* LIGAND DATABASE FILE (OPLS2005)
*
001     106   111    201    333     602
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02033    62.00915    78.77905
    3     1 S   H    _H1_     3     1.02142    50.31062  -125.32029
    4     1 S   H    _H2_     4     1.02064   106.14598   -24.19074
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08519   110.61667    58.74867
   26    24 S   HC   HB22    34     1.08547   109.95733   179.14202
   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   _C31    36     1.84576    97.20316  -178.14639
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CO4  _C32    37     1.53298   106.00000   -59.99662
   38    37 S   O    _O41    38     1.22783   122.97733    93.02766
   39    33 S   CM   _C27    84     1.51394   109.30863  -179.90309
   40    37 S   CA   _C23    39     1.48354   117.16360   -83.17601
   41    39 S   CT   _C28    85     1.52242   116.45748   -92.68891
   42    41 S   HC   _H7_    86     1.10219   105.91539   143.75536
   43    40 S   CA   _C22    40     1.39970   119.36298   157.00026
   44    43 S   HA   _H20    41     1.08531   121.60258     1.88367
   45    41 S   OS   _O40    87     1.43081   112.33488    23.61463
   46    41 S   CT   _C35    99     1.52933   113.42289  -103.64867
   47    46 S   HC   _H26   100     1.08880   109.79442    65.80688
   48    46 S   HC   _H27   101     1.08851   109.83672   -54.20076
   49    46 S   HC   _H28   102     1.08958   109.81373  -174.19336
   50    43 S   CA   _C21    42     1.39172   119.70419  -177.15944
   51    50 S   HA   _H19    43     1.08792   119.19432   179.58931
   52    45 S   CT   _C29    88     1.42955   117.68810   -54.31037
   53    52 S   HC   _H8_    89     1.15720   106.29763   145.38256
   54    50 S   CA   _C20    44     1.39276   119.81148     0.24309
   55    33 S   CT   _C30    90     1.53527   110.61972    59.79977
   56    55 S   HC   _H22    91     1.09531   111.79509   -59.38954
   57    55 S   HC   _H23    92     1.09752   108.26893  -176.12687
   58    52 S   CT   _C33    93     1.52410   110.63021  -101.67588
   59    58 S   HC   _H24    94     1.09453   108.63413  -175.66727
   60    58 S   HC   _H25    95     1.09431   108.64512    67.48810
   61    54 S   CA   _C16    45     1.45059   118.57877   179.12419
   62    54 S   CA   _C25    81     1.39778   120.25642    -0.75381
   63    58 S   CO3  _C34    96     1.52757   115.14930   -54.03042
   64    63 S   O2Z  _O43    97     1.26228   116.84189   -31.84430
   65    63 S   O2Z  _O42    98     1.26527   113.81754   148.17422
   66    61 S   CA   _C15    46     1.39369   118.76266    89.96296
   67    66 S   HA   _H17    47     1.08759   120.96743    -0.12511
   68    40 S   CA   _C24    82     1.40439   119.15234   -21.35356
   69    62 S   OH   _O39   105     1.36746   117.36692   178.84937
   70    69 S   HO   _H21   106     0.96732   109.84635  -180.00000
   71    66 S   CA   _C14    48     1.39537   120.08642  -179.92338
   72    71 S   HA   _H16    49     1.08669   118.58649   179.45679
   73    68 S   CM   _C26    83     1.47558   119.59414    -4.86571
   74    71 S   CA   _C13    50     1.40093   120.08639    -0.15323
   75    73 S   OH   _O44   103     1.38232   118.18082  -161.52151
   76    75 S   HO   _H29   104     0.96468   110.11847   179.93744
   77    74 S   CA   _C18    51     1.39634   119.74388    -0.31652
   78    61 S   CA   _C17    52     1.39394   121.19068   -90.22505
   79    77 S   CO4  _C19    55     1.47872   120.69960  -178.68300
   80    79 S   O    _O37    56     1.22693   119.66383  -166.06084
   81    78 S   OH   _O38    53     1.36655   118.39267    -0.98039
   82    81 S   HO   _H18    54     0.96879   110.02495  -180.00000
   83    79 S   CT   _C6_    57     1.52636   116.95954    17.27710
   84    83 S   HC   _H4_    58     1.09997   104.96836    74.83752
   85    83 S   CT   _C7_    59     1.52858   110.82309   -43.42879
   86    85 S   HC   _H5_    60     1.09792   107.69616   166.23427
   87    74 S   CO4  _C12    61     1.47910   119.24551   177.93304
   88    87 S   O    _O36    62     1.22893   120.34018     3.51357
   89    85 S   CT   _C8_    63     1.52977   111.35941   -74.64110
   90    89 S   HC   _H12    64     1.09893   109.45981    68.88312
   91    89 S   HC   _H13    65     1.09634   110.27589  -174.29216
   92    89 S   CT   _C9_    66     1.52799   110.65563   -52.08421
   93    92 S   HC   _H6_    67     1.09500   110.26072   -66.07543
   94    92 S   OS   _O33    68     1.42874   110.76068    55.16569
   95    92 S   CT   _C10    75     1.52310   110.89149   174.40073
   96    95 S   HC   _H14    76     1.09456   108.63611    59.36316
   97    95 S   HC   _H15    77     1.09385   108.67938   -57.56787
   98    83 S   CT   _C5_    69     1.54229   111.19188  -167.86397
   99    98 S   HC   _H3_    70     1.09763   109.38984   -42.50167
  100    95 S   CO3  _C11    78     1.52762   115.10976  -179.14202
  101   100 S   O2Z  _O35    79     1.26203   116.89501   -31.78295
  102   100 S   O2Z  _O34    80     1.26525   113.83587   148.20880
  103    98 S   CT   _C4_    71     1.52897   112.98273  -160.19920
  104   103 S   HC   _H9_    72     1.08809   109.69078   -60.29922
  105   103 S   HC   _H10    73     1.08801   109.70352   179.71607
  106   103 S   HC   _H11    74     1.08820   109.66036    59.71529
  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
  18   2   1   1  14   5  17  11  13   7   8   4  14   5   2   1
   1   8   3  10   7  12   7   2   1   5   4   3  13   7   2   1
   1   8   4   5   2   1   8   3   2  11   1   1  11   6  12   4
   1   1  16   8  13   7   6   1  10   5   4  11   6  10   6   4
   3   5   4   2   1   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    39    55    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    40    73    39    41    52    55    56    57  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    40    43    68    73    39    41    42    45    52    53    55    56    57    58    46    75  
   35    36  
   36  
    0  
   38    40    43    44    50    62    68    73    39    41    52    55    56    57  
   40    43    68    39    55  
   41    42    45    52    55    56    57    46    47    48    49    75    76    40    62    68    73  
   43    44    50    51    54    62    68    73    55    75    69  
   42    45    52    53    55    58    46    47    48    49    75    68    73  
   45    52    46    47    48    49    73  
   44    50    51    54    61    62    68    73  
   50    51    54    68  
   52    53    55    56    57    58    59    60    63    46    47    48    49    73  
   47    48    49    52    73  
   48    49  
   49  
    0  
   51    54    61    66    78    62    68    69  
   54    61    62  
   53    55    56    57    58    59    60    63    64    65  
   55    56    57    58    59    60    63  
   61    66    67    71    77    78    81    62    68    73    69    70  
   56    57    58    59    60    63    73  
   57    58  
   58  
   59    60    63    64    65  
   60    63    64    65  
   63    64    65  
   66    67    71    72    74    77    78    81    82    79    62    68    69  
   68    73    75    69    70    66    78  
   64    65  
   65  
    0  
   67    71    72    74    77    78    81    87  
   71    72    74    78  
   73    75    76    69    70  
   70    73  
    0  
   72    74    77    78    79    85    87    88  
   74    77    87  
   75    76  
   77    78    81    79    80    83    85    86    87    88    89  
   76  
    0  
   78    81    82    79    80    83    84    85    87    88    98  
   81    82    79    80    83    87  
   80    83    84    85    86    87    89    94    98    99   103    81  
   83    84    85    98  
   82  
    0  
   84    85    86    87    88    89    90    91    92    94    98    99   103   104   105   106  
   85    86    87    89    94    98    99   103  
   86    87    88    89    90    91    92    93    94    98    99   103    95  
   87    88    89    90    91    92    98  
   88    89    90    91    92    98  
   89  
   90    91    92    93    94    98    95    96    97   100  
   91    92    93    94    95  
   92    93    94    95  
   93    94    98    99   103    95    96    97   100   101   102  
   94    98    95    96    97   100  
   98    99   103   104   105   106    95    96    97   100  
   96    97   100   101   102    98  
   97   100   101   102  
  100   101   102  
   99   103   104   105   106  
  103   104   105   106  
  101   102  
  102  
    0  
  104   105   106  
  105   106  
  106  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   39   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   41   3.5000   0.0660   0.239000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   44   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   45   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   46   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   51   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   52   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   55   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   61   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   62   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   63   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   64   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   65   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   66   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   67   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   68   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   69   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   70   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   71   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   72   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   73   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   74   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   75   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   76   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   77   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   78   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   79   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   80   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   81   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   82   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   83   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   84   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   85   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   86   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   87   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   88   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   89   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   93   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   94   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   95   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   96   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   97   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   98   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   99   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  100   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
  101   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
  102   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
  103   3.5000   0.0660  -0.180000   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
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.522
   33    39   317.000  1.510
   33    55   268.000  1.529
   37    38   570.000  1.229
   37    40   310.000  1.470
   40    43   469.000  1.400
   40    68   469.000  1.400
   43    44   367.000  1.080
   43    50   469.000  1.400
   50    51   367.000  1.080
   50    54   469.000  1.400
   54    61   375.000  1.464
   54    62   469.000  1.400
   61    66   469.000  1.400
   61    78   469.000  1.400
   66    67   367.000  1.080
   66    71   469.000  1.400
   71    72   367.000  1.080
   71    74   469.000  1.400
   74    77   469.000  1.400
   74    87   310.000  1.470
   77    78   469.000  1.400
   77    79   310.000  1.470
   78    81   450.000  1.364
   81    82   553.000  0.945
   79    80   570.000  1.229
   79    83   317.000  1.522
   83    84   340.000  1.090
   83    85   268.000  1.529
   83    98   268.000  1.529
   85    86   340.000  1.090
   85    87   317.000  1.522
   85    89   268.000  1.529
   87    88   570.000  1.229
   89    90   340.000  1.090
   89    91   340.000  1.090
   89    92   268.000  1.529
   92    93   340.000  1.090
   92    94   320.000  1.410
   92    95   268.000  1.529
   94    98   320.000  1.410
   98    99   340.000  1.090
   98   103   268.000  1.529
  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   100   317.000  1.522
  100   101   656.000  1.250
  100   102   656.000  1.250
   62    68   469.000  1.400
   62    69   450.000  1.364
   68    73   320.000  1.460
   73    39   549.000  1.340
   73    75   510.000  1.338
   39    41   317.000  1.510
   41    42   340.000  1.090
   41    45   320.000  1.410
   41    46   268.000  1.529
   45    52   320.000  1.410
   52    53   340.000  1.090
   52    55   268.000  1.529
   52    58   268.000  1.529
   55    56   340.000  1.090
   55    57   340.000  1.090
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    63   317.000  1.522
   63    64   656.000  1.250
   63    65   656.000  1.250
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    49   340.000  1.090
   75    76   553.000  0.945
   69    70   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  110.18000
   29    33    39    75.00000  112.20000
   29    33    55    75.00000  111.63000
   33    37    38    80.00000  120.40000
   33    37    40    65.00000  115.47100
   33    39    73    70.00000  124.00000
   33    39    41    65.00000  117.92700
   33    55    52    58.35000  112.70000
   33    55    56    37.50000  110.70000
   33    55    57    37.50000  110.70000
   37    40    43    60.00000  119.52600
   37    40    68    60.00000  119.52600
   40    37    38    75.00000  123.78400
   40    43    44    35.00000  120.00000
   40    43    50    63.00000  120.00000
   40    68    62    63.00000  120.00000
   40    68    73    60.00000  120.93500
   43    50    51    35.00000  120.00000
   43    50    54    63.00000  120.00000
   50    43    44    35.00000  120.00000
   50    54    61    60.00000  122.76000
   50    54    62    63.00000  120.00000
   54    50    51    35.00000  120.00000
   54    61    66    60.00000  122.76000
   54    61    78    60.00000  122.76000
   54    62    68    63.00000  120.00000
   54    62    69    70.00000  120.00000
   61    66    67    35.00000  120.00000
   61    66    71    63.00000  120.00000
   61    78    77    63.00000  120.00000
   61    78    81    70.00000  120.00000
   66    71    72    35.00000  120.00000
   66    71    74    63.00000  120.00000
   71    66    67    35.00000  120.00000
   71    74    77    63.00000  120.00000
   71    74    87    60.00000  119.52600
   74    71    72    35.00000  120.00000
   74    77    78    63.00000  120.00000
   74    77    79    60.00000  119.52600
   74    87    85    65.00000  115.47100
   74    87    88    75.00000  123.78400
   77    78    81    70.00000  120.00000
   77    79    80    75.00000  123.78400
   77    79    83    65.00000  115.47100
   78    61    66    63.00000  120.00000
   78    81    82    35.00000  113.00000
   79    77    78    60.00000  119.52600
   79    83    84    35.00000  109.50000
   79    83    85    63.00000  111.10000
   79    83    98    63.00000  111.10000
   83    79    80    80.00000  120.40000
   83    85    86    37.50000  110.70000
   83    85    87    63.00000  111.10000
   83    85    89    58.35000  112.70000
   83    98    94    50.00000  109.50000
   83    98    99    37.50000  110.70000
   83    98   103    58.35000  112.70000
   85    83    84    37.50000  110.70000
   85    87    88    80.00000  120.40000
   85    89    90    37.50000  110.70000
   85    89    91    37.50000  110.70000
   85    89    92    58.35000  112.70000
   87    74    77    60.00000  119.52600
   87    85    86    35.00000  109.50000
   89    85    86    37.50000  110.70000
   89    85    87    63.00000  111.10000
   89    92    93    37.50000  110.70000
   89    92    94    50.00000  109.50000
   89    92    95    58.35000  112.70000
   91    89    90    33.00000  107.80000
   92    89    90    37.50000  110.70000
   92    89    91    37.50000  110.70000
   92    94    98    60.00000  109.50000
   92    95    96    37.50000  110.70000
   92    95    97    37.50000  110.70000
   92    95   100    70.00000  109.69300
   94    92    93    35.00000  109.50000
   94    98    99    35.00000  109.50000
   94    98   103    50.00000  109.50000
   98    83    84    37.50000  110.70000
   98    83    85    58.35000  112.70000
   98   103   104    37.50000  110.70000
   98   103   105    37.50000  110.70000
   98   103   106    37.50000  110.70000
  103    98    99    37.50000  110.70000
  105   103   104    33.00000  107.80000
  106   103   104    33.00000  107.80000
  106   103   105    33.00000  107.80000
   95    92    93    37.50000  110.70000
   95    92    94    50.00000  109.50000
   95   100   101    70.00000  117.00000
   95   100   102    70.00000  117.00000
   97    95    96    33.00000  107.80000
  100    95    96    35.00000  109.50000
  100    95    97    35.00000  109.50000
  102   100   101    80.00000  126.00000
   62    54    61    60.00000  122.76000
   62    68    73    60.00000  120.93500
   62    69    70    35.00000  113.00000
   68    40    43    63.00000  120.00000
   68    73    39    60.00000  123.20500
   68    73    75    85.00000  114.86500
   73    39    41    70.00000  124.00000
   73    75    76    70.00000  107.45700
   39    33    37    70.00000  109.06800
   39    41    42    35.00000  109.50000
   39    41    45    85.00000  110.90400
   39    41    46    70.00000  112.02700
   41    45    52    60.00000  109.50000
   41    46    47    37.50000  110.70000
   41    46    48    37.50000  110.70000
   41    46    49    37.50000  110.70000
   45    41    42    35.00000  109.50000
   45    52    53    35.00000  109.50000
   45    52    55    50.00000  109.50000
   45    52    58    50.00000  109.50000
   52    55    56    37.50000  110.70000
   52    55    57    37.50000  110.70000
   52    58    59    37.50000  110.70000
   52    58    60    37.50000  110.70000
   52    58    63    70.00000  109.69300
   55    33    37    63.00000  111.10000
   55    33    39    70.00000  112.02700
   55    52    53    37.50000  110.70000
   57    55    56    33.00000  107.80000
   58    52    53    37.50000  110.70000
   58    52    55    58.35000  112.70000
   58    63    64    70.00000  117.00000
   58    63    65    70.00000  117.00000
   60    58    59    33.00000  107.80000
   63    58    59    35.00000  109.50000
   63    58    60    35.00000  109.50000
   65    63    64    80.00000  126.00000
   46    41    42    37.50000  110.70000
   46    41    45    50.00000  109.50000
   48    46    47    33.00000  107.80000
   49    46    47    33.00000  107.80000
   49    46    48    33.00000  107.80000
   75    73    39    80.00000  121.38400
   69    62    68    70.00000  120.00000
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
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
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   58    52    55    57   0.15000  1.0 3.0
   59    58    63    64   0.00000  1.0 1.0
   59    58    63    65   0.00000  1.0 1.0
   60    58    63    64   0.00000  1.0 1.0
   60    58    63    65   0.00000  1.0 1.0
   46    41    45    52   0.06250  1.0 1.0
   46    41    45    52  -0.01100 -1.0 2.0
   46    41    45    52   0.28050  1.0 3.0
   75    73    39    33   7.00000 -1.0 2.0
   75    73    39    41   7.00000 -1.0 2.0
   69    62    68    40   3.62500 -1.0 2.0
   69    62    68    73   3.62500 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   33    40    37    38  10.50000 -1.0 2.0
   43    68    40    37   4.00000 -1.0 2.0
   50    44    43    40   1.10000 -1.0 2.0
   54    51    50    43   1.10000 -1.0 2.0
   61    62    54    50   4.00000 -1.0 2.0
   66    78    61    54   4.00000 -1.0 2.0
   71    67    66    61   1.10000 -1.0 2.0
   74    72    71    66   1.10000 -1.0 2.0
   77    87    74    71   4.00000 -1.0 2.0
   78    79    77    74   4.00000 -1.0 2.0
   77    81    78    61   4.00000 -1.0 2.0
   77    83    79    80  10.50000 -1.0 2.0
   74    85    87    88  10.50000 -1.0 2.0
  101    95   100   102  10.50000 -1.0 2.0
   68    69    62    54   4.00000 -1.0 2.0
   62    73    68    40   4.00000 -1.0 2.0
   68    75    73    39   1.10000 -1.0 2.0
   33    41    39    73   1.10000 -1.0 2.0
   64    58    63    65  10.50000 -1.0 2.0
END
