* LIGAND DATABASE FILE (OPLS2005)
*
001     114   116    210    322     606
    1     0 S   NP   _N1_     1    28.95769    97.97683   -24.46606
    2     1 S   H    _HN1     2     1.02784   109.19970   -89.76841
    3     1 S   H    _H1_     3     1.02950    64.57812    11.99457
    4     1 S   H    _H2_     4     1.02828    44.36220   173.96226
    5     1 S   CT   _CA1     5     1.50108   137.27145   105.10481
    6     5 S   HC   _HA1     6     1.09572   105.20536   103.43656
    7     5 S   CO3  _C1_     7     1.53795   112.47761   -16.82031
    8     7 S   O2Z  _O11     8     1.26372   115.00842   -42.27039
    9     7 S   O2Z  _O12     9     1.26242   114.95173   136.91501
   10     5 S   CT   _CB1    10     1.53084   107.42560  -138.55904
   11    10 S   HC   HB11    11     1.09831   109.40031   -49.68605
   12    10 S   HC   HB12    12     1.09813   110.43125    66.93245
   13    10 S   CT   _CG1    13     1.52981   112.59151  -170.66752
   14    13 S   HC   HG11    14     1.09583   110.61060   -65.06346
   15    13 S   HC   HG12    15     1.09669   109.80432    54.16104
   16    13 S   C    _CD1    16     1.51795   112.27813   174.63151
   17    16 S   O    _OE1    17     1.22724   123.30879     5.72848
   18    16 S   N    _N2_    18     1.38648   111.62756  -174.37681
   19    18 S   H    _HN2    19     1.01582   118.92647     1.93290
   20    18 S   CT1  _CA2    20     1.46205   123.42812   177.91053
   21    20 S   HC   _HA2    21     1.09735   109.37527     2.20815
   22    20 S   C    _C2_    22     1.53546   108.64239  -113.29005
   23    22 S   O    _O2_    23     1.23058   122.28013  -148.22470
   24    20 S   CT   _CB2    32     1.53331   111.47414   124.22230
   25    24 S   HC   HB21    33     1.09494   109.95603    56.17576
   26    24 S   HC   HB22    34     1.09520   110.24186   175.13373
   27    22 S   N    _N3_    24     1.38335   113.71172    39.25550
   28    27 S   H    _HN3    25     1.01588   119.58348    -3.36354
   29    24 S   S    _SG2    35     1.82832   111.46703   -65.29937
   30    27 S   CT   _CA3    26     1.45290   123.20806   177.09734
   31    30 S   HC   HA31    27     1.09552   107.50922   -64.53353
   32    30 S   HC   HA32    28     1.09560   107.98360    51.90585
   33    29 S   CT   _C27    36     1.83719    99.51004   177.99592
   34    33 S   HC   _H6_    37     1.09671   107.87983    39.61769
   35    30 S   CO3  _C3_    29     1.52966   114.08285   173.89970
   36    35 S   O2Z  _O31    30     1.26375   116.06526    -0.77126
   37    35 S   O2Z  _O32    31     1.26429   114.41480   179.28948
   38    33 S   CM   _C26    38     1.51033   107.24858   157.73902
   39    38 S   HC   _H32    39     1.08921   117.07874    58.15457
   40    33 S   CT   _C28    96     1.53503   110.32949   -80.84771
   41    40 S   HC   _H33    97     1.09641   111.77716    47.11911
   42    40 S   HC   _H34    98     1.09760   111.73555   -72.26433
   43    38 S   CM   _C25    40     1.34221   123.45853  -123.50720
   44    43 S   HC   _H31    41     1.08750   119.56824     0.60974
   45    40 S   C    _C29    99     1.51777   110.58662   165.28558
   46    45 S   O    _O36   100     1.22891   121.55886   -88.55220
   47    43 S   CM   _C24    42     1.44516   123.02101  -178.17404
   48    47 S   HC   _H30    43     1.08659   116.85804    -2.10775
   49    45 S   N    _N5_   101     1.38313   113.40288    89.83250
   50    49 S   H    _H35   102     1.01585   119.28148     1.50974
   51    47 S   CM   _C23    44     1.34342   122.94636   176.67210
   52    51 S   HC   _H29    45     1.09015   118.37844    -0.34492
   53    49 S   CT1  _C30   103     1.44215   122.23405  -176.63704
   54    53 S   HC   _H36   104     1.09329   112.57240   -34.38648
   55    51 S   CT   _C19    46     1.52287   125.94159  -178.67249
   56    53 S   CO4  _C31   105     1.51042   110.58914  -158.43441
   57    56 S   O    _O37   106     1.22395   124.73344    51.12764
   58    55 S   CM   _C18    47     1.52004   107.99410   101.06947
   59    58 S   HC   _H28    48     1.08597   113.92904    62.21137
   60    55 S   OH   _O39    94     1.43548   106.57352  -143.37548
   61    60 S   HO   _H41    95     0.97226   108.80280   -65.64947
   62    56 S   CT   _C32   107     1.50870   111.33911  -130.60478
   63    62 S   HC   _H37   108     1.09262   110.83655   139.79401
   64    62 S   HC   _H38   109     1.09413   108.67624   -99.22179
   65    58 S   CM   _C17    49     1.34438   126.28156  -115.82643
   66    62 S   CT   _C33   110     1.52811   104.92655    19.47937
   67    66 S   HC   _H39   111     1.09259   111.51811  -137.94277
   68    66 S   HC   _H40   112     1.09295   110.43673    99.31928
   69    65 S   CO4  _C22    50     1.49946   119.77617    -2.41338
   70    69 S   O    _O34    51     1.22616   121.69764   173.89523
   71    65 S   N    _N4_    57     1.38446   126.04715   176.97865
   72    71 S   H    _H27    58     1.01744   113.47699   179.15027
   73    53 S   CO4  _C34   113     1.51359   110.15389    88.49055
   74    73 S   O    _O38   114     1.22448   124.86821   -57.44390
   75    69 S   C3T  _C21    52     1.47469   118.21588    -6.95838
   76    75 S   HC   _H5_    53     1.08370   116.39978   159.29158
   77    71 S   C    _C16    59     1.38734   128.74146    -0.45585
   78    77 S   O    _O33    60     1.22786   126.43429     1.44089
   79    55 S   C3T  _C20    54     1.50739   114.12052   -26.99903
   80    79 S   HC   _H4_    55     1.08151   114.86919   -41.26794
   81    77 S   CM   _C14    61     1.50664   113.17274  -177.89058
   82    75 S   O3T  _O35    56     1.43756   113.10857   -60.40498
   83    81 S   CM   _C13    62     1.34781   115.60742  -150.89808
   84    83 S   HC   _H23    63     1.08968   120.00355     0.06256
   85    81 S   CT   _C15    90     1.50182   119.02280    32.65846
   86    85 S   HC   _H24    91     1.09456   110.59491   -83.99047
   87    85 S   HC   _H25    92     1.09522   110.76611    36.49630
   88    85 S   HC   _H26    93     1.09437   112.38072   155.07008
   89    83 S   CM   _C11    64     1.45915   126.68229  -179.31357
   90    89 S   CM   _C10    65     1.34794   120.69323   -59.71072
   91    90 S   HC   _H19    66     1.09108   117.96422     0.00000
   92    89 S   CT   _C12    86     1.50323   113.45583   122.86893
   93    92 S   HC   _H20    87     1.09607   110.56635    54.08044
   94    92 S   HC   _H21    88     1.09170   113.58498   173.91366
   95    92 S   HC   _H22    89     1.09569   110.20113   -65.52600
   96    90 S   CT   _C8_    67     1.51192   128.05031   180.00000
   97    96 S   HC   _H3_    68     1.09398   111.26026    -4.98892
   98    96 S   CT   _C9_    69     1.53238   108.98737  -122.44028
   99    98 S   HC   _H16    70     1.09603   111.61938   -62.18869
  100    98 S   HC   _H17    71     1.09589   110.97294    58.26228
  101    98 S   HC   _H18    72     1.09544   110.68369   177.71030
  102    96 S   CT   _C7_    73     1.54122   111.58032   115.85499
  103   102 S   HC   _H14    74     1.09780   108.86636   173.79205
  104   102 S   HC   _H15    75     1.09802   110.09013    57.33165
  105   102 S   CT   _C6_    76     1.53333   113.02377   -65.32718
  106   105 S   HC   _H12    77     1.09607   110.15526    62.36209
  107   105 S   HC   _H13    78     1.09681   109.52520   -55.34127
  108   105 S   CT   _C5_    79     1.52915   111.22127  -176.53683
  109   108 S   HC   _H10    80     1.09620   109.89096    58.95601
  110   108 S   HC   _H11    81     1.09622   109.84775   -58.79672
  111   108 S   CT   _C4_    82     1.52042   111.47887  -179.92338
  112   111 S   HC   _H7_    83     1.09469   111.00359    60.27784
  113   111 S   HC   _H8_    84     1.09449   110.26153  -179.97202
  114   111 S   HC   _H9_    85     1.09470   110.99654   -60.23727
  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
  12   7   2   1   1  10   4   8   4   3   6   3   7   3   7   3
   9   4  11   4  11   6  12   9   5  13   5   6   1   7   5   4
  11   4   3   2   9   5   7   3   1   1   4   3   9   3   2   1
   9   1  13   4   4   2   1   1  10  15   5   4   2   1   1  12
   8   7   3   2   1   9   5   4   9   5   4   6   5   4   3   2
   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    43    40    41    42    45  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    43    44    47    40    41    42    45    46    49  
   38    39    43    40    41    42    45  
   36    37  
   37  
    0  
   39    43    44    47    48    51    40    41    42    45  
   43    44    47    40  
   41    42    45    46    49    50    53    43  
   42    45    46    49  
   45    46    49  
   44    47    48    51    52    55  
   47    48    51  
   46    49    50    53    54    56    73  
   49    50    53  
   48    51    52    55    58    79    60  
   51    52    55  
   50    53    54    56    57    62    66    73    74  
   53    54    56    73  
   52    55    58    59    65    75    79    80    82    60    61  
   55    58    79    60  
   54    56    57    62    63    64    66    67    68    73    74  
   56    57    62    66    73    74  
   58    59    65    69    75    76    79    80    82    71    60    61  
   57    62    63    64    66    67    68    73    74  
   62    63    64    66    73  
   59    65    69    70    75    79    80    82    71    72    77    60    61  
   65    69    79    71    60  
   61    65    75    79    80    82  
   79  
   63    64    66    67    68    73    74  
   64    66    67    68    73  
   66    67    68    73  
   69    70    75    76    79    82    71    72    77    78    81  
   67    68    73    74  
   68    73    74  
   73    74  
   70    75    76    79    80    82    71    72    77  
   75    76    79    82    71  
   72    77    78    81    83    85    75  
   77    78    81  
   74  
    0  
   76    79    80    82  
   79    80    82  
   78    81    83    84    89    85    86    87    88  
   81    83    85  
   80    82  
   82  
   83    84    89    90    92    85    86    87    88  
    0  
   84    89    90    91    96    92    93    94    95    85    86    87    88  
   89    90    92    85  
   86    87    88    89  
   87    88  
   88  
    0  
   90    91    96    97    98   102    92    93    94    95  
   91    96    97    98    99   100   101   102   103   104   105    92    93    94    95  
   96    97    98   102    92  
   93    94    95    96  
   94    95  
   95  
    0  
   97    98    99   100   101   102   103   104   105   106   107   108  
   98    99   100   101   102   103   104   105  
   99   100   101   102   103   104   105  
  100   101   102  
  101   102  
  102  
  103   104   105   106   107   108   109   110   111  
  104   105   106   107   108  
  105   106   107   108  
  106   107   108   109   110   111   112   113   114  
  107   108   109   110   111  
  108   109   110   111  
  109   110   111   112   113   114  
  110   111   112   113   114  
  111   112   113   114  
  112   113   114  
  113   114  
  114  
    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   2.5000   0.0300   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   44   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   45   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   47   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   48   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   49   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   50   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   51   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   52   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   55   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   56   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   57   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   58   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   59   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   60   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   61   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   62   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5500   0.0760   0.051300   2.0020   1.7750   0.023028004  -0.852763146
   66   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   70   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   71   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
   72   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   73   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   74   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   75   3.5000   0.0660   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   76   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   77   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
   78   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   79   3.5000   0.0660   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   3.5500   0.0760  -0.056700   2.0020   1.7750   0.023028004  -0.852763146
   82   2.9000   0.1400  -0.352400   1.5900   1.4000   0.020110767  -0.896042159
   83   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   84   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   85   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   90   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   91   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   92   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  100   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  101   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  106   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  108   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  112   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  113   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  114   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  1.510
   33    40   268.000  1.529
   38    39   340.000  1.080
   38    43   549.000  1.340
   43    44   340.000  1.080
   43    47   380.000  1.444
   47    48   340.000  1.080
   47    51   549.000  1.340
   51    52   340.000  1.080
   51    55   317.000  1.510
   55    58   317.000  1.510
   55    79   275.000  1.510
   55    60   320.000  1.410
   58    59   340.000  1.080
   58    65   549.000  1.340
   65    69   320.000  1.462
   65    71   400.000  1.384
   69    70   570.000  1.229
   69    75   290.000  1.496
   75    76   340.000  1.088
   75    79   260.000  1.509
   75    82   335.000  1.432
   79    80   340.000  1.088
   79    82   335.000  1.432
   71    72   434.000  1.010
   71    77   490.000  1.335
   77    78   570.000  1.229
   77    81   410.000  1.444
   81    83   549.000  1.340
   81    85   317.000  1.510
   83    84   340.000  1.080
   83    89   380.000  1.444
   89    90   549.000  1.340
   89    92   317.000  1.510
   90    91   340.000  1.080
   90    96   317.000  1.510
   96    97   340.000  1.090
   96    98   268.000  1.529
   96   102   268.000  1.529
   98    99   340.000  1.090
   98   100   340.000  1.090
   98   101   340.000  1.090
  102   103   340.000  1.090
  102   104   340.000  1.090
  102   105   268.000  1.529
  105   106   340.000  1.090
  105   107   340.000  1.090
  105   108   268.000  1.529
  108   109   340.000  1.090
  108   110   340.000  1.090
  108   111   268.000  1.529
  111   112   340.000  1.090
  111   113   340.000  1.090
  111   114   340.000  1.090
   92    93   340.000  1.090
   92    94   340.000  1.090
   92    95   340.000  1.090
   85    86   340.000  1.090
   85    87   340.000  1.090
   85    88   340.000  1.090
   60    61   553.000  0.945
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    45   317.000  1.522
   45    46   570.000  1.229
   45    49   490.000  1.335
   49    50   434.000  1.010
   49    53   337.000  1.449
   53    54   340.000  1.090
   53    56   255.000  1.522
   53    73   255.000  1.522
   56    57   570.000  1.229
   56    62   317.000  1.522
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    66   268.000  1.529
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    73   317.000  1.522
   73    74   570.000  1.229
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  112.20000
   29    33    40    75.00000  111.63000
   33    38    39    35.00000  117.00000
   33    38    43    70.00000  124.00000
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   33    40    45    63.00000  111.10000
   38    33    34    35.00000  109.50000
   38    43    44    35.00000  120.00000
   38    43    47    70.00000  123.01800
   43    38    39    35.00000  120.00000
   43    47    48    35.00000  120.00000
   43    47    51    70.00000  123.01800
   47    43    44    35.00000  120.00000
   47    51    52    35.00000  120.00000
   47    51    55    70.00000  124.00000
   51    47    48    35.00000  120.00000
   51    55    58    70.00000  110.12100
   51    55    79    70.00000  112.02700
   51    55    60    90.00000  110.39200
   55    51    52    35.00000  117.00000
   55    58    59    35.00000  117.00000
   55    58    65    70.00000  124.00000
   55    79    75    60.00000  120.94000
   55    79    80    40.00000  115.04500
   55    79    82    80.00000  116.47100
   55    60    61    55.00000  108.50000
   58    65    69    65.00000  118.96000
   58    65    71    75.00000  120.83300
   65    58    59    35.00000  120.00000
   65    69    70    80.00000  123.72100
   65    69    75    65.00000  118.62400
   65    71    72    45.00000  117.55000
   65    71    77    70.00000  120.89900
   69    75    76    40.00000  116.18000
   69    75    79    65.00000  117.18000
   69    75    82    80.00000  114.91000
   75    69    70    75.00000  121.36600
   75    79    80    37.50000  117.20000
   75    79    82    15.00000   60.43100
   75    82    79    15.00000   59.14900
   79    55    58    70.00000  112.02700
   79    75    76    37.50000  117.20000
   82    75    76    50.00000  114.27700
   82    75    79    15.00000   60.43100
   82    79    80    50.00000  114.27700
   71    65    69    70.00000  117.92000
   71    77    78    80.00000  122.90000
   71    77    81    80.00000  111.56200
   77    71    72    35.00000  119.80000
   77    81    83    70.00000  118.70000
   77    81    85    70.00000  119.70000
   81    77    78    80.00000  125.30000
   81    83    84    35.00000  120.00000
   81    83    89    70.00000  123.01800
   81    85    86    35.00000  109.50000
   81    85    87    35.00000  109.50000
   81    85    88    35.00000  109.50000
   83    89    90    70.00000  123.01800
   83    89    92    70.00000  124.00000
   89    83    84    35.00000  120.00000
   89    90    91    35.00000  120.00000
   89    90    96    70.00000  124.00000
   89    92    93    35.00000  109.50000
   89    92    94    35.00000  109.50000
   89    92    95    35.00000  109.50000
   90    96    97    35.00000  109.50000
   90    96    98    70.00000  112.02700
   90    96   102    70.00000  112.02700
   96    90    91    35.00000  117.00000
   96    98    99    37.50000  110.70000
   96    98   100    37.50000  110.70000
   96    98   101    37.50000  110.70000
   96   102   103    37.50000  110.70000
   96   102   104    37.50000  110.70000
   96   102   105    58.35000  112.70000
   98    96    97    37.50000  110.70000
  100    98    99    33.00000  107.80000
  101    98    99    33.00000  107.80000
  101    98   100    33.00000  107.80000
  102    96    97    37.50000  110.70000
  102    96    98    58.35000  112.70000
  102   105   106    37.50000  110.70000
  102   105   107    37.50000  110.70000
  102   105   108    58.35000  112.70000
  104   102   103    33.00000  107.80000
  105   102   103    37.50000  110.70000
  105   102   104    37.50000  110.70000
  105   108   109    37.50000  110.70000
  105   108   110    37.50000  110.70000
  105   108   111    58.35000  112.70000
  107   105   106    33.00000  107.80000
  108   105   106    37.50000  110.70000
  108   105   107    37.50000  110.70000
  108   111   112    37.50000  110.70000
  108   111   113    37.50000  110.70000
  108   111   114    37.50000  110.70000
  110   108   109    33.00000  107.80000
  111   108   109    37.50000  110.70000
  111   108   110    37.50000  110.70000
  113   111   112    33.00000  107.80000
  114   111   112    33.00000  107.80000
  114   111   113    33.00000  107.80000
   92    89    90    70.00000  124.00000
   94    92    93    33.00000  107.80000
   95    92    93    33.00000  107.80000
   95    92    94    33.00000  107.80000
   85    81    83    70.00000  124.00000
   87    85    86    33.00000  107.80000
   88    85    86    33.00000  107.80000
   88    85    87    33.00000  107.80000
   60    55    58    90.00000  110.39200
   60    55    79    50.00000  109.50000
   40    33    34    37.50000  110.70000
   40    33    38    70.00000  112.02700
   40    45    46    80.00000  120.40000
   40    45    49    70.00000  116.60000
   42    40    41    33.00000  107.80000
   45    40    41    35.00000  109.50000
   45    40    42    35.00000  109.50000
   45    49    50    35.00000  119.80000
   45    49    53    50.00000  121.90000
   49    45    46    80.00000  122.90000
   49    53    54    35.00000  109.50000
   49    53    56    80.00000  110.29000
   49    53    73    80.00000  110.29000
   53    49    50    38.00000  118.40000
   53    56    57    75.00000  123.42600
   53    56    62    65.00000  117.09000
   53    73    66    65.00000  117.09000
   53    73    74    75.00000  123.42600
   56    53    54    45.00000  110.09800
   56    62    63    35.00000  109.50000
   56    62    64    35.00000  109.50000
   56    62    66    63.00000  111.10000
   62    56    57    80.00000  120.40000
   62    66    67    37.50000  110.70000
   62    66    68    37.50000  110.70000
   62    66    73    63.00000  111.10000
   64    62    63    33.00000  107.80000
   66    62    63    37.50000  110.70000
   66    62    64    37.50000  110.70000
   66    73    74    80.00000  120.40000
   68    66    67    33.00000  107.80000
   73    53    54    45.00000  110.09800
   73    53    56    65.00000  112.16000
   73    66    67    35.00000  109.50000
   73    66    68    35.00000  109.50000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
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   57    56    62    64   0.00000  1.0 1.0
   57    56    62    66   0.30150 -1.0 2.0
   62    66   -73    53   0.60050  1.0 1.0
   62    66   -73    53   0.05600 -1.0 2.0
   62    66   -73    53   0.26150  1.0 3.0
   62    66    73    74   0.30150 -1.0 2.0
   63    62    66    67   0.15000  1.0 3.0
   63    62    66    68   0.15000  1.0 3.0
   63    62    66    73  -0.11250  1.0 3.0
   64    62    66    67   0.15000  1.0 3.0
   64    62    66    68   0.15000  1.0 3.0
   64    62    66    73  -0.11250  1.0 3.0
   67    66    73    53   0.00000  1.0 1.0
   67    66    73    74   0.00000  1.0 1.0
   68    66    73    53   0.00000  1.0 1.0
   68    66    73    74   0.00000  1.0 1.0
   73    53    56    57   0.30150 -1.0 2.0
   73    53   -56    62   0.65300  1.0 1.0
   73    53   -56    62  -0.03850 -1.0 2.0
   73    53   -56    62   0.33900  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
   36    30    35    37  10.50000 -1.0 2.0
   33    39    38    43  15.00000 -1.0 2.0
   47    44    43    38  15.00000 -1.0 2.0
   43    48    47    51  15.00000 -1.0 2.0
   55    52    51    47  15.00000 -1.0 2.0
   55    59    58    65   1.10000 -1.0 2.0
   69    71    65    58   1.10000 -1.0 2.0
   65    75    69    70  10.50000 -1.0 2.0
   72    77    71    65   1.00000 -1.0 2.0
   71    81    77    78  10.50000 -1.0 2.0
   77    85    81    83  15.00000 -1.0 2.0
   89    84    83    81  15.00000 -1.0 2.0
   83    92    89    90  15.00000 -1.0 2.0
   96    91    90    89  15.00000 -1.0 2.0
   40    49    45    46  10.50000 -1.0 2.0
   50    45    49    53   1.00000 -1.0 2.0
   53    62    56    57  10.50000 -1.0 2.0
   53    66    73    74  10.50000 -1.0 2.0
END
