* LIGAND DATABASE FILE (OPLS2005)
*
001     107   111    210    341     634
    1     0 S   NP   _N1_     1    29.01590    91.08377   -21.84614
    2     1 S   H    _HN1     2     1.02778    92.97425   -88.07372
    3     1 S   H    _H1_     3     1.02955   105.76180    21.95496
    4     1 S   H    _H2_     4     1.02832    16.80352   118.83926
    5     1 S   CT   _CA1     5     1.50130   125.19385   151.91622
    6     5 S   HC   _HA1     6     1.09571   105.22876    49.48977
    7     5 S   CO3  _C1_     7     1.53802   112.35875   -70.73524
    8     7 S   O2Z  _O11     8     1.26364   114.99231   -43.22865
    9     7 S   O2Z  _O12     9     1.26228   114.95915   135.89005
   10     5 S   CT   _CB1    10     1.53086   107.39780   167.44424
   11    10 S   HC   HB11    11     1.09824   109.38447   -49.95097
   12    10 S   HC   HB12    12     1.09828   110.41008    66.62586
   13    10 S   CT   _CG1    13     1.53005   112.65703  -171.01976
   14    13 S   HC   HG11    14     1.09597   110.40163   -63.23578
   15    13 S   HC   HG12    15     1.09646   110.04935    56.02890
   16    13 S   C    _CD1    16     1.51795   112.24781   176.36962
   17    16 S   O    _OE1    17     1.22755   123.24871    -3.26429
   18    16 S   N    _N2_    18     1.38680   111.66547   176.69169
   19    18 S   H    _HN2    19     1.01603   119.05845     1.43217
   20    18 S   CT1  _CA2    20     1.46253   123.27480  -178.73684
   21    20 S   HC   _HA2    21     1.09763   109.17542   -11.87770
   22    20 S   C    _C2_    22     1.53371   108.64437  -127.35385
   23    22 S   O    _O2_    23     1.23025   122.35858  -149.13631
   24    20 S   CT   _CB2    32     1.53849   111.75705   109.91529
   25    24 S   HC   HB21    33     1.09427   109.05093    56.93100
   26    24 S   HC   HB22    34     1.09102   109.17821   176.08779
   27    22 S   N    _N3_    24     1.38368   113.47066    38.51296
   28    27 S   H    _HN3    25     1.01650   119.48857    -3.83313
   29    24 S   S    _SG2    35     1.82450   110.51739   -62.94858
   30    27 S   CT   _CA3    26     1.45288   123.08849   176.83306
   31    30 S   HC   HA31    27     1.09554   107.56209   -62.75356
   32    30 S   HC   HA32    28     1.09559   107.89476    53.63290
   33    29 S   CT   _C19    36     1.95710   106.27657  -169.81667
   34    30 S   CO3  _C3_    29     1.52926   114.16931   175.59460
   35    34 S   O2Z  _O31    30     1.26361   116.06680    -0.60263
   36    34 S   O2Z  _O32    31     1.26433   114.41180   179.44187
   37    33 S   CT   _C18    37     1.57323   105.97304   -39.18519
   38    37 S   HC   _H7_    38     1.09454   110.09311   -36.66515
   39    33 S   CT   _C20    61     1.65582   103.37023  -158.59068
   40    37 S   CO4  _C17    39     1.51166   114.82169    83.61079
   41    40 S   O    _O38    40     1.22781   122.16539  -144.14722
   42    39 S   CO4  _C21    62     1.54766   110.78619    52.45401
   43    42 S   O    _O39    63     1.23416   122.24681    36.28922
   44    39 S   CT   _C23    98     1.55580   113.21258   168.28594
   45    44 S   HC   _H19    99     1.09043   113.39748    17.12946
   46    44 S   HC   _H20   100     1.09667   112.40993  -103.47890
   47    44 S   HC   _H21   101     1.09061   112.67636   136.10975
   48    37 S   OH   _O40   106     1.42064   114.71510  -156.28676
   49    48 S   HO   _H22   107     0.97360   107.77556   165.97537
   50    40 S   OS   _O37    41     1.34921   116.04657    36.74730
   51    42 S   CT   _C22    64     1.50649   119.10395  -152.09672
   52    51 S   HC   _H17    65     1.09507   105.90038   168.41430
   53    51 S   HC   _H18    66     1.09313   108.35695   -77.77889
   54    50 S   CT   _C16    42     1.43895   118.47320    15.27607
   55    54 S   HC   _H6_    43     1.09888   106.88424    55.40340
   56    51 S   CT   _C10    67     1.53364   112.66459    47.85543
   57    56 S   HC   _H4_    68     1.10123   105.92488    49.93997
   58    54 S   C5BC _C24    44     1.50699   108.91256   168.51458
   59    33 S   CT   _C15    52     1.63747   111.86327    82.91948
   60    95 S   CT   _C11    69     1.61395   114.75746   161.99358
   61    56 S   CT   _C9_    78     1.57231   111.22932   162.62333
   62    58 S   C5BC _C25    45     1.42618   127.97553    35.68457
   63    62 S   HA   _H23    46     1.08100   127.35509     1.22109
   64    59 S   CT   _C14    53     1.55972   112.85937   117.50029
   65    64 S   HC   _H15    54     1.09885   110.25731  -170.05086
   66    64 S   HC   _H16    55     1.09418   110.54475    76.50477
   67    60 S   CT   _C6_    70     1.58402   107.05068    55.91541
   68    67 S   HC   _H3_    71     1.09528   107.73611   -50.25642
   69    61 S   CT   _C30    79     1.54018   115.14718    46.89730
   70    69 S   HC   _H32    80     1.09675   110.52847   176.80469
   71    69 S   HC   _H33    81     1.09095   112.65511    58.25587
   72    69 S   HC   _H34    82     1.09471   112.02394   -63.31689
   73    61 S   CT   _C31    83     1.54916   109.30006   -72.79431
   74    73 S   HC   _H35    84     1.09716   110.55120  -172.99537
   75    73 S   HC   _H36    85     1.09325   112.97017    66.23286
   76    73 S   HC   _H37    86     1.09652   110.93839   -55.81610
   77    60 S   CT   _C29    94     1.54378   111.80821   -62.57004
   78    77 S   HC   _H29    95     1.09367   111.76396    57.73124
   79    77 S   HC   _H30    96     1.09001   113.30276   -63.95561
   80    77 S   HC   _H31    97     1.09111   112.26864   176.34227
   81    59 S   CT   _C28   102     1.55703   113.60499    -2.16844
   82    81 S   HC   _H26   103     1.09220   112.39762   -66.51212
   83    81 S   HC   _H27   104     1.09617   111.62662   174.33597
   84    81 S   HC   _H28   105     1.09476   112.15068    56.84207
   85    62 S   C5A  _C26    47     1.37436   106.67856  -178.92516
   86    85 S   HA   _H24    48     1.08025   133.82464  -179.72164
   87    64 S   CT   _C13    56     1.52409   116.29516   -48.27308
   88    87 S   HC   _H13    57     1.09369   107.55395   160.45096
   89    87 S   HC   _H14    58     1.09730   107.37424   -86.04072
   90    67 S   CT   _C7_    72     1.53227   117.97907  -167.66095
   91    90 S   HC   _H11    73     1.09622   109.97756  -170.52925
   92    90 S   HC   _H12    74     1.09609   109.15903    71.48904
   93    67 S   OS   _O34    87     1.45033   108.99974    67.05290
   94    85 S   OA   _O41    49     1.35646   110.47061     0.64316
   95    87 S   CT   _C12    59     1.54204   115.18751    35.32149
   96    95 S   HC   _H5_    60     1.09398   102.73914   -88.90382
   97    90 S   CO4  _C8_    75     1.49767   115.95126   -49.65969
   98    97 S   O    _O35    76     1.22513   123.23333   158.81643
   99    93 S   CO4  _C5_    88     1.36127   118.53725  -142.47548
  100    99 S   O    _O33    89     1.22279   126.49019    -1.90773
  101    58 S   C5A  _C27    50     1.38229   127.05940  -141.79107
  102   101 S   HA   _H25    51     1.08072   133.41757    -1.17320
  103    97 S   OS   _O36    77     1.34861   112.62532   -27.81045
  104    99 S   CT   _C4_    90     1.49845   109.31940   177.51289
  105   104 S   HC   _H8_    91     1.09296   109.72698   -63.71884
  106   104 S   HC   _H9_    92     1.09369   109.37801   177.08913
  107   104 S   HC   _H10    93     1.09301   109.88570    58.12703
  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
  30   2   1   1  14   7  24   8   3  16   6   9   3   2   1   3
   1   8  12   5   4  17   6  24   8  10  13  22  15   6   4  11
   6   5  18   8   9   4   3   2   5   3   2   1   8   3   2   1
   4   2   1   1   4   2   4   3   2   8   5   4   8   2   1   1
   2   1   5   4   1   1   1   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    59    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    40    54    59    64    95    39    42    44    81    48  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    40    41    50    54    55    58    59    64    65    66    87    95    96    39    42    43    51    60    44    45    46    47    81    82    83    84    48    49  
   35    36  
   36  
    0  
   38    40    41    50    54    59    64    95    39    42    44    81    48    49  
   40    41    50    59    39    48    49  
   42    43    51    52    53    56    60    67    77    44    45    46    47    81    48    40    54    59    64    87    88    89    95    96  
   41    50    54    55    58    59    48    49  
   50    54    48  
   43    51    52    53    56    57    60    61    44    45    46    47    59    87    95    96  
   51    52    53    56    44    95  
   45    46    47    51    59    60    87    95    96  
   46    47    95  
   47    95  
   95  
   49    50    59  
    0  
   54    55    58    62   101    59    64    81  
   52    53    56    57    60    67   103    61    69    73    77    95  
   53    56    57    60    61  
   56    57    60    61  
   55    58    62    63    85    94   101   102    59    64    65    66    87    81    82    83    84  
   58    62   101    59    64    81  
   57    60    67    68    90    97   103    61    69    70    71    72    73    74    75    76    93    77    78    79    80    87    95    96  
   60    67   103    61    69    73    77    95  
   62    63    85    86    94   101   102    59    64    81  
   64    65    66    87    88    89    95    81    82    83    84    62   101  
   67    68    90    91    92    97   103    61    69    73    93    99    77    78    79    80    64    87    88    89    95    96  
   69    70    71    72    73    74    75    76    77    67    90    95    97    98   103  
   63    85    86    94   101   102  
   85    86    94   101  
   65    66    87    88    89    95    96    81    82    83    84  
   66    87    88    89    95    81  
   87    88    89    95    81  
   68    90    91    92    97    98   103    93    99   100   104    77    78    79    80    87    95    96  
   90    91    92    97    93    99    77    95  
   70    71    72    73    74    75    76    97   103  
   71    72    73   103  
   72    73   103  
   73   103  
   74    75    76    97   103  
   75    76   103  
   76   103  
  103  
   78    79    80    87    90    93    95    96  
   79    80    95  
   80    95  
   95  
   82    83    84    87  
   83    84  
   84  
    0  
   86    94   101   102  
   94   101  
   88    89    95    96  
   89    95    96  
   95    96  
   91    92    97    98   103    93    99    95  
   92    97    98   103    93  
   97    98   103    93  
   99   100   104   105   106   107    95    97  
  101   102  
   96  
    0  
   98   103  
  103  
  100   104   105   106   107  
  104   105   106   107  
  102  
    0  
    0  
  105   106   107  
  106   107  
  107  
    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   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   39   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   40   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   41   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   42   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   44   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   49   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   50   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   51   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   53   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   54   3.5000   0.0660   0.335000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   56   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5500   0.0760  -0.143000   2.0020   1.7750   0.001000000  -0.843144165
   59   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   60   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   61   3.5000   0.0660   0.250000   1.9750   1.7500   0.005000000  -0.741685710
   62   3.5500   0.0760  -0.154000   2.0020   1.7750   0.001000000  -0.843144165
   63   2.4200   0.0300   0.126000   1.3810   1.2100   0.030040813   0.268726247
   64   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   69   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   86   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   87   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   88   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   92   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   93   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   94   2.9000   0.1400  -0.190000   1.6450   1.4500   0.001000000  -0.126889456
   95   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   98   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   99   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
  100   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
  101   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
  102   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
  103   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
  104   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  105   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  106   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  107   2.4200   0.0150   0.060000   1.3810   1.2100   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    59   268.000  1.529
   33    39   268.000  1.529
   37    38   340.000  1.090
   37    40   317.000  1.522
   37    48   320.000  1.410
   40    41   570.000  1.229
   40    50   214.000  1.327
   50    54   320.000  1.410
   54    55   340.000  1.090
   54    58   285.000  1.502
   54    59   268.000  1.529
   58    62   469.000  1.424
   58   101   546.000  1.367
   62    63   367.000  1.080
   62    85   546.000  1.367
   85    86   367.000  1.080
   85    94   340.000  1.360
   94   101   340.000  1.360
  101   102   367.000  1.080
   59    64   268.000  1.529
   59    81   268.000  1.529
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    87   268.000  1.529
   87    88   340.000  1.090
   87    89   340.000  1.090
   87    95   268.000  1.529
   95    96   340.000  1.090
   95    39   268.000  1.529
   95    60   268.000  1.529
   39    42   317.000  1.522
   39    44   268.000  1.529
   42    43   570.000  1.229
   42    51   317.000  1.522
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    56   268.000  1.529
   56    57   340.000  1.090
   56    60   268.000  1.529
   56    61   268.000  1.529
   60    67   268.000  1.529
   60    77   268.000  1.529
   67    68   340.000  1.090
   67    90   268.000  1.529
   67    93   320.000  1.410
   90    91   340.000  1.090
   90    92   340.000  1.090
   90    97   317.000  1.522
   97    98   570.000  1.229
   97   103   214.000  1.327
  103    61   320.000  1.410
   61    69   268.000  1.529
   61    73   268.000  1.529
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   340.000  1.090
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    76   340.000  1.090
   93    99   214.000  1.327
   99   100   570.000  1.229
   99   104   317.000  1.522
  104   105   340.000  1.090
  104   106   340.000  1.090
  104   107   340.000  1.090
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    80   340.000  1.090
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   340.000  1.090
   81    82   340.000  1.090
   81    83   340.000  1.090
   81    84   340.000  1.090
   48    49   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    59    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    40    63.00000  111.10000
   33    37    48    50.00000  109.50000
   33    59    54    58.35000  112.70000
   33    59    64    58.35000  112.70000
   33    59    81    58.35000  112.70000
   33    39    95    58.35000  112.70000
   33    39    42    63.00000  111.10000
   33    39    44    58.35000  112.70000
   37    40    41    80.00000  120.40000
   37    40    50    81.00000  111.40000
   37    48    49    55.00000  108.50000
   40    37    38    35.00000  109.50000
   40    50    54    83.00000  116.90000
   50    40    41    83.00000  123.40000
   50    54    55    35.00000  109.50000
   50    54    58    85.00000  111.85700
   50    54    59    50.00000  109.50000
   54    58    62    60.00000  130.00000
   54    58   101    60.00000  130.00000
   54    59    64    58.35000  112.70000
   54    59    81    58.35000  112.70000
   58    54    55    35.00000  109.50000
   58    62    63    35.00000  127.50000
   58    62    85    70.00000  107.30000
   58   101    94    70.00000  110.60000
   58   101   102    35.00000  132.10000
   62    85    86    35.00000  132.10000
   62    85    94    70.00000  110.60000
   85    62    63    35.00000  125.70000
   85    94   101    70.00000  106.50000
   94    85    86    35.00000  113.40000
   94   101   102    35.00000  113.40000
  101    58    62    70.00000  107.30000
   59    33    37    58.35000  112.70000
   59    54    55    37.50000  110.70000
   59    54    58    70.00000  112.17500
   59    64    65    37.50000  110.70000
   59    64    66    37.50000  110.70000
   59    64    87    58.35000  112.70000
   59    81    82    37.50000  110.70000
   59    81    83    37.50000  110.70000
   59    81    84    37.50000  110.70000
   64    87    88    37.50000  110.70000
   64    87    89    37.50000  110.70000
   64    87    95    58.35000  112.70000
   66    64    65    33.00000  107.80000
   87    64    65    37.50000  110.70000
   87    64    66    37.50000  110.70000
   87    95    96    37.50000  110.70000
   87    95    39    58.35000  112.70000
   87    95    60    58.35000  112.70000
   89    87    88    33.00000  107.80000
   95    87    88    37.50000  110.70000
   95    87    89    37.50000  110.70000
   95    39    42    63.00000  111.10000
   95    39    44    58.35000  112.70000
   95    60    56    58.35000  112.70000
   95    60    67    58.35000  112.70000
   95    60    77    58.35000  112.70000
   39    33    37    58.35000  112.70000
   39    33    59    58.35000  112.70000
   39    95    96    37.50000  110.70000
   39    42    43    80.00000  120.40000
   39    42    51    70.00000  116.00000
   39    44    45    37.50000  110.70000
   39    44    46    37.50000  110.70000
   39    44    47    37.50000  110.70000
   42    51    52    35.00000  109.50000
   42    51    53    35.00000  109.50000
   42    51    56    63.00000  111.10000
   51    42    43    80.00000  120.40000
   51    56    57    37.50000  110.70000
   51    56    60    58.35000  112.70000
   51    56    61    58.35000  112.70000
   53    51    52    33.00000  107.80000
   56    51    52    37.50000  110.70000
   56    51    53    37.50000  110.70000
   56    60    67    58.35000  112.70000
   56    60    77    58.35000  112.70000
   56    61   103    50.00000  109.50000
   56    61    69    58.35000  112.70000
   56    61    73    58.35000  112.70000
   60    95    96    37.50000  110.70000
   60    95    39    58.35000  112.70000
   60    56    57    37.50000  110.70000
   60    67    68    37.50000  110.70000
   60    67    90    58.35000  112.70000
   60    67    93    50.00000  109.50000
   60    77    78    37.50000  110.70000
   60    77    79    37.50000  110.70000
   60    77    80    37.50000  110.70000
   67    90    91    37.50000  110.70000
   67    90    92    37.50000  110.70000
   67    90    97    63.00000  111.10000
   67    93    99    83.00000  116.90000
   90    67    68    37.50000  110.70000
   90    97    98    80.00000  120.40000
   90    97   103    81.00000  111.40000
   92    90    91    33.00000  107.80000
   97    90    91    35.00000  109.50000
   97    90    92    35.00000  109.50000
   97   103    61    83.00000  116.90000
  103    97    98    83.00000  123.40000
  103    61    69    50.00000  109.50000
  103    61    73    50.00000  109.50000
   61    56    57    37.50000  110.70000
   61    56    60    58.35000  112.70000
   61    69    70    37.50000  110.70000
   61    69    71    37.50000  110.70000
   61    69    72    37.50000  110.70000
   61    73    74    37.50000  110.70000
   61    73    75    37.50000  110.70000
   61    73    76    37.50000  110.70000
   71    69    70    33.00000  107.80000
   72    69    70    33.00000  107.80000
   72    69    71    33.00000  107.80000
   73    61    69    58.35000  112.70000
   75    73    74    33.00000  107.80000
   76    73    74    33.00000  107.80000
   76    73    75    33.00000  107.80000
   93    67    68    35.00000  109.50000
   93    67    90    50.00000  109.50000
   93    99   100    83.00000  123.40000
   93    99   104    81.00000  111.40000
   99   104   105    35.00000  109.50000
   99   104   106    35.00000  109.50000
   99   104   107    35.00000  109.50000
  104    99   100    80.00000  120.40000
  106   104   105    33.00000  107.80000
  107   104   105    33.00000  107.80000
  107   104   106    33.00000  107.80000
   77    60    67    58.35000  112.70000
   79    77    78    33.00000  107.80000
   80    77    78    33.00000  107.80000
   80    77    79    33.00000  107.80000
   44    39    42    63.00000  111.10000
   46    44    45    33.00000  107.80000
   47    44    45    33.00000  107.80000
   47    44    46    33.00000  107.80000
   81    59    64    58.35000  112.70000
   83    81    82    33.00000  107.80000
   84    81    82    33.00000  107.80000
   84    81    83    33.00000  107.80000
   48    37    38    35.00000  109.50000
   48    37    40    90.00000  109.61100
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
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   60    95    39    44   0.20000  1.0 3.0
   60    56    61   103   0.62750  1.0 1.0
   60    56    61   103  -0.30950 -1.0 2.0
   60    56    61   103   0.27300  1.0 3.0
   60    56    61    69   0.56750  1.0 1.0
   60    56    61    69  -0.07550 -1.0 2.0
   60    56    61    69   0.20000  1.0 3.0
   60    56    61    73   0.56750  1.0 1.0
   60    56    61    73  -0.07550 -1.0 2.0
   60    56    61    73   0.20000  1.0 3.0
   60    67    90    91   0.15000  1.0 3.0
   60    67    90    92   0.15000  1.0 3.0
   60    67    90    97  -0.95700  1.0 1.0
   60    67    90    97  -0.18200 -1.0 2.0
   60    67    90    97   0.29450  1.0 3.0
   60    67    93    99  -0.25900  1.0 1.0
   60    67    93    99  -0.47000 -1.0 2.0
   60    67    93    99   0.11750  1.0 3.0
   67    60    77    78   0.15000  1.0 3.0
   67    60    77    79   0.15000  1.0 3.0
   67    60    77    80   0.15000  1.0 3.0
   67    90    97    98   0.30150 -1.0 2.0
   67    90    97   103   0.36750  1.0 3.0
   67    93    99   100   3.00000 -1.0 2.0
   67    93    99   104   1.63150  1.0 1.0
   67    93    99   104   2.92000 -1.0 2.0
   68    67    90    91   0.15000  1.0 3.0
   68    67    90    92   0.15000  1.0 3.0
   68    67    90    97  -0.11250  1.0 3.0
   68    67    93    99   0.08050  1.0 3.0
   90    67    93    99  -0.25900  1.0 1.0
   90    67    93    99  -0.47000 -1.0 2.0
   90    67    93    99   0.11750  1.0 3.0
   90    97   103    61   1.63150  1.0 1.0
   90    97   103    61   2.92000 -1.0 2.0
   91    90    97    98   0.00000  1.0 1.0
   91    90    97   103   0.00000  1.0 1.0
   92    90    97    98   0.00000  1.0 1.0
   92    90    97   103   0.00000  1.0 1.0
   97   103    61    56  -0.25900  1.0 1.0
   97   103    61    56  -0.47000 -1.0 2.0
   97   103    61    56   0.11750  1.0 3.0
   97   103    61    69  -0.25900  1.0 1.0
   97   103    61    69  -0.47000 -1.0 2.0
   97   103    61    69   0.11750  1.0 3.0
   97   103    61    73  -0.25900  1.0 1.0
   97   103    61    73  -0.47000 -1.0 2.0
   97   103    61    73   0.11750  1.0 3.0
   98    97   103    61   3.00000 -1.0 2.0
  103    61    69    70   0.23400  1.0 3.0
  103    61    69    71   0.23400  1.0 3.0
  103    61    69    72   0.23400  1.0 3.0
  103    61    73    74   0.23400  1.0 3.0
  103    61    73    75   0.23400  1.0 3.0
  103    61    73    76   0.23400  1.0 3.0
   61    56    60    95   0.56750  1.0 1.0
   61    56    60    95  -0.07550 -1.0 2.0
   61    56    60    95   0.20000  1.0 3.0
   61    56    60    67   0.56750  1.0 1.0
   61    56    60    67  -0.07550 -1.0 2.0
   61    56    60    67   0.20000  1.0 3.0
   61    56    60    77   0.56750  1.0 1.0
   61    56    60    77  -0.07550 -1.0 2.0
   61    56    60    77   0.20000  1.0 3.0
   69    61    73    74   0.15000  1.0 3.0
   69    61    73    75   0.15000  1.0 3.0
   69    61    73    76   0.15000  1.0 3.0
   73    61    69    70   0.15000  1.0 3.0
   73    61    69    71   0.15000  1.0 3.0
   73    61    69    72   0.15000  1.0 3.0
   93    67    90    91   0.23400  1.0 3.0
   93    67    90    92   0.23400  1.0 3.0
   93    67    90    97  -0.09450  1.0 1.0
   93    67    90    97  -1.12950 -1.0 2.0
   93    67    90    97   0.54000  1.0 3.0
   93    99   104   105   0.00000  1.0 1.0
   93    99   104   106   0.00000  1.0 1.0
   93    99   104   107   0.00000  1.0 1.0
  100    99   104   105   0.00000  1.0 1.0
  100    99   104   106   0.00000  1.0 1.0
  100    99   104   107   0.00000  1.0 1.0
   77    60    67    68   0.15000  1.0 3.0
   77    60    67    90   0.56750  1.0 1.0
   77    60    67    90  -0.07550 -1.0 2.0
   77    60    67    90   0.20000  1.0 3.0
   77    60    67    93   0.62750  1.0 1.0
   77    60    67    93  -0.30950 -1.0 2.0
   77    60    67    93   0.27300  1.0 3.0
   44    39    42    43   0.30150 -1.0 2.0
   44    39    42    51   0.60050  1.0 1.0
   44    39    42    51   0.05600 -1.0 2.0
   44    39    42    51   0.26150  1.0 3.0
   81    59    64    65   0.15000  1.0 3.0
   81    59    64    66   0.15000  1.0 3.0
   81    59    64    87   0.56750  1.0 1.0
   81    59    64    87  -0.07550 -1.0 2.0
   81    59    64    87   0.20000  1.0 3.0
   48    37    40    41   0.30150 -1.0 2.0
   48    37    40    50   0.30750  1.0 1.0
   48    37    40    50   1.13850 -1.0 2.0
   48    37    40    50   0.38850  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
   35    30    34    36  10.50000 -1.0 2.0
   37    50    40    41  10.50000 -1.0 2.0
   62   101    58    54   4.00000 -1.0 2.0
   85    63    62    58   1.10000 -1.0 2.0
   94    86    85    62   1.10000 -1.0 2.0
   94   102   101    58   1.10000 -1.0 2.0
   39    51    42    43  10.50000 -1.0 2.0
   90   103    97    98  10.50000 -1.0 2.0
   93   104    99   100  10.50000 -1.0 2.0
END
