* LIGAND DATABASE FILE (OPLS2005)
*
001     112   118    228    383     693
    1     0 S   NP   _N1_     1    29.01177    95.04365   -16.76270
    2     1 S   H    _HN1     2     1.03105   111.65335    52.89326
    3     1 S   H    _H1_     3     1.02813    39.35551   143.52082
    4     1 S   H    _H2_     4     1.02738    69.62316   -49.27318
    5     1 S   CT   _CA1     5     1.50260   134.42325  -150.75646
    6     5 S   HC   _HA1     6     1.09600   105.11224    23.50900
    7     5 S   CO3  _C1_     7     1.53809   112.73253   -95.68326
    8     7 S   O2Z  _O11     8     1.26288   115.15088   -32.53024
    9     7 S   O2Z  _O12     9     1.26277   114.94682   146.47864
   10     5 S   CT   _CB1    10     1.53046   106.94325   140.78703
   11    10 S   HC   HB11    11     1.09819   108.83303   -55.13956
   12    10 S   HC   HB12    12     1.09589   110.12659    60.75489
   13    10 S   CT   _CG1    13     1.52915   113.68426  -177.03199
   14    13 S   HC   HG11    14     1.09591   110.04333   -65.67452
   15    13 S   HC   HG12    15     1.09611   110.34278    53.66470
   16    13 S   C    _CD1    16     1.51903   112.14116   173.66209
   17    16 S   O    _OE1    17     1.22743   123.08646   -17.00461
   18    16 S   N    _N2_    18     1.38580   111.83315   164.16218
   19    18 S   H    _HN2    19     1.01599   118.91692    -0.02798
   20    18 S   CT1  _CA2    20     1.46388   123.62204  -179.56389
   21    20 S   HC   _HA2    21     1.09750   109.25281   -20.00244
   22    20 S   C    _C2_    22     1.53472   107.93964  -135.45187
   23    22 S   O    _O2_    23     1.22989   122.38849  -145.03546
   24    20 S   CT   _CB2    32     1.53832   111.44088   102.44869
   25    24 S   HC   HB21    33     1.09097   108.62884    51.93077
   26    24 S   HC   HB22    34     1.09299   109.96609   170.10246
   27    22 S   N    _N3_    24     1.38555   113.22486    42.30585
   28    27 S   H    _HN3    25     1.01539   118.90960    -0.48335
   29    24 S   S    _SG2    35     1.83017   110.74272   -70.66495
   30    27 S   CT   _CA3    26     1.45452   123.43854   175.13647
   31    30 S   HC   HA31    27     1.09524   109.21015    24.56455
   32    30 S   HC   HA32    28     1.09494   107.11384   141.57282
   33    29 S   CT   _C29    36     1.93639   104.24357   161.78077
   34    30 S   CO3  _C3_    29     1.52936   113.19589   -98.89428
   35    34 S   O2Z  _O31    30     1.26398   115.45961   -42.85506
   36    34 S   O2Z  _O32    31     1.26363   114.94790   138.10605
   37    33 S   CT   _C19    37     1.59871   105.69609  -174.36344
   38    37 S   HC   _H60    38     1.10054   105.71749   -36.67449
   39    33 S   CT   _C22    86     1.56213   106.92008   -58.24673
   40    39 S   HC   _H63    87     1.09221   110.94792    63.89651
   41    37 S   CT   _C17    39     1.54936   113.74344  -150.48998
   42    41 S   HC   _H58    40     1.09067   111.92450   -76.76251
   43    37 S   CT   _C27    70     1.62752   115.13585    79.89075
   44    39 S   OH   _O40    88     1.42409   109.86092   178.18576
   45    44 S   HO   _H76    89     0.97296   108.00905  -175.28582
   46    41 S   CO4  _C8_    41     1.51578   114.65394    43.92105
   47    46 S   O    _O34    42     1.23175   121.24045   125.59945
   48    41 S   OH   _O39    68     1.42545   110.24839   164.86508
   49    48 S   HO   _H75    69     0.97286   107.90818   -63.92750
   50    43 S   CT   _C15    71     1.56333   109.15615  -136.16893
   51    50 S   HC   _H55    72     1.09891   109.80980    52.21417
   52    50 S   HC   _H56    73     1.09613   111.02181   -63.63538
   53    43 S   CT   _C32   109     1.55877   112.51035   104.44411
   54    53 S   HC   _H72   110     1.09162   112.40204   -54.19810
   55    53 S   HC   _H73   111     1.09273   113.02744  -173.96337
   56    53 S   HC   _H74   112     1.09457   111.82073    67.52337
   57    46 S   CT   _C25    43     1.53230   116.27618   -57.47611
   58    50 S   CT   _C21    74     1.53447   113.39503   173.74301
   59    58 S   HC   _H62    75     1.09622   109.51493    67.09553
   60    57 S   CT   _C16    44     1.57706   109.94800   167.74824
   61    60 S   HC   _H57    45     1.09874   110.28139    39.44544
   62    57 S   CT   _C31    64     1.53393   107.40072   -72.64187
   63    62 S   HC   _H69    65     1.09351   112.80675   171.03240
   64    62 S   HC   _H70    66     1.08942   113.65107    48.10892
   65    62 S   HC   _H71    67     1.09700   109.99780   -68.51638
   66    58 S   CT   _C20    76     1.52596   111.32250   -55.65483
   67    66 S   HC   _H61    77     1.09783   109.52308   -64.23044
   68    60 S   CM   _C5_    46     1.51613   117.82084   160.34886
   69    60 S   CT   _C11    55     1.53188   103.16396   -74.73031
   70    69 S   HC   _H47    56     1.09508   114.21500  -146.38540
   71    69 S   HC   _H48    57     1.09781   109.77227    95.36791
   72    66 S   CT   _C13    78     1.52773   111.60929    55.89993
   73    72 S   HC   _H51    79     1.09696   108.93388  -176.01017
   74    72 S   HC   _H52    80     1.09529   110.91929    69.02621
   75    66 S   OS   _O36    90     1.42977   109.25732   177.67115
   76    68 S   CM   _C4_    47     1.33371   129.23082    92.67713
   77    76 S   HC   _H42    48     1.07644   128.73111    -2.82743
   78    69 S   CT   _C12    58     1.52809   106.74829   -22.46489
   79    78 S   HC   _H49    59     1.09646   107.30978   118.89587
   80    78 S   HC   _H50    60     1.09488   108.24672  -124.31139
   81    43 S   CT   _C18    81     1.55490   111.15286   -18.15571
   82    81 S   HC   _H59    82     1.09265   107.43068   -61.21730
   83    75 S   CO   _C24    91     1.43965   111.10344    61.00721
   84    83 S   HC   _H65    92     1.09691   105.77043  -174.53862
   85    76 S   CO4  _C6_    49     1.46217   107.46817   176.75140
   86    85 S   O    _O30    50     1.21847   125.09475   178.97054
   87    33 S   CT   _C28    61     1.60961   106.81660    65.57984
   88    81 S   CT   _C14    83     1.53284   112.56396    57.17503
   89    88 S   HC   _H53    84     1.09731   109.71117    85.17957
   90    88 S   HC   _H54    85     1.09846   107.52222  -160.17719
   91    83 S   CO   _C26    93     1.54500   110.17631   -55.58604
   92    85 S   OS   _O35    51     1.36137   108.98713    -1.32264
   93    87 S   OH   _O42    62     1.43490   108.00728   -80.61185
   94    93 S   HO   _H78    63     0.97145   108.51192   -68.80294
   95    91 S   CO4  _C7_    94     1.52329   109.58793   168.81477
   96    95 S   O    _O33    95     1.23067   122.31457   138.74461
   97    58 S   OS   _O37   106     1.43341   109.22016  -175.56513
   98    91 S   OH   _O41   107     1.42167   109.36062   -71.75568
   99    98 S   HO   _H77   108     0.97314   107.21673  -161.15629
  100    68 S   CT   _C9_    52     1.48543   120.79747   -92.50708
  101   100 S   HC   _H43    53     1.09417   112.05686   -59.23311
  102   100 S   HC   _H44    54     1.09182   113.23083    65.45141
  103    95 S   CT   _C10    96     1.50695   116.11352   -44.10243
  104   103 S   HC   _H45    97     1.09475   109.39516   171.92110
  105   103 S   HC   _H46    98     1.09561   107.67452   -69.93210
  106   103 S   CT   _C23    99     1.52204   108.09395    50.97127
  107   106 S   HC   _H64   100     1.09757   110.84930    61.03697
  108    83 S   OS   _O38   101     1.43605   109.87128    69.36862
  109   106 S   CT   _C30   102     1.52204   110.78275  -177.95254
  110   109 S   HC   _H66   103     1.09566   111.08023    62.52894
  111   109 S   HC   _H67   104     1.09422   111.35723   -58.94327
  112   109 S   HC   _H68   105     1.09475   110.34549  -179.36789
  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
    9     5     7     8  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    34    35  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
