* LIGAND DATABASE FILE (OPLS2005)
*
001     104   109    206    337     606
    1     0 S   NP   _N1_     1    28.60198    98.72015   -22.67389
    2     1 S   H    _HN1     2     1.02788   102.48912   -95.45855
    3     1 S   H    _H1_     3     1.02949    63.20770     8.99257
    4     1 S   H    _H2_     4     1.02829    48.43569   161.60216
    5     1 S   CT   _CA1     5     1.50114   144.51748    96.97540
    6     5 S   HC   _HA1     6     1.09574   105.19094   105.57883
    7     5 S   CO3  _C1_     7     1.53779   112.42345   -14.65339
    8     7 S   O2Z  _O11     8     1.26372   115.01117   -43.57913
    9     7 S   O2Z  _O12     9     1.26236   114.94032   135.49559
   10     5 S   CT   _CB1    10     1.53072   107.41316  -136.46196
   11    10 S   HC   HB11    11     1.09836   109.35755   -49.73963
   12    10 S   HC   HB12    12     1.09812   110.46310    66.85780
   13    10 S   CT   _CG1    13     1.53002   112.61651  -170.70381
   14    13 S   HC   HG11    14     1.09579   110.65969   -65.98187
   15    13 S   HC   HG12    15     1.09670   109.76589    53.25714
   16    13 S   C    _CD1    16     1.51807   112.14155   173.71045
   17    16 S   O    _OE1    17     1.22746   123.24900     8.37222
   18    16 S   N    _N2_    18     1.38640   111.72957  -171.69981
   19    18 S   H    _HN2    19     1.01591   119.03317     1.26083
   20    18 S   CT1  _CA2    20     1.46197   123.38432   177.31970
   21    20 S   HC   _HA2    21     1.09743   109.27127     4.80428
   22    20 S   C    _C2_    22     1.53625   109.04075  -110.70864
   23    22 S   O    _O2_    23     1.23082   122.20778  -150.78549
   24    20 S   CT   _CB2    32     1.53318   111.56163   126.70856
   25    24 S   HC   HB21    33     1.09454   109.79626    56.33212
   26    24 S   HC   HB22    34     1.09504   110.00643   175.47862
   27    22 S   N    _N3_    24     1.38306   113.85718    36.81061
   28    27 S   H    _HN3    25     1.01562   119.56541    -3.59635
   29    24 S   S    _SG2    35     1.82789   111.37591   -64.61484
   30    27 S   CT   _CA3    26     1.45275   123.25188   177.06648
   31    30 S   HC   HA31    27     1.09549   107.53191   -64.21930
   32    30 S   HC   HA32    28     1.09557   107.96957    52.22634
   33    29 S   CT   _C27    36     1.86269   100.03410  -172.11683
   34    33 S   HC   _H6_    37     1.08959   104.83256    35.01482
   35    30 S   CO3  _C3_    29     1.52965   114.05825   174.21199
   36    35 S   O2Z  _O31    30     1.26380   116.07103    -0.37168
   37    35 S   O2Z  _O32    31     1.26427   114.41399   179.68721
   38    33 S   CM   _C28    38     1.52089   105.08235   -81.77426
   39    38 S   HC   _H31    39     1.09027   115.38665   -75.48776
   40    33 S   CT   _C9_    47     1.59802   113.99022   151.28674
   41    38 S   CMA  _C29    40     1.35715   127.81296   101.89937
   42    41 S   OM   _O41    41     1.26850   123.32297  -178.47813
   43    40 S   CT   _C8_    48     1.58410   111.60852   -57.76957
   44    43 S   HC   _H3_    49     1.09289   102.66838   -33.30908
   45    40 S   CT   _C26   101     1.55479   108.63230    64.76799
   46    45 S   HC   _H28   102     1.09431   111.92370    67.85483
   47    45 S   HC   _H29   103     1.09420   112.05150   -52.33685
   48    45 S   HC   _H30   104     1.08908   113.36321  -171.92737
   49    41 S   OS   _O42    42     1.41660   111.48458     0.98019
   50    43 S   CT   _C7_    50     1.53823   121.51307    84.49208
   51    50 S   HC   _H12    51     1.09489   111.64929    43.47415
   52    50 S   HC   _H13    52     1.09291   109.73945   -73.90007
   53    43 S   CT   _C14    73     1.55522   108.11464  -145.74078
   54    49 S   CT   _C30    43     1.42558   115.96630   179.78971
   55    54 S   HC   _H32    44     1.09406   107.73265   179.87489
   56    54 S   HC   _H33    45     1.09498   111.07048    61.95849
   57    54 S   HC   _H34    46     1.09498   111.01263   -62.18835
   58    50 S   CT   _C6_    53     1.54751   113.77759   166.33151
   59    58 S   HC   _H10    54     1.09691   107.85432   146.06095
   60    58 S   HC   _H11    55     1.09716   108.48244  -100.24165
   61    53 S   CO   _C13    74     1.54070   100.09120    41.15521
   62    53 S   CT   _C23    92     1.55883   113.57039   -75.74316
   63    62 S   HC   _H17    93     1.09561   111.99451  -174.86054
   64    62 S   HC   _H18    94     1.09008   113.03665    67.57593
   65    62 S   HC   _H19    95     1.09195   112.69665   -54.86800
   66    58 S   CT   _C5_    56     1.54922   114.93625    21.92466
   67    40 S   CT   _C10    75     1.60075   112.58480  -170.52933
   68    61 S   OH   _O39    90     1.42099   113.01948  -162.01138
   69    68 S   HO   _H20    91     0.97080   108.27419   -37.97399
   70    66 S   CT   _C18    57     1.57282   112.18506  -172.43696
   71    70 S   HC   _H5_    58     1.09904   110.17347    63.25637
   72    67 S   CO4  _C11    76     1.51731   119.71314    10.06531
   73    72 S   O    _O33    77     1.22576   124.04448   -88.51854
   74    67 S   OH   _O40    88     1.41769   111.92256  -117.19029
   75    74 S   HO   _H27    89     0.97372   107.37755    73.31262
   76    66 S   CT   _C4_    97     1.55655   109.80026    67.37289
   77    76 S   HC   _H7_    98     1.09431   112.30771   177.81797
   78    76 S   HC   _H8_    99     1.09508   110.93806    57.45448
   79    76 S   HC   _H9_   100     1.08822   114.48403   -61.90691
   80    70 S   C5BC _C19    59     1.50406   115.19274   -56.13345
   81    70 S   OS   _O37    67     1.46486   110.12302   179.71538
   82    72 S   CT   _C12    78     1.51238   112.41566    97.28704
   83    80 S   C5BC _C20    60     1.42540   128.10062   -90.14583
   84    83 S   HA   _H14    61     1.08097   127.39839     0.95039
   85    81 S   CO4  _C17    68     1.36949   122.61473   -40.94584
   86    85 S   O    _O36    69     1.22431   122.42505  -179.46259
   87    61 S   OS   _O34    79     1.44071   110.12239    73.45082
   88    82 S   CT   _C24    80     1.52669   110.96819   114.10258
   89    88 S   HC   _H21    81     1.09553   110.77158  -165.14392
   90    88 S   HC   _H22    82     1.09549   111.20388    73.85402
   91    88 S   HC   _H23    83     1.09456   112.14108   -45.91163
   92    82 S   CT   _C25    84     1.51952   113.74829  -120.26053
   93    92 S   HC   _H24    85     1.09610   110.61055   179.26965
   94    92 S   HC   _H25    86     1.09321   111.82042    61.56503
   95    92 S   HC   _H26    87     1.09443   111.58243   -59.97246
   96    83 S   C5A  _C21    62     1.37445   106.66370  -179.15744
   97    96 S   HA   _H15    63     1.08025   133.82321  -179.76015
   98    85 S   C3T  _C16    70     1.48260   117.05772     0.79475
   99    98 S   HC   _H4_    71     1.08137   115.55114   172.96018
  100    96 S   OA   _O38    64     1.35651   110.47578     0.55285
  101    66 S   C3T  _C15    72     1.54983   108.63975   -54.60169
  102    80 S   C5A  _C22    65     1.38213   126.90071    91.90717
  103   102 S   HA   _H16    66     1.08073   133.42403    -0.97979
  104    98 S   O3T  _O35    96     1.41427   111.50039   -48.62764
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   9   5   4   3
  19   7   2   1   1   9   4  23   6   2  26  10   9   3   2   1
   4  13   6   5  21   3   2   1   1  14   5   4  19  10   3   2
   1  15  11   6   1  18   7  13   5   3   1   8   3   2   1  10
   8   9   6   4   5   4   9   7   3   2   1   3   2   1   1   4
   2   3   2   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    41    40    43    67    45  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    41    42    49    40    43    44    50    53    61    67    72    74    45    46    47    48  
   38    39    41    40    43    67    45  
   36    37  
   37  
    0  
   39    41    42    49    54    40    43    67    45  
   41    42    49    40  
   43    44    50    51    52    58   101    53    61    67    72    73    82    87    74    75    68    62    45    46    47    48    41  
   42    49    54    55    56    57  
   49    54  
   44    50    51    52    58    59    60    66    98   101    53    61    67    72    87    74    68    62    63    64    65   104    45    46    47    48  
   50    51    52    58   101    53    61    67    62    45  
   46    47    48    50    53    61    67    72    74  
   47    48    67  
   48    67  
   67  
   54    55    56    57  
   51    52    58    59    60    66    70   101    53    61    67    62    76  
   52    58    59    60    66    53  
   58    59    60    66    53  
   61    67    72    82    87    74    68    69    62    63    64    65   104    76    58    66    70    85    98    99   101  
   55    56    57  
   56    57  
   57  
    0  
   59    60    66    70    71    80    81    98   101   104    76    77    78    79  
   60    66    70   101    76  
   66    70   101    76  
   67    72    73    82    87    88    92    74    75    68    69    62    63    64    65   104    66    98   101  
   63    64    65   104    66    67    68    87    98   101  
   64    65   101  
   65   101  
  101  
   70    71    80    83   102    81    85    98    99   101   104    76    77    78    79  
   72    73    82    87    88    92    74    75    68    69   101  
   69    72    74    82    87   101  
   87  
   71    80    83    84    96   100   102   103    81    85    86    98   101   104    76    77    78    79  
   80    83   102    81    85   101    76  
   73    82    87    88    89    90    91    92    93    94    95    74    75  
   82    87    88    92    74  
   75    82    87  
    0  
   77    78    79    80    81    98   101   104  
   78    79   101  
   79   101  
  101  
   83    84    96    97   100   102   103    81    85   101  
   85    86    98    99   101   104    83   102  
   87    88    89    90    91    92    93    94    95  
   84    96    97   100   102   103  
   96    97   100   102  
   86    98    99   101   104  
   98    99   101   104  
   88    89    90    91    92    93    94    95   101  
   89    90    91    92    93    94    95  
   90    91    92  
   91    92  
   92  
   93    94    95  
   94    95  
   95  
    0  
   97   100   102   103  
  100   102  
   99   101   104  
  101   104  
  102   103  
  104  
  103  
    0  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   41   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   43   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   2.8500   0.1400  -0.685000   1.5900   1.4000   0.020110767  -0.896042159
   50   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   54   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660   0.364700   1.9750   1.7500   0.005000000  -0.741685710
   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   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   67   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   68   3.1200   0.1700  -0.582700   1.7660   1.5600   0.021068034  -0.322181743
   69   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   70   3.5000   0.0660   0.335000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   72   3.7500   0.1050   0.422000   2.1120   1.8750   0.001000000  -0.126889456
   73   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   74   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   75   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   76   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   3.5500   0.0760  -0.143000   2.0020   1.7750   0.001000000  -0.843144165
   81   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   82   3.5000   0.0660   0.248000   1.9750   1.7500   0.005000000  -0.741685710
   83   3.5500   0.0760  -0.154000   2.0020   1.7750   0.001000000  -0.843144165
   84   2.4200   0.0300   0.126000   1.3810   1.2100   0.030040813   0.268726247
   85   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   86   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   87   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   88   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   97   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   98   3.5000   0.0660   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   99   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  100   2.9000   0.1400  -0.190000   1.6450   1.4500   0.001000000  -0.126889456
  101   3.5000   0.0660   0.176200   1.9750   1.7500   0.005000000  -0.741685710
  102   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
  103   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
  104   2.9000   0.1400  -0.352400   1.5900   1.4000   0.020110767  -0.896042159
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    40   268.000  1.529
   38    39   340.000  1.080
   38    41   465.000  1.376
   41    42   745.000  1.250
   41    49   440.000  1.360
   49    54   320.000  1.410
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   340.000  1.090
   40    43   268.000  1.529
   40    67   268.000  1.529
   40    45   268.000  1.529
   43    44   340.000  1.090
   43    50   268.000  1.529
   43    53   268.000  1.529
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    58   268.000  1.529
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    66   268.000  1.529
   66    70   268.000  1.529
   66   101   275.000  1.510
   66    76   268.000  1.529
   70    71   340.000  1.090
   70    80   285.000  1.502
   70    81   320.000  1.410
   80    83   469.000  1.424
   80   102   546.000  1.367
   83    84   367.000  1.080
   83    96   546.000  1.367
   96    97   367.000  1.080
   96   100   340.000  1.360
  100   102   340.000  1.360
  102   103   367.000  1.080
   81    85   214.000  1.327
   85    86   570.000  1.229
   85    98   290.000  1.496
   98    99   340.000  1.088
   98   101   260.000  1.509
   98   104   335.000  1.432
  101    53   275.000  1.510
  101   104   335.000  1.432
   53    61   250.000  1.527
   53    62   268.000  1.529
   61    67   250.000  1.527
   61    87   320.000  1.380
   61    68   380.000  1.407
   67    72   317.000  1.522
   67    74   320.000  1.410
   72    73   570.000  1.229
   72    82   317.000  1.522
   82    87   320.000  1.410
   82    88   268.000  1.529
   82    92   268.000  1.529
   88    89   340.000  1.090
   88    90   340.000  1.090
   88    91   340.000  1.090
   92    93   340.000  1.090
   92    94   340.000  1.090
   92    95   340.000  1.090
   74    75   553.000  0.945
   68    69   553.000  0.945
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   340.000  1.090
   76    77   340.000  1.090
   76    78   340.000  1.090
   76    79   340.000  1.090
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   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  112.20000
   29    33    40    75.00000  111.63000
   33    38    39    35.00000  117.00000
   33    38    41    70.00000  124.00000
   33    40    43    58.35000  112.70000
   33    40    67    58.35000  112.70000
   33    40    45    58.35000  112.70000
   38    33    34    35.00000  109.50000
   38    41    42    65.00000  137.10300
   38    41    49    80.00000  120.01400
   41    38    39    40.00000  120.50800
   41    49    54    90.00000  111.18400
   49    41    42    65.00000  121.00000
   49    54    55    35.00000  109.50000
   49    54    56    35.00000  109.50000
   49    54    57    35.00000  109.50000
   56    54    55    33.00000  107.80000
   57    54    55    33.00000  107.80000
   57    54    56    33.00000  107.80000
   40    33    34    37.50000  110.70000
   40    33    38    70.00000  112.02700
   40    43    44    37.50000  110.70000
   40    43    50    58.35000  112.70000
   40    43    53    58.35000  112.70000
   40    67    61    75.00000  109.43000
   40    67    72    63.00000  111.10000
   40    67    74    50.00000  109.50000
   40    45    46    37.50000  110.70000
   40    45    47    37.50000  110.70000
   40    45    48    37.50000  110.70000
   43    50    51    37.50000  110.70000
   43    50    52    37.50000  110.70000
   43    50    58    58.35000  112.70000
   43    53   101    70.00000  112.37300
   43    53    61    75.00000  109.43000
   43    53    62    58.35000  112.70000
   50    43    44    37.50000  110.70000
   50    58    59    37.50000  110.70000
   50    58    60    37.50000  110.70000
   50    58    66    58.35000  112.70000
   52    50    51    33.00000  107.80000
   58    50    51    37.50000  110.70000
   58    50    52    37.50000  110.70000
   58    66    70    58.35000  112.70000
   58    66   101    70.00000  112.37300
   58    66    76    58.35000  112.70000
   60    58    59    33.00000  107.80000
   66    58    59    37.50000  110.70000
   66    58    60    37.50000  110.70000
   66    70    71    37.50000  110.70000
   66    70    80    70.00000  112.17500
   66    70    81    50.00000  109.50000
   66   101    98    60.00000  120.94000
   66   101    53    58.35000  112.70000
   66   101   104    80.00000  116.47100
   66    76    77    37.50000  110.70000
   66    76    78    37.50000  110.70000
   66    76    79    37.50000  110.70000
   70    80    83    60.00000  130.00000
   70    80   102    60.00000  130.00000
   70    81    85    83.00000  116.90000
   80    70    71    35.00000  109.50000
   80    83    84    35.00000  127.50000
   80    83    96    70.00000  107.30000
   80   102   100    70.00000  110.60000
   80   102   103    35.00000  132.10000
   83    96    97    35.00000  132.10000
   83    96   100    70.00000  110.60000
   96    83    84    35.00000  125.70000
   96   100   102    70.00000  106.50000
  100    96    97    35.00000  113.40000
  100   102   103    35.00000  113.40000
  102    80    83    70.00000  107.30000
   81    70    71    35.00000  109.50000
   81    70    80    85.00000  111.85700
   81    85    86    83.00000  123.40000
   81    85    98    81.00000  111.40000
   85    98    99    40.00000  116.18000
   85    98   101    65.00000  117.18000
   85    98   104    80.00000  114.91000
   98    85    86    75.00000  121.36600
   98   101    53    60.00000  120.94000
   98   101   104    15.00000   60.43100
   98   104   101    15.00000   59.14900
  101    66    70    70.00000  112.37300
  101    98    99    37.50000  117.20000
  101    53    61    70.00000  112.37300
  101    53    62    70.00000  112.37300
   53    43    44    37.50000  110.70000
   53    43    50    58.35000  112.70000
   53    61    67    65.00000  112.71400
   53    61    87    90.00000  108.56700
   53    61    68    90.00000  110.19100
   53    62    63    37.50000  110.70000
   53    62    64    37.50000  110.70000
   53    62    65    37.50000  110.70000
   61    67    72    63.00000  111.10000
   61    67    74    90.00000  111.58700
   61    87    82    60.00000  109.50000
   61    68    69    70.00000  107.92000
   67    40    43    58.35000  112.70000
   67    72    73    80.00000  120.40000
   67    72    82    70.00000  116.00000
   67    74    75    55.00000  108.50000
   72    82    87    90.00000  108.74100
   72    82    88    63.00000  111.10000
   72    82    92    63.00000  111.10000
   82    72    73    80.00000  120.40000
   82    88    89    37.50000  110.70000
   82    88    90    37.50000  110.70000
   82    88    91    37.50000  110.70000
   82    92    93    37.50000  110.70000
   82    92    94    37.50000  110.70000
   82    92    95    37.50000  110.70000
   87    61    67    90.00000  108.56700
   88    82    87    50.00000  109.50000
   90    88    89    33.00000  107.80000
   91    88    89    33.00000  107.80000
   91    88    90    33.00000  107.80000
   92    82    87    50.00000  109.50000
   92    82    88    58.35000  112.70000
   94    92    93    33.00000  107.80000
   95    92    93    33.00000  107.80000
   95    92    94    33.00000  107.80000
   74    67    72    90.00000  109.61100
   68    61    67    90.00000  110.19100
   68    61    87   110.00000  112.08000
   62    53    61    75.00000  109.43000
   64    62    63    33.00000  107.80000
   65    62    63    33.00000  107.80000
   65    62    64    33.00000  107.80000
  104    98    99    50.00000  114.27700
  104    98   101    15.00000   60.43100
  104   101    53    80.00000  116.47100
   76    66    70    58.35000  112.70000
   76    66   101    70.00000  112.37300
   78    76    77    33.00000  107.80000
   79    76    77    33.00000  107.80000
   79    76    78    33.00000  107.80000
   45    40    43    58.35000  112.70000
   45    40    67    58.35000  112.70000
   47    45    46    33.00000  107.80000
   48    45    46    33.00000  107.80000
   48    45    47    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
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   72    82    88    91  -0.11250  1.0 3.0
   72    82    92    93  -0.11250  1.0 3.0
   72    82    92    94  -0.11250  1.0 3.0
   72    82    92    95  -0.11250  1.0 3.0
   73    72    82    87   0.30150 -1.0 2.0
   73    72    82    88   0.30150 -1.0 2.0
   73    72    82    92   0.30150 -1.0 2.0
   87    61    67    40   0.62750  1.0 1.0
   87    61    67    40  -0.30950 -1.0 2.0
   87    61    67    40   0.27300  1.0 3.0
   87    61   -67    72  -0.09450  1.0 1.0
   87    61   -67    72  -1.12950 -1.0 2.0
   87    61   -67    72   0.54000  1.0 3.0
   87    61    67    74   3.69350  1.0 1.0
   87    61    67    74  -1.82950 -1.0 2.0
   87    61    68    69  -0.50000  1.0 1.0
   87    61    68    69  -0.73950 -1.0 2.0
   87    61    68    69   0.17150  1.0 3.0
   87    82    88    89   0.23400  1.0 3.0
   87    82    88    90   0.23400  1.0 3.0
   87    82    88    91   0.23400  1.0 3.0
   87    82    92    93   0.23400  1.0 3.0
   87    82    92    94   0.23400  1.0 3.0
   87    82    92    95   0.23400  1.0 3.0
   88    82    87    61   0.06250  1.0 1.0
   88    82    87    61  -0.01100 -1.0 2.0
   88    82    87    61   0.28050  1.0 3.0
   88    82    92    93   0.15000  1.0 3.0
   88    82    92    94   0.15000  1.0 3.0
   88    82    92    95   0.15000  1.0 3.0
   92    82    87    61   0.06250  1.0 1.0
   92    82    87    61  -0.01100 -1.0 2.0
   92    82    87    61   0.28050  1.0 3.0
   92    82    88    89   0.15000  1.0 3.0
   92    82    88    90   0.15000  1.0 3.0
   92    82    88    91   0.15000  1.0 3.0
   74    67    72    73   0.30150 -1.0 2.0
   74    67    72    82   0.55300  1.0 1.0
   74    67    72    82   1.25850 -1.0 2.0
   74    67    72    82  -0.23600  1.0 3.0
   68    61    67    40   0.86500  1.0 1.0
   68    61    67    40  -0.17500 -1.0 2.0
   68    61    67    40   0.20800  1.0 3.0
   68    61    67    72  -0.09450  1.0 1.0
   68    61    67    72  -1.12950 -1.0 2.0
   68    61    67    72   0.54000  1.0 3.0
   68    61    67    74   3.75450  1.0 1.0
   68    61    87    82  -0.70900  1.0 1.0
   68    61    87    82  -1.18000 -1.0 2.0
   68    61    87    82   0.91650  1.0 3.0
   62    53    61    67   0.56750  1.0 1.0
   62    53    61    67  -0.07550 -1.0 2.0
   62    53    61    67   0.20000  1.0 3.0
   62    53    61    87   0.62750  1.0 1.0
   62    53    61    87  -0.30950 -1.0 2.0
   62    53    61    87   0.27300  1.0 3.0
   62    53    61    68   0.86500  1.0 1.0
   62    53    61    68  -0.17500 -1.0 2.0
   62    53    61    68   0.20800  1.0 3.0
  104    98  -101    66   0.02550  1.0 1.0
  104    98  -101    66  -0.02600 -1.0 2.0
  104    98  -101    66   1.20400  1.0 3.0
  104    98  -101    53   0.02550  1.0 1.0
  104    98  -101    53  -0.02600 -1.0 2.0
  104    98  -101    53   1.20400  1.0 3.0
  104   101    53    43   0.02550  1.0 1.0
  104   101    53    43  -0.02600 -1.0 2.0
  104   101    53    43   1.20400  1.0 3.0
  104   101    53    61   0.02550  1.0 1.0
  104   101    53    61  -0.02600 -1.0 2.0
  104   101    53    61   1.20400  1.0 3.0
  104   101    53    62   0.02550  1.0 1.0
  104   101    53    62  -0.02600 -1.0 2.0
  104   101    53    62   1.20400  1.0 3.0
   76    66    70    71   0.15000  1.0 3.0
   76    66    70    80  -0.03700  1.0 1.0
   76    66    70    80   0.37200 -1.0 2.0
   76    66    70    80  -0.47300  1.0 3.0
   76    66    70    81   0.62750  1.0 1.0
   76    66    70    81  -0.30950 -1.0 2.0
   76    66    70    81   0.27300  1.0 3.0
   76    66   101    98   0.07850  1.0 1.0
   76    66   101    98  -0.03950 -1.0 2.0
   76    66   101    98   0.67350  1.0 3.0
   76    66   101    53   0.56750  1.0 1.0
   76    66   101    53  -0.07550 -1.0 2.0
   76    66   101    53   0.20000  1.0 3.0
   76    66   101   104   0.02550  1.0 1.0
   76    66   101   104  -0.02600 -1.0 2.0
   76    66   101   104   1.20400  1.0 3.0
   45    40    43    44   0.15000  1.0 3.0
   45    40    43    50   0.56750  1.0 1.0
   45    40    43    50  -0.07550 -1.0 2.0
   45    40    43    50   0.20000  1.0 3.0
   45    40    43    53   0.56750  1.0 1.0
   45    40    43    53  -0.07550 -1.0 2.0
   45    40    43    53   0.20000  1.0 3.0
   45    40    67    61   3.97050  1.0 1.0
   45    40    67    72  -0.95700  1.0 1.0
   45    40    67    72  -0.18200 -1.0 2.0
   45    40    67    72   0.29450  1.0 3.0
   45    40    67    74   0.86500  1.0 1.0
   45    40    67    74  -0.17500 -1.0 2.0
   45    40    67    74   0.20800  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   33    39    38    41  15.00000 -1.0 2.0
   42    49    41    38  15.00000 -1.0 2.0
   83   102    80    70   4.00000 -1.0 2.0
   96    84    83    80   1.10000 -1.0 2.0
  100    97    96    83   1.10000 -1.0 2.0
  100   103   102    80   1.10000 -1.0 2.0
   81    98    85    86  10.50000 -1.0 2.0
   67    82    72    73  10.50000 -1.0 2.0
END
