* LIGAND DATABASE FILE (OPLS2005)
*
001     112   113    213    315     630
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02029    99.77256    21.02933
    3     1 S   H    _H1_     3     1.02118    37.16064   129.17261
    4     1 S   H    _H2_     4     1.02122    78.25241   -86.21221
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.05972   107.41041    47.01581
    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     1.34015   114.76575   162.47883
   19    18 S   H    _HN2    19     1.04748   118.84952     8.59078
   20    18 S   CT1  _CA2    20     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    21     1.08457   106.27517   -11.11459
   22    20 S   C    _C2_    22     1.54037   112.60135  -130.27230
   23    22 S   O    _O2_    23     1.23085   119.01196  -169.64989
   24    20 S   CT   _CB2    32     1.54652   109.46586   105.32505
   25    24 S   HC   HB21    33     1.08519   110.56213    58.83396
   26    24 S   HC   HB22    34     1.08612   109.94660   179.13182
   27    22 S   N    _N3_    24     1.34263   118.97450    10.45203
   28    27 S   H    _HN3    25     1.03492   120.05970     5.06895
   29    24 S   S    _SG2    35     1.81647   112.43692   -61.22030
   30    27 S   CT   _CA3    26     1.46098   124.53040  -172.10347
   31    30 S   HC   HA31    27     1.12298   109.15732    14.31073
   32    30 S   HC   HA32    28     1.12301   109.23063   127.81991
   33    29 S   CT   _C16    36     1.84007    97.58502   161.85233
   34    33 S   HC   _H3_    37     1.09596   104.28728   -42.61398
   35    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   36    35 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   37    35 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   38    33 S   CT   _C6_    38     1.53723   108.34775  -160.00201
   39    38 S   HC   _H35    39     1.09782   112.34177   -41.66385
   40    38 S   HC   _H36    40     1.09360   111.39863  -159.49202
   41    33 S   CT   _C12    59     1.56117   110.03975    73.41084
   42    41 S   HC   _H44    60     1.09935   108.33362   -34.45688
   43    38 S   CO4  _C4_    41     1.52357   112.44801    81.00926
   44    43 S   O    _O27    42     1.23099   120.95265  -101.19798
   45    41 S   CT   _C23    61     1.53585   112.53739    83.24899
   46    45 S   HC   _H61    62     1.08670   109.37706    61.31334
   47    45 S   HC   _H62    63     1.08545   109.41973   -58.68712
   48    45 S   HC   _H63    64     1.08554   109.39954  -178.70457
   49    43 S   CT   _C9_    43     1.53024   116.72126    79.41285
   50    49 S   HC   _H41    44     1.09329   105.82957   -37.15083
   51    49 S   CT   _C7_    45     1.53932   109.50239    82.37941
   52    51 S   HC   _H37    46     1.09611   109.92822   -39.87048
   53    51 S   HC   _H38    47     1.09889   108.56239    73.87941
   54    49 S   CT   _C20   109     1.52663   110.92278  -153.31385
   55    54 S   HC   _H52   110     1.08852   109.86677   -64.77679
   56    54 S   HC   _H53   111     1.08916   109.82618   175.14441
   57    54 S   HC   _H54   112     1.08924   109.78561    55.16738
   58    51 S   CT   _C11    48     1.54743   115.49137  -163.88932
   59    58 S   HC   _H43    49     1.09887   107.76116   -65.41022
   60    58 S   CT   _C14    50     1.55109   114.46068    53.60508
   61    60 S   HC   _H46    51     1.09591   107.32908   -62.14957
   62    58 S   CT   _C22   105     1.53612   109.30754  -179.82306
   63    62 S   HC   _H58   106     1.08592   109.40691   -64.24894
   64    62 S   HC   _H59   107     1.08640   109.40166   175.81334
   65    62 S   HC   _H60   108     1.08612   109.46044    55.79086
   66    60 S   CT   _C10    52     1.55134   114.99731    60.29360
   67    66 S   HC   _H42    53     1.09809   109.90573   -14.61534
   68    60 S   OS   _O35    77     1.42973   108.44201  -174.55994
   69    66 S   CO4  _C5_    54     1.52215   108.73103  -131.03385
   70    69 S   O    _O28    55     1.22447   124.09081   -62.81023
   71    66 S   CT   _C21    73     1.52811   115.34303   106.59165
   72    71 S   HC   _H55    74     1.08811   109.79334    57.34192
   73    71 S   HC   _H56    75     1.08841   109.77827   -62.70187
   74    71 S   HC   _H57    76     1.08874   109.78611   177.36738
   75    68 S   CO   _C19    78     1.42700   111.19134   114.23457
   76    75 S   HC   _H51    79     1.09687   107.22337    60.02725
   77    69 S   OS   _O29    56     1.36515   109.69788   115.57640
   78    75 S   CT   _C15    80     1.53262   107.91701   179.58693
   79    78 S   HC   _H47    81     1.09756   109.50809    51.48477
   80    77 S   CT   _C18    57     1.44269   117.94556  -172.87803
   81    80 S   HC   _H50    58     1.09857   108.93879    36.61653
   82    78 S   CT   _C13    82     1.53485   110.92178   173.94887
   83    82 S   HC   _H45    83     1.09320   109.38734    70.37113
   84    78 S   OH   _O33   103     1.42732   107.92341   -65.60195
   85    84 S   HO   _H77   104     0.96931   106.42390   -61.06348
   86    80 S   CT   _C28    65     1.52774   109.17920   -81.82430
   87    86 S   HC   _H76    66     1.09280   109.13878    57.50947
   88    82 S   CT   _C8_    84     1.53113   110.44331   -50.06104
   89    88 S   HC   _H39    85     1.09708   110.35585   174.23122
   90    88 S   HC   _H40    86     1.09883   109.24512   -67.95378
   91    82 S   NTH0 _N26    94     1.46373   110.78716  -171.58604
   92    86 S   CT   _C25    67     1.51818   111.67449   179.15721
   93    92 S   HC   _H67    68     1.09389   111.43470    58.76191
   94    92 S   HC   _H68    69     1.09563   110.08255   -61.80766
   95    92 S   HC   _H69    70     1.09531   111.23121  -179.82306
   96    86 S   OH   _O34    71     1.42194   108.97198   -59.81043
   97    96 S   HO   _H78    72     0.97063   106.80152   179.98022
   98    88 S   CT   _C17    87     1.52907   110.22316    52.10689
   99    98 S   HC   _H49    88     1.09715   110.56629    62.39179
  100    91 S   CT   _C26    95     1.46209   110.38091   -77.93752
  101   100 S   HC   _H70    96     1.09264   110.12497   179.97202
  102   100 S   HC   _H71    97     1.09356   110.20326    60.01466
  103   100 S   HC   _H72    98     1.09259   110.24878   -59.94812
  104    91 S   CT   _C27    99     1.46179   110.41229   159.60213
  105   104 S   HC   _H73   100     1.09254   110.12820  -180.00000
  106   104 S   HC   _H74   101     1.09350   110.20559    59.89442
  107   104 S   HC   _H75   102     1.09356   110.19554   -60.01641
  108    75 S   OS   _O30    89     1.42580   109.67492   -59.63032
  109    98 S   CT   _C24    90     1.52259   111.07136  -176.86013
  110   109 S   HC   _H64    91     1.08916   110.10852    58.17185
  111   109 S   HC   _H65    92     1.09065   110.01837   -61.84211
  112   109 S   HC   _H66    93     1.09117   110.03641   178.22778
  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
  17   8   2   1   1  12   5   4  14   8  11   4   7   3   2   1
  12   8  16   6   5   4   2   1   1  13   8  19   7   5   2   1
   1  11   8  10   9   3   4   2   1   1  13   6   6  13   7   9
   4  19   8   4   1   7   6  12   6   5   9   5   3   2   1   1
   1   6   5   7   3   2   1   3   2   1   1   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    41    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    43    80    41    42    45  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    43    44    49    77    80    81    41    42    45    46    47    48    86  
   38    39    40    43    80    41    42    45  
   36    37  
   37  
    0  
   39    40    43    44    49    50    51    80    41    42    45    54  
   40    43    44    49    41  
   43    44    49    41  
   42    45    46    47    48    86    87    92    96    43    69    77    80    81  
   45    46    47    48    86    77    80    81  
   44    49    50    51    52    53    58    54    55    56    57  
   49    50    51    54  
   46    47    48    86    77    80    81  
   47    48    80  
   48    80  
   80  
   50    51    52    53    58    59    60    62    54    55    56    57  
   51    52    53    58    54    55    56    57  
   52    53    58    59    60    61    66    68    62    63    64    65    54    55    56    57  
   53    58    59    60    62    54  
   58    59    60    62    54  
   55    56    57    58  
   56    57  
   57  
    0  
   59    60    61    66    67    69    71    68    75    62    63    64    65  
   60    61    66    68    62    63    64    65  
   61    66    67    69    70    77    71    72    73    74    68    75    76    78   108    62    63    64    65  
   66    67    69    71    68    75    62  
   63    64    65    66    68  
   64    65  
   65  
    0  
   67    69    70    77    80    71    72    73    74    68    75  
   69    70    77    71    72    73    74    68  
   75    76    78    79    82    98   108    84    69    71  
   70    77    80    81    86    71    72    73    74  
   77    80    71  
   72    73    74    77  
   73    74  
   74  
    0  
   76    78    79    82    83    88    98    99   108   109    91    84    85  
   78    79    82    98   108    84  
   80    81    86    87    92    96  
   79    82    83    88    89    90    98   108    91   100   104    84    85  
   82    83    88   108    91    84    85  
   81    86    87    92    93    94    95    96    97  
   86    87    92    96  
   83    88    89    90    98    99   108   109    91   100   101   102   103   104   105   106   107    84    85  
   88    89    90    98    91   100   104    84  
   85    88    91   108  
    0  
   87    92    93    94    95    96    97  
   92    93    94    95    96    97  
   89    90    98    99   108   109   110   111   112    91   100   104  
   90    98    99   108   109    91  
   98    99   108   109    91  
  100   101   102   103   104   105   106   107    98  
   93    94    95    96    97  
   94    95    96  
   95    96  
   96  
   97  
    0  
   99   108   109   110   111   112  
  108   109   110   111   112  
  101   102   103   104   105   106   107  
  102   103   104  
  103   104  
  104  
  105   106   107  
  106   107  
  107  
    0  
  109   110   111   112  
  110   111   112  
  111   112  
  112  
    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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   45   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   68   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   69   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   70   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   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   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   76   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   77   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   78   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   82   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   85   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   86   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   97   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   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   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
  101   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  102   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  103   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  104   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
  105   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  108   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
  109   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  110   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  112   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   268.000  1.529
   33    41   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    43   317.000  1.522
   43    44   570.000  1.229
   43    49   317.000  1.522
   49    50   340.000  1.090
   49    51   268.000  1.529
   49    54   268.000  1.529
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    58   268.000  1.529
   58    59   340.000  1.090
   58    60   268.000  1.529
   58    62   268.000  1.529
   60    61   340.000  1.090
   60    66   268.000  1.529
   60    68   320.000  1.410
   66    67   340.000  1.090
   66    69   317.000  1.522
   66    71   268.000  1.529
   69    70   570.000  1.229
   69    77   214.000  1.327
   77    80   320.000  1.410
   80    81   340.000  1.090
   80    41   268.000  1.529
   80    86   268.000  1.529
   41    42   340.000  1.090
   41    45   268.000  1.529
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   340.000  1.090
   86    87   340.000  1.090
   86    92   268.000  1.529
   86    96   320.000  1.410
   92    93   340.000  1.090
   92    94   340.000  1.090
   92    95   340.000  1.090
   96    97   553.000  0.945
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   340.000  1.090
   68    75   320.000  1.380
   75    76   340.000  1.090
   75    78   250.000  1.527
   75   108   320.000  1.380
   78    79   340.000  1.090
   78    82   268.000  1.529
   78    84   320.000  1.410
   82    83   340.000  1.090
   82    88   268.000  1.529
   82    91   310.000  1.447
   88    89   340.000  1.090
   88    90   340.000  1.090
   88    98   268.000  1.529
   98    99   340.000  1.090
   98   108   320.000  1.410
   98   109   268.000  1.529
  109   110   340.000  1.090
  109   111   340.000  1.090
  109   112   340.000  1.090
   91   100   310.000  1.447
   91   104   310.000  1.447
  100   101   340.000  1.090
  100   102   340.000  1.090
  100   103   340.000  1.090
  104   105   340.000  1.090
  104   106   340.000  1.090
  104   107   340.000  1.090
   84    85   553.000  0.945
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   340.000  1.090
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  111.63000
   29    33    41    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    43    63.00000  111.10000
   33    41    80    58.35000  112.70000
   33    41    42    37.50000  110.70000
   33    41    45    58.35000  112.70000
   38    33    34    37.50000  110.70000
   38    43    44    80.00000  120.40000
   38    43    49    70.00000  116.00000
   40    38    39    33.00000  107.80000
   43    38    39    35.00000  109.50000
   43    38    40    35.00000  109.50000
   43    49    50    35.00000  109.50000
   43    49    51    63.00000  111.10000
   43    49    54    63.00000  111.10000
   49    43    44    80.00000  120.40000
   49    51    52    37.50000  110.70000
   49    51    53    37.50000  110.70000
   49    51    58    58.35000  112.70000
   49    54    55    37.50000  110.70000
   49    54    56    37.50000  110.70000
   49    54    57    37.50000  110.70000
   51    49    50    37.50000  110.70000
   51    58    59    37.50000  110.70000
   51    58    60    58.35000  112.70000
   51    58    62    58.35000  112.70000
   53    51    52    33.00000  107.80000
   58    51    52    37.50000  110.70000
   58    51    53    37.50000  110.70000
   58    60    61    37.50000  110.70000
   58    60    66    58.35000  112.70000
   58    60    68    50.00000  109.50000
   58    62    63    37.50000  110.70000
   58    62    64    37.50000  110.70000
   58    62    65    37.50000  110.70000
   60    58    59    37.50000  110.70000
   60    66    67    37.50000  110.70000
   60    66    69    63.00000  111.10000
   60    66    71    58.35000  112.70000
   60    68    75    60.00000  109.50000
   66    60    61    37.50000  110.70000
   66    69    70    80.00000  120.40000
   66    69    77    81.00000  111.40000
   66    71    72    37.50000  110.70000
   66    71    73    37.50000  110.70000
   66    71    74    37.50000  110.70000
   69    66    67    35.00000  109.50000
   69    77    80    83.00000  116.90000
   77    69    70    83.00000  123.40000
   77    80    81    35.00000  109.50000
   77    80    41    50.00000  109.50000
   77    80    86    50.00000  109.50000
   80    41    42    37.50000  110.70000
   80    41    45    58.35000  112.70000
   80    86    87    37.50000  110.70000
   80    86    92    58.35000  112.70000
   80    86    96    50.00000  109.50000
   41    33    34    37.50000  110.70000
   41    33    38    58.35000  112.70000
   41    80    81    37.50000  110.70000
   41    45    46    37.50000  110.70000
   41    45    47    37.50000  110.70000
   41    45    48    37.50000  110.70000
   45    41    42    37.50000  110.70000
   47    45    46    33.00000  107.80000
   48    45    46    33.00000  107.80000
   48    45    47    33.00000  107.80000
   86    80    81    37.50000  110.70000
   86    80    41    58.35000  112.70000
   86    92    93    37.50000  110.70000
   86    92    94    37.50000  110.70000
   86    92    95    37.50000  110.70000
   86    96    97    55.00000  108.50000
   92    86    87    37.50000  110.70000
   94    92    93    33.00000  107.80000
   95    92    93    33.00000  107.80000
   95    92    94    33.00000  107.80000
   96    86    87    35.00000  109.50000
   96    86    92    50.00000  109.50000
   71    66    67    37.50000  110.70000
   71    66    69    63.00000  111.10000
   73    71    72    33.00000  107.80000
   74    71    72    33.00000  107.80000
   74    71    73    33.00000  107.80000
   68    60    61    35.00000  109.50000
   68    60    66    50.00000  109.50000
   68    75    76    35.00000  109.50000
   68    75    78    90.00000  108.56700
   68    75   108    92.60000  111.55000
   75    78    79    45.00000  108.72000
   75    78    82    75.00000  109.43000
   75    78    84    90.00000  111.58700
   75   108    98    60.00000  109.50000
   78    75    76    45.00000  112.01100
   78    82    83    37.50000  110.70000
   78    82    88    58.35000  112.70000
   78    82    91    75.00000  113.73300
   78    84    85    55.00000  108.50000
   82    78    79    37.50000  110.70000
   82    88    89    37.50000  110.70000
   82    88    90    37.50000  110.70000
   82    88    98    58.35000  112.70000
   82    91   100    80.00000  110.40700
   82    91   104    80.00000  110.40700
   88    82    83    37.50000  110.70000
   88    98    99    37.50000  110.70000
   88    98   108    50.00000  109.50000
   88    98   109    58.35000  112.70000
   90    88    89    33.00000  107.80000
   98    88    89    37.50000  110.70000
   98    88    90    37.50000  110.70000
   98   109   110    37.50000  110.70000
   98   109   111    37.50000  110.70000
   98   109   112    37.50000  110.70000
  108    75    76    35.00000  109.50000
  108    75    78    90.00000  108.56700
  108    98    99    35.00000  109.50000
  109    98    99    37.50000  110.70000
  109    98   108    50.00000  109.50000
  111   109   110    33.00000  107.80000
  112   109   110    33.00000  107.80000
  112   109   111    33.00000  107.80000
   91    82    83    50.00000  110.15500
   91    82    88    75.00000  113.73300
   91   100   101    50.00000  110.15500
   91   100   102    50.00000  110.15500
   91   100   103    50.00000  110.15500
   91   104   105    50.00000  110.15500
   91   104   106    50.00000  110.15500
   91   104   107    50.00000  110.15500
  102   100   101    33.00000  107.80000
  103   100   101    33.00000  107.80000
  103   100   102    33.00000  107.80000
  104    91   100    80.00000  110.40700
  106   104   105    33.00000  107.80000
  107   104   105    33.00000  107.80000
  107   104   106    33.00000  107.80000
   84    78    79    35.00000  109.50000
   84    78    82    50.00000  109.50000
   62    58    59    37.50000  110.70000
   62    58    60    58.35000  112.70000
   64    62    63    33.00000  107.80000
   65    62    63    33.00000  107.80000
   65    62    64    33.00000  107.80000
   54    49    50    37.50000  110.70000
   54    49    51    58.35000  112.70000
   56    54    55    33.00000  107.80000
   57    54    55    33.00000  107.80000
   57    54    56    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    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
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  108    75    78    84   3.69350  1.0 1.0
  108    75    78    84  -1.82950 -1.0 2.0
  108    98   109   110   0.23400  1.0 3.0
  108    98   109   111   0.23400  1.0 3.0
  108    98   109   112   0.23400  1.0 3.0
  109    98   108    75   0.06250  1.0 1.0
  109    98   108    75  -0.01100 -1.0 2.0
  109    98   108    75   0.28050  1.0 3.0
   91    82    88    89   0.15000  1.0 3.0
   91    82    88    90   0.15000  1.0 3.0
   91    82    88    98   1.85550  1.0 1.0
   91    82    88    98  -0.84100 -1.0 2.0
  100    91   104   105   0.28000  1.0 3.0
  100    91   104   106   0.28000  1.0 3.0
  100    91   104   107   0.28000  1.0 3.0
  104    91   100   101   0.28000  1.0 3.0
  104    91   100   102   0.28000  1.0 3.0
  104    91   100   103   0.28000  1.0 3.0
   84    78    82    83   0.23400  1.0 3.0
   84    78    82    88   0.86500  1.0 1.0
   84    78    82    88  -0.17500 -1.0 2.0
   84    78    82    88   0.20800  1.0 3.0
   84    78    82    91   3.18500  1.0 1.0
   62    58    60    61   0.15000  1.0 3.0
   62    58    60    66   0.56750  1.0 1.0
   62    58    60    66  -0.07550 -1.0 2.0
   62    58    60    66   0.20000  1.0 3.0
   62    58    60    68   0.62750  1.0 1.0
   62    58    60    68  -0.30950 -1.0 2.0
   62    58    60    68   0.27300  1.0 3.0
   54    49    51    52   0.15000  1.0 3.0
   54    49    51    53   0.15000  1.0 3.0
   54    49    51    58   0.56750  1.0 1.0
   54    49    51    58  -0.07550 -1.0 2.0
   54    49    51    58   0.20000  1.0 3.0
IPHI
    9     5     7     8  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
   37    30    35    36  10.50000 -1.0 2.0
   38    49    43    44  10.50000 -1.0 2.0
   66    77    69    70  10.50000 -1.0 2.0
END
