* LIGAND DATABASE FILE (OPLS2005)
*
001     106   109    208    337     628
    1     0 S   NP   _N1_     1    29.27519    95.68821   -25.43111
    2     1 S   H    _HN1     2     1.02948    72.45678     8.47816
    3     1 S   H    _H1_     3     1.02828    34.67231  -174.38497
    4     1 S   H    _H2_     4     1.02791   117.99230   -93.42199
    5     1 S   CT   _CA1     5     1.50113   125.68449   111.38866
    6     5 S   HC   _HA1     6     1.09574   105.18234    95.09484
    7     5 S   CO3  _C1_     7     1.53775   112.46079   -25.12968
    8     7 S   O2Z  _O11     8     1.26372   115.01139   -42.89722
    9     7 S   O2Z  _O12     9     1.26238   114.93816   136.19442
   10     5 S   CT   _CB1    10     1.53071   107.41581  -146.93981
   11    10 S   HC   HB11    11     1.09837   109.34053   -49.69421
   12    10 S   HC   HB12    12     1.09812   110.46756    66.90227
   13    10 S   CT   _CG1    13     1.53006   112.62505  -170.65586
   14    13 S   HC   HG11    14     1.09576   110.67629   -66.46680
   15    13 S   HC   HG12    15     1.09671   109.74533    52.77467
   16    13 S   C    _CD1    16     1.51807   112.12380   173.22859
   17    16 S   O    _OE1    17     1.22744   123.24079     9.24854
   18    16 S   N    _N2_    18     1.38652   111.74840  -170.76264
   19    18 S   H    _HN2    19     1.01581   118.96860     1.36745
   20    18 S   CT1  _CA2    20     1.46196   123.37336   177.04567
   21    20 S   HC   _HA2    21     1.09741   109.30073     5.69333
   22    20 S   C    _C2_    22     1.53621   108.87809  -109.80959
   23    22 S   O    _O2_    23     1.23078   122.22766  -149.19682
   24    20 S   CT   _CB2    32     1.53299   111.58343   127.64729
   25    24 S   HC   HB21    33     1.09530   110.10296    56.63526
   26    24 S   HC   HB22    34     1.09512   110.08280   175.61890
   27    22 S   N    _N3_    24     1.38306   113.83551    38.33057
   28    27 S   H    _HN3    25     1.01561   119.60934    -3.31044
   29    24 S   S    _SG2    35     1.82859   111.46026   -64.74167
   30    27 S   CT   _CA3    26     1.45291   123.27149   177.14453
   31    30 S   HC   HA31    27     1.09547   107.51561   -64.65579
   32    30 S   HC   HA32    28     1.09555   107.99054    51.79996
   33    29 S   CT   _C28    36     1.86098    99.63008  -179.72732
   34    33 S   HC   _H7_    37     1.09737   105.86919    28.06222
   35    30 S   CO3  _C3_    29     1.52975   114.04108   173.79509
   36    35 S   O2Z  _O31    30     1.26382   116.06082    -0.47560
   37    35 S   O2Z  _O32    31     1.26423   114.42238   179.58410
   38    33 S   CM   _C27    38     1.51098   106.56132   -83.73856
   39    38 S   HC   _H36    39     1.08954   117.95787    34.99541
   40    38 S   CMA  _C26    40     1.34421   124.57195  -147.87452
   41    40 S   OM   _O37    41     1.25956   130.69507  -178.41329
   42    40 S   CM   _C25    42     1.45327   117.77269     0.00000
   43    42 S   HC   _H35    43     1.09058   117.63893  -171.22813
   44    42 S   CM   _C24    44     1.34682   123.93303    11.22498
   45    44 S   CT   _C23    45     1.50903   119.15505   175.15394
   46    45 S   HC   _H33    46     1.09629   109.45304  -107.37032
   47    45 S   HC   _H34    47     1.09713   111.35449     9.34424
   48    45 S   CT   _C22    48     1.51753   111.81688   130.83051
   49    48 S   HC   _H31    49     1.09631   108.49555   176.18438
   50    48 S   HC   _H32    50     1.09806   109.43380   -67.74955
   51    48 S   CT   _C9_    51     1.53574   111.83691    54.47763
   52    51 S   HC   _H5_    52     1.09476   107.83312    63.05759
   53    51 S   CT   _C10    53     1.53865   109.69919  -177.33376
   54    53 S   HC   _H6_    54     1.10265   105.92241    61.31455
   55    51 S   CT   _C8_    68     1.56590   110.40797   -56.71538
   56    55 S   HC   _H4_    69     1.10332   104.66935   -58.82501
   57    53 S   CT   _C11    55     1.52601   118.49555   -57.36792
   58    57 S   HC   _H13    56     1.09489   111.94999    78.16453
   59    57 S   HC   _H14    57     1.09594   111.46895   -42.41241
   60    33 S   CT   _C29    70     1.59630   115.16092   146.97428
   61    57 S   CT   _C12    58     1.54181   104.50443  -161.61137
   62    61 S   HC   _H15    59     1.09543   108.69583   128.49098
   63    61 S   HC   _H16    60     1.09623   109.97628  -113.87704
   64    60 S   CT   _C30    71     1.55105   112.38125    33.68176
   65    64 S   HC   _H37    72     1.09078   113.83207   -58.76526
   66    64 S   HC   _H38    73     1.09477   112.34228  -179.05436
   67    64 S   HC   _H39    74     1.09750   110.85804    61.39514
   68    61 S   CT   _C13    61     1.54937   106.56123     7.14468
   69    53 S   CT   _C5_    62     1.54521   114.14517  -179.58504
   70    68 S   CO4  _C14    81     1.53370   113.95136   149.39067
   71    70 S   O    _O33    82     1.23229   121.37938  -144.27512
   72    68 S   OH   _O36   105     1.43065   107.15825   -95.96132
   73    72 S   HO   _H30   106     0.97258   108.27060   179.67857
   74    69 S   CT   _C6_    63     1.54142   106.76277   -60.86898
   75    74 S   HC   _H11    64     1.09647   110.23638   -64.19106
   76    74 S   HC   _H12    65     1.09654   109.56467   178.59584
   77    69 S   CT   _C4_    77     1.55498   112.82355    61.19908
   78    77 S   HC   _H8_    78     1.09474   112.61724    72.61708
   79    77 S   HC   _H9_    79     1.09163   113.21287   -47.67810
   80    77 S   HC   _H10    80     1.09527   110.93988  -167.73925
   81    70 S   CT   _C15    83     1.52136   117.26163    40.02820
   82    81 S   HC   _H17    84     1.09466   108.85423    51.47444
   83    81 S   HC   _H18    85     1.09351   109.17856   -70.26384
   84    74 S   CT   _C7_    66     1.54443   113.20200    55.72391
   85    84 S   HC   _H3_    67     1.09376   106.47989  -172.19365
   86    81 S   OS   _O34    86     1.42920   108.73322   170.73221
   87    84 S   OH   _O38    75     1.41925   109.20788    72.71728
   88    87 S   HO   _H40    76     0.97232   107.79803    59.47803
   89    86 S   CO4  _C16    87     1.36261   115.35126  -177.60559
   90    89 S   O    _O35    88     1.22404   125.90366    -0.67435
   91    89 S   CT   _C17    89     1.51166   110.10574   178.71732
   92    91 S   HC   _H19    90     1.09814   108.33112    31.15374
   93    91 S   HC   _H20    91     1.09800   106.92105   144.15792
   94    91 S   CT   _C18    92     1.54430   114.52095   -92.93716
   95    94 S   CT   _C19    93     1.54081   108.12804  -179.88809
   96    95 S   HC   _H21    94     1.09591   111.16970    59.89741
   97    95 S   HC   _H22    95     1.09591   111.16843   -60.14893
   98    95 S   HC   _H23    96     1.09594   111.29213   179.87646
   99    94 S   CT   _C20    97     1.53775   111.22146    61.07463
  100    99 S   HC   _H24    98     1.09521   111.68620   -65.76716
  101    99 S   HC   _H25    99     1.09572   111.14491    54.83927
  102    99 S   HC   _H26   100     1.09610   111.06377   174.65346
  103    94 S   CT   _C21   101     1.53779   111.08978   -60.94517
  104   103 S   HC   _H27   102     1.09507   111.69751    65.61128
  105   103 S   HC   _H28   103     1.09571   111.14584   -54.97436
  106   103 S   HC   _H29   104     1.09611   111.05962  -174.78327
  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
  17   7   2   1   1   9   4   6   3   9   3  15  11   6   5  12
   5   4  18   8  22   9  15   6  11   6   5   8  11   5   4   4
   2   1   1  17  15  10   5   4   1  10   5   4   4   2   1   1
   6   3   2   3   2   6   1   1   8   4  15   5   4  12  11   4
   3   2   7   3   2   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    60    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    44    55    60    64  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    44    45    51    84    55    56    60    64    65    66    67  
   38    39    40    44    55    60    64  
   36    37  
   37  
    0  
   39    40    41    42    43    44    55    60    64  
   40    41    42    60  
   41    42    43    44    45    60  
   42    43    44  
   43    44    45    46    47    48    55    60    64  
   44    45    60  
   45    46    47    48    49    50    51    84    55    56    60    64    65    66    67  
   46    47    48    49    50    51    52    53    55    60    64  
   47    48    49    50    51    60  
   48    49    50    51    60  
   49    50    51    52    53    54    57    69    84    55    56    60  
   50    51    52    53    55  
   51    52    53    55  
   52    53    54    57    58    59    61    68    69    74    84    85    55    56    60    64    87    77  
   53    54    57    69    84    55    56    60  
   54    57    58    59    61    62    63    68    69    74    75    76    84    55    56    60    77    78    79    80    70    72  
   57    58    59    61    68    69    74    55    77  
   56    60    64    65    66    67    87    88    57    69    74    75    76    84    85  
   60    64    87    74    84    85  
   58    59    61    62    63    68    69    74    77    70    72  
   59    61    62    63    68    69  
   61    62    63    68    69  
   64    65    66    67    87    74    84    85  
   62    63    68    69    74    77    70    71    81    72    73  
   63    68    69    70    72  
   68    69    70    72  
   65    66    67    84  
   66    67  
   67  
    0  
   69    74    75    76    84    77    78    79    80    70    71    81    82    83    86    72    73  
   74    75    76    84    85    87    77    78    79    80    70    71    81    72    73  
   71    81    82    83    86    89    72    73    74    77  
   81    82    83    86    72  
   73    74    77    81  
    0  
   75    76    84    85    87    88    77    78    79    80  
   76    84    85    87    77  
   84    85    87    77  
   78    79    80    84  
   79    80  
   80  
    0  
   82    83    86    89    90    91  
   83    86    89  
   86    89  
   85    87    88  
   87    88  
   89    90    91    92    93    94  
   88  
    0  
   90    91    92    93    94    95    99   103  
   91    92    93    94  
   92    93    94    95    96    97    98    99   100   101   102   103   104   105   106  
   93    94    95    99   103  
   94    95    99   103  
   95    96    97    98    99   100   101   102   103   104   105   106  
   96    97    98    99   100   101   102   103   104   105   106  
   97    98    99   103  
   98    99   103  
   99   103  
  100   101   102   103   104   105   106  
  101   102   103  
  102   103  
  103  
  104   105   106  
  105   106  
  106  
    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   3.5500   0.0760   0.976300   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   43   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   45   3.5000   0.0660  -0.120000   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   61   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   69   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   70   3.7500   0.1050   0.422000   2.1120   1.8750   0.001000000  -0.126889456
   71   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   72   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   73   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   74   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   0.238000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   83   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   84   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   87   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   88   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   89   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   90   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   91   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   93   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   94   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   95   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   99   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  100   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  101   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  102   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  103   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  104   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    60   268.000  1.529
   38    39   340.000  1.080
   38    40   465.000  1.376
   40    41   745.000  1.250
   40    42   465.000  1.376
   42    43   340.000  1.080
   42    44   549.000  1.340
   44    45   317.000  1.510
   44    60   317.000  1.510
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   268.000  1.529
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   268.000  1.529
   51    52   340.000  1.090
   51    53   268.000  1.529
   51    55   268.000  1.529
   53    54   340.000  1.090
   53    57   268.000  1.529
   53    69   268.000  1.529
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    61   268.000  1.529
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    68   268.000  1.529
   68    69   268.000  1.529
   68    70   317.000  1.522
   68    72   320.000  1.410
   69    74   268.000  1.529
   69    77   268.000  1.529
   74    75   340.000  1.090
   74    76   340.000  1.090
   74    84   268.000  1.529
   84    85   340.000  1.090
   84    55   268.000  1.529
   84    87   320.000  1.410
   55    56   340.000  1.090
   55    60   268.000  1.529
   60    64   268.000  1.529
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   340.000  1.090
   87    88   553.000  0.945
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    80   340.000  1.090
   70    71   570.000  1.229
   70    81   317.000  1.522
   81    82   340.000  1.090
   81    83   340.000  1.090
   81    86   320.000  1.410
   86    89   214.000  1.327
   89    90   570.000  1.229
   89    91   317.000  1.522
   91    92   340.000  1.090
   91    93   340.000  1.090
   91    94   268.000  1.529
   94    95   268.000  1.529
   94    99   268.000  1.529
   94   103   268.000  1.529
   95    96   340.000  1.090
   95    97   340.000  1.090
   95    98   340.000  1.090
   99   100   340.000  1.090
   99   101   340.000  1.090
   99   102   340.000  1.090
  103   104   340.000  1.090
  103   105   340.000  1.090
  103   106   340.000  1.090
   72    73   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    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    60    75.00000  111.63000
   33    38    39    35.00000  117.00000
   33    38    40    70.00000  124.00000
   33    60    44    70.00000  112.02700
   33    60    55    58.35000  112.70000
   33    60    64    58.35000  112.70000
   38    33    34    35.00000  109.50000
   38    40    41    65.00000  137.10300
   38    40    42    70.00000  123.01800
   40    38    39    40.00000  120.50800
   40    42    43    40.00000  120.50800
   40    42    44    70.00000  117.34000
   42    40    41    65.00000  137.10300
   42    44    45    70.00000  124.00000
   42    44    60    70.00000  124.00000
   44    42    43    35.00000  120.00000
   44    45    46    35.00000  109.50000
   44    45    47    35.00000  109.50000
   44    45    48    70.00000  112.02700
   44    60    55    70.00000  112.02700
   44    60    64    70.00000  112.02700
   45    48    49    37.50000  110.70000
   45    48    50    37.50000  110.70000
   45    48    51    58.35000  112.70000
   47    45    46    33.00000  107.80000
   48    45    46    37.50000  110.70000
   48    45    47    37.50000  110.70000
   48    51    52    37.50000  110.70000
   48    51    53    58.35000  112.70000
   48    51    55    58.35000  112.70000
   50    48    49    33.00000  107.80000
   51    48    49    37.50000  110.70000
   51    48    50    37.50000  110.70000
   51    53    54    37.50000  110.70000
   51    53    57    58.35000  112.70000
   51    53    69    58.35000  112.70000
   51    55    84    58.35000  112.70000
   51    55    56    37.50000  110.70000
   51    55    60    58.35000  112.70000
   53    51    52    37.50000  110.70000
   53    57    58    37.50000  110.70000
   53    57    59    37.50000  110.70000
   53    57    61    58.35000  112.70000
   53    69    68    58.35000  112.70000
   53    69    74    58.35000  112.70000
   53    69    77    58.35000  112.70000
   57    53    54    37.50000  110.70000
   57    61    62    37.50000  110.70000
   57    61    63    37.50000  110.70000
   57    61    68    58.35000  112.70000
   59    57    58    33.00000  107.80000
   61    57    58    37.50000  110.70000
   61    57    59    37.50000  110.70000
   61    68    69    58.35000  112.70000
   61    68    70    63.00000  111.10000
   61    68    72    50.00000  109.50000
   63    61    62    33.00000  107.80000
   68    61    62    37.50000  110.70000
   68    61    63    37.50000  110.70000
   68    69    74    58.35000  112.70000
   68    69    77    58.35000  112.70000
   68    70    71    80.00000  120.40000
   68    70    81    70.00000  116.00000
   68    72    73    55.00000  108.50000
   69    53    54    37.50000  110.70000
   69    53    57    58.35000  112.70000
   69    74    75    37.50000  110.70000
   69    74    76    37.50000  110.70000
   69    74    84    58.35000  112.70000
   69    77    78    37.50000  110.70000
   69    77    79    37.50000  110.70000
   69    77    80    37.50000  110.70000
   74    84    85    37.50000  110.70000
   74    84    55    58.35000  112.70000
   74    84    87    50.00000  109.50000
   76    74    75    33.00000  107.80000
   84    74    75    37.50000  110.70000
   84    74    76    37.50000  110.70000
   84    55    56    37.50000  110.70000
   84    55    60    58.35000  112.70000
   84    87    88    55.00000  108.50000
   55    51    52    37.50000  110.70000
   55    51    53    58.35000  112.70000
   55    84    85    37.50000  110.70000
   55    60    64    58.35000  112.70000
   60    33    34    37.50000  110.70000
   60    33    38    70.00000  112.02700
   60    44    45    65.00000  117.92700
   60    55    56    37.50000  110.70000
   60    64    65    37.50000  110.70000
   60    64    66    37.50000  110.70000
   60    64    67    37.50000  110.70000
   66    64    65    33.00000  107.80000
   67    64    65    33.00000  107.80000
   67    64    66    33.00000  107.80000
   87    84    85    35.00000  109.50000
   87    84    55    50.00000  109.50000
   77    69    74    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
   70    68    69    63.00000  111.10000
   70    81    82    35.00000  109.50000
   70    81    83    35.00000  109.50000
   70    81    86    90.00000  108.74100
   81    70    71    80.00000  120.40000
   81    86    89    83.00000  116.90000
   83    81    82    33.00000  107.80000
   86    81    82    35.00000  109.50000
   86    81    83    35.00000  109.50000
   86    89    90    83.00000  123.40000
   86    89    91    81.00000  111.40000
   89    91    92    35.00000  109.50000
   89    91    93    35.00000  109.50000
   89    91    94    63.00000  111.10000
   91    89    90    80.00000  120.40000
   91    94    95    58.35000  112.70000
   91    94    99    58.35000  112.70000
   91    94   103    58.35000  112.70000
   93    91    92    33.00000  107.80000
   94    91    92    37.50000  110.70000
   94    91    93    37.50000  110.70000
   94    95    96    37.50000  110.70000
   94    95    97    37.50000  110.70000
   94    95    98    37.50000  110.70000
   94    99   100    37.50000  110.70000
   94    99   101    37.50000  110.70000
   94    99   102    37.50000  110.70000
   94   103   104    37.50000  110.70000
   94   103   105    37.50000  110.70000
   94   103   106    37.50000  110.70000
   97    95    96    33.00000  107.80000
   98    95    96    33.00000  107.80000
   98    95    97    33.00000  107.80000
   99    94    95    58.35000  112.70000
  101    99   100    33.00000  107.80000
  102    99   100    33.00000  107.80000
  102    99   101    33.00000  107.80000
  103    94    95    58.35000  112.70000
  103    94    99    58.35000  112.70000
  105   103   104    33.00000  107.80000
  106   103   104    33.00000  107.80000
  106   103   105    33.00000  107.80000
   72    68    69    50.00000  109.50000
   72    68    70    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
   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
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   70    81    86    89   0.03650  1.0 3.0
   71    70    81    82   0.00000  1.0 1.0
   71    70    81    83   0.00000  1.0 1.0
   71    70    81    86   0.30150 -1.0 2.0
   81    86    89    90   3.00000 -1.0 2.0
   81    86    89    91   1.63150  1.0 1.0
   81    86    89    91   2.92000 -1.0 2.0
   82    81    86    89   0.08050  1.0 3.0
   83    81    86    89   0.08050  1.0 3.0
   86    89    91    92   0.00000  1.0 1.0
   86    89    91    93   0.00000  1.0 1.0
   86    89    91    94   0.36750  1.0 3.0
   89    91    94    95  -0.95700  1.0 1.0
   89    91    94    95  -0.18200 -1.0 2.0
   89    91    94    95   0.29450  1.0 3.0
   89    91    94    99  -0.95700  1.0 1.0
   89    91    94    99  -0.18200 -1.0 2.0
   89    91    94    99   0.29450  1.0 3.0
   89    91    94   103  -0.95700  1.0 1.0
   89    91    94   103  -0.18200 -1.0 2.0
   89    91    94   103   0.29450  1.0 3.0
   90    89    91    92   0.00000  1.0 1.0
   90    89    91    93   0.00000  1.0 1.0
   90    89    91    94   0.30150 -1.0 2.0
   91    94    95    96   0.15000  1.0 3.0
   91    94    95    97   0.15000  1.0 3.0
   91    94    95    98   0.15000  1.0 3.0
   91    94    99   100   0.15000  1.0 3.0
   91    94    99   101   0.15000  1.0 3.0
   91    94    99   102   0.15000  1.0 3.0
   91    94   103   104   0.15000  1.0 3.0
   91    94   103   105   0.15000  1.0 3.0
   91    94   103   106   0.15000  1.0 3.0
   92    91    94    95   0.15000  1.0 3.0
   92    91    94    99   0.15000  1.0 3.0
   92    91    94   103   0.15000  1.0 3.0
   93    91    94    95   0.15000  1.0 3.0
   93    91    94    99   0.15000  1.0 3.0
   93    91    94   103   0.15000  1.0 3.0
   95    94    99   100   0.15000  1.0 3.0
   95    94    99   101   0.15000  1.0 3.0
   95    94    99   102   0.15000  1.0 3.0
   95    94   103   104   0.15000  1.0 3.0
   95    94   103   105   0.15000  1.0 3.0
   95    94   103   106   0.15000  1.0 3.0
   99    94    95    96   0.15000  1.0 3.0
   99    94    95    97   0.15000  1.0 3.0
   99    94    95    98   0.15000  1.0 3.0
   99    94   103   104   0.15000  1.0 3.0
   99    94   103   105   0.15000  1.0 3.0
   99    94   103   106   0.15000  1.0 3.0
  103    94    95    96   0.15000  1.0 3.0
  103    94    95    97   0.15000  1.0 3.0
  103    94    95    98   0.15000  1.0 3.0
  103    94    99   100   0.15000  1.0 3.0
  103    94    99   101   0.15000  1.0 3.0
  103    94    99   102   0.15000  1.0 3.0
   72    68    69    53   0.86500  1.0 1.0
   72    68    69    53  -0.17500 -1.0 2.0
   72    68    69    53   0.20800  1.0 3.0
   72    68    69    74   0.86500  1.0 1.0
   72    68    69    74  -0.17500 -1.0 2.0
   72    68    69    74   0.20800  1.0 3.0
   72    68    69    77   0.86500  1.0 1.0
   72    68    69    77  -0.17500 -1.0 2.0
   72    68    69    77   0.20800  1.0 3.0
   72    68    70    71   0.30150 -1.0 2.0
   72    68    70    81   0.55300  1.0 1.0
   72    68    70    81   1.25850 -1.0 2.0
   72    68    70    81  -0.23600  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    40   1.10000 -1.0 2.0
   42    41    40    38   1.10000 -1.0 2.0
   40    43    42    44   1.10000 -1.0 2.0
   45    60    44    42   1.10000 -1.0 2.0
   68    81    70    71  10.50000 -1.0 2.0
   86    91    89    90  10.50000 -1.0 2.0
END
