
   60    69    70    81    82    83    84    86    71    72    73    74  
   69    70    81    82    71    72    73    74  
   75    76    77    85    87   111    62    63    64    65  
   63    64    65    75    76  
   64    65  
   65  
    0  
   67    68    78    79    80  
   68    78    79    80  
   78    79    80  
   70    81    82    83    84    86    88   115    71    72    73    74  
   81    82    83    84    86    71  
   72    73    74    81    82  
   73    74  
   74  
    0  
   76    77    85  
   77    85    87    89    98   111    90  
   85    87   111  
   79    80  
   80  
    0  
   82    83    84    86  
   83    84    86    88    94   102   115   116    95  
   84    86    88   115  
   86    88   115  
   87    89    98    99   111   100    90    91    92    93  
   88    94   102   115   116   117   103    95    96    97   107  
   89    98    99   111   100   101   112    90    91    92    93  
   94   102   115   116   117   103   104   105   106    95    96    97   107   108   109   110  
   98    99   111   100   101   112   113   114    90    91    92    93  
   91    92    93    98   100   111  
   92    93  
   93  
    0  
  102   115   116   117   118   119   103   104   105   106    95    96    97   107  
   96    97   107   108   109   110   102   103   115  
   97   107   108   109   110  
  107   108   109   110  
   99   111   100   101   112  
  111   100  
  101   112   113   114   111  
  112   113   114  
  115   116   117   118   119   103   104   105   106  
  104   105   106   115   117  
  105   106  
  106  
    0  
  108   109   110  
  109   110  
  110  
    0  
    0  
  113   114  
  114  
    0  
  116   117   118   119  
  117  
  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   0.432500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   38   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   39   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   40   3.5500   0.0760  -0.006600   2.0020   1.7750   0.023028004  -0.852763146
   41   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.7500   0.1050   0.356900   2.0020   1.7750   0.023028004  -0.852763146
   44   3.7500   0.1050   0.356900   2.0020   1.7750   0.023028004  -0.852763146
   45   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   46   3.5000   0.0660  -0.023900   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660  -0.023900   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660   0.160000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   52   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   53   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   54   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5500   0.0760   0.122500   2.0020   1.7750   0.023028004  -0.852763146
   62   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   69   3.5000   0.0660   0.160200   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.2800   0.1700  -0.512200   1.8540   1.6400   0.005000000   0.000000000
   76   3.5500   0.0760  -0.118300   2.0020   1.7750   0.023028004  -0.852763146
   77   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   78   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   79   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   80   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   81   3.2800   0.1700  -0.609900   1.8540   1.6400   0.005000000   0.000000000
   82   3.5000   0.0660   0.035000   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   3.7500   0.1050   0.396300   2.0020   1.7750   0.023028004  -0.852763146
   86   3.5500   0.0700  -0.163000   2.0020   1.7750   0.001000000  -0.843144165
   87   3.5500   0.0760  -0.003300   2.0020   1.7750   0.023028004  -0.852763146
   88   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   89   3.5500   0.0760  -0.056700   2.0020   1.7750   0.023028004  -0.852763146
   90   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   95   3.5000   0.0660  -0.005000   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   3.7500   0.1050   0.401700   2.1120   1.8750   0.001000000  -0.126889456
   99   2.9600   0.2100  -0.222500   1.6780   1.4800   0.001000000  -0.126889456
  100   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
  101   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  102   3.5500   0.0700  -0.123000   2.0020   1.7750   0.001000000  -0.843144165
  103   3.5000   0.0660  -0.065000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  108   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  109   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  110   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   3.2800   0.1700  -0.512200   1.8540   1.6400   0.005000000   0.000000000
  112   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
  113   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  114   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  115   3.2500   0.1700  -0.239000   1.8650   1.6500   0.001000000  -0.511443539
  116   0.5000   0.0300   0.317000   0.9960   0.8600   0.030040813  -0.651083722
  117   3.7500   0.1050   0.565000   2.1120   1.8750   0.001000000  -0.126889456
  118   2.9600   0.2100  -0.450000   1.6780   1.4800   0.001000000  -0.126889456
  119   2.4200   0.0150   0.000000   1.3810   1.2100   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    48   268.000  1.529
   33    38   320.000  1.410
   37    40   549.000  1.340
   37    41   320.000  1.462
   40    43   320.000  1.464
   40    44   320.000  1.464
   43    46   270.000  1.508
   43    75   500.000  1.261
   46    47   340.000  1.090
   46    54   268.000  1.529
   46    56   268.000  1.529
   54    55   340.000  1.090
   54    61   317.000  1.510
   54    62   268.000  1.529
   61    75   405.000  1.380
   61    76   549.000  1.340
   76    77   340.000  1.080
   76    85   320.000  1.464
   85    87   320.000  1.464
   85   111   500.000  1.261
   87    89   549.000  1.340
   87    90   317.000  1.510
   89    98   410.000  1.444
   89   100   380.000  1.444
   98    99   570.000  1.229
   98   111   415.000  1.368
  100   101   340.000  1.080
  100   112   549.000  1.340
  112   113   340.000  1.080
  112   114   340.000  1.080
   90    91   340.000  1.090
   90    92   340.000  1.090
   90    93   340.000  1.090
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   340.000  1.090
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    66   268.000  1.529
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    78   317.000  1.522
   78    79   656.000  1.250
   78    80   656.000  1.250
   44    48   270.000  1.508
   44    81   500.000  1.261
   48    49   340.000  1.090
   48    59   268.000  1.529
   59    60   340.000  1.090
   59    69   268.000  1.529
   59    71   268.000  1.529
   69    70   340.000  1.090
   69    81   315.000  1.435
   69    82   268.000  1.529
   82    83   340.000  1.090
   82    84   340.000  1.090
   82    86   295.000  1.489
   86    88   546.000  1.367
   86   115   427.000  1.381
   88    94   469.000  1.424
   88    95   285.000  1.502
   94   102   546.000  1.367
   94   103   285.000  1.502
  102   115   427.000  1.381
  102   117   335.000  1.450
  115   116   434.000  1.010
  117   118   570.000  1.229
  117   119   340.000  1.090
  103   104   340.000  1.090
  103   105   340.000  1.090
  103   106   340.000  1.090
   95    96   340.000  1.090
   95    97   340.000  1.090
   95   107   268.000  1.529
  107   108   340.000  1.090
  107   109   340.000  1.090
  107   110   340.000  1.090
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   340.000  1.090
   41    42   570.000  1.229
   41    45   214.000  1.327
   45    50   320.000  1.410
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   340.000  1.090
   38    39   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    48    75.00000  111.63000
   29    33    38    85.00000  114.68000
   33    37    40    70.00000  124.00000
   33    37    41    65.00000  116.34900
   33    48    44    70.00000  111.76100
   33    48    49    37.50000  110.70000
   33    48    59    58.35000  112.70000
   33    38    39    55.00000  108.50000
   37    40    43    60.00000  124.00000
   37    40    44    60.00000  120.31500
   37    41    42    80.00000  123.72100
   37    41    45    90.00000  111.29400
   40    43    46    60.00000  124.00000
   40    43    75    65.00000  125.00000
   40    44    48    65.00000  117.24000
   40    44    81    70.00000  121.86000
   43    46    47    45.00000  109.49600
   43    46    54    70.00000  111.76100
   43    46    56    70.00000  111.76100
   43    75    61    75.00000  115.77100
   46    54    55    37.50000  110.70000
   46    54    61    70.00000  112.02700
   46    54    62    58.35000  112.70000
   46    56    57    37.50000  110.70000
   46    56    58    37.50000  110.70000
   46    56    66    58.35000  112.70000
   54    46    47    37.50000  110.70000
   54    61    75    65.00000  119.96000
   54    61    76    70.00000  124.00000
   54    62    63    37.50000  110.70000
   54    62    64    37.50000  110.70000
   54    62    65    37.50000  110.70000
   61    54    55    35.00000  109.50000
   61    76    77    35.00000  120.00000
   61    76    85    60.00000  120.31500
   75    43    46    65.00000  122.10100
   76    61    75    70.00000  120.83400
   76    85    87    65.00000  123.36000
   76    85   111    70.00000  121.86000
   85    76    77    40.00000  114.85300
   85    87    89    60.00000  120.31500
   85    87    90    65.00000  117.22000
   85   111    98    80.00000  110.69000
   87    89    98    70.00000  118.70000
   87    89   100    70.00000  123.01800
   87    90    91    35.00000  109.50000
   87    90    92    35.00000  109.50000
   87    90    93    35.00000  109.50000
   89    98    99    80.00000  125.30000
   89    98   111    75.00000  112.93000
   89   100   101    35.00000  120.00000
   89   100   112    70.00000  123.01800
  111    85    87    70.00000  121.86000
  111    98    99    80.00000  126.08800
  100    89    98    70.00000  118.70000
  100   112   113    35.00000  120.00000
  100   112   114    35.00000  120.00000
  112   100   101    35.00000  120.00000
  114   112   113    35.00000  117.00000
   90    87    89    70.00000  124.00000
   92    90    91    33.00000  107.80000
   93    90    91    33.00000  107.80000
   93    90    92    33.00000  107.80000
   62    54    55    37.50000  110.70000
   62    54    61    70.00000  112.02700
   64    62    63    33.00000  107.80000
   65    62    63    33.00000  107.80000
   65    62    64    33.00000  107.80000
   56    46    47    37.50000  110.70000
   56    46    54    58.35000  112.70000
   56    66    67    37.50000  110.70000
   56    66    68    37.50000  110.70000
   56    66    78    70.00000  109.69300
   58    56    57    33.00000  107.80000
   66    56    57    37.50000  110.70000
   66    56    58    37.50000  110.70000
   66    78    79    70.00000  117.00000
   66    78    80    70.00000  117.00000
   68    66    67    33.00000  107.80000
   78    66    67    35.00000  109.50000
   78    66    68    35.00000  109.50000
   80    78    79    80.00000  126.00000
   44    40    43    60.00000  124.00000
   44    48    49    45.00000  109.49600
   44    48    59    70.00000  111.76100
   44    81    69    70.00000  113.48600
   48    33    37    70.00000  112.02700
   48    59    60    37.50000  110.70000
   48    59    69    58.35000  112.70000
   48    59    71    58.35000  112.70000
   59    48    49    37.50000  110.70000
   59    69    70    37.50000  110.70000
   59    69    81    80.00000  110.18800
   59    69    82    58.35000  112.70000
   59    71    72    37.50000  110.70000
   59    71    73    37.50000  110.70000
   59    71    74    37.50000  110.70000
   69    59    60    37.50000  110.70000
   69    82    83    37.50000  110.70000
   69    82    84    37.50000  110.70000
   69    82    86    70.00000  113.44400
   81    44    48    65.00000  122.10100
   81    69    70    50.00000  110.29200
   82    69    70    37.50000  110.70000
   82    69    81    80.00000  110.18800
   82    86    88    50.00000  133.50000
   82    86   115    65.00000  122.56900
   84    82    83    33.00000  107.80000
   86    82    83    45.00000  110.47400
   86    82    84    45.00000  110.47400
   86    88    94    70.00000  107.30000
   86    88    95    60.00000  130.00000
   86   115   102    70.00000  109.80000
   86   115   116    35.00000  120.00000
   88    94   102    70.00000  107.30000
   88    94   103    60.00000  130.00000
   88    95    96    35.00000  109.50000
   88    95    97    35.00000  109.50000
   88    95   107    70.00000  112.17500
   94   102   115    70.00000  107.70000
   94   102   117    55.00000  130.80000
   94   103   104    35.00000  109.50000
   94   103   105    35.00000  109.50000
   94   103   106    35.00000  109.50000
  102   115   116    35.00000  120.00000
  102   117   118    80.00000  122.40000
  102   117   119    35.00000  115.00000
  115    86    88    70.00000  107.70000
  117   102   115    70.00000  119.02500
  119   117   118    35.00000  123.00000
  103    94   102    60.00000  130.00000
  105   103   104    33.00000  107.80000
  106   103   104    33.00000  107.80000
  106   103   105    33.00000  107.80000
   95    88    94    60.00000  130.00000
   95   107   108    37.50000  110.70000
   95   107   109    37.50000  110.70000
   95   107   110    37.50000  110.70000
   97    95    96    33.00000  107.80000
  107    95    96    37.50000  110.70000
  107    95    97    37.50000  110.70000
  109   107   108    33.00000  107.80000
  110   107   108    33.00000  107.80000
  110   107   109    33.00000  107.80000
   71    59    60    37.50000  110.70000
   71    59    69    58.35000  112.70000
   73    71    72    33.00000  107.80000
   74    71    72    33.00000  107.80000
   74    71    73    33.00000  107.80000
   41    37    40    65.00000  118.96000
   41    45    50    83.00000  116.90000
   45    41    42    83.00000  123.40000
   45    50    51    35.00000  109.50000
   45    50    52    35.00000  109.50000
   45    50    53    35.00000  109.50000
   52    50    51    33.00000  107.80000
   53    50    51    33.00000  107.80000
   53    50    52    33.00000  107.80000
   38    33    37    90.00000  110.39200
   38    33    48    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
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   81    44    48    49   0.00000  1.0 1.0
   81    44   -48    59   0.00000  1.0 1.0
   81    69    82    83   0.15000  1.0 3.0
   81    69    82    84   0.15000  1.0 3.0
   81    69    82    86   0.56750  1.0 1.0
   81    69    82    86  -0.07550 -1.0 2.0
   81    69    82    86   0.20000  1.0 3.0
   82    69    81    44  -0.12500  1.0 1.0
   82    69    81    44  -0.12500 -1.0 2.0
   82    69    81    44   0.25000  1.0 3.0
   82    86    88    94   3.62500 -1.0 2.0
   82    86    88    95   3.62500 -1.0 2.0
   82    86   115   102   3.62500 -1.0 2.0
   82    86   115   116   2.00000 -1.0 2.0
   83    82    86    88   0.00000  1.0 1.0
   83    82    86   115   0.00000  1.0 1.0
   84    82    86    88   0.00000  1.0 1.0
   84    82    86   115   0.00000  1.0 1.0
   86    88   -94   102   3.62500 -1.0 2.0
   86    88    94   103   3.62500 -1.0 2.0
   86    88    95    96   0.00000  1.0 1.0
   86    88    95    97   0.00000  1.0 1.0
   86    88    95   107   0.04150 -1.0 2.0
   88    86  -115   102   3.62500 -1.0 2.0
   88    86   115   116   2.00000 -1.0 2.0
   88    94  -102   115   3.62500 -1.0 2.0
   88    94   102   117   3.62500 -1.0 2.0
   88    94   103   104   0.00000  1.0 1.0
   88    94   103   105   0.00000  1.0 1.0
   88    94   103   106   0.00000  1.0 1.0
   88    95   107   108   0.43200  1.0 3.0
   88    95   107   109   0.43200  1.0 3.0
   88    95   107   110   0.43200  1.0 3.0
   94    88    95    96   0.00000  1.0 1.0
   94    88    95    97   0.00000  1.0 1.0
   94    88    95   107   0.04150 -1.0 2.0
   94   102  -115    86   3.62500 -1.0 2.0
   94   102   115   116   2.00000 -1.0 2.0
   94   102   117   118   1.05000 -1.0 2.0
   94   102   117   119   0.56600 -1.0 2.0
  102    94   103   104   0.00000  1.0 1.0
  102    94   103   105   0.00000  1.0 1.0
  102    94   103   106   0.00000  1.0 1.0
  115    86   -88    94   3.62500 -1.0 2.0
  115    86    88    95   3.62500 -1.0 2.0
  115   102   117   118   1.85000 -1.0 2.0
  115   102   117   119   0.56600 -1.0 2.0
  117   102   115    86   3.62500 -1.0 2.0
  117   102   115   116   2.00000 -1.0 2.0
  103    94   102   115   3.62500 -1.0 2.0
  103    94   102   117   3.62500 -1.0 2.0
   95    88    94   102   3.62500 -1.0 2.0
   95    88    94   103   3.62500 -1.0 2.0
   96    95   107   108   0.15000  1.0 3.0
   96    95   107   109   0.15000  1.0 3.0
   96    95   107   110   0.15000  1.0 3.0
   97    95   107   108   0.15000  1.0 3.0
   97    95   107   109   0.15000  1.0 3.0
   97    95   107   110   0.15000  1.0 3.0
   71    59    69    70   0.15000  1.0 3.0
   71    59    69    81   0.56750  1.0 1.0
   71    59    69    81  -0.07550 -1.0 2.0
   71    59    69    81   0.20000  1.0 3.0
   71    59    69    82   0.56750  1.0 1.0
   71    59    69    82  -0.07550 -1.0 2.0
   71    59    69    82   0.20000  1.0 3.0
   41    37    40    43   7.00000 -1.0 2.0
   41    37    40    44   7.00000 -1.0 2.0
   41    45    50    51   0.08050  1.0 3.0
   41    45    50    52   0.08050  1.0 3.0
   41    45    50    53   0.08050  1.0 3.0
   42    41    45    50   3.00000 -1.0 2.0
   38    33    37    40   0.67800  1.0 1.0
   38    33    37    40   0.47050 -1.0 2.0
   38    33    37    40  -0.62500  1.0 3.0
   38    33    37    41   0.09700  1.0 1.0
   38    33    37    41   0.15600 -1.0 2.0
   38    33    37    41  -0.50800  1.0 3.0
   38    33    48    44   1.05650  1.0 1.0
   38    33    48    44   0.15600 -1.0 2.0
   38    33    48    44   0.53150  1.0 3.0
   38    33    48    49   0.23400  1.0 3.0
   38    33    48    59   0.86500  1.0 1.0
   38    33    48    59  -0.17500 -1.0 2.0
   38    33    48    59   0.20800  1.0 3.0
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    41    37    40   1.10000 -1.0 2.0
   43    44    40    37   1.10000 -1.0 2.0
   40    46    43    75  10.50000 -1.0 2.0
   54    75    61    76   1.10000 -1.0 2.0
   85    77    76    61   1.10000 -1.0 2.0
   76    87    85   111  10.50000 -1.0 2.0
   85    90    87    89   1.10000 -1.0 2.0
   98   100    89    87   1.10000 -1.0 2.0
   89   111    98    99  10.50000 -1.0 2.0
   89   101   100   112  15.00000 -1.0 2.0
  113   114   112   100  15.00000 -1.0 2.0
   79    66    78    80  10.50000 -1.0 2.0
   40    48    44    81  10.50000 -1.0 2.0
   88   115    86    82   4.00000 -1.0 2.0
   94    95    88    86   4.00000 -1.0 2.0
  102   103    94    88   4.00000 -1.0 2.0
  117   115   102    94   4.00000 -1.0 2.0
  116    86   115   102   1.00000 -1.0 2.0
  102   119   117   118  10.50000 -1.0 2.0
   37    45    41    42  10.50000 -1.0 2.0
END
