* LIGAND DATABASE FILE (OPLS2005)
*
001     110   113    204    329     599
    1     0 S   NP   _N1_     1    29.63901    94.86689   -28.16173
    2     1 S   H    _HN1     2     1.02949    65.80309    20.75056
    3     1 S   H    _H1_     3     1.02828    41.44714  -153.57495
    4     1 S   H    _H2_     4     1.02786   124.25878   -75.67985
    5     1 S   CT   _CA1     5     1.50114   121.80108   120.60221
    6     5 S   HC   _HA1     6     1.09573   105.18846   104.14577
    7     5 S   CO3  _C1_     7     1.53789   112.48404   -16.08155
    8     7 S   O2Z  _O11     8     1.26373   115.00650   -42.01057
    9     7 S   O2Z  _O12     9     1.26241   114.94674   137.12455
   10     5 S   CT   _CB1    10     1.53080   107.42151  -137.86364
   11    10 S   HC   HB11    11     1.09833   109.36884   -49.61548
   12    10 S   HC   HB12    12     1.09812   110.44683    66.99519
   13    10 S   CT   _CG1    13     1.52991   112.60891  -170.58842
   14    13 S   HC   HG11    14     1.09580   110.64066   -65.91867
   15    13 S   HC   HG12    15     1.09671   109.77250    53.31180
   16    13 S   C    _CD1    16     1.51801   112.21977   173.77181
   17    16 S   O    _OE1    17     1.22731   123.28757     7.57227
   18    16 S   N    _N2_    18     1.38656   111.67941  -172.52656
   19    18 S   H    _HN2    19     1.01580   118.91585     1.72386
   20    18 S   CT1  _CA2    20     1.46194   123.39321   177.31008
   21    20 S   HC   _HA2    21     1.09736   109.37486     3.24371
   22    20 S   C    _C2_    22     1.53565   108.58087  -112.23113
   23    22 S   O    _O2_    23     1.23060   122.27099  -147.53441
   24    20 S   CT   _CB2    32     1.53357   111.59843   125.29190
   25    24 S   HC   HB21    33     1.09584   110.05553    56.03782
   26    24 S   HC   HB22    34     1.09422   109.95811   175.09727
   27    22 S   N    _N3_    24     1.38326   113.71421    39.89476
   28    27 S   H    _HN3    25     1.01581   119.60237    -3.28014
   29    24 S   S    _SG2    35     1.82772   111.49457   -64.98182
   30    27 S   CT   _CA3    26     1.45290   123.22558   177.15924
   31    30 S   HC   HA31    27     1.09549   107.50553   -64.69829
   32    30 S   HC   HA32    28     1.09556   107.99223    51.74569
   33    29 S   CT   _C14    36     1.83709    99.83363   170.80664
   34    33 S   HC   _H3_    37     1.09621   107.19552   -47.59098
   35    30 S   CO3  _C3_    29     1.52965   114.06888   173.74116
   36    35 S   O2Z  _O31    30     1.26376   116.06428    -0.83110
   37    35 S   O2Z  _O32    31     1.26426   114.41712   179.23102
   38    33 S   CM   _C13    38     1.51006   107.59446  -165.21402
   39    38 S   HC   _H20    39     1.08895   117.27809   -60.00426
   40    33 S   CT   _C15    63     1.53589   110.96816    72.72609
   41    40 S   HC   _H21    64     1.09624   111.26008   -61.59947
   42    40 S   HC   _H22    65     1.09790   111.14593    57.60461
   43    38 S   CM   _C12    40     1.34244   123.06094   122.08522
   44    43 S   HC   _H19    41     1.08744   119.52025    -1.02029
   45    40 S   C    _C16    66     1.52268   112.05839   178.17030
   46    45 S   O    _O33    67     1.22802   120.47291  -112.38053
   47    43 S   CM   _C11    42     1.44438   123.32451   177.88576
   48    47 S   HC   _H18    43     1.08704   117.46732     1.87628
   49    45 S   N    _N4_    68     1.38840   112.33368    67.21654
   50    49 S   H    _H23    69     1.01830   117.07372     5.16960
   51    47 S   CM   _C10    44     1.34164   122.82868  -177.35758
   52    51 S   HC   _H17    45     1.08863   119.67377    -0.25717
   53    49 S   CM   _C17    70     1.38256   128.72152  -173.89395
   54    51 S   CT   _C7_    46     1.50897   123.76832   178.98086
   55    54 S   HC   _H12    47     1.09881   109.54613     2.82985
   56    53 S   CM   _C18    71     1.34404   125.89708     0.35222
   57    56 S   HC   _H24    72     1.08639   119.88175    -1.58992
   58    54 S   CT   _C6_    48     1.53643   110.41334   121.65691
   59    58 S   HC   _H10    49     1.09826   110.16192    55.37031
   60    58 S   HC   _H11    50     1.09709   110.05979   -61.97951
   61    56 S   CT   _C19    73     1.51715   126.34015   176.71753
   62    58 S   CT   _C5_    51     1.52776   111.66266   176.57149
   63    62 S   HC   _H8_    52     1.09585   109.62652  -176.39853
   64    62 S   HC   _H9_    53     1.09695   109.40527    66.62695
   65    61 S   C3T  _C20    74     1.50772   114.23222    11.46133
   66    65 S   HC   _H4_    75     1.08142   114.97360  -165.44356
   67    61 S   CM   _C23    81     1.52193   107.85453  -117.28834
   68    67 S   HC   _H25    82     1.09051   115.21517   -74.52599
   69    61 S   OH   _O39   109     1.43549   106.11409   128.92150
   70    69 S   HO   _H37   110     0.97267   107.88871   177.98346
   71    62 S   CT   _C4_    54     1.52568   111.67184   -54.70368
   72    71 S   HC   _H6_    55     1.09569   109.69373   176.31135
   73    71 S   HC   _H7_    56     1.09688   109.41265   -66.59344
   74    65 S   C3T  _C21    76     1.49683   119.00664   -11.92638
   75    74 S   HC   _H5_    77     1.08371   117.26394  -148.96329
   76    67 S   CM   _C24    83     1.34335   126.27829   104.06473
   77    76 S   HC   _H26    84     1.08655   120.24846    -0.01978
   78    71 S   CT   _C9_    57     1.52504   111.52786    54.61459
   79    78 S   HC   _H15    58     1.09691   109.49652    66.47933
   80    78 S   HC   _H16    59     1.09554   109.66861  -176.51687
   81    53 S   CO4  _C22    78     1.49888   114.26947   179.17386
   82    81 S   O    _O34    79     1.22621   121.71834    -4.88856
   83    65 S   O3T  _O35    80     1.43688   115.76178    54.93506
   84    76 S   CM   _C25    85     1.44658   122.86999  -178.78550
   85    84 S   HC   _H27    86     1.08803   117.04112    -1.14637
   86    54 S   CT   _C8_    60     1.53572   110.00913  -115.81489
   87    86 S   HC   _H13    61     1.09709   110.19615    61.32982
   88    86 S   HC   _H14    62     1.09712   109.80915   -55.99513
   89    84 S   CM   _C26    87     1.34172   123.06335   178.06649
   90    89 S   HC   _H28    88     1.08775   120.03953     0.24708
   91    89 S   CM   _C27    89     1.44699   122.83812  -178.83249
   92    91 S   HC   _H29    90     1.08759   116.80926    -1.94320
   93    91 S   CM   _C28    91     1.34028   122.84420   177.08362
   94    93 S   HC   _H30    92     1.08479   121.48111     0.57164
   95    93 S   C    _C29    93     1.48831   119.95882  -178.73933
   96    95 S   O    _O36    94     1.22619   122.67238    -0.61676
   97    95 S   N    _N5_    95     1.38300   112.04337   179.33383
   98    97 S   H    _H31    96     1.01571   119.84795    -0.32264
   99    97 S   CT1  _C30    97     1.44278   121.96301  -179.29724
  100    99 S   HC   _H32    98     1.09354   112.60779   -30.37058
  101    99 S   CO4  _C31    99     1.51032   110.70965  -154.16795
  102   101 S   O    _O37   100     1.22391   124.77130    50.52427
  103   101 S   CT   _C32   101     1.50866   111.25744  -131.47506
  104   103 S   HC   _H33   102     1.09282   110.92699   140.40138
  105   103 S   HC   _H34   103     1.09427   108.58547   -98.65055
  106   103 S   CT   _C33   104     1.52908   104.92543    19.95476
  107   106 S   HC   _H35   105     1.09281   111.41756  -137.92327
  108   106 S   HC   _H36   106     1.09446   110.57832    99.44135
  109    99 S   CO4  _C34   107     1.51308   110.38225    92.52588
  110   109 S   O    _O38   108     1.22425   124.84294   -57.04257
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   9   5   4   3
  12   7   2   1   1  10   4   8   4   3   6   3   6   3   7   3
   8   3  11   4  11  14   8  13   5  12   6   5  13   9   5   4
  11   6  10   4   4   1   8   5   4   4   3   6   3   5   4   3
   2   1   1   6   3   2   1   1   6   3   6   3   6   3   7   3
   9   4  11   6   9   5   7   5   4   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    43    40    41    42    45  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    43    44    47    40    41    42    45    46    49  
   38    39    43    40    41    42    45  
   36    37  
   37  
    0  
   39    43    44    47    48    51    40    41    42    45  
   43    44    47    40  
   41    42    45    46    49    50    53    43  
   42    45    46    49  
   45    46    49  
   44    47    48    51    52    54  
   47    48    51  
   46    49    50    53    56    81  
   49    50    53  
   48    51    52    54    55    58    86  
   51    52    54  
   50    53    56    57    61    74    81    82  
   53    56    81  
   52    54    55    58    59    60    62    78    86    87    88  
   54    55    58    86  
   56    57    61    65    74    75    81    82    83    67    69  
   55    58    59    60    62    63    64    71    78    79    80    86    87    88  
   58    59    60    62    78    86    87    88  
   57    61    65    66    74    81    82    83    67    68    76    69    70  
   61    65    81    67    69  
   59    60    62    63    64    71    72    73    78    86    87    88  
   60    62    63    64    71    86  
   62    63    64    71    86  
   65    66    74    75    81    83    67    68    76    77    84    69    70  
   63    64    71    72    73    78    79    80    86  
   64    71    72    73    78  
   71    72    73    78  
   66    74    75    81    82    83    67    68    76    69    70  
   74    75    81    83    67    69  
   68    76    77    84    85    89    69    70    74    83  
   76    77    84    69  
   70    74    76    83  
    0  
   72    73    78    79    80    86    87    88  
   73    78    79    80    86  
   78    79    80    86  
   75    81    82    83  
   81    82    83  
   77    84    85    89    90    91  
   84    85    89  
   79    80    86    87    88  
   80    86    87    88  
   86    87    88  
   82    83  
   83  
    0  
   85    89    90    91    92    93  
   89    90    91  
   87    88  
   88  
    0  
   90    91    92    93    94    95  
   91    92    93  
   92    93    94    95    96    97  
   93    94    95  
   94    95    96    97    98    99  
   95    96    97  
   96    97    98    99   100   101   109  
   97    98    99  
   98    99   100   101   102   103   106   109   110  
   99   100   101   109  
  100   101   102   103   104   105   106   107   108   109   110  
  101   102   103   106   109   110  
  102   103   104   105   106   107   108   109   110  
  103   104   105   106   109  
  104   105   106   107   108   109   110  
  105   106   107   108   109  
  106   107   108   109  
  107   108   109   110  
  108   109   110  
  109   110  
  110  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   44   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   45   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   47   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   48   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   49   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
   50   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   51   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   52   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5500   0.0760   0.051300   2.0020   1.7750   0.023028004  -0.852763146
   54   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   57   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   62   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.5000   0.0660   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   68   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   69   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   70   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   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   3.5000   0.0660   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   75   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   76   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   77   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   78   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   82   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   83   2.9000   0.1400  -0.352400   1.5900   1.4000   0.020110767  -0.896042159
   84   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   85   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   86   3.5000   0.0660  -0.120000   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   90   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   91   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   92   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   93   3.5500   0.0760  -0.171700   2.0020   1.7750   0.023028004  -0.852763146
   94   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   95   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
   96   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   97   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   98   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   99   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
  100   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
  101   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
  102   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
  103   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  104   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  107   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  108   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  109   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
  110   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    40   268.000  1.529
   38    39   340.000  1.080
   38    43   549.000  1.340
   43    44   340.000  1.080
   43    47   380.000  1.444
   47    48   340.000  1.080
   47    51   549.000  1.340
   51    52   340.000  1.080
   51    54   317.000  1.510
   54    55   340.000  1.090
   54    58   268.000  1.529
   54    86   268.000  1.529
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    62   268.000  1.529
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    71   268.000  1.529
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    78   268.000  1.529
   78    79   340.000  1.090
   78    80   340.000  1.090
   78    86   268.000  1.529
   86    87   340.000  1.090
   86    88   340.000  1.090
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    45   317.000  1.522
   45    46   570.000  1.229
   45    49   490.000  1.335
   49    50   434.000  1.010
   49    53   400.000  1.384
   53    56   549.000  1.340
   53    81   320.000  1.462
   56    57   340.000  1.080
   56    61   317.000  1.510
   61    65   275.000  1.510
   61    67   317.000  1.510
   61    69   320.000  1.410
   65    66   340.000  1.088
   65    74   260.000  1.509
   65    83   335.000  1.432
   74    75   340.000  1.088
   74    81   290.000  1.496
   74    83   335.000  1.432
   81    82   570.000  1.229
   67    68   340.000  1.080
   67    76   549.000  1.340
   76    77   340.000  1.080
   76    84   380.000  1.444
   84    85   340.000  1.080
   84    89   549.000  1.340
   89    90   340.000  1.080
   89    91   380.000  1.444
   91    92   340.000  1.080
   91    93   549.000  1.340
   93    94   340.000  1.080
   93    95   410.000  1.444
   95    96   570.000  1.229
   95    97   490.000  1.335
   97    98   434.000  1.010
   97    99   337.000  1.449
   99   100   340.000  1.090
   99   101   255.000  1.522
   99   109   255.000  1.522
  101   102   570.000  1.229
  101   103   317.000  1.522
  103   104   340.000  1.090
  103   105   340.000  1.090
  103   106   268.000  1.529
  106   107   340.000  1.090
  106   108   340.000  1.090
  106   109   317.000  1.522
  109   110   570.000  1.229
   69    70   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    40    75.00000  111.63000
   33    38    39    35.00000  117.00000
   33    38    43    70.00000  124.00000
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   33    40    45    63.00000  111.10000
   38    33    34    35.00000  109.50000
   38    43    44    35.00000  120.00000
   38    43    47    70.00000  123.01800
   43    38    39    35.00000  120.00000
   43    47    48    35.00000  120.00000
   43    47    51    70.00000  123.01800
   47    43    44    35.00000  120.00000
   47    51    52    35.00000  120.00000
   47    51    54    70.00000  124.00000
   51    47    48    35.00000  120.00000
   51    54    55    35.00000  109.50000
   51    54    58    70.00000  112.02700
   51    54    86    70.00000  112.02700
   54    51    52    35.00000  117.00000
   54    58    59    37.50000  110.70000
   54    58    60    37.50000  110.70000
   54    58    62    58.35000  112.70000
   54    86    78    58.35000  112.70000
   54    86    87    37.50000  110.70000
   54    86    88    37.50000  110.70000
   58    54    55    37.50000  110.70000
   58    62    63    37.50000  110.70000
   58    62    64    37.50000  110.70000
   58    62    71    58.35000  112.70000
   60    58    59    33.00000  107.80000
   62    58    59    37.50000  110.70000
   62    58    60    37.50000  110.70000
   62    71    72    37.50000  110.70000
   62    71    73    37.50000  110.70000
   62    71    78    58.35000  112.70000
   64    62    63    33.00000  107.80000
   71    62    63    37.50000  110.70000
   71    62    64    37.50000  110.70000
   71    78    79    37.50000  110.70000
   71    78    80    37.50000  110.70000
   71    78    86    58.35000  112.70000
   73    71    72    33.00000  107.80000
   78    71    72    37.50000  110.70000
   78    71    73    37.50000  110.70000
   78    86    87    37.50000  110.70000
   78    86    88    37.50000  110.70000
   80    78    79    33.00000  107.80000
   86    54    55    37.50000  110.70000
   86    54    58    58.35000  112.70000
   86    78    79    37.50000  110.70000
   86    78    80    37.50000  110.70000
   88    86    87    33.00000  107.80000
   40    33    34    37.50000  110.70000
   40    33    38    70.00000  112.02700
   40    45    46    80.00000  120.40000
   40    45    49    70.00000  116.60000
   42    40    41    33.00000  107.80000
   45    40    41    35.00000  109.50000
   45    40    42    35.00000  109.50000
   45    49    50    35.00000  119.80000
   45    49    53    70.00000  120.89900
   49    45    46    80.00000  122.90000
   49    53    56    75.00000  120.83300
   49    53    81    70.00000  117.92000
   53    49    50    45.00000  117.55000
   53    56    57    35.00000  120.00000
   53    56    61    70.00000  124.00000
   53    81    74    65.00000  118.62400
   53    81    82    80.00000  123.72100
   56    61    65    70.00000  112.02700
   56    61    67    70.00000  110.12100
   56    61    69    90.00000  110.39200
   61    56    57    35.00000  117.00000
   61    65    66    40.00000  115.04500
   61    65    74    60.00000  120.94000
   61    65    83    80.00000  116.47100
   61    67    68    35.00000  117.00000
   61    67    76    70.00000  124.00000
   61    69    70    55.00000  108.50000
   65    74    75    37.50000  117.20000
   65    74    81    65.00000  117.18000
   65    74    83    15.00000   60.43100
   65    83    74    15.00000   59.14900
   74    65    66    37.50000  117.20000
   74    81    82    75.00000  121.36600
   81    53    56    65.00000  118.96000
   81    74    75    40.00000  116.18000
   83    65    66    50.00000  114.27700
   83    65    74    15.00000   60.43100
   83    74    75    50.00000  114.27700
   83    74    81    80.00000  114.91000
   67    61    65    70.00000  112.02700
   67    76    77    35.00000  120.00000
   67    76    84    70.00000  123.01800
   76    67    68    35.00000  120.00000
   76    84    85    35.00000  120.00000
   76    84    89    70.00000  123.01800
   84    76    77    35.00000  120.00000
   84    89    90    35.00000  120.00000
   84    89    91    70.00000  123.01800
   89    84    85    35.00000  120.00000
   89    91    92    35.00000  120.00000
   89    91    93    70.00000  123.01800
   91    89    90    35.00000  120.00000
   91    93    94    35.00000  120.00000
   91    93    95    70.00000  118.70000
   93    91    92    35.00000  120.00000
   93    95    96    80.00000  125.30000
   93    95    97    80.00000  111.56200
   95    93    94    35.00000  119.70000
   95    97    98    35.00000  119.80000
   95    97    99    50.00000  121.90000
   97    95    96    80.00000  122.90000
   97    99   100    35.00000  109.50000
   97    99   101    80.00000  110.29000
   97    99   109    80.00000  110.29000
   99    97    98    38.00000  118.40000
   99   101   102    75.00000  123.42600
   99   101   103    65.00000  117.09000
   99   109   106    65.00000  117.09000
   99   109   110    75.00000  123.42600
  101    99   100    45.00000  110.09800
  101   103   104    35.00000  109.50000
  101   103   105    35.00000  109.50000
  101   103   106    63.00000  111.10000
  103   101   102    80.00000  120.40000
  103   106   107    37.50000  110.70000
  103   106   108    37.50000  110.70000
  103   106   109    63.00000  111.10000
  105   103   104    33.00000  107.80000
  106   103   104    37.50000  110.70000
  106   103   105    37.50000  110.70000
  106   109   110    80.00000  120.40000
  108   106   107    33.00000  107.80000
  109    99   100    45.00000  110.09800
  109    99   101    65.00000  112.16000
  109   106   107    35.00000  109.50000
  109   106   108    35.00000  109.50000
   69    61    65    50.00000  109.50000
   69    61    67    90.00000  110.39200
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
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  109    99  -101   103  -0.03850 -1.0 2.0
  109    99  -101   103   0.33900  1.0 3.0
   69    61    65    66   0.23400  1.0 3.0
   69    61    65    74   0.86500  1.0 1.0
   69    61    65    74  -0.17500 -1.0 2.0
   69    61    65    74   0.20800  1.0 3.0
   69    61    65    83   3.69350  1.0 1.0
   69    61    65    83  -1.82950 -1.0 2.0
   69    61    67    68   0.00000  1.0 1.0
   69    61    67    76   0.67800  1.0 1.0
   69    61    67    76   0.47050 -1.0 2.0
   69    61    67    76  -0.62500  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   33    39    38    43  15.00000 -1.0 2.0
   47    44    43    38  15.00000 -1.0 2.0
   43    48    47    51  15.00000 -1.0 2.0
   54    52    51    47  15.00000 -1.0 2.0
   40    49    45    46  10.50000 -1.0 2.0
   50    45    49    53   1.00000 -1.0 2.0
   49    81    53    56   1.10000 -1.0 2.0
   61    57    56    53   1.10000 -1.0 2.0
   53    74    81    82  10.50000 -1.0 2.0
   61    68    67    76  15.00000 -1.0 2.0
   84    77    76    67  15.00000 -1.0 2.0
   76    85    84    89  15.00000 -1.0 2.0
   91    90    89    84  15.00000 -1.0 2.0
   89    92    91    93  15.00000 -1.0 2.0
   95    94    93    91  15.00000 -1.0 2.0
   93    97    95    96  10.50000 -1.0 2.0
   98    95    97    99   1.00000 -1.0 2.0
   99   103   101   102  10.50000 -1.0 2.0
   99   106   109   110  10.50000 -1.0 2.0
END
