* LIGAND DATABASE FILE (OPLS2005)
*
001     114   116    210    325     617
    1     0 S   NP   _N1_     1    29.04913    94.01517   -26.07996
    2     1 S   H    _HN1     2     1.02828    29.75193  -161.89899
    3     1 S   H    _H1_     3     1.02793   120.45139   -90.01446
    4     1 S   H    _H2_     4     1.02947    77.41392    14.06907
    5     1 S   CT   _CA1     5     1.50128   120.88606   120.51808
    6     5 S   HC   _HA1     6     1.09573   105.16676    90.47683
    7     5 S   CO3  _C1_     7     1.53773   112.42084   -29.73044
    8     7 S   O2Z  _O11     8     1.26377   115.00107   -43.21517
    9     7 S   O2Z  _O12     9     1.26233   114.94148   135.76512
   10     5 S   CT   _CB1    10     1.53059   107.40584  -151.56495
   11    10 S   HC   HB11    11     1.09839   109.34534   -49.38407
   12    10 S   HC   HB12    12     1.09811   110.47590    67.21588
   13    10 S   CT   _CG1    13     1.53015   112.62664  -170.31716
   14    13 S   HC   HG11    14     1.09574   110.70404   -66.80131
   15    13 S   HC   HG12    15     1.09670   109.72396    52.44586
   16    13 S   C    _CD1    16     1.51814   112.03191   172.92088
   17    16 S   O    _OE1    17     1.22762   123.16779    10.98648
   18    16 S   N    _N2_    18     1.38622   111.77868  -169.00825
   19    18 S   H    _HN2    19     1.01572   119.14031     0.79402
   20    18 S   CT1  _CA2    20     1.46266   123.44277   177.47889
   21    20 S   HC   _HA2    21     1.09750   109.14343     7.92823
   22    20 S   C    _C2_    22     1.53717   109.32793  -107.59270
   23    22 S   O    _O2_    23     1.23090   122.24876  -152.73534
   24    20 S   CT   _CB2    32     1.53396   111.50293   129.72159
   25    24 S   HC   HB21    33     1.09515   109.74021    57.36017
   26    24 S   HC   HB22    34     1.09407   109.58007   176.32821
   27    22 S   N    _N3_    24     1.38321   113.99263    34.86964
   28    27 S   H    _HN3    25     1.01527   119.56078    -3.55413
   29    24 S   S    _SG2    35     1.83269   110.87128   -64.01133
   30    27 S   CT   _CA3    26     1.45256   123.25510   177.09734
   31    30 S   HC   HA31    27     1.09548   107.55212   -64.00940
   32    30 S   HC   HA32    28     1.09557   107.95631    52.43922
   33    29 S   CT   _C11    36     1.88062   101.54764   174.42269
   34    33 S   OM   _O35    37     1.31542   107.99321   -68.83889
   35    30 S   CO3  _C3_    29     1.52955   114.05655   174.43739
   36    35 S   O2Z  _O31    30     1.26383   116.09593     0.52039
   37    35 S   O2Z  _O32    31     1.26427   114.40963  -179.44117
   38    33 S   CM   _C10    38     1.54797   105.89984   174.58753
   39    38 S   CM   _C9_    39     1.35485   121.33886   -93.68952
   40    38 S   CT   _C21    87     1.53715   119.81471    80.78995
   41    40 S   HC   _H16    88     1.09904   106.54786  -123.21759
   42    40 S   HC   _H17    89     1.09640   110.78351   -11.54328
   43    39 S   CT   _C8_    40     1.53093   125.59171     0.71107
   44    39 S   OH   _O37    85     1.39279   118.81586   177.78353
   45    44 S   HO   _H31    86     0.96967   109.28296  -179.31901
   46    40 S   CT   _C22    90     1.55091   116.96935   115.16883
   47    46 S   HC   _H3_    91     1.09562   109.64580    53.45778
   48    43 S   CO4  _C20    41     1.54597   110.72749     0.41778
   49    48 S   O    _O34    42     1.23181   121.75960   149.21125
   50    43 S   CT   _C7_    57     1.56144   108.75842  -117.58848
   51    50 S   HC   _H9_    58     1.09394   110.38152   -45.42118
   52    50 S   HC   _H10    59     1.09724   109.42494    68.75353
   53    43 S   CT   _C31    71     1.56971   110.10450   120.95675
   54    53 S   HC   _H32    72     1.09449   110.01586    70.26053
   55    53 S   HC   _H33    73     1.09840   110.00849  -175.21312
   56    46 S   CT   _C23    92     1.55630   114.93565   -70.48480
   57    56 S   HC   _H4_    93     1.09918   106.93386   -38.73647
   58    33 S   CM   _C12    43     1.55396   109.59186    54.64456
   59    50 S   CM   _C6_    60     1.50893   115.15666  -170.55910
   60    59 S   HC   _H8_    61     1.08825   114.31569   -67.29852
   61    53 S   CM   _C32    74     1.50994   114.88837   -55.89379
   62    61 S   HC   _H34    75     1.08963   113.85170   -70.00487
   63    56 S   CT   _C24    94     1.54632   105.01466  -152.18084
   64    63 S   HC   _H18    95     1.09609   113.48243  -115.57779
   65    63 S   HC   _H19    96     1.09706   109.44042   125.04916
   66    56 S   CM   _C28   107     1.52063   119.59740    83.19856
   67    58 S   CMA  _C13    44     1.37788   129.83619  -112.84741
   68    67 S   OM   _O33    45     1.26981   128.92270     0.97799
   69    59 S   CM   _C5_    62     1.34682   128.17868   113.22429
   70    61 S   CM   _C33    76     1.34658   128.58995   110.57036
   71    63 S   CT   _C25    97     1.52743   106.81748     5.89784
   72    71 S   HC   _H20    98     1.09500   110.75563   142.72088
   73    71 S   HC   _H21    99     1.09693   109.16867   -98.14705
   74    66 S   CM   _C29   108     1.34244   125.06435    21.77225
   75    74 S   HC   _H26   109     1.08543   121.08147  -179.74821
   76    74 S   HC   _H27   110     1.08225   122.61000     0.56924
   77    66 S   CT   _C30   111     1.50751   115.15404  -158.95487
   78    77 S   HC   _H28   112     1.09477   110.33771   -61.32843
   79    77 S   HC   _H29   113     1.09414   110.63647    58.59353
   80    77 S   HC   _H30   114     1.09529   112.27214   178.66236
   81    67 S   CA   _C14    46     1.50233   116.30423  -178.46520
   82    69 S   CT   _C4_    63     1.50611   120.21539   178.75353
   83    82 S   HC   _H5_    64     1.09494   110.26885   119.08106
   84    82 S   HC   _H6_    65     1.09497   110.19559  -121.10021
   85    82 S   HC   _H7_    66     1.09521   112.45752    -1.06275
   86    69 S   CT   _C36    67     1.50233   125.46679    -1.85330
   87    86 S   HC   _H41    68     1.09482   110.07776   114.24924
   88    86 S   HC   _H42    69     1.09547   110.00749  -126.50488
   89    86 S   HC   _H43    70     1.09178   113.68688    -6.91736
   90    70 S   CT   _C34    77     1.50635   120.15912  -179.44715
   91    90 S   HC   _H35    78     1.09503   110.19983   119.73540
   92    90 S   HC   _H36    79     1.09491   110.24956  -120.44613
   93    90 S   HC   _H37    80     1.09519   112.49255    -0.30261
   94    70 S   CT   _C35    81     1.50176   125.59663    -0.25564
   95    94 S   HC   _H38    82     1.09519   110.03506   122.84208
   96    94 S   HC   _H39    83     1.09518   110.01147  -117.91317
   97    94 S   HC   _H40    84     1.09126   113.74885     2.63864
   98    46 S   CT   _C26   100     1.54833   112.60426   172.49303
   99    81 S   CA   _C15    47     1.40426   120.21189    95.24073
  100    99 S   HA   _H11    48     1.08732   120.28938    -2.25238
  101    98 S   CT   _C27   101     1.52473   113.93417   -72.26947
  102   101 S   HC   _H22   102     1.09485   111.28581    68.47175
  103   101 S   HC   _H23   103     1.09467   111.77030   -53.09895
  104   101 S   HC   _H24   104     1.09605   110.57241  -173.70129
  105    98 S   OH   _O36   105     1.42706   110.50675    50.49521
  106   105 S   HO   _H25   106     0.97215   108.02265   176.06174
  107    99 S   CA   _C16    49     1.39613   120.41460   177.39196
  108   107 S   HA   _H12    50     1.08600   119.88440   179.58836
  109   107 S   CA   _C17    51     1.39410   120.06915    -0.50513
  110   109 S   HA   _H13    52     1.08603   119.98581   179.90109
  111   109 S   CA   _C18    53     1.39423   120.03829    -0.59413
  112   111 S   HA   _H14    54     1.08600   120.05685  -179.35229
  113    81 S   CA   _C19    55     1.40486   120.66657   -89.28535
  114   113 S   HA   _H15    56     1.08757   120.21740     2.69414
  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   8   5   4   3
  15   6   2   1   1  16  18  15   5   4  18   4   1  19   8  13
   4  12   5   4   9   4   3  18   8   5  10   3  10   3  11   6
   5   9   8   3   8   8   9   4   3   6   2   1   3   2   1   1
   9   7   3   2   1   3   2   1   1   7   3   2   1   3   2   1
   1   6   8   4   5   3   2   1   1   1   6   3   5   3   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    58    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    48    58    67    40  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    43    48    49    58    67    68    81    44    40    41    42    46  
   38    39    48    58    67    40  
   36    37  
   37  
    0  
   39    43    48    58    67    50    53    44    45    40    41    42    46    47    56    98  
   43    48    49    58    50    51    52    59    53    54    55    61    44    45    40    41    42    46  
   41    42    46    47    56    57    63    71    98   101   105    66    43    44    58  
   42    46    47    56    98  
   46    47    56    98  
   48    49    58    67    50    51    52    59    60    69    53    54    55    61    62    70    44    45  
   45    48    50    53  
    0  
   47    56    57    63    64    65    71    72    73    98   101   102   103   104   105   106    66    74    77  
   56    57    63    71    98   101   105    66  
   49    58    67    68    81    50    51    52    59    53    54    55    61  
   58    67    50    53  
   51    52    59    60    69    82    86    53    54    55    61    58  
   52    59    60    69    53  
   59    60    69    53  
   54    55    61    62    70    90    94    58    59  
   55    61    62    70  
   61    62    70  
   57    63    64    65    71    72    73    98   101   105    66    74    75    76    77    78    79    80  
   63    64    65    71    98    66    74    77  
   67    68    81    99   113  
   60    69    82    83    84    85    86    87    88    89  
   69    82    86  
   62    70    90    91    92    93    94    95    96    97  
   70    90    94  
   64    65    71    72    73    98   101   105    66    74    77  
   65    71    72    73    98    66  
   71    72    73    98    66  
   74    75    76    77    78    79    80    71    98  
   68    81    99   100   107   111   113   114  
   81    99   113  
   82    83    84    85    86    87    88    89  
   90    91    92    93    94    95    96    97  
   72    73    98   101   102   103   104   105   106  
   73    98   101   105  
   98   101   105  
   75    76    77    78    79    80  
   76    77  
   77  
   78    79    80  
   79    80  
   80  
    0  
   99   100   107   108   109   111   112   113   114  
   83    84    85    86    87    88    89  
   84    85    86  
   85    86  
   86  
   87    88    89  
   88    89  
   89  
    0  
   91    92    93    94    95    96    97  
   92    93    94  
   93    94  
   94  
   95    96    97  
   96    97  
   97  
    0  
  101   102   103   104   105   106  
  100   107   108   109   110   111   113   114  
  107   108   109   113  
  102   103   104   105   106  
  103   104   105  
  104   105  
  105  
  106  
    0  
  108   109   110   111   112   113  
  109   110   111  
  110   111   112   113   114  
  111   112   113  
  112   113   114  
  113   114  
  114  
    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  -0.175000   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   4.2000   0.3000  -0.012500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   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   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   44   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   45   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   46   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   49   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   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  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   59   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   60   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   62   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   67   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   68   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   69   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   70   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   71   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   75   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   76   2.4200   0.0300   0.115000   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   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   82   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   99   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
  100   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
  101   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  102   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  103   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  104   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  106   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  107   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
  108   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
  109   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
  110   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
  111   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
  112   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
  113   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
  114   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   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   570.000  1.307
   33    38   317.000  1.510
   33    58   317.000  1.510
   38    39   549.000  1.340
   38    40   317.000  1.510
   39    43   317.000  1.510
   39    44   510.000  1.338
   43    48   317.000  1.522
   43    50   268.000  1.529
   43    53   268.000  1.529
   48    49   570.000  1.229
   48    58   320.000  1.462
   58    67   465.000  1.376
   67    68   745.000  1.250
   67    81   320.000  1.460
   81    99   469.000  1.400
   81   113   469.000  1.400
   99   100   367.000  1.080
   99   107   469.000  1.400
  107   108   367.000  1.080
  107   109   469.000  1.400
  109   110   367.000  1.080
  109   111   469.000  1.400
  111   112   367.000  1.080
  111   113   469.000  1.400
  113   114   367.000  1.080
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    59   317.000  1.510
   59    60   340.000  1.080
   59    69   549.000  1.340
   69    82   317.000  1.510
   69    86   317.000  1.510
   82    83   340.000  1.090
   82    84   340.000  1.090
   82    85   340.000  1.090
   86    87   340.000  1.090
   86    88   340.000  1.090
   86    89   340.000  1.090
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    61   317.000  1.510
   61    62   340.000  1.080
   61    70   549.000  1.340
   70    90   317.000  1.510
   70    94   317.000  1.510
   90    91   340.000  1.090
   90    92   340.000  1.090
   90    93   340.000  1.090
   94    95   340.000  1.090
   94    96   340.000  1.090
   94    97   340.000  1.090
   44    45   553.000  0.945
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    46   268.000  1.529
   46    47   340.000  1.090
   46    56   268.000  1.529
   46    98   268.000  1.529
   56    57   340.000  1.090
   56    63   268.000  1.529
   56    66   317.000  1.510
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    71   268.000  1.529
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    98   268.000  1.529
   98   101   268.000  1.529
   98   105   320.000  1.410
  101   102   340.000  1.090
  101   103   340.000  1.090
  101   104   340.000  1.090
  105   106   553.000  0.945
   66    74   549.000  1.340
   66    77   317.000  1.510
   74    75   340.000  1.080
   74    76   340.000  1.080
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    80   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    85.00000  114.68000
   29    33    38    75.00000  112.20000
   29    33    58    75.00000  112.20000
   33    38    39    70.00000  124.00000
   33    38    40    65.00000  117.92700
   33    58    48    65.00000  116.34900
   33    58    67    70.00000  124.00000
   38    33    34    85.00000  110.90400
   38    39    43    70.00000  124.00000
   38    39    44    80.00000  121.38400
   38    40    41    35.00000  109.50000
   38    40    42    35.00000  109.50000
   38    40    46    70.00000  112.02700
   39    43    48    70.00000  109.06800
   39    43    50    70.00000  112.02700
   39    43    53    70.00000  112.02700
   39    44    45    70.00000  107.45700
   43    48    49    80.00000  120.40000
   43    48    58    65.00000  118.62400
   43    50    51    37.50000  110.70000
   43    50    52    37.50000  110.70000
   43    50    59    70.00000  112.02700
   43    53    54    37.50000  110.70000
   43    53    55    37.50000  110.70000
   43    53    61    70.00000  112.02700
   48    58    67    60.00000  125.92000
   58    33    34    85.00000  110.90400
   58    33    38    70.00000  110.12100
   58    48    49    80.00000  123.72100
   58    67    68    65.00000  137.10300
   58    67    81    60.00000  123.20500
   67    81    99    60.00000  120.93500
   67    81   113    60.00000  120.93500
   81    67    68    85.00000  114.86500
   81    99   100    35.00000  120.00000
   81    99   107    63.00000  120.00000
   81   113   111    63.00000  120.00000
   81   113   114    35.00000  120.00000
   99   107   108    35.00000  120.00000
   99   107   109    63.00000  120.00000
  107    99   100    35.00000  120.00000
  107   109   110    35.00000  120.00000
  107   109   111    63.00000  120.00000
  109   107   108    35.00000  120.00000
  109   111   112    35.00000  120.00000
  109   111   113    63.00000  120.00000
  111   109   110    35.00000  120.00000
  111   113   114    35.00000  120.00000
  113    81    99    63.00000  120.00000
  113   111   112    35.00000  120.00000
   50    43    48    63.00000  111.10000
   50    59    60    35.00000  117.00000
   50    59    69    70.00000  124.00000
   52    50    51    33.00000  107.80000
   59    50    51    35.00000  109.50000
   59    50    52    35.00000  109.50000
   59    69    82    70.00000  124.00000
   59    69    86    70.00000  124.00000
   69    59    60    35.00000  120.00000
   69    82    83    35.00000  109.50000
   69    82    84    35.00000  109.50000
   69    82    85    35.00000  109.50000
   69    86    87    35.00000  109.50000
   69    86    88    35.00000  109.50000
   69    86    89    35.00000  109.50000
   84    82    83    33.00000  107.80000
   85    82    83    33.00000  107.80000
   85    82    84    33.00000  107.80000
   86    69    82    65.00000  117.92700
   88    86    87    33.00000  107.80000
   89    86    87    33.00000  107.80000
   89    86    88    33.00000  107.80000
   53    43    48    63.00000  111.10000
   53    43    50    58.35000  112.70000
   53    61    62    35.00000  117.00000
   53    61    70    70.00000  124.00000
   55    53    54    33.00000  107.80000
   61    53    54    35.00000  109.50000
   61    53    55    35.00000  109.50000
   61    70    90    70.00000  124.00000
   61    70    94    70.00000  124.00000
   70    61    62    35.00000  120.00000
   70    90    91    35.00000  109.50000
   70    90    92    35.00000  109.50000
   70    90    93    35.00000  109.50000
   70    94    95    35.00000  109.50000
   70    94    96    35.00000  109.50000
   70    94    97    35.00000  109.50000
   92    90    91    33.00000  107.80000
   93    90    91    33.00000  107.80000
   93    90    92    33.00000  107.80000
   94    70    90    65.00000  117.92700
   96    94    95    33.00000  107.80000
   97    94    95    33.00000  107.80000
   97    94    96    33.00000  107.80000
   44    39    43    90.00000  109.34000
   40    38    39    70.00000  124.00000
   40    46    47    37.50000  110.70000
   40    46    56    58.35000  112.70000
   40    46    98    58.35000  112.70000
   42    40    41    33.00000  107.80000
   46    40    41    37.50000  110.70000
   46    40    42    37.50000  110.70000
   46    56    57    37.50000  110.70000
   46    56    63    58.35000  112.70000
   46    56    66    70.00000  112.02700
   46    98    71    58.35000  112.70000
   46    98   101    58.35000  112.70000
   46    98   105    50.00000  109.50000
   56    46    47    37.50000  110.70000
   56    63    64    37.50000  110.70000
   56    63    65    37.50000  110.70000
   56    63    71    58.35000  112.70000
   56    66    74    70.00000  124.00000
   56    66    77    65.00000  117.92700
   63    56    57    37.50000  110.70000
   63    71    72    37.50000  110.70000
   63    71    73    37.50000  110.70000
   63    71    98    58.35000  112.70000
   65    63    64    33.00000  107.80000
   71    63    64    37.50000  110.70000
   71    63    65    37.50000  110.70000
   71    98   101    58.35000  112.70000
   71    98   105    50.00000  109.50000
   73    71    72    33.00000  107.80000
   98    46    47    37.50000  110.70000
   98    46    56    58.35000  112.70000
   98    71    72    37.50000  110.70000
   98    71    73    37.50000  110.70000
   98   101   102    37.50000  110.70000
   98   101   103    37.50000  110.70000
   98   101   104    37.50000  110.70000
   98   105   106    55.00000  108.50000
  103   101   102    33.00000  107.80000
  104   101   102    33.00000  107.80000
  104   101   103    33.00000  107.80000
  105    98   101    50.00000  109.50000
   66    56    57    35.00000  109.50000
   66    56    63    70.00000  112.02700
   66    74    75    35.00000  120.00000
   66    74    76    35.00000  120.00000
   66    77    78    35.00000  109.50000
   66    77    79    35.00000  109.50000
   66    77    80    35.00000  109.50000
   76    74    75    35.00000  117.00000
   77    66    74    70.00000  124.00000
   79    77    78    33.00000  107.80000
   80    77    78    33.00000  107.80000
   80    77    79    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
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   63    56    66    77   0.08550 -1.0 2.0
   63    56    66    77   0.09800  1.0 3.0
   63    71   -98    46   0.56750  1.0 1.0
   63    71   -98    46  -0.07550 -1.0 2.0
   63    71   -98    46   0.20000  1.0 3.0
   63    71    98   101   0.56750  1.0 1.0
   63    71    98   101  -0.07550 -1.0 2.0
   63    71    98   101   0.20000  1.0 3.0
   63    71    98   105   0.86500  1.0 1.0
   63    71    98   105  -0.17500 -1.0 2.0
   63    71    98   105   0.20800  1.0 3.0
   64    63    71    72   0.15000  1.0 3.0
   64    63    71    73   0.15000  1.0 3.0
   64    63    71    98   0.15000  1.0 3.0
   65    63    71    72   0.15000  1.0 3.0
   65    63    71    73   0.15000  1.0 3.0
   65    63    71    98   0.15000  1.0 3.0
   71    98   101   102   0.15000  1.0 3.0
   71    98   101   103   0.15000  1.0 3.0
   71    98   101   104   0.15000  1.0 3.0
   71    98   105   106  -0.11600  1.0 1.0
   71    98   105   106  -0.09450 -1.0 2.0
   71    98   105   106   0.21250  1.0 3.0
   72    71    98    46   0.15000  1.0 3.0
   72    71    98   101   0.15000  1.0 3.0
   72    71    98   105   0.23400  1.0 3.0
   73    71    98    46   0.15000  1.0 3.0
   73    71    98   101   0.15000  1.0 3.0
   73    71    98   105   0.23400  1.0 3.0
   98    46    56    57   0.15000  1.0 3.0
   98    46   -56    63   0.56750  1.0 1.0
   98    46   -56    63  -0.07550 -1.0 2.0
   98    46   -56    63   0.20000  1.0 3.0
   98    46    56    66   0.34400  1.0 1.0
   98    46    56    66   0.09450 -1.0 2.0
   98    46    56    66   0.11100  1.0 3.0
  101    98   105   106  -0.11600  1.0 1.0
  101    98   105   106  -0.09450 -1.0 2.0
  101    98   105   106   0.21250  1.0 3.0
  105    98   101   102   0.23400  1.0 3.0
  105    98   101   103   0.23400  1.0 3.0
  105    98   101   104   0.23400  1.0 3.0
   66    56    63    64   0.15000  1.0 3.0
   66    56    63    65   0.15000  1.0 3.0
   66    56    63    71   0.34400  1.0 1.0
   66    56    63    71   0.09450 -1.0 2.0
   66    56    63    71   0.11100  1.0 3.0
   74    66    77    78   0.00000  1.0 1.0
   74    66    77    79   0.00000  1.0 1.0
   74    66    77    80   0.00000  1.0 1.0
   77    66    74    75   7.00000 -1.0 2.0
   77    66    74    76   7.00000 -1.0 2.0
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    40    38    39   1.10000 -1.0 2.0
   43    44    39    38   1.10000 -1.0 2.0
   43    58    48    49  10.50000 -1.0 2.0
   33    48    58    67   1.10000 -1.0 2.0
   81    68    67    58   1.10000 -1.0 2.0
   99   113    81    67   4.00000 -1.0 2.0
  107   100    99    81   1.10000 -1.0 2.0
  109   108   107    99   1.10000 -1.0 2.0
  111   110   109   107   1.10000 -1.0 2.0
  113   112   111   109   1.10000 -1.0 2.0
  111   114   113    81   1.10000 -1.0 2.0
   50    60    59    69  15.00000 -1.0 2.0
   82    86    69    59  15.00000 -1.0 2.0
   53    62    61    70  15.00000 -1.0 2.0
   90    94    70    61  15.00000 -1.0 2.0
   56    77    66    74  15.00000 -1.0 2.0
   75    76    74    66  15.00000 -1.0 2.0
END
