* LIGAND DATABASE FILE (OPLS2005)
*
001     112   114    208    296     593
    1     0 S   NP   _N1_     1    28.84891    96.57217   -24.23922
    2     1 S   H    _HN1     2     1.02781   108.79860   -85.99940
    3     1 S   H    _H1_     3     1.02950    68.37979    16.89341
    4     1 S   H    _H2_     4     1.02827    40.62963   178.15751
    5     1 S   CT   _CA1     5     1.50108   136.50547   114.18217
    6     5 S   HC   _HA1     6     1.09573   105.20700    97.95198
    7     5 S   CO3  _C1_     7     1.53792   112.44251   -22.28496
    8     7 S   O2Z  _O11     8     1.26371   115.00263   -42.79863
    9     7 S   O2Z  _O12     9     1.26240   114.94387   136.34955
   10     5 S   CT   _CB1    10     1.53084   107.42210  -144.07083
   11    10 S   HC   HB11    11     1.09830   109.38034   -49.90649
   12    10 S   HC   HB12    12     1.09813   110.44420    66.70541
   13    10 S   CT   _CG1    13     1.52974   112.59192  -170.90191
   14    13 S   HC   HG11    14     1.09588   110.59407   -65.16035
   15    13 S   HC   HG12    15     1.09673   109.82697    54.05707
   16    13 S   C    _CD1    16     1.51802   112.29022   174.50196
   17    16 S   O    _OE1    17     1.22718   123.33602     5.09639
   18    16 S   N    _N2_    18     1.38641   111.57484  -174.98241
   19    18 S   H    _HN2    19     1.01556   118.86106     1.76713
   20    18 S   CT1  _CA2    20     1.46161   123.41936   177.88604
   21    20 S   HC   _HA2    21     1.09700   109.39223     2.47607
   22    20 S   C    _C2_    22     1.53596   109.23473  -113.55578
   23    22 S   O    _O2_    23     1.23094   122.00912  -153.58584
   24    20 S   CT   _CB2    32     1.53136   111.37373   124.60992
   25    24 S   HC   HB21    33     1.09550   109.76838    57.62265
   26    24 S   HC   HB22    34     1.09524   110.40909   176.22053
   27    22 S   N    _N3_    24     1.38205   113.99375    33.42708
   28    27 S   H    _HN3    25     1.01581   119.56367    -3.09067
   29    24 S   S    _SG2    35     1.82752   112.31375   -63.63861
   30    27 S   CT   _CA3    26     1.45270   123.22362   177.90800
   31    30 S   HC   HA31    27     1.09547   107.55116   -63.72070
   32    30 S   HC   HA32    28     1.09550   107.95911    52.73425
   33    29 S   CT   _C22    36     1.83695    98.39440   162.26751
   34    33 S   HC   _H12    37     1.09686   106.40616   -65.18438
   35    30 S   CO3  _C3_    29     1.52961   114.02786   174.63389
   36    35 S   O2Z  _O31    30     1.26388   116.05231    -1.76912
   37    35 S   O2Z  _O32    31     1.26426   114.43540   178.26652
   38    33 S   CT   _C21    38     1.53376   111.93208   173.30025
   39    38 S   HC   _H11    39     1.10042   106.96785   -58.39731
   40    33 S   OS   _O39    52     1.42724   109.22412    53.41078
   41    38 S   CT   _C14    40     1.53996   111.49746  -174.95756
   42    41 S   HC   _H10    41     1.10228   107.28484   159.98044
   43    38 S   CO4  _C23   106     1.52007   112.96087    60.35413
   44    43 S   O    _O40   107     1.22399   124.66679    31.27367
   45    41 S   CT   _C15    42     1.53958   115.97433   -80.97888
   46    45 S   HC   _H18    43     1.09463   113.22914    37.56665
   47    45 S   HC   _H19    44     1.09439   111.00382   -85.63616
   48    43 S   OS   _O41   108     1.36485   109.57701  -150.26585
   49    45 S   CM   _C16    45     1.49356   101.95180   155.76754
   50    49 S   HC   _H20    46     1.08090   123.46360   163.16230
   51    48 S   CT   _C24   109     1.43041   115.17017  -179.23332
   52    51 S   HC   _H26   110     1.09326   108.10844  -179.38866
   53    51 S   HC   _H27   111     1.09422   110.25137    61.93814
   54    51 S   HC   _H28   112     1.09426   110.32211   -60.68438
   55    49 S   CM   _C17    47     1.34015   111.66435   -18.52291
   56    41 S   CT   _C13    48     1.54633   114.16340    40.37168
   57    56 S   HC   _H9_    49     1.09704   108.88464    85.91408
   58    55 S   CT   _C18    96     1.49125   126.34560  -178.58861
   59    58 S   HC   _H21    97     1.09563   109.97894   114.03078
   60    58 S   HC   _H22    98     1.09641   110.73620    -6.24529
   61    56 S   CO   _C12    50     1.53714   113.17177   -37.14406
   62    61 S   HC   _H8_    51     1.09825   110.91480   -73.01087
   63    58 S   OS   _O37    99     1.43493   108.68559  -125.88705
   64    61 S   OS   _O36    53     1.43236   107.82216   168.39228
   65    63 S   CO4  _C19   100     1.36258   115.33137  -177.40354
   66    65 S   O    _O38   101     1.22344   126.24989    -1.53824
   67    64 S   CO   _C11    54     1.43375   113.23887   179.94405
   68    67 S   HC   _H7_    55     1.09783   108.35686    59.40415
   69    65 S   CT   _C20   102     1.49840   109.58566   179.09561
   70    69 S   HC   _H23   103     1.09310   109.93646   -55.95998
   71    69 S   HC   _H24   104     1.09376   109.34607  -174.74029
   72    69 S   HC   _H25   105     1.09269   109.77220    65.91051
   73    67 S   CT   _C10    56     1.53341   107.49892   178.00787
   74    73 S   HC   _H6_    57     1.09798   110.35601    55.41661
   75    73 S   CT   _C9_    58     1.53357   110.87217   176.24871
   76    75 S   HC   _H5_    59     1.09801   110.89397    72.43597
   77    73 S   OS   _O42    89     1.44699   108.60227   -65.54577
   78    75 S   CT   _C8_    60     1.53502   111.18103   -49.56034
   79    78 S   HC   _H4_    61     1.09836   109.59820   -70.65363
   80    75 S   OS   _O44    82     1.44919   108.36633  -167.54540
   81    77 S   CO4  _C25    90     1.36175   117.98523   101.75486
   82    81 S   O    _O43    91     1.22282   126.66110     0.68614
   83    78 S   CT   _C7_    62     1.53335   110.41271    50.08443
   84    83 S   HC   _H3_    63     1.09801   110.80819    63.87022
   85    78 S   OS   _O46    75     1.44554   108.64607   168.36397
   86    80 S   CO4  _C27    83     1.36162   118.20347   -96.63552
   87    86 S   O    _O45    84     1.22291   126.61438     0.05935
   88    81 S   CT   _C26    92     1.49820   109.39858  -179.44822
   89    88 S   HC   _H29    93     1.09291   109.81553   -61.45028
   90    88 S   HC   _H30    94     1.09382   109.35072   179.46405
   91    88 S   HC   _H31    95     1.09293   109.82201    60.47333
   92    67 S   OS   _O35    64     1.42798   111.30972   -61.78349
   93    83 S   CT   _C6_    65     1.53277   111.34201  -174.95364
   94    93 S   HC   _H16    66     1.09564   110.43367    71.11578
   95    93 S   HC   _H17    67     1.09571   112.46128   -49.07255
   96    85 S   CO4  _C29    76     1.36210   118.00140    96.53249
   97    96 S   O    _O47    77     1.22289   126.58779     0.60652
   98    86 S   CT   _C28    85     1.49832   109.37681  -180.00000
   99    98 S   HC   _H32    86     1.09290   109.80879   -61.44412
  100    98 S   HC   _H33    87     1.09377   109.36942   179.48833
  101    98 S   HC   _H34    88     1.09298   109.82207    60.46359
  102    93 S   OS   _O34    68     1.44319   110.03737  -171.93162
  103    96 S   CT   _C30    78     1.49839   109.39598  -179.36851
  104   103 S   HC   _H35    79     1.09294   109.83199   -60.45967
  105   103 S   HC   _H36    80     1.09378   109.36716  -179.49140
  106   103 S   HC   _H37    81     1.09291   109.80606    61.45048
  107   102 S   CO4  _C5_    69     1.36327   116.65631    87.47484
  108   107 S   O    _O33    70     1.22313   126.27380    -0.79549
  109   107 S   CT   _C4_    71     1.49843   109.70936   178.06235
  110   109 S   HC   _H13    72     1.09250   109.68704   -71.41341
  111   109 S   HC   _H14    73     1.09377   109.32074   168.98953
  112   109 S   HC   _H15    74     1.09294   110.12443    50.33294
  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
  14   6   2   1   1  16   8   9  16   9   8   2   9   5   4   4
   9   3   3   2   1   1  10   9   4   7   3   2   6   2   6   8
   5   4  13   6   3   2   1   1  14   7  15   7   9  14   7   8
   5   4   9   6   8   5   4   3   2   1   1   4   6   3   2   5
   4   3   2   1   1   6   3   2   1   1   5   4   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    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    41    61    40    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    41    42    45    56    61    62    40    64    43    44    48  
   38    39    41    61    40    43  
   36    37  
   37  
    0  
   39    41    42    45    46    47    49    55    56    57    61    40    43    44    48    51  
   41    42    45    56    40    43    44    48  
   64    67    43    41    55    56    57    61    62  
   42    45    46    47    49    50    55    56    57    61    62    64    58    43    44    48  
   45    46    47    49    55    56    57    61    43  
   44    48    51    52    53    54    45    56  
   48    51  
   46    47    49    50    55    56    57    61    58  
   47    49    50    55    56  
   49    50    55    56  
   51    52    53    54  
   50    55    56    57    61    58    59    60    63  
   55    56    58  
   52    53    54  
   53    54  
   54  
    0  
   56    57    61    62    64    58    59    60    63    65  
   57    61    62    64    67    58    59    60    63  
   61    62    64    58  
   59    60    63    65    66    69    61  
   60    63    65  
   63    65  
   62    64    67    68    73    92  
   64    67  
   65    66    69    70    71    72  
   67    68    73    74    75    83    92    77  
   66    69    70    71    72  
   69    70    71    72  
   68    73    74    75    76    78    83    84    92    93    80    77    81  
   73    74    75    83    92    77  
   70    71    72  
   71    72  
   72  
    0  
   74    75    76    78    79    83    92    85    80    86    77    81    82    88  
   75    76    78    92    80    77    81  
   76    78    79    83    84    92    93    85    96    80    86    87    98    77    81  
   78    79    83    85    80    86    77  
   81    82    88    89    90    91    78    80    92  
   79    83    84    92    93    94    95   102    85    96    97   103    80    86  
   83    84    92    93    85    96    80  
   86    87    98    99   100   101    83    85  
   82    88    89    90    91  
   88    89    90    91  
   84    92    93    94    95   102   107    85    96  
   92    93    94    95   102    85  
   96    97   103   104   105   106    92    93  
   87    98    99   100   101  
   98    99   100   101  
   89    90    91  
   90    91  
   91  
    0  
   93    94    95   102  
   94    95   102   107   108   109  
   95   102   107  
  102   107  
   97   103   104   105   106  
  103   104   105   106  
   99   100   101  
  100   101  
  101  
    0  
  107   108   109   110   111   112  
  104   105   106  
  105   106  
  106  
    0  
  108   109   110   111   112  
  109   110   111   112  
  110   111   112  
  111   112  
  112  
    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  -0.316400   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   0.318900   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.030000   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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   40   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   41   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   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   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   49   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   50   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660   0.160000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   53   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   54   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   55   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   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   3.5000   0.0660   0.259000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   60   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   61   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   63   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   64   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   65   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   66   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   67   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   71   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   72   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   73   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   75   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   76   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   77   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   78   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   79   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   80   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   81   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   82   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   83   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   84   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   85   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   86   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   87   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   88   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   89   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   90   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   91   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   92   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   93   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   94   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   95   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   96   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   97   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   98   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   99   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  100   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  101   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  102   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
  103   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  104   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  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   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
  108   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
  109   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  110   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  111   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  112   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    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   268.000  1.529
   33    40   320.000  1.410
   38    39   340.000  1.090
   38    41   268.000  1.529
   38    43   317.000  1.522
   41    42   340.000  1.090
   41    45   268.000  1.529
   41    56   268.000  1.529
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    49   317.000  1.510
   49    50   340.000  1.080
   49    55   549.000  1.340
   55    56   317.000  1.510
   55    58   317.000  1.510
   56    57   340.000  1.090
   56    61   250.000  1.527
   61    62   340.000  1.090
   61    40   320.000  1.380
   61    64   320.000  1.380
   64    67   320.000  1.380
   67    68   340.000  1.090
   67    73   250.000  1.527
   67    92   320.000  1.380
   73    74   340.000  1.090
   73    75   268.000  1.529
   73    77   320.000  1.410
   75    76   340.000  1.090
   75    78   268.000  1.529
   75    80   320.000  1.410
   78    79   340.000  1.090
   78    83   268.000  1.529
   78    85   320.000  1.410
   83    84   340.000  1.090
   83    92   320.000  1.410
   83    93   268.000  1.529
   93    94   340.000  1.090
   93    95   340.000  1.090
   93   102   320.000  1.410
  102   107   214.000  1.327
  107   108   570.000  1.229
  107   109   317.000  1.522
  109   110   340.000  1.090
  109   111   340.000  1.090
  109   112   340.000  1.090
   85    96   214.000  1.327
   96    97   570.000  1.229
   96   103   317.000  1.522
  103   104   340.000  1.090
  103   105   340.000  1.090
  103   106   340.000  1.090
   80    86   214.000  1.327
   86    87   570.000  1.229
   86    98   317.000  1.522
   98    99   340.000  1.090
   98   100   340.000  1.090
   98   101   340.000  1.090
   77    81   214.000  1.327
   81    82   570.000  1.229
   81    88   317.000  1.522
   88    89   340.000  1.090
   88    90   340.000  1.090
   88    91   340.000  1.090
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    63   320.000  1.410
   63    65   214.000  1.327
   65    66   570.000  1.229
   65    69   317.000  1.522
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   340.000  1.090
   43    44   570.000  1.229
   43    48   214.000  1.327
   48    51   320.000  1.410
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    54   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  111.63000
   29    33    40    85.00000  114.68000
   33    38    39    37.50000  110.70000
   33    38    41    58.35000  112.70000
   33    38    43    63.00000  111.10000
   33    40    61    60.00000  109.50000
   38    33    34    37.50000  110.70000
   38    41    42    37.50000  110.70000
   38    41    45    58.35000  112.70000
   38    41    56    58.35000  112.70000
   38    43    44    80.00000  120.40000
   38    43    48    81.00000  111.40000
   41    38    39    37.50000  110.70000
   41    45    46    37.50000  110.70000
   41    45    47    37.50000  110.70000
   41    45    49    70.00000  112.02700
   41    56    55    70.00000  112.02700
   41    56    57    37.50000  110.70000
   41    56    61    75.00000  109.43000
   45    41    42    37.50000  110.70000
   45    49    50    35.00000  117.00000
   45    49    55    70.00000  124.00000
   47    45    46    33.00000  107.80000
   49    45    46    35.00000  109.50000
   49    45    47    35.00000  109.50000
   49    55    56    70.00000  124.00000
   49    55    58    70.00000  124.00000
   55    49    50    35.00000  120.00000
   55    56    57    35.00000  109.50000
   55    56    61    70.00000  112.02700
   55    58    59    35.00000  109.50000
   55    58    60    35.00000  109.50000
   55    58    63    85.00000  110.90400
   56    41    42    37.50000  110.70000
   56    41    45    58.35000  112.70000
   56    61    62    45.00000  112.01100
   56    61    40    90.00000  108.56700
   56    61    64    90.00000  108.56700
   61    56    57    45.00000  108.72000
   61    64    67   100.00000  109.58800
   40    33    34    35.00000  109.50000
   40    33    38    50.00000  109.50000
   40    61    62    35.00000  109.50000
   64    61    62    35.00000  109.50000
   64    61    40    92.60000  111.55000
   64    67    68    35.00000  109.50000
   64    67    73    90.00000  108.56700
   64    67    92    92.60000  111.55000
   67    73    74    45.00000  108.72000
   67    73    75    75.00000  109.43000
   67    73    77    90.00000  109.38000
   67    92    83    60.00000  109.50000
   73    67    68    45.00000  112.01100
   73    75    76    37.50000  110.70000
   73    75    78    58.35000  112.70000
   73    75    80    50.00000  109.50000
   73    77    81    83.00000  116.90000
   75    73    74    37.50000  110.70000
   75    78    79    37.50000  110.70000
   75    78    83    58.35000  112.70000
   75    78    85    50.00000  109.50000
   75    80    86    83.00000  116.90000
   78    75    76    37.50000  110.70000
   78    83    84    37.50000  110.70000
   78    83    92    50.00000  109.50000
   78    83    93    58.35000  112.70000
   78    85    96    83.00000  116.90000
   83    78    79    37.50000  110.70000
   83    93    94    37.50000  110.70000
   83    93    95    37.50000  110.70000
   83    93   102    50.00000  109.50000
   92    67    68    35.00000  109.50000
   92    67    73    90.00000  108.56700
   92    83    84    35.00000  109.50000
   93    83    84    37.50000  110.70000
   93    83    92    50.00000  109.50000
   93   102   107    83.00000  116.90000
   95    93    94    33.00000  107.80000
  102    93    94    35.00000  109.50000
  102    93    95    35.00000  109.50000
  102   107   108    83.00000  123.40000
  102   107   109    81.00000  111.40000
  107   109   110    35.00000  109.50000
  107   109   111    35.00000  109.50000
  107   109   112    35.00000  109.50000
  109   107   108    80.00000  120.40000
  111   109   110    33.00000  107.80000
  112   109   110    33.00000  107.80000
  112   109   111    33.00000  107.80000
   85    78    79    35.00000  109.50000
   85    78    83    50.00000  109.50000
   85    96    97    83.00000  123.40000
   85    96   103    81.00000  111.40000
   96   103   104    35.00000  109.50000
   96   103   105    35.00000  109.50000
   96   103   106    35.00000  109.50000
  103    96    97    80.00000  120.40000
  105   103   104    33.00000  107.80000
  106   103   104    33.00000  107.80000
  106   103   105    33.00000  107.80000
   80    75    76    35.00000  109.50000
   80    75    78    50.00000  109.50000
   80    86    87    83.00000  123.40000
   80    86    98    81.00000  111.40000
   86    98    99    35.00000  109.50000
   86    98   100    35.00000  109.50000
   86    98   101    35.00000  109.50000
   98    86    87    80.00000  120.40000
  100    98    99    33.00000  107.80000
  101    98    99    33.00000  107.80000
  101    98   100    33.00000  107.80000
   77    73    74    35.00000  109.50000
   77    73    75    50.00000  109.50000
   77    81    82    83.00000  123.40000
   77    81    88    81.00000  111.40000
   81    88    89    35.00000  109.50000
   81    88    90    35.00000  109.50000
   81    88    91    35.00000  109.50000
   88    81    82    80.00000  120.40000
   90    88    89    33.00000  107.80000
   91    88    89    33.00000  107.80000
   91    88    90    33.00000  107.80000
   58    55    56    65.00000  117.92700
   58    63    65    83.00000  116.90000
   60    58    59    33.00000  107.80000
   63    58    59    35.00000  109.50000
   63    58    60    35.00000  109.50000
   63    65    66    83.00000  123.40000
   63    65    69    81.00000  111.40000
   65    69    70    35.00000  109.50000
   65    69    71    35.00000  109.50000
   65    69    72    35.00000  109.50000
   69    65    66    80.00000  120.40000
   71    69    70    33.00000  107.80000
   72    69    70    33.00000  107.80000
   72    69    71    33.00000  107.80000
   43    38    39    35.00000  109.50000
   43    38    41    63.00000  111.10000
   43    48    51    83.00000  116.90000
   48    43    44    83.00000  123.40000
   48    51    52    35.00000  109.50000
   48    51    53    35.00000  109.50000
   48    51    54    35.00000  109.50000
   53    51    52    33.00000  107.80000
   54    51    52    33.00000  107.80000
   54    51    53    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
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   66    65    69    70   0.00000  1.0 1.0
   66    65    69    71   0.00000  1.0 1.0
   66    65    69    72   0.00000  1.0 1.0
   43    38    41    42  -0.11250  1.0 3.0
   43    38    41    45  -0.95700  1.0 1.0
   43    38    41    45  -0.18200 -1.0 2.0
   43    38    41    45   0.29450  1.0 3.0
   43    38    41    56  -0.95700  1.0 1.0
   43    38    41    56  -0.18200 -1.0 2.0
   43    38    41    56   0.29450  1.0 3.0
   43    48    51    52   0.08050  1.0 3.0
   43    48    51    53   0.08050  1.0 3.0
   43    48    51    54   0.08050  1.0 3.0
   44    43    48    51   3.00000 -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
   45    50    49    55   1.10000 -1.0 2.0
   56    58    55    49   1.10000 -1.0 2.0
  102   109   107   108  10.50000 -1.0 2.0
   85   103    96    97  10.50000 -1.0 2.0
   80    98    86    87  10.50000 -1.0 2.0
   77    88    81    82  10.50000 -1.0 2.0
   63    69    65    66  10.50000 -1.0 2.0
   38    48    43    44  10.50000 -1.0 2.0
END
