* LIGAND DATABASE FILE (OPLS2005)
*
001     110   113    202    330     597
    1     0 S   NP   _N1_     1    28.70111    93.89000   -20.80213
    2     1 S   H    _HN1     2     1.02076    32.84125   165.53586
    3     1 S   H    _H1_     3     1.02134    90.28349   -68.78004
    4     1 S   H    _H2_     4     1.02051    90.33883    39.92341
    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   167.74439
   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    57.98761
   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     8.59075
   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   105.32504
   25    24 S   HC   HB21    33     1.08638   110.54412    58.87165
   26    24 S   HC   HB22    34     1.08575   109.90351   179.04858
   27    22 S   N    _N3_    24     1.34263   118.97449    10.45205
   28    27 S   H    _HN3    25     1.03492   120.05970     5.06898
   29    24 S   S    _SG2    35     1.81647   112.43692   -61.22029
   30    27 S   CT   _CA3    26     1.46098   124.53040  -172.10345
   31    30 S   HC   HA31    27     1.12298   109.15732    14.31071
   32    30 S   HC   HA32    28     1.12301   109.23063   127.81991
   33    29 S   CT   _C34    36     1.82130    98.18261  -178.14017
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13160
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33884
   37    33 S   CT   _C23    37     1.53238   111.27523   -60.03866
   38    37 S   HC   _H57    38     1.09540   112.88895    76.52900
   39    37 S   HC   _H58    39     1.09806   111.53924   -46.08395
   40    33 S   OH   _O40   109     1.43034   109.63788    59.52372
   41    40 S   HO   _H76   110     0.96824   106.23423    58.55951
   42    37 S   CT   _C22    40     1.52751   104.44816  -163.65837
   43    42 S   HC   _H55    41     1.09394   111.81651   -82.80316
   44    42 S   HC   _H56    42     1.09170   111.70148   152.42057
   45    42 S   CO4  _C7_    43     1.50697   101.77235    33.57755
   46    45 S   O    _O35    44     1.22485   123.45367   162.05245
   47    33 S   CT1  _C30    45     1.53965   114.60100  -178.54290
   48    47 S   HC   _H70    46     1.09505   112.52905   -92.82816
   49    47 S   N    _N33    47     1.43386   116.47367    35.40632
   50    49 S   H    _H74    48     1.01605   117.06578    20.87042
   51    49 S   C    _C21    49     1.38481   123.05915  -159.48539
   52    51 S   O    _O37    50     1.22612   125.73444     0.01978
   53    51 S   CM   _C15    51     1.48969   111.77692  -179.94766
   54    53 S   HC   _H50    52     1.08564   118.47198     0.04846
   55    53 S   CM   _C13    53     1.34081   120.16169   180.00000
   56    55 S   HC   _H48    54     1.08705   120.55614     0.04846
   57    55 S   CM   _C9_    55     1.44771   122.65594  -179.98022
   58    57 S   HC   _H44    56     1.08721   117.00382     0.05935
   59    57 S   CM   _C11    57     1.34197   122.97275  -179.96044
   60    59 S   HC   _H46    58     1.08720   120.02352     0.01978
   61    59 S   CM   _C17    59     1.44612   122.93171  -179.92598
   62    61 S   HC   _H52    60     1.08713   117.36490    -0.02798
   63    61 S   CM   _C19    61     1.34127   123.11542   180.00000
   64    63 S   HC   _H54    62     1.08712   120.10296     0.00000
   65    63 S   CT   _C33    63     1.49421   123.68752   179.96574
   66    65 S   CM   _C4_    64     1.51943   109.05408    89.99901
   67    66 S   HC   _H42    65     1.09026   115.63082    59.80899
   68    65 S   OH   _O39   107     1.43735   107.95488  -155.14145
   69    68 S   HO   _H75   108     0.96647   105.80396   -56.84779
   70    66 S   CM   _C5_    66     1.34205   125.96183  -119.33387
   71    70 S   CO4  _C6_    67     1.48793   121.52015    -1.67748
   72    71 S   O    _O34    68     1.22512   122.34311   178.25909
   73    70 S   N    _N32    74     1.36617   121.52659   178.74306
   74    73 S   H    _H73    75     1.01605   116.34794   149.99044
   75    71 S   C3T  _C29    69     1.47498   117.40809    -2.43574
   76    75 S   HC   _H69    70     1.08391   116.51540   154.40484
   77    73 S   C    _C20    76     1.38571   123.46295   -30.03669
   78    77 S   O    _O36    77     1.22672   126.00990     0.09891
   79    65 S   C3T  _C32    71     1.51092   112.23395   -37.09980
   80    79 S   HC   _H72    72     1.08140   114.57727   -36.02421
   81    77 S   CM   _C14    78     1.49105   111.65010   179.97202
   82    81 S   HC   _H49    79     1.08560   118.39719     0.00000
   83    75 S   O3T  _O38    73     1.43681   113.08223   -65.17214
   84    81 S   CM   _C12    80     1.34055   120.19675  -179.93439
   85    84 S   HC   _H47    81     1.08666   120.57786    -0.10279
   86    84 S   CM   _C8_    82     1.44696   122.66835  -180.00000
   87    86 S   HC   _H43    83     1.08823   117.00933    -0.10653
   88    86 S   CM   _C10    84     1.34136   123.03076   179.96574
   89    88 S   HC   _H45    85     1.08706   119.99432    -0.04423
   90    88 S   CM   _C16    86     1.44618   122.97884   179.90935
   91    90 S   HC   _H51    87     1.08756   117.36642     0.00000
   92    90 S   CM   _C18    88     1.34092   123.15385   179.95154
   93    92 S   HC   _H53    89     1.08721   120.08237     0.08156
   94    92 S   CT   _C31    90     1.50042   123.68890   180.00000
   95    94 S   HC   _H71    91     1.08137   107.61020     0.11364
   96    94 S   CT   _C27    92     1.53085   109.88928   118.49906
   97    96 S   HC   _H65    93     1.09044   111.07958    53.22788
   98    96 S   HC   _H66    94     1.09114   108.81911   -64.41038
   99    96 S   CT   _C25    95     1.52636   111.67561   176.18105
  100    99 S   HC   _H61    96     1.09566   109.69434  -175.80679
  101    99 S   HC   _H62    97     1.09556   109.56732    67.18336
  102    99 S   CT   _C24    98     1.52525   111.67305   -54.31516
  103   102 S   HC   _H59    99     1.09644   109.51134   175.93201
  104   102 S   HC   _H60   100     1.09655   109.65755   -67.08196
  105   102 S   CT   _C26   101     1.52562   111.59699    54.50295
  106   105 S   HC   _H63   102     1.09656   109.46904    66.86897
  107   105 S   HC   _H64   103     1.09695   109.58410  -176.46986
  108    94 S   CT   _C28   104     1.53036   109.95763  -118.41477
  109   108 S   HC   _H67   105     1.09298   108.93670    64.16717
  110   108 S   HC   _H68   106     1.09108   111.02209   -53.30069
  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
  15   2   1   1  12   7   6   6   1   7   4   3   6   3   6   3
   6   3   6   3   6   3   6   3   6   3   6   3   7   3  11   4
  12  13   5   6   1  11   9   5   7   3   4   3   6   3   2   1
   6   3   1   6   3   6   3   6   3   7   3  11   4  14   8  12
   6   5   9   5   4   8   5   4   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    47    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    42    45    47    48    49    40    41  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    42    43    44    45    46    47    48    49    50    51    40    41  
   35    36  
   36  
    0  
   38    39    42    43    44    45    46    47    48    49    40    41  
   39    42    43    44    45    47    40  
   42    43    44    45    47    40  
   41    42    45    47    48    49  
   47  
   43    44    45    46    47    48    49  
   44    45    46    47  
   45    46    47  
   46    47    48    49    50    51  
   47    48    49  
   48    49    50    51    52    53  
   49    50    51  
   50    51    52    53    54    55  
   51    52    53  
   52    53    54    55    56    57  
   53    54    55  
   54    55    56    57    58    59  
   55    56    57  
   56    57    58    59    60    61  
   57    58    59  
   58    59    60    61    62    63  
   59    60    61  
   60    61    62    63    64    65  
   61    62    63  
   62    63    64    65    66    79    68  
   63    64    65  
   64    65    66    67    70    75    79    80    83    68    69  
   65    66    79    68  
   66    67    70    71    75    76    79    80    83    73    68    69  
   67    70    71    72    75    79    80    83    73    74    77    68    69  
   70    71    79    73    68  
   69    70    75    79    80    83  
   79  
   71    72    75    76    79    83    73    74    77    78    81  
   72    75    76    79    80    83    73    74    77  
   75    76    79    83    73  
   74    77    78    81    82    84    75  
   77    78    81  
   76    79    80    83  
   79    80    83  
   78    81    82    84    85    86  
   81    82    84  
   80    83  
   83  
   82    84    85    86    87    88  
   84    85    86  
    0  
   85    86    87    88    89    90  
   86    87    88  
   87    88    89    90    91    92  
   88    89    90  
   89    90    91    92    93    94  
   90    91    92  
   91    92    93    94    95    96   108  
   92    93    94  
   93    94    95    96    97    98    99   105   108   109   110  
   94    95    96   108  
   95    96    97    98    99   100   101   102   105   106   107   108   109   110  
   96    97    98    99   105   108   109   110  
   97    98    99   100   101   102   103   104   105   108   109   110  
   98    99   100   101   102   108  
   99   100   101   102   108  
  100   101   102   103   104   105   106   107   108  
  101   102   103   104   105  
  102   103   104   105  
  103   104   105   106   107   108   109   110  
  104   105   106   107   108  
  105   106   107   108  
  106   107   108   109   110  
  107   108   109   110  
  108   109   110  
  109   110  
  110  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.432500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   41   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   42   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   47   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   49   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   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
   52   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   53   3.5500   0.0760  -0.171700   2.0020   1.7750   0.023028004  -0.852763146
   54   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   56   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   58   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   60   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   62   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   64   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   66   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   67   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   68   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   69   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   70   3.5500   0.0760   0.051300   2.0020   1.7750   0.023028004  -0.852763146
   71   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   72   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   73   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
   74   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   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  -0.171700   2.0020   1.7750   0.023028004  -0.852763146
   82   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   83   2.9000   0.1400  -0.352400   1.5900   1.4000   0.020110767  -0.896042159
   84   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   85   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   86   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   87   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   88   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   89   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   93   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   94   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   99   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  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
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   268.000  1.529
   33    47   268.000  1.529
   33    40   320.000  1.410
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    42   268.000  1.529
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    45   317.000  1.522
   45    46   570.000  1.229
   45    47   255.000  1.522
   47    48   340.000  1.090
   47    49   337.000  1.449
   49    50   434.000  1.010
   49    51   490.000  1.335
   51    52   570.000  1.229
   51    53   410.000  1.444
   53    54   340.000  1.080
   53    55   549.000  1.340
   55    56   340.000  1.080
   55    57   380.000  1.444
   57    58   340.000  1.080
   57    59   549.000  1.340
   59    60   340.000  1.080
   59    61   380.000  1.444
   61    62   340.000  1.080
   61    63   549.000  1.340
   63    64   340.000  1.080
   63    65   317.000  1.510
   65    66   317.000  1.510
   65    79   275.000  1.510
   65    68   320.000  1.410
   66    67   340.000  1.080
   66    70   549.000  1.340
   70    71   320.000  1.462
   70    73   400.000  1.384
   71    72   570.000  1.229
   71    75   290.000  1.496
   75    76   340.000  1.088
   75    79   260.000  1.509
   75    83   335.000  1.432
   79    80   340.000  1.088
   79    83   335.000  1.432
   73    74   434.000  1.010
   73    77   490.000  1.335
   77    78   570.000  1.229
   77    81   410.000  1.444
   81    82   340.000  1.080
   81    84   549.000  1.340
   84    85   340.000  1.080
   84    86   380.000  1.444
   86    87   340.000  1.080
   86    88   549.000  1.340
   88    89   340.000  1.080
   88    90   380.000  1.444
   90    91   340.000  1.080
   90    92   549.000  1.340
   92    93   340.000  1.080
   92    94   317.000  1.510
   94    95   340.000  1.090
   94    96   268.000  1.529
   94   108   268.000  1.529
   96    97   340.000  1.090
   96    98   340.000  1.090
   96    99   268.000  1.529
   99   100   340.000  1.090
   99   101   340.000  1.090
   99   102   268.000  1.529
  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
   68    69   553.000  0.945
   40    41   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  111.63000
   29    33    47    75.00000  108.68000
   29    33    40    85.00000  114.68000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    42    58.35000  112.70000
   33    47    45    70.00000  110.61500
   33    47    48    37.50000  110.70000
   33    47    49    80.00000  109.70000
   33    40    41    55.00000  108.50000
   37    42    43    37.50000  110.70000
   37    42    44    37.50000  110.70000
   37    42    45    63.00000  111.10000
   39    37    38    33.00000  107.80000
   42    37    38    37.50000  110.70000
   42    37    39    37.50000  110.70000
   42    45    46    80.00000  120.40000
   42    45    47    65.00000  117.09000
   44    42    43    33.00000  107.80000
   45    42    43    35.00000  109.50000
   45    42    44    35.00000  109.50000
   45    47    48    45.00000  110.09800
   45    47    49    80.00000  110.29000
   47    33    37    58.35000  112.70000
   47    45    46    75.00000  123.42600
   47    49    50    38.00000  118.40000
   47    49    51    50.00000  121.90000
   49    47    48    35.00000  109.50000
   49    51    52    80.00000  122.90000
   49    51    53    80.00000  111.56200
   51    49    50    35.00000  119.80000
   51    53    54    35.00000  119.70000
   51    53    55    70.00000  118.70000
   53    51    52    80.00000  125.30000
   53    55    56    35.00000  120.00000
   53    55    57    70.00000  123.01800
   55    53    54    35.00000  120.00000
   55    57    58    35.00000  120.00000
   55    57    59    70.00000  123.01800
   57    55    56    35.00000  120.00000
   57    59    60    35.00000  120.00000
   57    59    61    70.00000  123.01800
   59    57    58    35.00000  120.00000
   59    61    62    35.00000  120.00000
   59    61    63    70.00000  123.01800
   61    59    60    35.00000  120.00000
   61    63    64    35.00000  120.00000
   61    63    65    70.00000  124.00000
   63    61    62    35.00000  120.00000
   63    65    66    70.00000  110.12100
   63    65    79    70.00000  112.02700
   63    65    68    90.00000  110.39200
   65    63    64    35.00000  117.00000
   65    66    67    35.00000  117.00000
   65    66    70    70.00000  124.00000
   65    79    75    60.00000  120.94000
   65    79    80    40.00000  115.04500
   65    79    83    80.00000  116.47100
   65    68    69    55.00000  108.50000
   66    70    71    65.00000  118.96000
   66    70    73    75.00000  120.83300
   70    66    67    35.00000  120.00000
   70    71    72    80.00000  123.72100
   70    71    75    65.00000  118.62400
   70    73    74    45.00000  117.55000
   70    73    77    70.00000  120.89900
   71    75    76    40.00000  116.18000
   71    75    79    65.00000  117.18000
   71    75    83    80.00000  114.91000
   75    71    72    75.00000  121.36600
   75    79    80    37.50000  117.20000
   75    79    83    15.00000   60.43100
   75    83    79    15.00000   59.14900
   79    65    66    70.00000  112.02700
   79    75    76    37.50000  117.20000
   83    75    76    50.00000  114.27700
   83    75    79    15.00000   60.43100
   83    79    80    50.00000  114.27700
   73    70    71    70.00000  117.92000
   73    77    78    80.00000  122.90000
   73    77    81    80.00000  111.56200
   77    73    74    35.00000  119.80000
   77    81    82    35.00000  119.70000
   77    81    84    70.00000  118.70000
   81    77    78    80.00000  125.30000
   81    84    85    35.00000  120.00000
   81    84    86    70.00000  123.01800
   84    81    82    35.00000  120.00000
   84    86    87    35.00000  120.00000
   84    86    88    70.00000  123.01800
   86    84    85    35.00000  120.00000
   86    88    89    35.00000  120.00000
   86    88    90    70.00000  123.01800
   88    86    87    35.00000  120.00000
   88    90    91    35.00000  120.00000
   88    90    92    70.00000  123.01800
   90    88    89    35.00000  120.00000
   90    92    93    35.00000  120.00000
   90    92    94    70.00000  124.00000
   92    90    91    35.00000  120.00000
   92    94    95    35.00000  109.50000
   92    94    96    70.00000  112.02700
   92    94   108    70.00000  112.02700
   94    92    93    35.00000  117.00000
   94    96    97    37.50000  110.70000
   94    96    98    37.50000  110.70000
   94    96    99    58.35000  112.70000
   94   108   105    58.35000  112.70000
   94   108   109    37.50000  110.70000
   94   108   110    37.50000  110.70000
   96    94    95    37.50000  110.70000
   96    99   100    37.50000  110.70000
   96    99   101    37.50000  110.70000
   96    99   102    58.35000  112.70000
   98    96    97    33.00000  107.80000
   99    96    97    37.50000  110.70000
   99    96    98    37.50000  110.70000
   99   102   103    37.50000  110.70000
   99   102   104    37.50000  110.70000
   99   102   105    58.35000  112.70000
  101    99   100    33.00000  107.80000
  102    99   100    37.50000  110.70000
  102    99   101    37.50000  110.70000
  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
  107   105   106    33.00000  107.80000
  108    94    95    37.50000  110.70000
  108    94    96    58.35000  112.70000
  108   105   106    37.50000  110.70000
  108   105   107    37.50000  110.70000
  110   108   109    33.00000  107.80000
   68    65    66    90.00000  110.39200
   68    65    79    50.00000  109.50000
   40    33    37    50.00000  109.50000
   40    33    47    50.00000  109.50000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    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
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  108    94   -96    99   0.20000  1.0 3.0
   68    65    66    67   0.00000  1.0 1.0
   68    65    66    70   0.67800  1.0 1.0
   68    65    66    70   0.47050 -1.0 2.0
   68    65    66    70  -0.62500  1.0 3.0
   68    65    79    75   0.86500  1.0 1.0
   68    65    79    75  -0.17500 -1.0 2.0
   68    65    79    75   0.20800  1.0 3.0
   68    65    79    80   0.23400  1.0 3.0
   68    65    79    83   3.69350  1.0 1.0
   68    65    79    83  -1.82950 -1.0 2.0
   40    33    37    38   0.23400  1.0 3.0
   40    33    37    39   0.23400  1.0 3.0
   40    33    37    42   0.86500  1.0 1.0
   40    33    37    42  -0.17500 -1.0 2.0
   40    33    37    42   0.20800  1.0 3.0
   40    33    47    45  -2.82700  1.0 1.0
   40    33    47    45  -0.43600 -1.0 2.0
   40    33    47    48   0.23400  1.0 3.0
   40    33    47    49   2.71450  1.0 1.0
   40    33    47    49  -0.43950 -1.0 2.0
   40    33    47    49   0.52900  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
   36    30    34    35  10.50000 -1.0 2.0
   42    47    45    46  10.50000 -1.0 2.0
   50    51    49    47   1.00000 -1.0 2.0
   49    53    51    52  10.50000 -1.0 2.0
   51    54    53    55  15.00000 -1.0 2.0
   57    56    55    53  15.00000 -1.0 2.0
   55    58    57    59  15.00000 -1.0 2.0
   61    60    59    57  15.00000 -1.0 2.0
   59    62    61    63  15.00000 -1.0 2.0
   65    64    63    61  15.00000 -1.0 2.0
   65    67    66    70   1.10000 -1.0 2.0
   71    73    70    66   1.10000 -1.0 2.0
   70    75    71    72  10.50000 -1.0 2.0
   74    77    73    70   1.00000 -1.0 2.0
   73    81    77    78  10.50000 -1.0 2.0
   77    82    81    84  15.00000 -1.0 2.0
   86    85    84    81  15.00000 -1.0 2.0
   84    87    86    88  15.00000 -1.0 2.0
   90    89    88    86  15.00000 -1.0 2.0
   88    91    90    92  15.00000 -1.0 2.0
   94    93    92    90  15.00000 -1.0 2.0
END
