* LIGAND DATABASE FILE (OPLS2005)
*
001     116   119    207    329     605
    1     0 S   NT   _N1_     1    36.02202   106.27301   -25.52848
    2     1 S   H    _H1_     2     1.01035   112.57998  -121.42813
    3     1 S   H    _H2_     3     1.01010   116.61458   114.66056
    4     1 S   CT1  _CA1     4     1.46042    97.73354    -4.32142
    5     4 S   HC   _HA1     5     1.09057   107.25010   -56.78930
    6     4 S   C    _C1_     6     1.53612   109.75097  -172.62020
    7     6 S   O    _O12     8     1.22968   121.55989  -113.56823
    8     4 S   CT   _CB1     9     1.54581   110.13074    60.72518
    9     8 S   HC   HB11    10     1.09166   109.84404    68.75325
   10     8 S   HC   HB12    11     1.09156   108.60588   -46.36227
   11     6 S   OH   _O11     7     1.36342   116.23623    65.34376
   12     8 S   CT   _CG1    12     1.54389   113.94856  -167.11446
   13    12 S   HC   HG11    13     1.09102   109.30412    53.75559
   14    12 S   HC   HG12    14     1.08984   110.79421   -63.47910
   15    11 S   HO   _H41   116     0.94467   112.05158  -179.36173
   16    12 S   C    _CD1    15     1.53132   113.07356   175.36566
   17    16 S   O    _OE1    16     1.23114   120.69666    29.81462
   18    16 S   N    _N2_    17     1.34237   116.15090  -150.71909
   19    18 S   H    _HN2    18     1.00977   117.93174    -0.32325
   20    18 S   CT1  _CA2    19     1.46502   125.50687   179.58410
   21    20 S   HC   _HA2    20     1.09202   106.61654   -34.28533
   22    20 S   C    _C2_    21     1.54068   111.36402  -147.47075
   23    22 S   O    _O2_    22     1.23089   120.76870  -142.33421
   24    20 S   CT   _CB2    31     1.54615   110.36191    81.79239
   25    24 S   HC   HB21    32     1.09048   111.25516    80.21450
   26    24 S   HC   HB22    33     1.08837   109.78032   -37.69739
   27    22 S   N    _N3_    23     1.34148   116.87548    36.75052
   28    27 S   H    _HN3    24     1.01034   118.57944     1.01027
   29    24 S   S    _SG2    34     1.82351   110.12980  -157.37826
   30    27 S   CT   _CA3    25     1.45619   124.59573  -179.29390
   31    30 S   HC   HA31    26     1.09070   109.57808   -64.31972
   32    30 S   HC   HA32    27     1.09083   109.82465    53.76431
   33    29 S   CT   _C24    35     1.84315   104.76812   161.93791
   34    30 S   C    _C3_    28     1.52853   111.21391   174.68212
   35    34 S   OC3  _O32    30     1.23023   124.55442    -1.08588
   36    33 S   CT   _C25    36     1.55941   111.73573   -86.93536
   37    36 S   HC   _H4_    37     1.09135   108.35244   159.00018
   38    33 S   CT   _C29   109     1.54284   110.73166    39.22932
   39    38 S   HC   _H24   110     1.09033   111.25005    53.32755
   40    38 S   HC   _H25   111     1.09034   111.44410   173.18764
   41    38 S   HC   _H26   112     1.08926   112.01941   -67.68793
   42    34 S   OH   _O31    29     1.36279   111.77711   179.02201
   43    36 S   C    _C26    38     1.52243   102.90395   -90.44350
   44    43 S   O    _O34    39     1.22929   124.31559   162.65513
   45    36 S   CM   _C27   104     1.52209   117.02872    37.91727
   46    45 S   HC   _H21   105     1.08038   116.87929   -58.14228
   47    42 S   HO   _H40   115     0.94478   112.19532   180.00000
   48    43 S   N    _N7_    40     1.32958   109.97794   -16.99719
   49    48 S   H    _H20    41     1.00928   124.33975  -179.95154
   50    45 S   CM   _C28   106     1.34163   124.68501   122.83550
   51    50 S   HC   _H22   107     1.08027   120.70848   179.60336
   52    50 S   HC   _H23   108     1.08005   121.47563    -0.43790
   53    33 S   CT   _C23    42     1.56070   110.13019   161.03613
   54    53 S   HC   _H3_    43     1.09218   108.56326  -157.72480
   55    53 S   CT   _C22    44     1.55052   117.21023   -35.43492
   56    55 S   HC   _H18    45     1.08925   109.65383   -51.01913
   57    55 S   HC   _H19    46     1.09035   110.65142    65.72773
   58    55 S   CD   _C21    47     1.52151   113.19257  -173.93227
   59    58 S   CM   _C20    48     1.47000   123.63992   109.71785
   60    59 S   CM   _C19    49     1.33865   105.46952   179.41283
   61    59 S   CT   _C30   100     1.51770   123.95045    -0.40926
   62    61 S   HC   _H27   101     1.08891   111.88160  -179.48074
   63    61 S   HC   _H28   102     1.09031   110.29936   -59.12774
   64    61 S   HC   _H29   103     1.09019   110.27366    60.63926
   65    60 S   CM   _C18    50     1.44512   106.41248     0.29871
   66    60 S   CT   _C31    91     1.51982   127.44130   179.24775
   67    66 S   HC   _H30    92     1.09079   108.25906  -134.40867
   68    66 S   HC   _H31    93     1.08959   109.98424   -19.27022
   69    58 S   NI   _N6_    51     1.26691   124.31552   -70.93965
   70    65 S   CM   _C17    52     1.35051   126.59172  -179.94405
   71    70 S   HC   _H17    53     1.07970   116.49056    -0.49178
   72    66 S   CT   _C32    94     1.53846   111.97390   104.02611
   73    72 S   HC   _H32    95     1.09072   110.17480   -62.00053
   74    72 S   HC   _H33    96     1.09068   110.40352    55.41966
   75    70 S   C5A  _C7_    54     1.43473   130.25042  -179.79633
   76    72 S   C    _C33    97     1.52741   112.06144   176.46759
   77    76 S   O    _O35    99     1.22876   123.19351  -108.50458
   78    75 S   C5BC _C6_    55     1.37046   132.84513  -172.49766
   79    76 S   OH   _O36    98     1.36366   111.71047    71.65710
   80    79 S   HO   _H38   113     0.94470   112.16327   179.89913
   81    78 S   C5BC _C5_    56     1.43727   107.65950   178.27274
   82    78 S   CT   _C34    82     1.50948   125.43242    -1.12987
   83    82 S   HC   _H34    83     1.09044   109.38859  -159.93353
   84    82 S   HC   _H35    84     1.09093   108.24547   -44.55694
   85    81 S   C5A  _C8_    57     1.37257   107.68623     0.55883
   86    81 S   CT   _C4_    78     1.50757   126.03173  -179.21267
   87    86 S   HC   _H5_    79     1.08997   111.17576   161.12145
   88    86 S   HC   _H6_    80     1.08996   110.16939   -78.57786
   89    86 S   HC   _H7_    81     1.09013   110.43950    41.27096
   90    82 S   CT   _C35    85     1.53740   111.92894    77.56569
   91    90 S   HC   _H36    86     1.09087   110.31002   -53.59702
   92    90 S   HC   _H37    87     1.09068   110.16720    63.83668
   93    75 S   NA   _N4_    58     1.37069   120.60289     5.65731
   94    93 S   H    _H8_    59     1.00931   123.17498     2.35085
   95    85 S   CM   _C9_    60     1.43481   133.22792  -178.76362
   96    95 S   HC   _H9_    61     1.07916   112.82895   -24.83636
   97    90 S   C    _C36    88     1.52683   111.94128  -174.22396
   98    97 S   O    _O37    90     1.22857   123.30803  -104.04901
   99    95 S   CM   _C10    62     1.35192   130.30981   159.15490
  100    97 S   OH   _O38    89     1.36392   111.52250    76.17142
  101   100 S   HO   _H39   114     0.94470   112.41687   179.47623
  102    99 S   CM   _C11    63     1.44237   128.00936   176.17423
  103   102 S   CM   _C12    64     1.35020   106.85300  -179.18964
  104   102 S   CM   _C15    73     1.46005   124.40767    -4.13337
  105   104 S   HC   _H14    74     1.07962   117.53775   -18.01570
  106   103 S   C    _C13    65     1.45634   109.03082    -2.82092
  107   106 S   O    _O33    66     1.22946   128.72489  -177.41305
  108   103 S   CT   _C14    69     1.51891   129.48638   175.36409
  109   108 S   HC   _H11    70     1.09068   110.98345  -157.37905
  110   108 S   HC   _H12    71     1.08962   111.02287   -38.45873
  111   108 S   HC   _H13    72     1.08998   110.43186    82.73747
  112   104 S   CM   _C16    75     1.34354   126.44585   163.22767
  113   112 S   HC   _H15    76     1.08005   120.20084   178.81700
  114   112 S   HC   _H16    77     1.07808   122.83465    -1.72522
  115    99 S   N    _N5_    67     1.38144   125.24692    -5.31567
  116   115 S   H    _H10    68     1.00866   123.01908    -3.24703
  11   5   4  12   7   7   3   9   5   4   1   7   4   3   1   7
   3  10   4  11   7  11   4   8   3   2   7   4  13   6   4   3
  19   3   2  17   8   9   3   2   1   1   9   4   6   3   1   7
   3   2   1   1   7   4   8   4   3  10  12  16   6   2   1   1
  10  10   5   4   3   8   3   6   4   3  11   3   2  16   1   1
  14  11   5   4  11   5   2   1   1   6   4   3   4   1   8   3
   3   2  10   1   1  14  11   7   3   7   3   4   2   1   1   2
   1   1   1   1
    2     3     4     5     6    11     7     8     9    10    12  
    3     4     5     6     8  
    4     5     6     8  
    5     6    11     7     8     9    10    12    13    14    16    15  
    6    11     7     8     9    10    12  
   11     7     8     9    10    12    15  
    8    15    11  
    9    10    12    13    14    16    17    18    11  
   10    12    13    14    16  
   12    13    14    16  
   15  
   13    14    16    17    18    19    20  
   14    16    17    18  
   16    17    18  
    0  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    36    53    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    42    35  
   30    31    32    34  
   33    36    37    43    48    53    54    55    45    38    39    40    41  
   31    32    34    42    35    47  
   32    34    42    35  
   34    42    35  
   36    37    43    44    48    49    53    54    55    56    57    58    45    46    50    38    39    40    41  
   42    35    47  
   47    42  
   37    43    44    48    49    53    54    55    45    46    50    51    52    38    39    40    41  
   43    44    48    53    45    46    50    38  
   39    40    41    43    45    48    53    54    55  
   40    41    53  
   41    53  
   53  
   47  
   44    48    49    53    54    55    45    46    50  
   48    49    53    45  
   46    50    51    52    48    53  
   50    51    52  
    0  
   49    53    54    55    56    57    58  
   53    54    55  
   51    52  
   52  
    0  
   54    55    56    57    58    59    69  
   55    56    57    58  
   56    57    58    59    60    65    69    61  
   57    58    59    69  
   58    59    69  
   59    60    65    69    70    66    61    62    63    64  
   60    65    69    70    66    67    68    72    61    62    63    64  
   65    69    70    71    75    66    67    68    72    73    74    76    61    62    63    64  
   62    63    64    65    66    69  
   63    64  
   64  
    0  
   69    70    71    75    78    93    66    67    68    72  
   67    68    72    73    74    76    79    77    69    70  
   68    72    73    74    76  
   72    73    74    76  
   70    71    75  
   71    75    78    81    85    93    94    82  
   75    78    93  
   73    74    76    79    77    80  
   74    76    79    77  
   76    79    77  
   78    81    85    93    94    95    86    82    83    84    90  
   79    77    80  
   80    79  
   81    85    93    94    95    86    87    88    89    82    83    84    90    91    92    97  
   80  
    0  
   85    93    94    95    96    99    86    87    88    89    82    83    84    90  
   83    84    90    91    92    97   100    98    85    86    93  
   84    90    91    92    97  
   90    91    92    97  
   93    94    95    96    99   102   115    86    87    88    89  
   87    88    89    93    95  
   88    89  
   89  
    0  
   91    92    97   100    98   101  
   92    97   100    98  
   97   100    98  
   94    95    96    99  
   95  
   96    99   102   103   106   115   116   104  
   99   102   115  
  100    98   101  
  101   100  
  102   103   106   107   115   116   108   104   105   112  
  101  
    0  
  103   106   107   115   116   108   109   110   111   104   105   112   113   114  
  106   107   115   116   108   109   110   111   104   105   112  
  105   112   113   114   106   108   115  
  112   113   114  
  107   115   116   108   109   110   111  
  115   116   108  
  109   110   111   115  
  110   111  
  111  
    0  
  113   114  
  114  
    0  
  116  
    0  
NBON
    1   3.3000   0.1700  -0.943900   1.8650   1.6500   0.051222218  -2.220205820
    2   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
    4   3.5000   0.0660   0.163900   1.9750   1.7500   0.005000000  -0.741685710
    5   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
    6   3.7500   0.1050   0.520000   2.1120   1.8750   0.001000000  -0.126889456
    7   2.9600   0.2100  -0.440000   1.9750   1.7500   0.001000000  -0.126889456
    8   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
    9   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   10   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   11   3.0000   0.1700  -0.530000   1.7660   1.5600   0.021068034  -0.322181743
   12   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   13   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   14   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   15   0.5000   0.0300   0.450000   0.9960   0.8600   0.030040813  -0.651083722
   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   0.080000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.520000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.440000   1.9750   1.7500   0.001000000  -0.126889456
   36   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   37   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   38   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.0000   0.1700  -0.530000   1.7660   1.5600   0.021068034  -0.322181743
   43   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   45   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   46   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   47   0.5000   0.0300   0.450000   0.9960   0.8600   0.030040813  -0.651083722
   48   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   49   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   50   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   51   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   52   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   55   3.5000   0.0660  -0.083900   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.7500   0.1050   0.356900   2.0020   1.7750   0.023028004  -0.852763146
   59   3.5500   0.0760  -0.003300   2.0020   1.7750   0.023028004  -0.852763146
   60   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   61   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5500   0.0760   0.122500   2.0020   1.7750   0.023028004  -0.852763146
   66   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.2800   0.1700  -0.512200   1.8540   1.6400   0.005000000   0.000000000
   70   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   71   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   72   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.5500   0.0700  -0.008000   2.0020   1.7750   0.001000000  -0.843144165
   76   3.7500   0.1050   0.520000   2.1120   1.8750   0.001000000  -0.126889456
   77   2.9600   0.2100  -0.440000   1.9750   1.7500   0.001000000  -0.126889456
   78   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   79   3.0000   0.1700  -0.530000   1.7660   1.5600   0.021068034  -0.322181743
   80   0.5000   0.0300   0.450000   0.9960   0.8600   0.030040813  -0.651083722
   81   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   82   3.5000   0.0660  -0.005000   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   3.5500   0.0700  -0.008000   2.0020   1.7750   0.001000000  -0.843144165
   86   3.5000   0.0660  -0.065000   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  -0.120000   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   3.2500   0.1700  -0.239000   1.8650   1.6500   0.001000000  -0.511443539
   94   0.5000   0.0300   0.317000   0.9960   0.8600   0.030040813  -0.651083722
   95   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   96   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   97   3.7500   0.1050   0.520000   2.1120   1.8750   0.001000000  -0.126889456
   98   2.9600   0.2100  -0.440000   1.9750   1.7500   0.001000000  -0.126889456
   99   3.5500   0.0760   0.051300   2.0020   1.7750   0.023028004  -0.852763146
  100   3.0000   0.1700  -0.530000   1.7660   1.5600   0.021068034  -0.322181743
  101   0.5000   0.0300   0.450000   0.9960   0.8600   0.030040813  -0.651083722
  102   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
  103   3.5500   0.0760  -0.056700   2.0020   1.7750   0.023028004  -0.852763146
  104   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
  105   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  106   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
  107   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
  108   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  109   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  110   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  112   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
  113   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  114   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  115   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
  116   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   305.000  1.457
    4     5   340.000  1.090
    4     6   317.000  1.522
    4     8   268.000  1.529
    6    11   450.000  1.364
    6     7   570.000  1.229
   11    15   553.000  0.945
    8     9   340.000  1.090
    8    10   340.000  1.090
    8    12   268.000  1.529
   12    13   340.000  1.090
   12    14   340.000  1.090
   12    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    42   450.000  1.364
   34    35   570.000  1.229
   42    47   553.000  0.945
   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    36   268.000  1.529
   33    53   268.000  1.529
   33    38   268.000  1.529
   36    37   340.000  1.090
   36    43   317.000  1.522
   36    45   317.000  1.510
   43    44   570.000  1.229
   43    48   490.000  1.335
   48    49   434.000  1.010
   48    53   337.000  1.449
   53    54   340.000  1.090
   53    55   268.000  1.529
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   270.000  1.508
   58    59   320.000  1.464
   58    69   500.000  1.261
   59    60   549.000  1.340
   59    61   317.000  1.510
   60    65   380.000  1.444
   60    66   317.000  1.510
   65    69   405.000  1.380
   65    70   549.000  1.340
   70    71   340.000  1.080
   70    75   375.000  1.423
   75    78   546.000  1.367
   75    93   427.000  1.381
   78    81   469.000  1.424
   78    82   285.000  1.502
   81    85   546.000  1.367
   81    86   285.000  1.502
   85    93   427.000  1.381
   85    95   375.000  1.423
   93    94   434.000  1.010
   95    96   340.000  1.080
   95    99   549.000  1.340
   99   102   380.000  1.444
   99   115   400.000  1.384
  102   103   549.000  1.340
  102   104   380.000  1.444
  103   106   410.000  1.444
  103   108   317.000  1.510
  106   107   570.000  1.229
  106   115   490.000  1.335
  115   116   434.000  1.010
  108   109   340.000  1.090
  108   110   340.000  1.090
  108   111   340.000  1.090
  104   105   340.000  1.080
  104   112   549.000  1.340
  112   113   340.000  1.080
  112   114   340.000  1.080
   86    87   340.000  1.090
   86    88   340.000  1.090
   86    89   340.000  1.090
   82    83   340.000  1.090
   82    84   340.000  1.090
   82    90   268.000  1.529
   90    91   340.000  1.090
   90    92   340.000  1.090
   90    97   317.000  1.522
   97   100   450.000  1.364
   97    98   570.000  1.229
  100   101   553.000  0.945
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    72   268.000  1.529
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    76   317.000  1.522
   76    79   450.000  1.364
   76    77   570.000  1.229
   79    80   553.000  0.945
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   340.000  1.090
   45    46   340.000  1.080
   45    50   549.000  1.340
   50    51   340.000  1.080
   50    52   340.000  1.080
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    41   340.000  1.090
THET
    1     4     5    50.00000  109.55000
    1     4     6    75.00000  111.54000
    1     4     8    80.00000  111.22000
    3     1     2    43.60000  106.40000
    4     1     2    50.00000  111.55300
    4     1     3    50.00000  111.55300
    4     6    11    80.00000  116.87500
    4     6     7    80.00000  120.40000
    4     8     9    37.50000  110.70000
    4     8    10    37.50000  110.70000
    4     8    12    58.35000  112.70000
    6     4     5    35.00000  109.50000
    6    11    15    35.00000  113.00000
    7     6    11   100.00000  123.32000
    8     4     5    37.50000  110.70000
    8     4     6    63.00000  111.10000
    8    12    13    37.50000  110.70000
    8    12    14    37.50000  110.70000
    8    12    16    63.00000  111.10000
   10     8     9    33.00000  107.80000
   12     8     9    37.50000  110.70000
   12     8    10    37.50000  110.70000
   12    16    17    80.00000  120.40000
   12    16    18    70.00000  116.60000
   14    12    13    33.00000  107.80000
   16    12    13    35.00000  109.50000
   16    12    14    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    75.00000  110.24000
   30    27    28    38.00000  118.40000
   30    34    42    70.00000  108.00000
   30    34    35    80.00000  120.40000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   34    42    47    35.00000  113.00000
   35    34    42    80.00000  121.00000
   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    36    75.00000  111.63000
   29    33    53    75.00000  111.63000
   29    33    38    75.00000  111.63000
   33    36    37    37.50000  110.70000
   33    36    43    63.00000  111.10000
   33    36    45    70.00000  112.02700
   33    53    48    70.00000  110.72300
   33    53    54    37.50000  110.70000
   33    53    55    58.35000  112.70000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    41    37.50000  110.70000
   36    43    44    80.00000  120.40000
   36    43    48    70.00000  116.60000
   36    45    46    35.00000  117.00000
   36    45    50    70.00000  124.00000
   43    36    37    35.00000  109.50000
   43    48    49    35.00000  119.80000
   43    48    53    50.00000  121.90000
   48    43    44    80.00000  122.90000
   48    53    54    35.00000  109.50000
   48    53    55    70.00000  110.72300
   53    33    36    58.35000  112.70000
   53    48    49    38.00000  118.40000
   53    55    56    37.50000  110.70000
   53    55    57    37.50000  110.70000
   53    55    58    70.00000  111.76100
   55    53    54    37.50000  110.70000
   55    58    59    65.00000  117.24000
   55    58    69    65.00000  122.10100
   57    55    56    33.00000  107.80000
   58    55    56    45.00000  109.49600
   58    55    57    45.00000  109.49600
   58    59    60    60.00000  120.31500
   58    59    61    65.00000  117.22000
   58    69    65    75.00000  115.77100
   59    60    65    70.00000  123.01800
   59    60    66    70.00000  124.00000
   59    61    62    35.00000  109.50000
   59    61    63    35.00000  109.50000
   59    61    64    35.00000  109.50000
   60    65    69    70.00000  120.83400
   60    65    70    70.00000  123.01800
   60    66    67    35.00000  109.50000
   60    66    68    35.00000  109.50000
   60    66    72    70.00000  112.02700
   65    70    71    35.00000  120.00000
   65    70    75    55.00000  128.24000
   69    58    59    70.00000  121.86000
   70    65    69    70.00000  120.83400
   70    75    78    50.00000  133.16000
   70    75    93    70.00000  120.38000
   75    70    71    40.00000  117.26300
   75    78    81    70.00000  107.30000
   75    78    82    60.00000  130.00000
   75    93    85    70.00000  109.80000
   75    93    94    35.00000  120.00000
   78    81    85    70.00000  107.30000
   78    81    86    60.00000  130.00000
   78    82    83    35.00000  109.50000
   78    82    84    35.00000  109.50000
   78    82    90    70.00000  112.17500
   81    85    93    70.00000  107.70000
   81    85    95    50.00000  133.16000
   81    86    87    35.00000  109.50000
   81    86    88    35.00000  109.50000
   81    86    89    35.00000  109.50000
   85    93    94    35.00000  120.00000
   85    95    96    40.00000  117.26300
   85    95    99    55.00000  128.24000
   93    75    78    70.00000  107.70000
   95    85    93    70.00000  120.38000
   95    99   102    70.00000  123.01800
   95    99   115    75.00000  120.83300
   99    95    96    35.00000  120.00000
   99   102   103    70.00000  123.01800
   99   102   104    70.00000  123.01800
   99   115   106    70.00000  120.89900
   99   115   116    45.00000  117.55000
  102   103   106    70.00000  118.70000
  102   103   108    70.00000  124.00000
  102   104   105    35.00000  120.00000
  102   104   112    70.00000  123.01800
  103   106   107    80.00000  125.30000
  103   106   115    80.00000  111.56200
  103   108   109    35.00000  109.50000
  103   108   110    35.00000  109.50000
  103   108   111    35.00000  109.50000
  106   115   116    35.00000  119.80000
  115    99   102    75.00000  120.83300
  115   106   107    80.00000  122.90000
  108   103   106    70.00000  119.70000
  110   108   109    33.00000  107.80000
  111   108   109    33.00000  107.80000
  111   108   110    33.00000  107.80000
  104   102   103    70.00000  123.01800
  104   112   113    35.00000  120.00000
  104   112   114    35.00000  120.00000
  112   104   105    35.00000  120.00000
  114   112   113    35.00000  117.00000
   86    81    85    60.00000  130.00000
   88    86    87    33.00000  107.80000
   89    86    87    33.00000  107.80000
   89    86    88    33.00000  107.80000
   82    78    81    60.00000  130.00000
   82    90    91    37.50000  110.70000
   82    90    92    37.50000  110.70000
   82    90    97    63.00000  111.10000
   84    82    83    33.00000  107.80000
   90    82    83    37.50000  110.70000
   90    82    84    37.50000  110.70000
   90    97   100    70.00000  108.00000
   90    97    98    80.00000  120.40000
   92    90    91    33.00000  107.80000
   97    90    91    35.00000  109.50000
   97    90    92    35.00000  109.50000
   97   100   101    35.00000  113.00000
   98    97   100   100.00000  123.32000
   66    60    65    70.00000  124.00000
   66    72    73    37.50000  110.70000
   66    72    74    37.50000  110.70000
   66    72    76    63.00000  111.10000
   68    66    67    33.00000  107.80000
   72    66    67    37.50000  110.70000
   72    66    68    37.50000  110.70000
   72    76    79    70.00000  108.00000
   72    76    77    80.00000  120.40000
   74    72    73    33.00000  107.80000
   76    72    73    35.00000  109.50000
   76    72    74    35.00000  109.50000
   76    79    80    35.00000  113.00000
   77    76    79   100.00000  123.32000
   61    59    60    70.00000  124.00000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
   45    36    37    35.00000  109.50000
   45    36    43    70.00000  115.00700
   45    50    51    35.00000  120.00000
   45    50    52    35.00000  120.00000
   50    45    46    35.00000  120.00000
   52    50    51    35.00000  117.00000
   38    33    36    58.35000  112.70000
   38    33    53    58.35000  112.70000
   40    38    39    33.00000  107.80000
   41    38    39    33.00000  107.80000
   41    38    40    33.00000  107.80000
PHI
    1     4     6    11   0.40000  1.0 3.0
    1     4     6     7   0.30150 -1.0 2.0
    1     4     8     9   0.15000  1.0 3.0
    1     4     8    10   0.15000  1.0 3.0
    1     4     8    12   1.53400  1.0 1.0
    1     4     8    12  -0.09950 -1.0 2.0
    1     4     8    12   0.05700  1.0 3.0
    2     1     4     5   0.20000  1.0 3.0
    2     1     4     6   0.21900  1.0 1.0
    2     1     4     6  -0.24900 -1.0 2.0
    2     1     4     6   0.15200  1.0 3.0
    2     1     4     8  -0.05950  1.0 1.0
    2     1     4     8   0.08850 -1.0 2.0
    2     1     4     8   0.11750  1.0 3.0
    3     1     4     5   0.20000  1.0 3.0
    3     1     4     6   0.21900  1.0 1.0
    3     1     4     6  -0.24900 -1.0 2.0
    3     1     4     6   0.15200  1.0 3.0
    3     1     4     8  -0.05950  1.0 1.0
    3     1     4     8   0.08850 -1.0 2.0
    3     1     4     8   0.11750  1.0 3.0
    4     6    11    15   1.50000  1.0 1.0
    4     6    11    15   2.45000 -1.0 2.0
    4     8    12    13   0.15000  1.0 3.0
    4     8    12    14   0.15000  1.0 3.0
    4     8    12    16  -0.84850  1.0 1.0
    4     8    12    16  -0.22800 -1.0 2.0
    4     8    12    16   0.29250  1.0 3.0
    5     4     6    11   0.00000  1.0 1.0
    5     4     6     7   0.00000  1.0 1.0
    5     4     8     9   0.15000  1.0 3.0
    5     4     8    10   0.15000  1.0 3.0
    5     4     8    12   0.15000  1.0 3.0
    6     4     8     9  -0.03800  1.0 3.0
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   66    72    76    77   0.30150 -1.0 2.0
   67    66    72    73   0.15000  1.0 3.0
   67    66    72    74   0.15000  1.0 3.0
   67    66    72    76  -0.11250  1.0 3.0
   68    66    72    73   0.15000  1.0 3.0
   68    66    72    74   0.15000  1.0 3.0
   68    66    72    76  -0.11250  1.0 3.0
   72    76    79    80   1.50000  1.0 1.0
   72    76    79    80   2.45000 -1.0 2.0
   73    72    76    79   0.00000  1.0 1.0
   73    72    76    77   0.00000  1.0 1.0
   74    72    76    79   0.00000  1.0 1.0
   74    72    76    77   0.00000  1.0 1.0
   77    76    79    80   0.92200  1.0 1.0
   77    76    79    80   3.74100 -1.0 2.0
   61    59    60    65   7.00000 -1.0 2.0
   61    59    60    66   7.00000 -1.0 2.0
   45    36    43    44   0.30150 -1.0 2.0
   45    36    43    48   0.00000  1.0 1.0
   46    45    50    51   7.00000 -1.0 2.0
   46    45    50    52   7.00000 -1.0 2.0
   38    33    36    37   0.15000  1.0 3.0
   38    33    36    43  -0.95700  1.0 1.0
   38    33    36    43  -0.18200 -1.0 2.0
   38    33    36    43   0.29450  1.0 3.0
   38    33    36    45   0.34400  1.0 1.0
   38    33    36    45   0.09450 -1.0 2.0
   38    33    36    45   0.11100  1.0 3.0
   38    33    53    48   0.43900  1.0 1.0
   38    33    53    48   0.49100 -1.0 2.0
   38    33    53    48   0.28400  1.0 3.0
   38    33    53    54   0.15000  1.0 3.0
   38    33    53    55   0.56750  1.0 1.0
   38    33    53    55  -0.07550 -1.0 2.0
   38    33    53    55   0.20000  1.0 3.0
IPHI
    4    11     6     7  10.50000 -1.0 2.0
   12    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
   30    42    34    35  10.50000 -1.0 2.0
   36    48    43    44  10.50000 -1.0 2.0
   49    43    48    53   1.00000 -1.0 2.0
   55    59    58    69  10.50000 -1.0 2.0
   58    61    59    60   1.10000 -1.0 2.0
   65    66    60    59   1.10000 -1.0 2.0
   60    69    65    70   1.10000 -1.0 2.0
   75    71    70    65   1.10000 -1.0 2.0
   78    93    75    70   4.00000 -1.0 2.0
   81    82    78    75   4.00000 -1.0 2.0
   85    86    81    78   4.00000 -1.0 2.0
   95    93    85    81   4.00000 -1.0 2.0
   94    75    93    85   1.00000 -1.0 2.0
   85    96    95    99   1.10000 -1.0 2.0
  102   115    99    95   1.10000 -1.0 2.0
   99   104   102   103   1.10000 -1.0 2.0
  106   108   103   102   1.10000 -1.0 2.0
  103   115   106   107  10.50000 -1.0 2.0
  116   106   115    99   1.00000 -1.0 2.0
  102   105   104   112  15.00000 -1.0 2.0
  113   114   112   104  15.00000 -1.0 2.0
   90   100    97    98  10.50000 -1.0 2.0
   72    79    76    77  10.50000 -1.0 2.0
   36    46    45    50  15.00000 -1.0 2.0
   51    52    50    45  15.00000 -1.0 2.0
END
