* LIGAND DATABASE FILE (OPLS2005)
*
001     102   106    201    332     607
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02124    44.25932   108.40562
    3     1 S   H    _H1_     3     1.02097    68.76440   -98.62397
    4     1 S   H    _H2_     4     1.02060   104.35629     6.20368
    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     1.08491   110.67486    58.67070
   26    24 S   HC   HB22    34     1.08491   110.07674   179.26272
   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   _C22    36     1.91018    95.11455  -158.10947
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CT   _C15    37     1.59118   104.40619   -40.04936
   38    37 S   OM   _O27    38     1.31921   112.71262   -80.64549
   39    37 S   HC   _H47    39     1.10348   105.95848    48.55877
   40    33 S   CT   _C19    62     1.66504   105.68915  -166.84405
   41    37 S   CO4  _C9_    40     1.53479   116.82990   159.64517
   42    41 S   O    _O29    41     1.23195   123.49849   157.40701
   43    40 S   CO4  _C8_    63     1.58997   114.99460    47.68431
   44    43 S   O    _O28    64     1.23183   124.05119    16.79473
   45    40 S   CT   _C24    95     1.55155   111.11794   165.48724
   46    45 S   HC   _H51    96     1.08099   108.63696    55.72728
   47    45 S   HC   _H52    97     1.08121   108.66256   -64.30396
   48    45 S   HC   _H53    98     1.08106   108.64274   175.71097
   49    41 S   OS   _O34    42     1.34935   117.00866   -30.65798
   50    43 S   CT   _C11    65     1.52752   118.49163  -166.02150
   51    50 S   HC   _H40    66     1.09657   107.99457   172.12149
   52    50 S   HC   _H41    67     1.09047   110.45389   -71.25547
   53    49 S   CT   _C14    43     1.44456   124.47299    26.69811
   54    53 S   HC   _H46    44     1.09788   104.73244    81.36368
   55    50 S   CT   _C16    68     1.50675   107.60924    53.88453
   56    55 S   HC   _H48    69     1.10465   104.69639    52.46589
   57    53 S   C5BC _C7_    45     1.52681   106.13617  -170.38209
   58    33 S   CT   _C20    53     1.62260   107.70586    72.33871
   59    86 S   CT   _C21    70     1.57538   114.01185  -164.81651
   60    57 S   C5BC _C4_    46     1.41617   127.01190    40.35650
   61    60 S   HA   _H37    47     1.08017   127.72858     0.00000
   62    58 S   CT   _C13    54     1.54709   111.36511    70.19187
   63    62 S   HC   _H44    55     1.09676   110.39884   -70.86501
   64    62 S   HC   _H45    56     1.09708   110.32261   174.38993
   65    59 S   CT   _C18    71     1.55408   117.19979    63.78148
   66    65 S   HC   _H50    72     1.09831   110.34739    37.31973
   67    59 S   CT   _C29    90     1.54359   113.16943   -63.97523
   68    67 S   HC   _H65    91     1.08408   109.09102   -80.84038
   69    67 S   HC   _H66    92     1.08380   109.05389   158.27982
   70    58 S   CT   _C25    99     1.56583   113.03862   -48.26928
   71    70 S   HC   _H54   100     1.07610   107.81652   -58.11628
   72    70 S   HC   _H55   101     1.07563   107.89274  -178.16304
   73    70 S   HC   _H56   102     1.07625   107.78486    61.83787
   74    60 S   C5A  _C5_    48     1.37560   106.12832  -179.95577
   75    74 S   HA   _H38    49     1.07949   133.75915  -179.93147
   76    62 S   CT   _C12    57     1.52116   114.64384    52.22164
   77    76 S   HC   _H42    58     1.09209   110.89481    65.60438
   78    76 S   HC   _H43    59     1.09149   106.04361  -179.44152
   79    65 S   OS   _O35    73     1.45923   104.75000   151.99008
   80    65 S   CT   _C28    83     1.52356   119.28617   -89.21562
   81    80 S   HC   _H63    84     1.09331   109.10694   -72.34084
   82    80 S   HC   _H64    85     1.09297   109.09258    47.06639
   83    67 S   OH   _O37    93     1.41055   107.89946    38.77737
   84    83 S   HO   _H68    94     0.97382   107.41628   179.97202
   85    74 S   OA   _O33    50     1.35852   110.56267     0.00000
   86    76 S   CT   _C17    60     1.52659   110.97562   -59.91126
   87    86 S   HC   _H49    61     1.09813   104.27108   -53.08452
   88    55 S   CT   _C23    74     1.52740   120.92712   170.18991
   89    80 S   C    _C10    86     1.50533   111.84456   167.35469
   90    89 S   O    _O30    87     1.22165   126.35059     0.52823
   91    57 S   C5A  _C6_    51     1.37625   126.91057  -139.59313
   92    91 S   HA   _H39    52     1.08028   133.86781    -0.02798
   93    88 S   CT   _C26    75     1.52859   115.58631    35.13251
   94    93 S   HC   _H57    76     1.08898   109.73603  -180.00000
   95    93 S   HC   _H58    77     1.08859   109.76479    59.99867
   96    93 S   HC   _H59    78     1.08796   109.72836   -60.00811
   97    88 S   CT   _C27    79     1.53460   111.36907   -89.21352
   98    97 S   HC   _H60    80     1.08663   109.44515   180.00000
   99    97 S   HC   _H61    81     1.08673   109.43248    60.04411
  100    97 S   HC   _H62    82     1.08634   109.48753   -59.98466
  101    89 S   OH   _O36    88     1.35730   109.88684  -179.50268
  102   101 S   HO   _H67    89     0.98092   111.92459  -179.96044
  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  13   5   4   3
  29   2   1   1  13   6   5  23   6   2  16   6   9   3   2   1
   8  12   5   4  17   6  22   8  10  13  21   6   4  11   6   5
  18   8  10   4   3   4   2   1   1   4   2   4   3   2  14   8
   4   3   2   1   2   2   1   8   3   2   1   1   7   3   2   1
   3   2   1   1   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    58    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    41    53    58    62    86    40    43    45    70  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    41    42    49    53    54    57    58    62    63    64    76    86    87    40    43    44    50    59    45    46    47    48    70    71    72    73  
   35    36  
   36  
    0  
   38    39    41    42    49    53    58    62    86    40    43    45    70  
   39    41    42    49    58    40  
   41    42    49    58    40  
   43    44    50    51    52    55    59    65    67    45    46    47    48    70    41    53    58    62    76    77    78    86    87  
   42    49    53    54    57    58  
   49    53  
   44    50    51    52    55    56    59    88    45    46    47    48    58    76    86    87  
   50    51    52    55    45    86  
   46    47    48    50    58    59    76    86    87  
   47    48    86  
   48    86  
   86  
   53    54    57    60    91    58    62    70  
   51    52    55    56    59    65    79    88    93    97    67    86  
   52    55    56    59    88  
   55    56    59    88  
   54    57    60    61    74    85    91    92    58    62    63    64    76    70    71    72    73  
   57    60    91    58    62    70  
   56    59    65    66    79    88    93    94    95    96    97    98    99   100    80    67    68    69    83    76    86    87  
   59    65    79    88    93    97    67    86  
   60    61    74    75    85    91    92    58    62    70  
   62    63    64    76    77    78    86    70    71    72    73    60    91  
   65    66    79    88    93    97    80    81    82    89    67    68    69    83    84    62    76    77    78    86    87  
   61    74    75    85    91    92  
   74    75    85    91  
   63    64    76    77    78    86    87    70    71    72    73  
   64    76    77    78    86    70  
   76    77    78    86    70  
   66    79    88    93    97    80    81    82    89    90   101    67    68    69    83    76    86    87  
   79    88    80    81    82    89    67    86  
   68    69    83    84    76    79    80    86    87    88  
   69    83    84    86  
   83    84    86  
   71    72    73    76  
   72    73  
   73  
    0  
   75    85    91    92  
   85    91  
   77    78    86    87  
   78    86    87  
   86    87  
   88    93    94    95    96    97    98    99   100    80    81    82    89    86  
   81    82    89    90   101   102    86    88  
   82    89    90   101  
   89    90   101  
   84    86  
    0  
   91    92  
   87    88  
    0  
   93    94    95    96    97    98    99   100  
   90   101   102  
  101   102  
   92  
    0  
   94    95    96    97    98    99   100  
   95    96    97  
   96    97  
   97  
   98    99   100  
   99   100  
  100  
    0  
  102  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   38   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   39   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   40   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   41   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.7500   0.1050   0.470000   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   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   50   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   52   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   53   3.5000   0.0660   0.335000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   55   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5500   0.0760  -0.143000   2.0020   1.7750   0.001000000  -0.843144165
   58   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   59   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   60   3.5500   0.0760  -0.154000   2.0020   1.7750   0.001000000  -0.843144165
   61   2.4200   0.0300   0.126000   1.3810   1.2100   0.030040813   0.268726247
   62   3.5000   0.0660  -0.120000   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   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   75   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   76   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   77   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   80   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   84   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   85   2.9000   0.1400  -0.190000   1.6450   1.4500   0.001000000  -0.126889456
   86   3.5000   0.0660  -0.060000   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   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   89   3.7500   0.1050   0.520000   2.1120   1.8750   0.001000000  -0.126889456
   90   2.9600   0.2100  -0.440000   1.9750   1.7500   0.001000000  -0.126889456
   91   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   92   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   93   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   98   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.0000   0.1700  -0.530000   1.7660   1.5600   0.021068034  -0.322181743
  102   0.5000   0.0300   0.450000   0.9960   0.8600   0.030040813  -0.651083722
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    58   268.000  1.529
   33    40   268.000  1.529
   37    38   570.000  1.307
   37    39   340.000  1.090
   37    41   317.000  1.522
   41    42   570.000  1.229
   41    49   214.000  1.327
   49    53   320.000  1.410
   53    54   340.000  1.090
   53    57   285.000  1.502
   53    58   268.000  1.529
   57    60   469.000  1.424
   57    91   546.000  1.367
   60    61   367.000  1.080
   60    74   546.000  1.367
   74    75   367.000  1.080
   74    85   340.000  1.360
   85    91   340.000  1.360
   91    92   367.000  1.080
   58    62   268.000  1.529
   58    70   268.000  1.529
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    76   268.000  1.529
   76    77   340.000  1.090
   76    78   340.000  1.090
   76    86   268.000  1.529
   86    87   340.000  1.090
   86    40   268.000  1.529
   86    59   268.000  1.529
   40    43   317.000  1.522
   40    45   268.000  1.529
   43    44   570.000  1.229
   43    50   317.000  1.522
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    55   268.000  1.529
   55    56   340.000  1.090
   55    59   268.000  1.529
   55    88   268.000  1.529
   59    65   268.000  1.529
   59    67   268.000  1.529
   65    66   340.000  1.090
   65    79   320.000  1.410
   65    80   268.000  1.529
   79    88   320.000  1.410
   88    93   268.000  1.529
   88    97   268.000  1.529
   93    94   340.000  1.090
   93    95   340.000  1.090
   93    96   340.000  1.090
   97    98   340.000  1.090
   97    99   340.000  1.090
   97   100   340.000  1.090
   80    81   340.000  1.090
   80    82   340.000  1.090
   80    89   317.000  1.522
   89    90   570.000  1.229
   89   101   450.000  1.364
  101   102   553.000  0.945
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    83   320.000  1.410
   83    84   553.000  0.945
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   340.000  1.090
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   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    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    58    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    37    38    50.00000  109.50000
   33    37    39    37.50000  110.70000
   33    37    41    63.00000  111.10000
   33    58    53    58.35000  112.70000
   33    58    62    58.35000  112.70000
   33    58    70    58.35000  112.70000
   33    40    86    58.35000  112.70000
   33    40    43    63.00000  111.10000
   33    40    45    58.35000  112.70000
   37    41    42    80.00000  120.40000
   37    41    49    81.00000  111.40000
   39    37    38    45.00000  125.66300
   41    37    38    90.00000  108.74100
   41    37    39    35.00000  109.50000
   41    49    53    83.00000  116.90000
   49    41    42    83.00000  123.40000
   49    53    54    35.00000  109.50000
   49    53    57    85.00000  111.85700
   49    53    58    50.00000  109.50000
   53    57    60    60.00000  130.00000
   53    57    91    60.00000  130.00000
   53    58    62    58.35000  112.70000
   53    58    70    58.35000  112.70000
   57    53    54    35.00000  109.50000
   57    60    61    35.00000  127.50000
   57    60    74    70.00000  107.30000
   57    91    85    70.00000  110.60000
   57    91    92    35.00000  132.10000
   60    74    75    35.00000  132.10000
   60    74    85    70.00000  110.60000
   74    60    61    35.00000  125.70000
   74    85    91    70.00000  106.50000
   85    74    75    35.00000  113.40000
   85    91    92    35.00000  113.40000
   91    57    60    70.00000  107.30000
   58    33    37    58.35000  112.70000
   58    53    54    37.50000  110.70000
   58    53    57    70.00000  112.17500
   58    62    63    37.50000  110.70000
   58    62    64    37.50000  110.70000
   58    62    76    58.35000  112.70000
   58    70    71    37.50000  110.70000
   58    70    72    37.50000  110.70000
   58    70    73    37.50000  110.70000
   62    76    77    37.50000  110.70000
   62    76    78    37.50000  110.70000
   62    76    86    58.35000  112.70000
   64    62    63    33.00000  107.80000
   76    62    63    37.50000  110.70000
   76    62    64    37.50000  110.70000
   76    86    87    37.50000  110.70000
   76    86    40    58.35000  112.70000
   76    86    59    58.35000  112.70000
   78    76    77    33.00000  107.80000
   86    76    77    37.50000  110.70000
   86    76    78    37.50000  110.70000
   86    40    43    63.00000  111.10000
   86    40    45    58.35000  112.70000
   86    59    55    58.35000  112.70000
   86    59    65    58.35000  112.70000
   86    59    67    58.35000  112.70000
   40    33    37    58.35000  112.70000
   40    33    58    58.35000  112.70000
   40    86    87    37.50000  110.70000
   40    43    44    80.00000  120.40000
   40    43    50    70.00000  116.00000
   40    45    46    37.50000  110.70000
   40    45    47    37.50000  110.70000
   40    45    48    37.50000  110.70000
   43    50    51    35.00000  109.50000
   43    50    52    35.00000  109.50000
   43    50    55    63.00000  111.10000
   50    43    44    80.00000  120.40000
   50    55    56    37.50000  110.70000
   50    55    59    58.35000  112.70000
   50    55    88    58.35000  112.70000
   52    50    51    33.00000  107.80000
   55    50    51    37.50000  110.70000
   55    50    52    37.50000  110.70000
   55    59    65    58.35000  112.70000
   55    59    67    58.35000  112.70000
   55    88    79    50.00000  109.50000
   55    88    93    58.35000  112.70000
   55    88    97    58.35000  112.70000
   59    86    87    37.50000  110.70000
   59    86    40    58.35000  112.70000
   59    55    56    37.50000  110.70000
   59    65    66    37.50000  110.70000
   59    65    79    50.00000  109.50000
   59    65    80    58.35000  112.70000
   59    67    68    37.50000  110.70000
   59    67    69    37.50000  110.70000
   59    67    83    50.00000  109.50000
   65    79    88    60.00000  109.50000
   65    80    81    37.50000  110.70000
   65    80    82    37.50000  110.70000
   65    80    89    63.00000  111.10000
   79    65    66    35.00000  109.50000
   79    88    93    50.00000  109.50000
   79    88    97    50.00000  109.50000
   88    55    56    37.50000  110.70000
   88    55    59    58.35000  112.70000
   88    93    94    37.50000  110.70000
   88    93    95    37.50000  110.70000
   88    93    96    37.50000  110.70000
   88    97    98    37.50000  110.70000
   88    97    99    37.50000  110.70000
   88    97   100    37.50000  110.70000
   95    93    94    33.00000  107.80000
   96    93    94    33.00000  107.80000
   96    93    95    33.00000  107.80000
   97    88    93    58.35000  112.70000
   99    97    98    33.00000  107.80000
  100    97    98    33.00000  107.80000
  100    97    99    33.00000  107.80000
   80    65    66    37.50000  110.70000
   80    65    79    50.00000  109.50000
   80    89    90    80.00000  120.40000
   80    89   101    70.00000  108.00000
   82    80    81    33.00000  107.80000
   89    80    81    35.00000  109.50000
   89    80    82    35.00000  109.50000
   89   101   102    35.00000  113.00000
  101    89    90   100.00000  123.32000
   67    59    65    58.35000  112.70000
   67    83    84    55.00000  108.50000
   69    67    68    33.00000  107.80000
   83    67    68    35.00000  109.50000
   83    67    69    35.00000  109.50000
   45    40    43    63.00000  111.10000
   47    45    46    33.00000  107.80000
   48    45    46    33.00000  107.80000
   48    45    47    33.00000  107.80000
   70    58    62    58.35000  112.70000
   72    70    71    33.00000  107.80000
   73    70    71    33.00000  107.80000
   73    70    72    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
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
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   65    79    88    93   0.06250  1.0 1.0
   65    79    88    93  -0.01100 -1.0 2.0
   65    79    88    93   0.28050  1.0 3.0
   65    79    88    97   0.06250  1.0 1.0
   65    79    88    97  -0.01100 -1.0 2.0
   65    79    88    97   0.28050  1.0 3.0
   65    80    89    90   0.30150 -1.0 2.0
   65    80    89   101   0.50000  1.0 1.0
   65    80    89   101   0.27300 -1.0 2.0
   65    80    89   101   0.22500  1.0 3.0
   66    65    79    88   0.37050  1.0 3.0
   66    65    80    81   0.15000  1.0 3.0
   66    65    80    82   0.15000  1.0 3.0
   66    65    80    89  -0.11250  1.0 3.0
   79    65    80    81   0.23400  1.0 3.0
   79    65    80    82   0.23400  1.0 3.0
   79    65    80    89  -0.09450  1.0 1.0
   79    65    80    89  -1.12950 -1.0 2.0
   79    65    80    89   0.54000  1.0 3.0
   79    88    93    94   0.23400  1.0 3.0
   79    88    93    95   0.23400  1.0 3.0
   79    88    93    96   0.23400  1.0 3.0
   79    88    97    98   0.23400  1.0 3.0
   79    88    97    99   0.23400  1.0 3.0
   79    88    97   100   0.23400  1.0 3.0
   88    55    59    86   0.56750  1.0 1.0
   88    55    59    86  -0.07550 -1.0 2.0
   88    55    59    86   0.20000  1.0 3.0
   88    55   -59    65   0.56750  1.0 1.0
   88    55   -59    65  -0.07550 -1.0 2.0
   88    55   -59    65   0.20000  1.0 3.0
   88    55    59    67   0.56750  1.0 1.0
   88    55    59    67  -0.07550 -1.0 2.0
   88    55    59    67   0.20000  1.0 3.0
   93    88    97    98   0.15000  1.0 3.0
   93    88    97    99   0.15000  1.0 3.0
   93    88    97   100   0.15000  1.0 3.0
   97    88    93    94   0.15000  1.0 3.0
   97    88    93    95   0.15000  1.0 3.0
   97    88    93    96   0.15000  1.0 3.0
   80    65    79    88   0.06250  1.0 1.0
   80    65    79    88  -0.01100 -1.0 2.0
   80    65    79    88   0.28050  1.0 3.0
   80    89   101   102   1.50000  1.0 1.0
   80    89   101   102   2.45000 -1.0 2.0
   81    80    89    90   0.00000  1.0 1.0
   81    80    89   101   0.00000  1.0 1.0
   82    80    89    90   0.00000  1.0 1.0
   82    80    89   101   0.00000  1.0 1.0
   90    89   101   102   0.92200  1.0 1.0
   90    89   101   102   3.74100 -1.0 2.0
   67    59    65    66   0.15000  1.0 3.0
   67    59    65    79   0.62750  1.0 1.0
   67    59    65    79  -0.30950 -1.0 2.0
   67    59    65    79   0.27300  1.0 3.0
   67    59    65    80   0.56750  1.0 1.0
   67    59    65    80  -0.07550 -1.0 2.0
   67    59    65    80   0.20000  1.0 3.0
   68    67    83    84   0.19450  1.0 3.0
   69    67    83    84   0.19450  1.0 3.0
   45    40    43    44   0.30150 -1.0 2.0
   45    40    43    50   0.60050  1.0 1.0
   45    40    43    50   0.05600 -1.0 2.0
   45    40    43    50   0.26150  1.0 3.0
   70    58    62    63   0.15000  1.0 3.0
   70    58    62    64   0.15000  1.0 3.0
   70    58    62    76   0.56750  1.0 1.0
   70    58    62    76  -0.07550 -1.0 2.0
   70    58    62    76   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
   36    30    34    35  10.50000 -1.0 2.0
   37    49    41    42  10.50000 -1.0 2.0
   60    91    57    53   4.00000 -1.0 2.0
   74    61    60    57   1.10000 -1.0 2.0
   85    75    74    60   1.10000 -1.0 2.0
   85    92    91    57   1.10000 -1.0 2.0
   40    50    43    44  10.50000 -1.0 2.0
   80   101    89    90  10.50000 -1.0 2.0
END
