* LIGAND DATABASE FILE (OPLS2005)
*
001     116   119    213    324     608
    1     0 S   NP   _N1_     1    29.09421    97.69126   -22.08538
    2     1 S   H    _HN1     2     1.02946    67.87359    13.71855
    3     1 S   H    _H1_     3     1.02826    44.94393   162.69203
    4     1 S   H    _H2_     4     1.02786   100.15947   -92.10562
    5     1 S   CT   _CA1     5     1.50116   145.59894   107.87645
    6     5 S   HC   _HA1     6     1.09572   105.19427    97.41166
    7     5 S   CO3  _C1_     7     1.53797   112.40666   -22.83636
    8     7 S   O2Z  _O11     8     1.26377   115.00939   -43.55046
    9     7 S   O2Z  _O12     9     1.26234   114.95470   135.51317
   10     5 S   CT   _CB1    10     1.53075   107.40889  -144.60223
   11    10 S   HC   HB11    11     1.09834   109.41628   -49.36475
   12    10 S   HC   HB12    12     1.09811   110.44939    67.26025
   13    10 S   CT   _CG1    13     1.52979   112.57782  -170.30511
   14    13 S   HC   HG11    14     1.09586   110.65784   -65.27903
   15    13 S   HC   HG12    15     1.09674   109.77487    53.93295
   16    13 S   C    _CD1    16     1.51808   112.18612   174.43965
   17    16 S   O    _OE1    17     1.22735   123.26360     8.00190
   18    16 S   N    _N2_    18     1.38454   111.61129  -172.22352
   19    18 S   H    _HN2    19     1.01745   119.17716     2.51886
   20    18 S   CT1  _CA2    20     1.46197   123.80475   177.74554
   21    20 S   HC   _HA2    21     1.09743   109.52063    -0.06256
   22    20 S   C    _C2_    22     1.53576   108.25623  -115.18769
   23    22 S   O    _O2_    23     1.23019   122.62470  -146.07930
   24    20 S   CT   _CB2    32     1.53347   110.95905   122.21726
   25    24 S   HC   HB21    33     1.09376   109.90314    49.94914
   26    24 S   HC   HB22    34     1.09015   109.59502   169.15966
   27    22 S   N    _N3_    24     1.38398   113.54877    40.98428
   28    27 S   H    _HN3    25     1.01569   119.49756    -3.28432
   29    24 S   S    _SG2    35     1.83149   110.69802   -71.73408
   30    27 S   CT   _CA3    26     1.45240   123.09578   178.38553
   31    30 S   HC   HA31    27     1.09542   107.55426   -65.67542
   32    30 S   HC   HA32    28     1.09576   107.94377    50.76244
   33    29 S   CT   _C9_    36     1.82670   102.51412   170.82977
   34    30 S   CO3  _C3_    29     1.52950   114.04727   172.83831
   35    34 S   O2Z  _O31    30     1.26387   116.11006     3.87677
   36    34 S   O2Z  _O32    31     1.26436   114.45357  -176.13011
   37    33 S   CM   _C6_    37     1.50738   113.40989   -60.30559
   38    33 S   CT   _C10   113     1.52773   109.84937   172.52853
   39    38 S   HC   _H8_   114     1.09617   111.93389   -58.87788
   40    38 S   HC   _H9_   115     1.09708   111.27027  -178.02345
   41    38 S   HC   _H10   116     1.09604   111.82748    61.77024
   42    37 S   CMA  _C7_    38     1.35072   110.37084   118.63353
   43    42 S   OM   _O38    39     1.25768   132.99866   179.36326
   44    37 S   CT   _C5_   106     1.50270   123.13553   -61.34366
   45    44 S   HC   _H6_   107     1.09533   110.44132    26.51881
   46    44 S   HC   _H7_   108     1.09665   109.68444   142.41829
   47    42 S   NI   _N4_    40     1.37965   111.41680    -0.24866
   48    44 S   CT   _C4_   109     1.52225   112.90815   -96.09836
   49    48 S   HC   _H3_   110     1.09497   111.39875   -59.57744
   50    48 S   HC   _H4_   111     1.09490   109.98341  -179.00771
   51    48 S   HC   _H5_   112     1.09384   111.72445    61.40347
   52    33 S   CD   _C8_    41     1.52103   112.38190    47.44889
   53    52 S   CM   _C11    42     1.48848   120.65032    61.69263
   54    53 S   HC   _H11    43     1.08261   116.52059    42.57412
   55    53 S   CMA  _C12    44     1.34757   120.55674  -133.47858
   56    55 S   CM   _C33    45     1.45804   121.95535   176.55440
   57    56 S   CM   _C32    46     1.34136   107.70285  -177.35462
   58    56 S   CT   _C34   102     1.49173   123.92141     1.82199
   59    58 S   HC   _H33   103     1.09526   110.63937   -57.89487
   60    58 S   HC   _H34   104     1.09332   112.61512  -177.31015
   61    58 S   HC   _H35   105     1.09499   110.58015    62.49178
   62    57 S   CMA  _C13    47     1.46547   107.51376    -0.27124
   63    57 S   CT   _C35    93     1.50181   126.96802  -178.55599
   64    63 S   HC   _H36    94     1.09690   109.81843    25.56428
   65    63 S   HC   _H37    95     1.09683   110.38516   139.95243
   66    55 S   NM   _N5_    48     1.35953   130.33466    -2.06507
   67    62 S   CM   _C14    49     1.35257   122.09787   178.78260
   68    67 S   HC   _H12    50     1.08572   119.53994    -1.05684
   69    63 S   CT   _C36    96     1.52712   112.29559   -96.13316
   70    69 S   HC   _H38    97     1.09695   110.14825   -62.80344
   71    69 S   HC   _H39    98     1.09786   109.59185    54.77779
   72    67 S   C5A  _C15    51     1.42862   125.26236   179.06309
   73    69 S   CO3  _C37    99     1.53214   114.82169   175.75209
   74    73 S   O2Z  _O37   100     1.26550   114.08769  -173.68223
   75    73 S   O2Z  _O36   101     1.26156   116.74705     6.20504
   76    72 S   C5BC _C16    52     1.39111   132.10949   177.00226
   77    76 S   C5BC _C17    53     1.43791   107.45580   177.77358
   78    76 S   CT   _C29    84     1.50098   126.83698    -1.08643
   79    78 S   HC   _H29    85     1.09711   109.73822    33.53665
   80    78 S   HC   _H30    86     1.09738   109.14005   148.80829
   81    77 S   C5A  _C18    54     1.38361   107.07432     0.20748
   82    77 S   CT   _C28    80     1.48809   126.24982  -178.77635
   83    82 S   HC   _H26    81     1.09462   110.18889    72.34365
   84    82 S   HC   _H27    82     1.09453   111.71730  -167.44347
   85    82 S   HC   _H28    83     1.09463   110.67147   -47.62981
   86    78 S   CT   _C30    87     1.52546   112.36592   -89.06221
   87    86 S   HC   _H31    88     1.09754   109.74160    62.49450
   88    86 S   HC   _H32    89     1.09767   109.80708   -54.66103
   89    72 S   NA   _N6_    55     1.37677   120.92664    -4.31765
   90    89 S   H    _H13    56     1.01281   124.15141     0.18975
   91    81 S   CM   _C19    57     1.41712   133.08871  -174.65617
   92    91 S   HC   _H14    58     1.08466   115.37808    58.32289
   93    86 S   CO3  _C31    90     1.53147   114.78946  -175.90184
   94    93 S   O2Z  _O35    91     1.26530   114.11622   177.69386
   95    93 S   O2Z  _O34    92     1.26160   116.71517    -2.05147
   96    91 S   CM   _C20    59     1.34257   124.24541  -116.81423
   97    96 S   CM   _C21    60     1.45960   127.84435   176.96120
   98    97 S   CT   _C24    61     1.53264   107.32701  -162.05369
   99    97 S   CM   _C22    74     1.34647   129.54802    23.09695
  100    99 S   HC   _H15    75     1.08867   117.71729   179.86730
  101    98 S   C    _C25    62     1.52610   101.49833   -14.27202
  102   101 S   O    _O33    63     1.22298   125.38302  -171.64986
  103    98 S   CT   _C26    66     1.53271   111.12213   101.30752
  104   103 S   HC   _H20    67     1.09626   111.00124  -173.61162
  105   103 S   HC   _H21    68     1.09575   111.26853    66.27071
  106   103 S   HC   _H22    69     1.09666   111.76496   -54.31507
  107    98 S   CT   _C27    70     1.53185   114.93873  -131.73604
  108   107 S   HC   _H23    71     1.09637   111.13841   171.45408
  109   107 S   HC   _H24    72     1.09500   111.32363    52.31660
  110   107 S   HC   _H25    73     1.09511   111.83211   -68.61552
  111    99 S   CT   _C23    76     1.49357   128.92875     2.90529
  112   111 S   HC   _H16    77     1.09361   110.52602   -94.06711
  113   111 S   HC   _H17    78     1.09551   109.27600   147.35460
  114   111 S   HC   _H18    79     1.09266   112.74257    29.35357
  115    96 S   N    _N7_    64     1.36710   124.47577     2.84290
  116   115 S   H    _H19    65     1.01487   123.35610    -8.76024
  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  11   5   4   3
  16   2   1   1  16   8   3   2   1   8   3   8   5   4   4   3
   2   1   1   5   7   3  10  12  16   6   2   1   1  10  10   5
   4   3   8   3   5   4   3  11   2   1   1  16  14  11   5   4
  11   5   2   1   1   5   4   3   4   1   8   3   2   1   1  11
  19  15   9   4  11   4   8   3   2   1   4   2   1   1   3   2
   1   1   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    52    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    42    47    52    53    44    38    39    40    41  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    42    43    47    52    53    54    55    44    45    46    48    38    39    40    41  
   35    36  
   36  
    0  
   42    43    47    52    53    44    45    46    48    49    50    51    38    39    40    41  
   39    40    41    42    44    47    52    53  
   40    41    52  
   41    52  
   52  
   43    47    52    53    44    45    46    48  
   47    52    44  
   45    46    48    49    50    51    47    52  
   46    48    49    50    51  
   48    49    50    51  
   52    53    54    55  
   49    50    51  
   50    51  
   51  
    0  
   53    54    55    56    66  
   54    55    56    57    62    66    58  
   55    56    66  
   56    57    62    66    67    63    58    59    60    61  
   57    62    66    67    63    64    65    69    58    59    60    61  
   62    66    67    68    72    63    64    65    69    70    71    73    58    59    60    61  
   59    60    61    62    63    66  
   60    61  
   61  
    0  
   66    67    68    72    76    89    63    64    65    69  
   64    65    69    70    71    73    74    75    66    67  
   65    69    70    71    73  
   69    70    71    73  
   67    68    72  
   68    72    76    77    81    89    90    78  
   72    76    89  
   70    71    73    74    75  
   71    73    74    75  
   73    74    75  
   76    77    81    89    90    91    82    78    79    80    86  
   74    75  
   75  
    0  
   77    81    89    90    91    82    83    84    85    78    79    80    86    87    88    93  
   81    89    90    91    92    96    82    83    84    85    78    79    80    86  
   79    80    86    87    88    93    94    95    81    82    89  
   80    86    87    88    93  
   86    87    88    93  
   89    90    91    92    96    97   115    82    83    84    85  
   83    84    85    89    91  
   84    85  
   85  
    0  
   87    88    93    94    95  
   88    93    94    95  
   93    94    95  
   90    91    92    96  
   91  
   92    96    97    98   101   115   116    99  
   96    97   115  
   94    95  
   95  
    0  
   97    98   101   102   115   116   103   107    99   100   111  
   98   101   102   115   116   103   104   105   106   107   108   109   110    99   100   111   112   113   114  
  101   102   115   116   103   104   105   106   107   108   109   110    99   100   111  
  100   111   112   113   114   101   103   107   115  
  111   112   113   114  
  102   115   116   103   104   105   106   107   108   109   110  
  115   116   103   107  
  104   105   106   107   108   109   110   115  
  105   106   107  
  106   107  
  107  
  108   109   110   115  
  109   110  
  110  
    0  
  112   113   114  
  113   114  
  114  
    0  
  116  
    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   0.203600   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   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760   0.497600   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   44   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.2800   0.1700  -0.912200   1.8540   1.6400   0.005000000   0.000000000
   48   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.7500   0.1050   0.356900   2.0020   1.7750   0.023028004  -0.852763146
   53   3.5500   0.0760  -0.737500   2.0020   1.7750   0.023028004  -0.852763146
   54   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5500   0.0760   1.360900   2.0020   1.7750   0.023028004  -0.852763146
   56   3.5500   0.0760  -0.619200   2.0020   1.7750   0.023028004  -0.852763146
   57   3.5500   0.0760  -0.619200   2.0020   1.7750   0.023028004  -0.852763146
   58   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5500   0.0760   1.360900   2.0020   1.7750   0.023028004  -0.852763146
   63   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.4200   0.1700  -1.245000   1.9310   1.7100   0.005000000   0.000000000
   67   3.5500   0.0760  -0.734200   2.0020   1.7750   0.023028004  -0.852763146
   68   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   72   3.5500   0.0700  -0.008000   2.0020   1.7750   0.001000000  -0.843144165
   73   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   74   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   75   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   76   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   77   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   78   3.5000   0.0660  -0.005000   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   3.5500   0.0700  -0.008000   2.0020   1.7750   0.001000000  -0.843144165
   82   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   88   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   89   3.2500   0.1700  -0.239000   1.8650   1.6500   0.001000000  -0.511443539
   90   0.5000   0.0300   0.317000   0.9960   0.8600   0.030040813  -0.651083722
   91   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   92   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   93   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   94   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   95   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   96   3.5500   0.0760   0.051300   2.0020   1.7750   0.023028004  -0.852763146
   97   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   98   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   99   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
  100   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  101   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
  102   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
  103   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  104   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  108   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  109   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  110   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  112   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  113   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  114   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  115   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
  116   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   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   317.000  1.510
   33    52   270.000  1.508
   33    38   268.000  1.529
   37    42   465.000  1.376
   37    44   317.000  1.510
   42    43   745.000  1.250
   42    47   405.000  1.380
   47    52   500.000  1.261
   52    53   320.000  1.464
   53    54   340.000  1.080
   53    55   465.000  1.376
   55    56   465.000  1.376
   55    66   500.000  1.344
   56    57   549.000  1.340
   56    58   317.000  1.510
   57    62   465.000  1.376
   57    63   317.000  1.510
   62    66   500.000  1.344
   62    67   465.000  1.376
   67    68   340.000  1.080
   67    72   375.000  1.423
   72    76   546.000  1.367
   72    89   427.000  1.381
   76    77   469.000  1.424
   76    78   285.000  1.502
   77    81   546.000  1.367
   77    82   285.000  1.502
   81    89   427.000  1.381
   81    91   375.000  1.423
   89    90   434.000  1.010
   91    92   340.000  1.080
   91    96   549.000  1.340
   96    97   380.000  1.444
   96   115   400.000  1.384
   97    98   317.000  1.510
   97    99   549.000  1.340
   98   101   317.000  1.522
   98   103   268.000  1.529
   98   107   268.000  1.529
  101   102   570.000  1.229
  101   115   490.000  1.335
  115   116   434.000  1.010
  103   104   340.000  1.090
  103   105   340.000  1.090
  103   106   340.000  1.090
  107   108   340.000  1.090
  107   109   340.000  1.090
  107   110   340.000  1.090
   99   100   340.000  1.080
   99   111   317.000  1.510
  111   112   340.000  1.090
  111   113   340.000  1.090
  111   114   340.000  1.090
   82    83   340.000  1.090
   82    84   340.000  1.090
   82    85   340.000  1.090
   78    79   340.000  1.090
   78    80   340.000  1.090
   78    86   268.000  1.529
   86    87   340.000  1.090
   86    88   340.000  1.090
   86    93   317.000  1.522
   93    94   656.000  1.250
   93    95   656.000  1.250
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    69   268.000  1.529
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    73   317.000  1.522
   73    74   656.000  1.250
   73    75   656.000  1.250
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   340.000  1.090
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    48   268.000  1.529
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   340.000  1.090
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    41   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  112.20000
   29    33    52    75.00000  114.43000
   29    33    38    75.00000  111.63000
   33    37    42    70.00000  124.00000
   33    37    44    65.00000  117.92700
   33    52    47    65.00000  122.10100
   33    52    53    65.00000  117.24000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    41    37.50000  110.70000
   37    42    43    65.00000  137.10300
   37    42    47    70.00000  120.83400
   37    44    45    35.00000  109.50000
   37    44    46    35.00000  109.50000
   37    44    48    70.00000  112.02700
   42    47    52    75.00000  115.77100
   47    42    43    65.00000  121.00000
   47    52    53    70.00000  121.86000
   52    33    37    70.00000  110.51600
   52    53    54    40.00000  114.85300
   52    53    55    60.00000  120.31500
   53    55    56    70.00000  123.01800
   53    55    66    65.00000  126.19400
   55    53    54    40.00000  120.50800
   55    56    57    70.00000  117.34000
   55    56    58    70.00000  124.00000
   55    66    62    80.00000  117.00000
   56    57    62    70.00000  117.34000
   56    57    63    70.00000  124.00000
   56    58    59    35.00000  109.50000
   56    58    60    35.00000  109.50000
   56    58    61    35.00000  109.50000
   57    62    66    65.00000  126.19400
   57    62    67    70.00000  123.01800
   57    63    64    35.00000  109.50000
   57    63    65    35.00000  109.50000
   57    63    69    70.00000  112.02700
   62    67    68    40.00000  120.50800
   62    67    72    55.00000  128.24000
   66    55    56    65.00000  126.19400
   67    62    66    65.00000  126.19400
   67    72    76    50.00000  133.16000
   67    72    89    70.00000  120.38000
   72    67    68    40.00000  117.26300
   72    76    77    70.00000  107.30000
   72    76    78    60.00000  130.00000
   72    89    81    70.00000  109.80000
   72    89    90    35.00000  120.00000
   76    77    81    70.00000  107.30000
   76    77    82    60.00000  130.00000
   76    78    79    35.00000  109.50000
   76    78    80    35.00000  109.50000
   76    78    86    70.00000  112.17500
   77    81    89    70.00000  107.70000
   77    81    91    50.00000  133.16000
   77    82    83    35.00000  109.50000
   77    82    84    35.00000  109.50000
   77    82    85    35.00000  109.50000
   81    89    90    35.00000  120.00000
   81    91    92    40.00000  117.26300
   81    91    96    55.00000  128.24000
   89    72    76    70.00000  107.70000
   91    81    89    70.00000  120.38000
   91    96    97    70.00000  123.01800
   91    96   115    75.00000  120.83300
   96    91    92    35.00000  120.00000
   96    97    98    70.00000  124.00000
   96    97    99    70.00000  123.01800
   96   115   101    70.00000  120.89900
   96   115   116    45.00000  117.55000
   97    98   101    70.00000  115.00700
   97    98   103    70.00000  112.02700
   97    98   107    70.00000  112.02700
   97    99   100    35.00000  120.00000
   97    99   111    70.00000  124.00000
   98   101   102    80.00000  120.40000
   98   101   115    70.00000  116.60000
   98   103   104    37.50000  110.70000
   98   103   105    37.50000  110.70000
   98   103   106    37.50000  110.70000
   98   107   108    37.50000  110.70000
   98   107   109    37.50000  110.70000
   98   107   110    37.50000  110.70000
  101   115   116    35.00000  119.80000
  115    96    97    75.00000  120.83300
  115   101   102    80.00000  122.90000
  103    98   101    63.00000  111.10000
  105   103   104    33.00000  107.80000
  106   103   104    33.00000  107.80000
  106   103   105    33.00000  107.80000
  107    98   101    63.00000  111.10000
  107    98   103    58.35000  112.70000
  109   107   108    33.00000  107.80000
  110   107   108    33.00000  107.80000
  110   107   109    33.00000  107.80000
   99    97    98    70.00000  124.00000
   99   111   112    35.00000  109.50000
   99   111   113    35.00000  109.50000
   99   111   114    35.00000  109.50000
  111    99   100    35.00000  117.00000
  113   111   112    33.00000  107.80000
  114   111   112    33.00000  107.80000
  114   111   113    33.00000  107.80000
   82    77    81    60.00000  130.00000
   84    82    83    33.00000  107.80000
   85    82    83    33.00000  107.80000
   85    82    84    33.00000  107.80000
   78    76    77    60.00000  130.00000
   78    86    87    37.50000  110.70000
   78    86    88    37.50000  110.70000
   78    86    93    70.00000  109.69300
   80    78    79    33.00000  107.80000
   86    78    79    37.50000  110.70000
   86    78    80    37.50000  110.70000
   86    93    94    70.00000  117.00000
   86    93    95    70.00000  117.00000
   88    86    87    33.00000  107.80000
   93    86    87    35.00000  109.50000
   93    86    88    35.00000  109.50000
   95    93    94    80.00000  126.00000
   63    57    62    70.00000  124.00000
   63    69    70    37.50000  110.70000
   63    69    71    37.50000  110.70000
   63    69    73    70.00000  109.69300
   65    63    64    33.00000  107.80000
   69    63    64    37.50000  110.70000
   69    63    65    37.50000  110.70000
   69    73    74    70.00000  117.00000
   69    73    75    70.00000  117.00000
   71    69    70    33.00000  107.80000
   73    69    70    35.00000  109.50000
   73    69    71    35.00000  109.50000
   75    73    74    80.00000  126.00000
   58    56    57    70.00000  124.00000
   60    58    59    33.00000  107.80000
   61    58    59    33.00000  107.80000
   61    58    60    33.00000  107.80000
   44    37    42    70.00000  124.00000
   44    48    49    37.50000  110.70000
   44    48    50    37.50000  110.70000
   44    48    51    37.50000  110.70000
   46    44    45    33.00000  107.80000
   48    44    45    37.50000  110.70000
   48    44    46    37.50000  110.70000
   50    48    49    33.00000  107.80000
   51    48    49    33.00000  107.80000
   51    48    50    33.00000  107.80000
   38    33    37    70.00000  112.02700
   38    33    52    70.00000  111.76100
   40    38    39    33.00000  107.80000
   41    38    39    33.00000  107.80000
   41    38    40    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    52  -0.62250  1.0 1.0
   24    29    33    52  -0.38450 -1.0 2.0
   24    29    33    52   0.81900  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    42   0.42700  1.0 1.0
   29    33    37    42  -0.70350 -1.0 2.0
   29    33    37    42  -0.43150  1.0 3.0
   29    33    37    44   0.30250  1.0 1.0
   29    33    37    44  -0.14950 -1.0 2.0
   29    33    37    44   0.36900  1.0 3.0
   29    33    52    47   0.00000  1.0 1.0
   29    33    52    53   0.42700  1.0 1.0
   29    33    52    53  -0.70350 -1.0 2.0
   29    33    52    53  -0.43150  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.15000  1.0 3.0
   33    37    42    43   7.00000 -1.0 2.0
   33    37   -42    47   7.00000 -1.0 2.0
   33    37    44    45   0.34800  1.0 3.0
   33    37    44    46   0.34800  1.0 3.0
   33    37    44    48   0.46850  1.0 1.0
   33    37    44    48   0.08550 -1.0 2.0
   33    37    44    48   0.09800  1.0 3.0
   33    52    53    54   0.00000  1.0 1.0
   33    52    53    55   0.69550 -1.0 2.0
   37    33   -52    47   0.00000  1.0 1.0
   37    33    52    53  -0.28300  1.0 1.0
   37    33    52    53   0.26700 -1.0 2.0
   37    33    52    53  -0.63300  1.0 3.0
   37    33    38    39   0.15000  1.0 3.0
   37    33    38    40   0.15000  1.0 3.0
   37    33    38    41   0.15000  1.0 3.0
   37    42   -47    52   0.00000  1.0 1.0
   37    44    48    49   0.15000  1.0 3.0
   37    44    48    50   0.15000  1.0 3.0
   37    44    48    51   0.15000  1.0 3.0
   42    37    44    45   0.00000  1.0 1.0
   42    37    44    46   0.00000  1.0 1.0
   42    37    44    48   0.09850  1.0 1.0
   42    37    44    48   0.15250 -1.0 2.0
   42    37    44    48  -0.50650  1.0 3.0
   42    47   -52    33   6.00000 -1.0 2.0
   42    47    52    53   6.00000 -1.0 2.0
   43    42    47    52   0.00000  1.0 1.0
   47    52    53    54   1.00600 -1.0 2.0
   47    52    53    55   1.09650  1.0 1.0
   47    52    53    55   0.48950 -1.0 2.0
   47    52    53    55   0.49400  1.0 3.0
   52    33   -37    42  -0.28300  1.0 1.0
   52    33   -37    42   0.26700 -1.0 2.0
   52    33   -37    42  -0.63300  1.0 3.0
   52    33    37    44   0.09700  1.0 1.0
   52    33    37    44   0.15600 -1.0 2.0
   52    33    37    44  -0.50800  1.0 3.0
   52    33    38    39   0.15000  1.0 3.0
   52    33    38    40   0.15000  1.0 3.0
   52    33    38    41   0.15000  1.0 3.0
   52    53    55    56   7.00000 -1.0 2.0
   52    53    55    66   7.00000 -1.0 2.0
   53    55    56    57   7.00000 -1.0 2.0
   53    55    56    58   7.00000 -1.0 2.0
   53    55    66    62   0.00000  1.0 1.0
   54    53    55    56   7.00000 -1.0 2.0
   54    53    55    66   7.00000 -1.0 2.0
   55    56   -57    62   7.00000 -1.0 2.0
   55    56    57    63   7.00000 -1.0 2.0
   55    56    58    59   0.00000  1.0 1.0
   55    56    58    60   0.00000  1.0 1.0
   55    56    58    61   0.00000  1.0 1.0
   56    55   -66    62   0.00000  1.0 1.0
   56    57   -62    66   7.00000 -1.0 2.0
   56    57    62    67   7.00000 -1.0 2.0
   56    57    63    64   0.00000  1.0 1.0
   56    57    63    65   0.00000  1.0 1.0
   56    57    63    69   0.09850  1.0 1.0
   56    57    63    69   0.15250 -1.0 2.0
   56    57    63    69  -0.50650  1.0 3.0
   57    56    58    59   0.00000  1.0 1.0
   57    56    58    60   0.00000  1.0 1.0
   57    56    58    61   0.00000  1.0 1.0
   57    62   -66    55   0.00000  1.0 1.0
   57    62    67    68   7.00000 -1.0 2.0
   57    62    67    72   7.00000 -1.0 2.0
   57    63    69    70   0.15000  1.0 3.0
   57    63    69    71   0.15000  1.0 3.0
   57    63    69    73  -0.98800  1.0 1.0
   57    63    69    73   0.48800 -1.0 2.0
   57    63    69    73   0.76800  1.0 3.0
   62    57    63    64   0.00000  1.0 1.0
   62    57    63    65   0.00000  1.0 1.0
   62    57    63    69   0.09850  1.0 1.0
   62    57    63    69   0.15250 -1.0 2.0
   62    57    63    69  -0.50650  1.0 3.0
   62    67    72    76   0.15800  1.0 1.0
   62    67    72    76   1.85350 -1.0 2.0
   62    67    72    76  -0.48700  1.0 3.0
   62    67    72    89   0.11450  1.0 1.0
   62    67    72    89   1.85100 -1.0 2.0
   62    67    72    89  -0.49050  1.0 3.0
   66    55   -56    57   7.00000 -1.0 2.0
   66    55    56    58   7.00000 -1.0 2.0
   66    62    67    68   7.00000 -1.0 2.0
   66    62    67    72   7.00000 -1.0 2.0
   67    62    66    55   0.00000  1.0 1.0
   67    72    76    77   3.62500 -1.0 2.0
   67    72    76    78   3.62500 -1.0 2.0
   67    72    89    81   3.62500 -1.0 2.0
   67    72    89    90   2.00000 -1.0 2.0
   68    67    72    76   0.56550  1.0 3.0
   68    67    72    89   0.54250  1.0 3.0
   72    76   -77    81   3.62500 -1.0 2.0
   72    76    77    82   3.62500 -1.0 2.0
   72    76    78    79   0.00000  1.0 1.0
   72    76    78    80   0.00000  1.0 1.0
   72    76    78    86   0.04150 -1.0 2.0
   76    72   -89    81   3.62500 -1.0 2.0
   76    72    89    90   2.00000 -1.0 2.0
   76    77   -81    89   3.62500 -1.0 2.0
   76    77    81    91   3.62500 -1.0 2.0
   76    77    82    83   0.00000  1.0 1.0
   76    77    82    84   0.00000  1.0 1.0
   76    77    82    85   0.00000  1.0 1.0
   76    78    86    87   0.43200  1.0 3.0
   76    78    86    88   0.43200  1.0 3.0
   76    78    86    93  -2.95950  1.0 1.0
   76    78    86    93   0.02300  1.0 3.0
   77    76    78    79   0.00000  1.0 1.0
   77    76    78    80   0.00000  1.0 1.0
   77    76    78    86   0.04150 -1.0 2.0
   77    81   -89    72   3.62500 -1.0 2.0
   77    81    89    90   2.00000 -1.0 2.0
   77    81    91    92   0.56550  1.0 3.0
   77    81    91    96   0.15800  1.0 1.0
   77    81    91    96   1.85350 -1.0 2.0
   77    81    91    96  -0.48700  1.0 3.0
   81    77    82    83   0.00000  1.0 1.0
   81    77    82    84   0.00000  1.0 1.0
   81    77    82    85   0.00000  1.0 1.0
   81    91    96    97   7.00000 -1.0 2.0
   81    91    96   115   7.00000 -1.0 2.0
   89    72   -76    77   3.62500 -1.0 2.0
   89    72    76    78   3.62500 -1.0 2.0
   89    81    91    92   0.54250  1.0 3.0
   89    81    91    96   0.11450  1.0 1.0
   89    81    91    96   1.85100 -1.0 2.0
   89    81    91    96  -0.49050  1.0 3.0
   91    81    89    72   3.62500 -1.0 2.0
   91    81    89    90   2.00000 -1.0 2.0
   91    96    97    98  -0.18600  1.0 3.0
   91    96    97    99   0.28850  1.0 1.0
   91    96    97    99   2.61350 -1.0 2.0
   91    96    97    99   0.78400  1.0 3.0
   91    96   115   101  -0.18900  1.0 1.0
   91    96   115   101   1.70900 -1.0 2.0
   91    96   115   116   0.78350 -1.0 2.0
   92    91    96    97   7.00000 -1.0 2.0
   92    91    96   115   7.00000 -1.0 2.0
   96    97   -98   101  -0.51250  1.0 1.0
   96    97   -98   101  -0.88800 -1.0 2.0
   96    97   -98   101   0.08850  1.0 3.0
   96    97    98   103   0.98200  1.0 1.0
   96    97    98   103  -0.11900 -1.0 2.0
   96    97    98   103   0.24250  1.0 3.0
   96    97    98   107   0.98200  1.0 1.0
   96    97    98   107  -0.11900 -1.0 2.0
   96    97    98   107   0.24250  1.0 3.0
   96    97    99   100   7.00000 -1.0 2.0
   96    97    99   111   7.00000 -1.0 2.0
   97    96  -115   101  -0.18900  1.0 1.0
   97    96  -115   101   1.70900 -1.0 2.0
   97    96   115   116   0.78350 -1.0 2.0
   97    98   101   102   0.30150 -1.0 2.0
   97    98  -101   115   0.00000  1.0 1.0
   97    98   103   104   0.15000  1.0 3.0
   97    98   103   105   0.15000  1.0 3.0
   97    98   103   106   0.15000  1.0 3.0
   97    98   107   108   0.15000  1.0 3.0
   97    98   107   109   0.15000  1.0 3.0
   97    98   107   110   0.15000  1.0 3.0
   97    99   111   112   0.00000  1.0 1.0
   97    99   111   113   0.00000  1.0 1.0
   97    99   111   114   0.00000  1.0 1.0
   98    97    99   100   7.00000 -1.0 2.0
   98    97    99   111   7.00000 -1.0 2.0
   98   101  -115    96   0.67100  1.0 1.0
   98   101  -115    96   1.42150 -1.0 2.0
   98   101  -115    96   0.18700  1.0 3.0
   98   101   115   116   2.45000 -1.0 2.0
  101    98   103   104  -0.11250  1.0 3.0
  101    98   103   105  -0.11250  1.0 3.0
  101    98   103   106  -0.11250  1.0 3.0
  101    98   107   108  -0.11250  1.0 3.0
  101    98   107   109  -0.11250  1.0 3.0
  101    98   107   110  -0.11250  1.0 3.0
  102   101   115    96   2.67200 -1.0 2.0
  102   101   115   116   2.45000 -1.0 2.0
  115    96   -97    98   1.08500 -1.0 2.0
  115    96    97    99  -0.18600  1.0 3.0
  103    98   101   102   0.30150 -1.0 2.0
  103    98   101   115   1.39750  1.0 1.0
  103    98   101   115  -0.07950 -1.0 2.0
  103    98   101   115  -0.18750  1.0 3.0
  103    98   107   108   0.15000  1.0 3.0
  103    98   107   109   0.15000  1.0 3.0
  103    98   107   110   0.15000  1.0 3.0
  107    98   101   102   0.30150 -1.0 2.0
  107    98   101   115   1.39750  1.0 1.0
  107    98   101   115  -0.07950 -1.0 2.0
  107    98   101   115  -0.18750  1.0 3.0
  107    98   103   104   0.15000  1.0 3.0
  107    98   103   105   0.15000  1.0 3.0
  107    98   103   106   0.15000  1.0 3.0
   99    97    98   101  -0.51250  1.0 1.0
   99    97    98   101  -0.88800 -1.0 2.0
   99    97    98   101   0.08850  1.0 3.0
   99    97    98   103   0.09850  1.0 1.0
   99    97    98   103   0.15250 -1.0 2.0
   99    97    98   103  -0.50650  1.0 3.0
   99    97    98   107   0.09850  1.0 1.0
   99    97    98   107   0.15250 -1.0 2.0
   99    97    98   107  -0.50650  1.0 3.0
  100    99   111   112   0.33100  1.0 3.0
  100    99   111   113   0.33100  1.0 3.0
  100    99   111   114   0.33100  1.0 3.0
   82    77    81    89   3.62500 -1.0 2.0
   82    77    81    91   3.62500 -1.0 2.0
   78    76    77    81   3.62500 -1.0 2.0
   78    76    77    82   3.62500 -1.0 2.0
   78    86    93    94   0.41150 -1.0 2.0
   78    86    93    95   0.41150 -1.0 2.0
   79    78    86    87   0.15000  1.0 3.0
   79    78    86    88   0.15000  1.0 3.0
   79    78    86    93  -0.11250  1.0 3.0
   80    78    86    87   0.15000  1.0 3.0
   80    78    86    88   0.15000  1.0 3.0
   80    78    86    93  -0.11250  1.0 3.0
   87    86    93    94   0.00000  1.0 1.0
   87    86    93    95   0.00000  1.0 1.0
   88    86    93    94   0.00000  1.0 1.0
   88    86    93    95   0.00000  1.0 1.0
   63    57    62    66   7.00000 -1.0 2.0
   63    57    62    67   7.00000 -1.0 2.0
   63    69    73    74   0.41150 -1.0 2.0
   63    69    73    75   0.41150 -1.0 2.0
   64    63    69    70   0.15000  1.0 3.0
   64    63    69    71   0.15000  1.0 3.0
   64    63    69    73  -0.11250  1.0 3.0
   65    63    69    70   0.15000  1.0 3.0
   65    63    69    71   0.15000  1.0 3.0
   65    63    69    73  -0.11250  1.0 3.0
   70    69    73    74   0.00000  1.0 1.0
   70    69    73    75   0.00000  1.0 1.0
   71    69    73    74   0.00000  1.0 1.0
   71    69    73    75   0.00000  1.0 1.0
   58    56    57    62   7.00000 -1.0 2.0
   58    56    57    63   7.00000 -1.0 2.0
   44    37    42    43   7.00000 -1.0 2.0
   44    37    42    47   7.00000 -1.0 2.0
   45    44    48    49   0.15000  1.0 3.0
   45    44    48    50   0.15000  1.0 3.0
   45    44    48    51   0.15000  1.0 3.0
   46    44    48    49   0.15000  1.0 3.0
   46    44    48    50   0.15000  1.0 3.0
   46    44    48    51   0.15000  1.0 3.0
   38    33    37    42   0.09850  1.0 1.0
   38    33    37    42   0.15250 -1.0 2.0
   38    33    37    42  -0.50650  1.0 3.0
   38    33    37    44   0.46850  1.0 1.0
   38    33    37    44   0.08550 -1.0 2.0
   38    33    37    44   0.09800  1.0 3.0
   38    33    52    47   0.00000  1.0 1.0
   38    33    52    53   0.09850  1.0 1.0
   38    33    52    53   0.15250 -1.0 2.0
   38    33    52    53  -0.50650  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
   33    44    37    42   1.10000 -1.0 2.0
   47    43    42    37   1.10000 -1.0 2.0
   33    53    52    47  10.50000 -1.0 2.0
   52    54    53    55   1.10000 -1.0 2.0
   56    66    55    53   1.10000 -1.0 2.0
   55    58    56    57   1.10000 -1.0 2.0
   62    63    57    56   1.10000 -1.0 2.0
   57    66    62    67   1.10000 -1.0 2.0
   72    68    67    62   1.10000 -1.0 2.0
   76    89    72    67   4.00000 -1.0 2.0
   77    78    76    72   4.00000 -1.0 2.0
   81    82    77    76   4.00000 -1.0 2.0
   91    89    81    77   4.00000 -1.0 2.0
   90    72    89    81   1.00000 -1.0 2.0
   81    92    91    96   1.10000 -1.0 2.0
   97   115    96    91   1.10000 -1.0 2.0
   96    98    97    99   1.10000 -1.0 2.0
   98   115   101   102  10.50000 -1.0 2.0
  116   101   115    96   1.00000 -1.0 2.0
  111   100    99    97   1.10000 -1.0 2.0
   94    86    93    95  10.50000 -1.0 2.0
   74    69    73    75  10.50000 -1.0 2.0
END
