* LIGAND DATABASE FILE (OPLS2005)
*
001     112   118    228    383     693
    1     0 S   NP   _N1_     1    28.85125    94.00614   -20.67838
    2     1 S   H    _HN1     2     1.02772    88.70702   -54.62774
    3     1 S   H    _H1_     3     1.02964    96.47392    53.73429
    4     1 S   H    _H2_     4     1.02828    26.94592   168.94581
    5     1 S   CT   _CA1     5     1.50183   137.07515  -176.82023
    6     5 S   HC   _HA1     6     1.09566   105.19977    52.44601
    7     5 S   CO3  _C1_     7     1.53879   112.38704   -67.68487
    8     7 S   O2Z  _O11     8     1.26374   115.00635   -38.59606
    9     7 S   O2Z  _O12     9     1.26237   115.00525   140.44394
   10     5 S   CT   _CB1    10     1.53096   107.35173   170.46793
   11    10 S   HC   HB11    11     1.09814   109.44360   -48.07669
   12    10 S   HC   HB12    12     1.09839   110.32118    68.50241
   13    10 S   CT   _CG1    13     1.53018   112.76061  -169.21455
   14    13 S   HC   HG11    14     1.09519   110.29562   -60.16498
   15    13 S   HC   HG12    15     1.09622   110.24821    58.86933
   16    13 S   C    _CD1    16     1.51860   111.95944   178.72835
   17    16 S   O    _OE1    17     1.22764   123.04145   -19.15954
   18    16 S   N    _N2_    18     1.38543   111.88770   161.93127
   19    18 S   H    _HN2    19     1.01595   119.03630     0.47888
   20    18 S   CT1  _CA2    20     1.46319   123.54794  -178.55870
   21    20 S   HC   _HA2    21     1.09749   109.28634   -16.60061
   22    20 S   C    _C2_    22     1.53405   108.28746  -132.09938
   23    22 S   O    _O2_    23     1.23027   122.49716  -147.84553
   24    20 S   CT   _CB2    32     1.53799   111.28894   105.66663
   25    24 S   HC   HB21    33     1.09141   108.46707    53.19092
   26    24 S   HC   HB22    34     1.09420   109.78605   172.11285
   27    22 S   N    _N3_    24     1.38426   113.39603    39.84755
   28    27 S   H    _HN3    25     1.01661   119.49173    -3.84975
   29    24 S   S    _SG2    35     1.82482   110.66149   -69.23343
   30    27 S   CT   _CA3    26     1.45290   122.99632   176.77718
   31    30 S   HC   HA31    27     1.09557   107.57495   -62.08634
   32    30 S   HC   HA32    28     1.09562   107.85708    54.26579
   33    29 S   CT   _C15    36     1.89948   105.85555   164.79353
   34    30 S   CO3  _C3_    29     1.52905   114.25333   176.22384
   35    34 S   O2Z  _O31    30     1.26348   116.09342    -0.57198
   36    34 S   O2Z  _O32    31     1.26442   114.39763   179.45968
   37    33 S   CT   _C16    37     1.58968   107.07428   160.30517
   38    37 S   HC   _H8_    38     1.09845   105.39592   171.67131
   39    33 S   CT   _C14    86     1.56911   113.84059    40.78428
   40    39 S   HC   _H7_    87     1.09621   107.77434  -175.05589
   41    37 S   CT   _C21    39     1.54271   112.96610    57.67736
   42    41 S   HC   _H10    40     1.09295   110.59813   -99.01223
   43    37 S   CT   _C17    70     1.60488   116.09489   -76.07504
   44    39 S   OH   _O42    88     1.42035   113.60689   -60.01138
   45    44 S   HO   _H38    89     0.97222   108.09349  -176.42702
   46    41 S   CO4  _C22    41     1.51745   115.86091    21.90415
   47    46 S   O    _O37    42     1.23618   118.20970  -156.35527
   48    41 S   OH   _O41    68     1.42311   110.10983   142.39661
   49    48 S   HO   _H37    69     0.97340   107.42945   168.89683
   50    43 S   CT   _C18    71     1.56488   109.99638  -167.08897
   51    50 S   HC   _H21    72     1.09864   109.94604    47.67205
   52    50 S   HC   _H22    73     1.09701   110.68427   -68.49922
   53    43 S   CT   _C20   109     1.55256   113.64243    72.68844
   54    53 S   HC   _H23   110     1.08912   113.23815   -66.81266
   55    53 S   HC   _H24   111     1.09332   112.48827   174.99398
   56    53 S   HC   _H25   112     1.09292   112.19033    56.01026
   57    46 S   CT   _C23    43     1.53670   120.15550    27.95365
   58    50 S   CT   _C19    74     1.53473   113.71219   169.56627
   59    58 S   HC   _H9_    75     1.09581   109.53260    69.01119
   60    57 S   CT   _C27    44     1.56882   109.03811    79.14192
   61    60 S   HC   _H11    45     1.09931   108.81813   -36.90001
   62    57 S   CT   _C32    64     1.54961   107.71991  -160.00121
   63    62 S   HC   _H34    65     1.09489   112.20763  -173.68882
   64    62 S   HC   _H35    66     1.09465   110.82661    65.21620
   65    62 S   HC   _H36    67     1.09497   112.18129   -53.42767
   66    58 S   CT   _C10    76     1.52512   111.72679   -53.81813
   67    66 S   HC   _H5_    77     1.09859   110.07432   -65.61931
   68    60 S   CM   _C28    46     1.50596   118.13000    83.15023
   69    60 S   CT   _C26    55     1.53016   103.19598  -149.20395
   70    69 S   HC   _H28    56     1.09616   112.20232   -74.50162
   71    69 S   HC   _H29    57     1.09519   112.31666   163.50450
   72    66 S   CT   _C11    78     1.52807   111.59479    54.81733
   73    72 S   HC   _H17    79     1.09757   108.74576  -177.48635
   74    72 S   HC   _H18    80     1.09599   110.94203    67.20619
   75    66 S   OS   _O35    90     1.42954   108.81856   176.19178
   76    68 S   CM   _C29    47     1.33314   128.38968   111.55642
   77    76 S   HC   _H30    48     1.07602   128.94143    -1.98248
   78    69 S   CT   _C25    58     1.51881   102.45167    43.85811
   79    78 S   HC   _H26    59     1.09312   107.94358    78.05722
   80    78 S   HC   _H27    60     1.09578   110.34950  -164.45969
   81    43 S   CT   _C12    81     1.56048   107.78806   -50.54441
   82    81 S   HC   _H6_    82     1.10197   106.92487   -58.76830
   83    75 S   CO   _C9_    91     1.43955   111.31134    60.86102
   84    83 S   HC   _H4_    92     1.09696   105.41655  -174.34224
   85    76 S   CO4  _C30    49     1.46279   107.27328   176.86887
   86    85 S   O    _O38    50     1.21856   125.04361   179.76179
   87    33 S   CT   _C24    61     1.59445   108.25493   -83.57471
   88    81 S   CT   _C13    83     1.52960   112.18592    57.09217
   89    88 S   HC   _H19    84     1.09428   112.70754    61.91994
   90    88 S   HC   _H20    85     1.09807   109.58940   178.38662
   91    83 S   CO   _C8_    93     1.54355   110.97950   -54.07962
   92    85 S   OS   _O39    51     1.36157   109.01586    -0.94956
   93    87 S   OH   _O40    62     1.43815   107.90953    57.77135
   94    93 S   HO   _H33    63     0.97144   109.43081   165.26854
   95    91 S   CO4  _C7_    94     1.52277   109.38756   167.93811
   96    95 S   O    _O33    95     1.23066   122.23789  -172.38691
   97    58 S   OS   _O36   106     1.43253   109.32274  -173.97735
   98    91 S   OH   _O43   107     1.42173   109.57400   -74.60699
   99    98 S   HO   _H39   108     0.97306   107.07608  -168.06222
  100    68 S   CT   _C31    52     1.48305   121.45174   -71.98035
  101   100 S   HC   _H31    53     1.09391   112.20776   -58.48378
  102   100 S   HC   _H32    54     1.09141   112.95687    66.49004
  103    95 S   CT   _C6_    96     1.50681   116.13649    11.37996
  104   103 S   HC   _H15    97     1.09674   106.71428    69.26398
  105   103 S   HC   _H16    98     1.09482   110.39805  -174.63086
  106   103 S   CT   _C5_    99     1.52939   110.38874   -50.53565
  107   106 S   HC   _H3_   100     1.09642   108.64796   153.22302
  108    83 S   OS   _O34   101     1.42866   110.55452    68.54538
  109   106 S   CT   _C4_   102     1.52541   111.47241   -87.89354
  110   109 S   HC   _H12   103     1.09567   110.95031    63.09797
  111   109 S   HC   _H13   104     1.09424   111.43984   -58.21083
  112   109 S   HC   _H14   105     1.09555   110.43477  -178.86185
  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  13   5   4   3
  27   2   1   1  27  10  15   7  13   6  22   6   1  15   5   2
   1  17   7   6   8   3   2   1  18  13   6  21   9   8   3   2
   1  13   7  13   9   5   4  10   5   4   9   7   4   5   3   2
   4   3  12   6   5   2   3   2   1   1  10   3   1   1  11   6
   4   3   1   2   1   1   9   5   4   6   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    87    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    57    78    87    93    43    88    39    40    44  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    42    46    57    60    69    78    79    80    87    93    94    62    48    43    50    81    88    89    90    39    40    44    45    53  
   35    36  
   36  
    0  
   38    41    42    46    47    57    78    87    93    48    49    43    50    51    52    58    72    81    82    88    39    40    44    53    54    55    56  
   41    42    46    87    48    43    50    81    39    53  
   40    44    45    41    43    57    72    78    81    82    87    88    89    90    93  
   44    45    81    87    88    89    90  
   42    46    47    57    60    87    62    48    49    43    50    81    53  
   46    47    57    48    49    43  
   50    51    52    58    59    66    72    73    74    81    82    88    89    90    97    53    54    55    56    46    48    87  
   45    81    87    88    89    90  
   88  
   47    57    60    61    68    69    78    87    93    62    63    64    65    48    49  
   57    60    87    62    48  
   49    57  
    0  
   51    52    58    59    66    67    72    81    82    88    75    91    97    53    54    55    56  
   52    58    59    66    81    97    53  
   58    59    66    81    97    53  
   54    55    56    58    72    81    82    88  
   55    56    81  
   56    81  
   81  
   60    61    68    76   100    69    70    71    78    79    80    87    93    94    62    63    64    65  
   59    66    67    72    73    74    81    75    83    91    95    97    98  
   66    67    72    75    91    97  
   61    68    76    77    85    92   100   101   102    69    70    71    78    79    80    87    93    62    63    64    65  
   68    76   100    69    70    71    78    87    62  
   63    64    65    68    69    78    87    93  
   64    65    87  
   65    87  
   87  
   67    72    73    74    81    82    88    75    83    84    91   108    97  
   72    73    74    81    75    83    97  
   76    77    85    86    92   100   101   102    69    70    71    78    87  
   70    71    78    79    80    87    93    76   100  
   71    78    79    80    87  
   78    79    80    87  
   73    74    81    82    88    89    90    75    83    97  
   74    81    82    88    75  
   81    82    88    75  
   83    84    91    95   106   108    97    98    81  
   77    85    86    92   100   101   102  
   85    86    92   100  
   79    80    87    93    94  
   80    87    93  
   87    93  
   82    88    89    90  
   88    89    90  
   84    91    95    96   103   106   107   108   109    97    98    99  
   91    95   106   108    97    98  
   86    92   100   101   102  
   92   100  
   93    94    88  
   89    90  
   90  
    0  
   95    96   103   104   105   106   108    97    98    99  
  100   101   102  
   94  
    0  
   96   103   104   105   106   107   108   109    97    98    99  
  103   104   105   106    97    98  
   98    99   103   108  
   99   103   108  
    0  
  101   102  
  102  
    0  
  104   105   106   107   108   109   110   111   112  
  105   106   107   108   109  
  106   107   108   109  
  107   108   109   110   111   112  
  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  -0.335000   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   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   43   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   44   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   45   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   46   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   47   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   48   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   49   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   50   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   58   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   69   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   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   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   84   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   85   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   86   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   87   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   88   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   3.5000   0.0660   0.364700   1.9750   1.7500   0.005000000  -0.741685710
   92   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   93   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   94   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   95   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   96   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   97   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   98   3.1200   0.1700  -0.582700   1.7660   1.5600   0.021068034  -0.322181743
   99   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  100   3.5000   0.0660   0.259000   1.9750   1.7500   0.005000000  -0.741685710
  101   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
  102   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
  103   3.5000   0.0660  -0.120000   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   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
  107   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  108   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
  109   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   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    37   268.000  1.529
   33    87   268.000  1.529
   33    39   268.000  1.529
   37    38   340.000  1.090
   37    41   268.000  1.529
   37    43   268.000  1.529
   41    42   340.000  1.090
   41    46   317.000  1.522
   41    48   320.000  1.410
   46    47   570.000  1.229
   46    57   317.000  1.522
   57    60   268.000  1.529
   57    87   268.000  1.529
   57    62   268.000  1.529
   60    61   340.000  1.090
   60    68   317.000  1.510
   60    69   268.000  1.529
   68    76   549.000  1.340
   68   100   317.000  1.510
   76    77   340.000  1.080
   76    85   320.000  1.462
   85    86   570.000  1.229
   85    92   214.000  1.327
   92   100   320.000  1.410
  100   101   340.000  1.090
  100   102   340.000  1.090
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    78   268.000  1.529
   78    79   340.000  1.090
   78    80   340.000  1.090
   78    87   268.000  1.529
   87    93   320.000  1.410
   93    94   553.000  0.945
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   340.000  1.090
   48    49   553.000  0.945
   43    50   268.000  1.529
   43    81   268.000  1.529
   43    53   268.000  1.529
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    58   268.000  1.529
   58    59   340.000  1.090
   58    66   268.000  1.529
   58    97   320.000  1.410
   66    67   340.000  1.090
   66    72   268.000  1.529
   66    75   320.000  1.410
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    81   268.000  1.529
   81    82   340.000  1.090
   81    88   268.000  1.529
   88    89   340.000  1.090
   88    90   340.000  1.090
   88    39   268.000  1.529
   39    40   340.000  1.090
   39    44   320.000  1.410
   44    45   553.000  0.945
   75    83   320.000  1.380
   83    84   340.000  1.090
   83    91   250.000  1.527
   83   108   320.000  1.380
   91    95   235.000  1.518
   91    97   320.000  1.380
   91    98   380.000  1.407
   95    96   570.000  1.229
   95   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   320.000  1.410
  106   109   268.000  1.529
  109   110   340.000  1.090
  109   111   340.000  1.090
  109   112   340.000  1.090
   98    99   553.000  0.945
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   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    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    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    37    75.00000  111.63000
   29    33    87    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    41    58.35000  112.70000
   33    37    43    58.35000  112.70000
   33    87    57    58.35000  112.70000
   33    87    78    58.35000  112.70000
   33    87    93    50.00000  109.50000
   33    39    88    58.35000  112.70000
   33    39    40    37.50000  110.70000
   33    39    44    50.00000  109.50000
   37    41    42    37.50000  110.70000
   37    41    46    63.00000  111.10000
   37    41    48    50.00000  109.50000
   37    43    50    58.35000  112.70000
   37    43    81    58.35000  112.70000
   37    43    53    58.35000  112.70000
   41    37    38    37.50000  110.70000
   41    46    47    80.00000  120.40000
   41    46    57    70.00000  116.00000
   41    48    49    55.00000  108.50000
   46    41    42    35.00000  109.50000
   46    57    60    63.00000  111.10000
   46    57    87    63.00000  111.10000
   46    57    62    63.00000  111.10000
   57    46    47    80.00000  120.40000
   57    60    61    37.50000  110.70000
   57    60    68    70.00000  112.02700
   57    60    69    58.35000  112.70000
   57    87    78    58.35000  112.70000
   57    87    93    50.00000  109.50000
   57    62    63    37.50000  110.70000
   57    62    64    37.50000  110.70000
   57    62    65    37.50000  110.70000
   60    68    76    70.00000  124.00000
   60    68   100    65.00000  117.92700
   60    69    70    37.50000  110.70000
   60    69    71    37.50000  110.70000
   60    69    78    58.35000  112.70000
   68    60    61    35.00000  109.50000
   68    76    77    35.00000  120.00000
   68    76    85    65.00000  118.96000
   68   100    92    85.00000  110.90400
   68   100   101    35.00000  109.50000
   68   100   102    35.00000  109.50000
   76    85    86    80.00000  123.72100
   76    85    92    90.00000  111.29400
   85    76    77    40.00000  117.72500
   85    92   100    83.00000  116.90000
   92    85    86    83.00000  123.40000
   92   100   101    35.00000  109.50000
   92   100   102    35.00000  109.50000
  100    68    76    70.00000  124.00000
  102   100   101    33.00000  107.80000
   69    60    61    37.50000  110.70000
   69    60    68    70.00000  112.02700
   69    78    79    37.50000  110.70000
   69    78    80    37.50000  110.70000
   69    78    87    58.35000  112.70000
   71    69    70    33.00000  107.80000
   78    69    70    37.50000  110.70000
   78    69    71    37.50000  110.70000
   78    87    93    50.00000  109.50000
   80    78    79    33.00000  107.80000
   87    33    37    58.35000  112.70000
   87    57    60    58.35000  112.70000
   87    78    79    37.50000  110.70000
   87    78    80    37.50000  110.70000
   87    93    94    55.00000  108.50000
   62    57    60    58.35000  112.70000
   62    57    87    58.35000  112.70000
   64    62    63    33.00000  107.80000
   65    62    63    33.00000  107.80000
   65    62    64    33.00000  107.80000
   48    41    42    35.00000  109.50000
   48    41    46    90.00000  109.61100
   43    37    38    37.50000  110.70000
   43    37    41    58.35000  112.70000
   43    50    51    37.50000  110.70000
   43    50    52    37.50000  110.70000
   43    50    58    58.35000  112.70000
   43    81    72    58.35000  112.70000
   43    81    82    37.50000  110.70000
   43    81    88    58.35000  112.70000
   43    53    54    37.50000  110.70000
   43    53    55    37.50000  110.70000
   43    53    56    37.50000  110.70000
   50    58    59    37.50000  110.70000
   50    58    66    58.35000  112.70000
   50    58    97    50.00000  109.50000
   52    50    51    33.00000  107.80000
   58    50    51    37.50000  110.70000
   58    50    52    37.50000  110.70000
   58    66    67    37.50000  110.70000
   58    66    72    58.35000  112.70000
   58    66    75    50.00000  109.50000
   58    97    91    60.00000  109.50000
   66    58    59    37.50000  110.70000
   66    72    73    37.50000  110.70000
   66    72    74    37.50000  110.70000
   66    72    81    58.35000  112.70000
   66    75    83    60.00000  109.50000
   72    66    67    37.50000  110.70000
   72    81    82    37.50000  110.70000
   72    81    88    58.35000  112.70000
   74    72    73    33.00000  107.80000
   81    43    50    58.35000  112.70000
   81    72    73    37.50000  110.70000
   81    72    74    37.50000  110.70000
   81    88    89    37.50000  110.70000
   81    88    90    37.50000  110.70000
   81    88    39    58.35000  112.70000
   88    81    82    37.50000  110.70000
   88    39    40    37.50000  110.70000
   88    39    44    50.00000  109.50000
   90    88    89    33.00000  107.80000
   39    33    37    58.35000  112.70000
   39    33    87    58.35000  112.70000
   39    88    89    37.50000  110.70000
   39    88    90    37.50000  110.70000
   39    44    45    55.00000  108.50000
   44    39    40    35.00000  109.50000
   75    66    67    35.00000  109.50000
   75    66    72    50.00000  109.50000
   75    83    84    35.00000  109.50000
   75    83    91    90.00000  108.56700
   75    83   108    92.60000  111.55000
   83    91    95    65.00000  114.32000
   83    91    97    90.00000  108.56700
   83    91    98    90.00000  110.19100
   83   108   106    60.00000  109.50000
   91    83    84    45.00000  112.01100
   91    95    96    75.00000  120.68000
   91    95   103    70.00000  116.00000
   91    98    99    70.00000  107.92000
   95   103   104    35.00000  109.50000
   95   103   105    35.00000  109.50000
   95   103   106    63.00000  111.10000
  103    95    96    80.00000  120.40000
  103   106   107    37.50000  110.70000
  103   106   108    50.00000  109.50000
  103   106   109    58.35000  112.70000
  105   103   104    33.00000  107.80000
  106   103   104    37.50000  110.70000
  106   103   105    37.50000  110.70000
  106   109   110    37.50000  110.70000
  106   109   111    37.50000  110.70000
  106   109   112    37.50000  110.70000
  108    83    84    35.00000  109.50000
  108    83    91    90.00000  108.56700
  108   106   107    35.00000  109.50000
  109   106   107    37.50000  110.70000
  109   106   108    50.00000  109.50000
  111   109   110    33.00000  107.80000
  112   109   110    33.00000  107.80000
  112   109   111    33.00000  107.80000
   97    58    59    35.00000  109.50000
   97    58    66    50.00000  109.50000
   97    91    95    90.00000  107.81500
   98    91    95    90.00000  109.61100
   98    91    97   110.00000  112.08000
   53    43    50    58.35000  112.70000
   53    43    81    58.35000  112.70000
   55    53    54    33.00000  107.80000
   56    53    54    33.00000  107.80000
   56    53    55    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
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   62    57    87    93   0.20800  1.0 3.0
   48    41    46    47   0.30150 -1.0 2.0
   48    41    46    57   0.55300  1.0 1.0
   48    41    46    57   1.25850 -1.0 2.0
   48    41    46    57  -0.23600  1.0 3.0
   43    37    41    42   0.15000  1.0 3.0
   43    37    41    46  -0.95700  1.0 1.0
   43    37    41    46  -0.18200 -1.0 2.0
   43    37    41    46   0.29450  1.0 3.0
   43    37    41    48   0.86500  1.0 1.0
   43    37    41    48  -0.17500 -1.0 2.0
   43    37    41    48   0.20800  1.0 3.0
   43    50    58    59   0.15000  1.0 3.0
   43    50    58    66   0.56750  1.0 1.0
   43    50    58    66  -0.07550 -1.0 2.0
   43    50    58    66   0.20000  1.0 3.0
   43    50    58    97   0.62750  1.0 1.0
   43    50    58    97  -0.30950 -1.0 2.0
   43    50    58    97   0.27300  1.0 3.0
   43    81    88    89   0.15000  1.0 3.0
   43    81    88    90   0.15000  1.0 3.0
   43    81    88    39   0.56750  1.0 1.0
   43    81    88    39  -0.07550 -1.0 2.0
   43    81    88    39   0.20000  1.0 3.0
   50    43    81    72   0.56750  1.0 1.0
   50    43    81    72  -0.07550 -1.0 2.0
   50    43    81    72   0.20000  1.0 3.0
   50    43    81    82   0.15000  1.0 3.0
   50    43    81    88   0.56750  1.0 1.0
   50    43    81    88  -0.07550 -1.0 2.0
   50    43    81    88   0.20000  1.0 3.0
   50    43    53    54   0.15000  1.0 3.0
   50    43    53    55   0.15000  1.0 3.0
   50    43    53    56   0.15000  1.0 3.0
   50    58    66    67   0.15000  1.0 3.0
   50    58   -66    72   0.56750  1.0 1.0
   50    58   -66    72  -0.07550 -1.0 2.0
   50    58   -66    72   0.20000  1.0 3.0
   50    58    66    75   0.62750  1.0 1.0
   50    58    66    75  -0.30950 -1.0 2.0
   50    58    66    75   0.27300  1.0 3.0
   50    58    97    91   0.06250  1.0 1.0
   50    58    97    91  -0.01100 -1.0 2.0
   50    58    97    91   0.28050  1.0 3.0
   51    50    58    59   0.15000  1.0 3.0
   51    50    58    66   0.15000  1.0 3.0
   51    50    58    97   0.23400  1.0 3.0
   52    50    58    59   0.15000  1.0 3.0
   52    50    58    66   0.15000  1.0 3.0
   52    50    58    97   0.23400  1.0 3.0
   58    66    72    73   0.15000  1.0 3.0
   58    66    72    74   0.15000  1.0 3.0
   58    66    72    81   0.56750  1.0 1.0
   58    66    72    81  -0.07550 -1.0 2.0
   58    66    72    81   0.20000  1.0 3.0
   58    66    75    83   0.06250  1.0 1.0
   58    66    75    83  -0.01100 -1.0 2.0
   58    66    75    83   0.28050  1.0 3.0
   59    58    66    67   0.15000  1.0 3.0
   59    58    66    72   0.15000  1.0 3.0
   59    58    66    75   0.23400  1.0 3.0
   59    58    97    91   0.37050  1.0 3.0
   66    58    97    91   0.06250  1.0 1.0
   66    58    97    91  -0.01100 -1.0 2.0
   66    58    97    91   0.28050  1.0 3.0
   66    72   -81    43   0.56750  1.0 1.0
   66    72   -81    43  -0.07550 -1.0 2.0
   66    72   -81    43   0.20000  1.0 3.0
   66    72    81    82   0.15000  1.0 3.0
   66    72    81    88   0.56750  1.0 1.0
   66    72    81    88  -0.07550 -1.0 2.0
   66    72    81    88   0.20000  1.0 3.0
   66    75    83    84   0.37050  1.0 3.0
   66    75   -83    91   0.06250  1.0 1.0
   66    75   -83    91  -0.01100 -1.0 2.0
   66    75   -83    91   0.28050  1.0 3.0
   66    75    83   108  -0.53350  1.0 1.0
   66    75    83   108  -0.78350 -1.0 2.0
   66    75    83   108   0.33750  1.0 3.0
   67    66    72    73   0.15000  1.0 3.0
   67    66    72    74   0.15000  1.0 3.0
   67    66    72    81   0.15000  1.0 3.0
   67    66    75    83   0.37050  1.0 3.0
   72    66    75    83   0.06250  1.0 1.0
   72    66    75    83  -0.01100 -1.0 2.0
   72    66    75    83   0.28050  1.0 3.0
   72    81    88    89   0.15000  1.0 3.0
   72    81    88    90   0.15000  1.0 3.0
   72    81    88    39   0.56750  1.0 1.0
   72    81    88    39  -0.07550 -1.0 2.0
   72    81    88    39   0.20000  1.0 3.0
   73    72    81    43   0.15000  1.0 3.0
   73    72    81    82   0.15000  1.0 3.0
   73    72    81    88   0.15000  1.0 3.0
   74    72    81    43   0.15000  1.0 3.0
   74    72    81    82   0.15000  1.0 3.0
   74    72    81    88   0.15000  1.0 3.0
   81    43    50    51   0.15000  1.0 3.0
   81    43    50    52   0.15000  1.0 3.0
   81    43   -50    58   0.56750  1.0 1.0
   81    43   -50    58  -0.07550 -1.0 2.0
   81    43   -50    58   0.20000  1.0 3.0
   81    43    53    54   0.15000  1.0 3.0
   81    43    53    55   0.15000  1.0 3.0
   81    43    53    56   0.15000  1.0 3.0
   81    88   -39    33   0.56750  1.0 1.0
   81    88   -39    33  -0.07550 -1.0 2.0
   81    88   -39    33   0.20000  1.0 3.0
   81    88    39    40   0.15000  1.0 3.0
   81    88    39    44   0.86500  1.0 1.0
   81    88    39    44  -0.17500 -1.0 2.0
   81    88    39    44   0.20800  1.0 3.0
   82    81    88    89   0.15000  1.0 3.0
   82    81    88    90   0.15000  1.0 3.0
   82    81    88    39   0.15000  1.0 3.0
   88    39    44    45  -0.11600  1.0 1.0
   88    39    44    45  -0.09450 -1.0 2.0
   88    39    44    45   0.21250  1.0 3.0
   89    88    39    33   0.15000  1.0 3.0
   89    88    39    40   0.15000  1.0 3.0
   89    88    39    44   0.23400  1.0 3.0
   90    88    39    33   0.15000  1.0 3.0
   90    88    39    40   0.15000  1.0 3.0
   90    88    39    44   0.23400  1.0 3.0
   39    33    37    38   0.15000  1.0 3.0
   39    33    37    41   0.56750  1.0 1.0
   39    33    37    41  -0.07550 -1.0 2.0
   39    33    37    41   0.20000  1.0 3.0
   39    33   -37    43   0.56750  1.0 1.0
   39    33   -37    43  -0.07550 -1.0 2.0
   39    33   -37    43   0.20000  1.0 3.0
   39    33    87    57   0.56750  1.0 1.0
   39    33    87    57  -0.07550 -1.0 2.0
   39    33    87    57   0.20000  1.0 3.0
   39    33    87    78   0.56750  1.0 1.0
   39    33    87    78  -0.07550 -1.0 2.0
   39    33    87    78   0.20000  1.0 3.0
   39    33    87    93   0.86500  1.0 1.0
   39    33    87    93  -0.17500 -1.0 2.0
   39    33    87    93   0.20800  1.0 3.0
   40    39    44    45   0.19450  1.0 3.0
   75    66    72    73   0.23400  1.0 3.0
   75    66    72    74   0.23400  1.0 3.0
   75    66    72    81   0.62750  1.0 1.0
   75    66    72    81  -0.30950 -1.0 2.0
   75    66    72    81   0.27300  1.0 3.0
   75    83    91    95  -0.09450  1.0 1.0
   75    83    91    95  -1.12950 -1.0 2.0
   75    83    91    95   0.54000  1.0 3.0
   75    83    91    97   1.11900  1.0 1.0
   75    83    91    97  -1.16350 -1.0 2.0
   75    83    91    97  -0.34150  1.0 3.0
   75    83    91    98   3.69350  1.0 1.0
   75    83    91    98  -1.82950 -1.0 2.0
   75    83   108   106  -0.53350  1.0 1.0
   75    83   108   106  -0.78350 -1.0 2.0
   75    83   108   106   0.33750  1.0 3.0
   83    91    95    96   0.30150 -1.0 2.0
   83    91    95   103   0.60050  1.0 1.0
   83    91    95   103   0.05600 -1.0 2.0
   83    91    95   103   0.26150  1.0 3.0
   83    91   -97    58   0.06250  1.0 1.0
   83    91   -97    58  -0.01100 -1.0 2.0
   83    91   -97    58   0.28050  1.0 3.0
   83    91    98    99  -0.11600  1.0 1.0
   83    91    98    99  -0.09450 -1.0 2.0
   83    91    98    99   0.21250  1.0 3.0
   84    83    91    95  -0.11250  1.0 3.0
   84    83    91    97   0.23400  1.0 3.0
   84    83    91    98   0.23400  1.0 3.0
   84    83   108   106   0.37050  1.0 3.0
   91    83   108   106   0.06250  1.0 1.0
   91    83   108   106  -0.01100 -1.0 2.0
   91    83   108   106   0.28050  1.0 3.0
   91    95   103   104   0.00000  1.0 1.0
   91    95   103   105   0.00000  1.0 1.0
   91    95  -103   106   0.60050  1.0 1.0
   91    95  -103   106   0.05600 -1.0 2.0
   91    95  -103   106   0.26150  1.0 3.0
   95    91    97    58  -1.11000  1.0 1.0
   95    91    97    58   0.50250 -1.0 2.0
   95    91    97    58   0.47450  1.0 3.0
   95    91    98    99   0.91850  1.0 1.0
   95    91    98    99   0.57950  1.0 3.0
   95   103   106   107  -0.11250  1.0 3.0
   95   103   106   108  -0.09450  1.0 1.0
   95   103   106   108  -1.12950 -1.0 2.0
   95   103   106   108   0.54000  1.0 3.0
   95   103   106   109  -0.95700  1.0 1.0
   95   103   106   109  -0.18200 -1.0 2.0
   95   103   106   109   0.29450  1.0 3.0
   96    95   103   104   0.00000  1.0 1.0
   96    95   103   105   0.00000  1.0 1.0
   96    95   103   106   0.30150 -1.0 2.0
  103   106  -108    83   0.06250  1.0 1.0
  103   106  -108    83  -0.01100 -1.0 2.0
  103   106  -108    83   0.28050  1.0 3.0
  103   106   109   110   0.15000  1.0 3.0
  103   106   109   111   0.15000  1.0 3.0
  103   106   109   112   0.15000  1.0 3.0
  104   103   106   107   0.15000  1.0 3.0
  104   103   106   108   0.23400  1.0 3.0
  104   103   106   109   0.15000  1.0 3.0
  105   103   106   107   0.15000  1.0 3.0
  105   103   106   108   0.23400  1.0 3.0
  105   103   106   109   0.15000  1.0 3.0
  107   106   108    83   0.37050  1.0 3.0
  107   106   109   110   0.15000  1.0 3.0
  107   106   109   111   0.15000  1.0 3.0
  107   106   109   112   0.15000  1.0 3.0
  108    83   -91    95  -0.09450  1.0 1.0
  108    83   -91    95  -1.12950 -1.0 2.0
  108    83   -91    95   0.54000  1.0 3.0
  108    83    91    97   1.11900  1.0 1.0
  108    83    91    97  -1.16350 -1.0 2.0
  108    83    91    97  -0.34150  1.0 3.0
  108    83    91    98   3.69350  1.0 1.0
  108    83    91    98  -1.82950 -1.0 2.0
  108   106   109   110   0.23400  1.0 3.0
  108   106   109   111   0.23400  1.0 3.0
  108   106   109   112   0.23400  1.0 3.0
  109   106   108    83   0.06250  1.0 1.0
  109   106   108    83  -0.01100 -1.0 2.0
  109   106   108    83   0.28050  1.0 3.0
   97    58    66    67   0.23400  1.0 3.0
   97    58    66    72   0.62750  1.0 1.0
   97    58    66    72  -0.30950 -1.0 2.0
   97    58    66    72   0.27300  1.0 3.0
   97    58   -66    75   1.11900  1.0 1.0
   97    58   -66    75  -1.16350 -1.0 2.0
   97    58   -66    75  -0.34150  1.0 3.0
   97    91    95    96   0.30150 -1.0 2.0
   97    91    95   103   0.55300  1.0 1.0
   97    91    95   103   1.25850 -1.0 2.0
   97    91    95   103  -0.23600  1.0 3.0
   97    91    98    99  -0.50000  1.0 1.0
   97    91    98    99  -0.73950 -1.0 2.0
   97    91    98    99   0.17150  1.0 3.0
   98    91    95    96   0.30150 -1.0 2.0
   98    91    95   103   0.55300  1.0 1.0
   98    91    95   103   1.25850 -1.0 2.0
   98    91    95   103  -0.23600  1.0 3.0
   98    91    97    58  -0.81800  1.0 1.0
   53    43    50    51   0.15000  1.0 3.0
   53    43    50    52   0.15000  1.0 3.0
   53    43    50    58   0.56750  1.0 1.0
   53    43    50    58  -0.07550 -1.0 2.0
   53    43    50    58   0.20000  1.0 3.0
   53    43    81    72   0.56750  1.0 1.0
   53    43    81    72  -0.07550 -1.0 2.0
   53    43    81    72   0.20000  1.0 3.0
   53    43    81    82   0.15000  1.0 3.0
   53    43    81    88   0.56750  1.0 1.0
   53    43    81    88  -0.07550 -1.0 2.0
   53    43    81    88   0.20000  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
   35    30    34    36  10.50000 -1.0 2.0
   41    57    46    47  10.50000 -1.0 2.0
   60   100    68    76   1.10000 -1.0 2.0
   85    77    76    68   1.10000 -1.0 2.0
   76    92    85    86  10.50000 -1.0 2.0
   91   103    95    96  10.50000 -1.0 2.0
END
