* LIGAND DATABASE FILE (OPLS2005)
*
001     102   105    193    310     579
    1     0 S   NP   _N1_     1    28.70111    93.89000   -20.80213
    2     1 S   H    _HN1     2     1.02068   104.03580   -36.23595
    3     1 S   H    _H1_     3     1.02137    69.63385    68.78540
    4     1 S   H    _H2_     4     1.02167    43.53881  -138.75491
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.05972   107.41041    47.01581
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74439
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98761
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34015   114.76575   162.47883
   19    18 S   H    _HN2    19     1.04748   118.84952     8.59075
   20    18 S   CT1  _CA2    20     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    21     1.08457   106.27517   -11.11459
   22    20 S   C    _C2_    22     1.54037   112.60135  -130.27230
   23    22 S   O    _O2_    23     1.23085   119.01196  -169.64989
   24    20 S   CT   _CB2    32     1.54652   109.46586   105.32504
   25    24 S   HC   HB21    33     1.08491   110.56590    58.77998
   26    24 S   HC   HB22    34     1.08612   109.94660   179.13182
   27    22 S   N    _N3_    24     1.34263   118.97449    10.45205
   28    27 S   H    _HN3    25     1.03492   120.05970     5.06898
   29    24 S   S    _SG2    35     1.81647   112.43692   -61.22029
   30    27 S   CT   _CA3    26     1.46098   124.53040  -172.10345
   31    30 S   HC   HA31    27     1.12298   109.15732    14.31071
   32    30 S   HC   HA32    28     1.12301   109.23063   127.81991
   33    29 S   CT   _C21    36     1.84751    97.40314   161.87126
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13160
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33884
   37    33 S   CM   _C8_    37     1.50196   110.18293  -179.97202
   38    33 S   CT   _C16    59     1.54294   109.36928    47.43939
   39    38 S   HC   _H45    60     1.09918   108.48585    60.06579
   40    38 S   HC   _H46    61     1.10043   108.13214   -53.09878
   41    37 S   CMA  _C9_    38     1.35313   110.86654   112.47612
   42    41 S   OM   _O27    39     1.26400   129.06199  -178.44380
   43    37 S   CT   _C18    43     1.53405   120.69684   -62.79468
   44    43 S   HC   _H48    44     1.09965   107.30501     7.12709
   45    41 S   OS   _O34    40     1.42636   109.76714     0.60133
   46    43 S   CT   _C17    45     1.55615   117.29588  -112.09535
   47    46 S   HC   _H47    46     1.09717   107.72424  -162.83240
   48    43 S   CT   _C28    80     1.54149   110.94842   120.52562
   49    48 S   HC   _H64    81     1.08900   108.66601    79.96325
   50    33 S   CO4  _C13    41     1.50778   105.12877   -73.03720
   51    50 S   O    _O33    42     1.22431   125.69696    62.01377
   52    46 S   CM   _C7_    47     1.49400   114.23656    78.23208
   53    46 S   OH   _O37    78     1.42342   112.99404   -47.25885
   54    53 S   HO   _H66    79     0.96973   106.62668  -171.78059
   55    48 S   CT   _C27    82     1.52525   110.52476  -158.22803
   56    55 S   HC   _H62    83     1.09817   109.87607    59.96907
   57    55 S   HC   _H63    84     1.09618   109.88202   -58.19419
   58    48 S   OH   _O38   101     1.41927   108.06062   -37.96840
   59    58 S   HO   _H67   102     0.97065   106.91700   -59.99568
   60    52 S   CM   _C6_    48     1.33317   131.00724   -70.58245
   61    55 S   CT   _C26    85     1.53366   111.43916  -179.65850
   62    61 S   HC   _H60    86     1.09507   109.41708   -59.66473
   63    61 S   HC   _H61    87     1.09581   109.43817    57.70004
   64    60 S   CO4  _C11    49     1.46443   108.01226  -178.85107
   65    64 S   O    _O29    50     1.21802   126.60916   178.89359
   66    60 S   CT   _C15    54     1.48804   129.92695     0.44762
   67    66 S   HC   _H43    55     1.09864   108.09714  -132.73215
   68    66 S   HC   _H44    56     1.09302   111.12946   -18.40283
   69    61 S   CT   _C25    88     1.53053   111.13976   178.86927
   70    69 S   HC   _H58    89     1.09667   109.80686    58.27375
   71    69 S   HC   _H59    90     1.09727   109.01922   -58.23806
   72    64 S   OS   _O35    51     1.35404   107.16928    -1.08984
   73    66 S   CT   _C19    57     1.53824   112.97983   106.42801
   74    73 S   HC   _H49    58     1.10081   106.77995    60.82779
   75    69 S   CT   _C24    91     1.53152   113.40168  -178.72282
   76    75 S   HC   _H56    92     1.09624   109.57234   -60.04716
   77    75 S   HC   _H57    93     1.09660   108.11611    55.87682
   78    52 S   CO4  _C12    52     1.46776   121.79162   109.32304
   79    78 S   O    _O30    53     1.21846   126.63860    -0.91450
   80    73 S   CT   _C29    62     1.53002   109.71093   174.22209
   81    80 S   HC   _H65    63     1.09214   109.04176    80.01083
   82    75 S   CT   _C23    94     1.52934   113.41365   176.92954
   83    82 S   HC   _H54    95     1.09664   109.88864   -55.96554
   84    82 S   HC   _H55    96     1.09494   110.40104    62.20605
   85    80 S   CT   _C20    64     1.52195   111.56564  -158.41187
   86    85 S   HC   _H50    65     1.09841   108.51007   -58.74366
   87    80 S   OH   _O39    76     1.42062   108.83989   -37.35477
   88    87 S   HO   _H68    77     0.97092   106.82095  -180.00000
   89    82 S   CT   _C22    97     1.52090   111.38123  -177.08295
   90    89 S   HC   _H51    98     1.09476   111.01280   -58.47192
   91    89 S   HC   _H52    99     1.09490   110.20151    61.22644
   92    89 S   HC   _H53   100     1.09428   111.01298  -179.05436
   93    85 S   CT   _C14    66     1.52237   111.50632   178.97168
   94    93 S   HC   _H41    67     1.09624   109.83813    68.91524
   95    93 S   HC   _H42    68     1.09639   111.58984   -50.63836
   96    93 S   CM   _C5_    69     1.49056   108.87289  -170.45206
   97    96 S   HC   _H40    70     1.08524   118.48271  -153.65346
   98    96 S   CM   _C4_    71     1.33592   121.77794    26.60176
   99    98 S   HC   _H39    72     1.08368   121.22986   179.21167
  100    98 S   CO4  _C10    73     1.47492   120.55238     3.89254
  101   100 S   O    _O28    74     1.22560   120.80997   167.90467
  102    85 S   OS   _O36    75     1.44417   107.88501    57.39910
  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
  17   2   1   1  19  17   6   5   8   3  18   8   2  14   6  12
   6   2   1  12   3   1  11   6   5   2   1  11   9   5   4   8
   3  10   4   3   9   5   4   2   9   4   9   5   4   1   1  11
   6   6   5   4  12   7   3   1   3   2   1   1   8   5   4   6
   3   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    50    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    41    45    50    51    43    73    38    39    40  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    41    42    45    50    51    43    44    46    66    73    74    38    39    40    80    48  
   35    36  
   36  
    0  
   41    42    45    50    51    43    44    46    47    52    73    38    39    40    53    48    49    55    58  
   39    40    80    81    85    87    41    43    45    50    51    60    66    67    68    73    74  
   40    80    50    66    73    74  
   80    50    66    73    74  
   42    45    50    51    43    44    46    48  
   45    50    43  
   44    46    47    52    60    78    53    54    48    49    55    56    57    61    58    59    45    50  
   46    47    52    53    48    49    55    58  
   50    51  
   47    52    60    64    72    78    79    66    53    54    48    49    55    58  
   52    60    78    53    54    48  
   49    55    56    57    61    62    63    69    58    59    52    53  
   55    56    57    61    58    59  
   51    73  
    0  
   60    64    65    72    78    79    66    67    68    73    53    54  
   54    60    78  
    0  
   56    57    61    62    63    69    70    71    75    58    59  
   57    61    62    63    69    58  
   61    62    63    69    58  
   59    61  
    0  
   64    65    72    78    79    66    67    68    73    74    80  
   62    63    69    70    71    75    76    77    82  
   63    69    70    71    75  
   69    70    71    75  
   65    72    78    79    66    67    68    73  
   72    78    66  
   67    68    73    74    80    81    85    87    72    78  
   68    73    74    80  
   73    74    80  
   70    71    75    76    77    82    83    84    89  
   71    75    76    77    82  
   75    76    77    82  
   78    79  
   74    80    81    85    86    93   102    87    88  
   80    81    85    87  
   76    77    82    83    84    89    90    91    92  
   77    82    83    84    89  
   82    83    84    89  
   79  
    0  
   81    85    86    93    94    95    96   100   102    87    88  
   85    86    93   102    87    88  
   83    84    89    90    91    92  
   84    89    90    91    92  
   89    90    91    92  
   86    93    94    95    96    97    98   100   101   102    87    88  
   93    94    95    96   100   102    87  
   88    93   102  
    0  
   90    91    92  
   91    92  
   92  
    0  
   94    95    96    97    98    99   100   102  
   95    96    97    98   102  
   96    97    98   102  
   97    98    99   100   101   102  
   98    99   100  
   99   100   101   102  
  100   101   102  
  101   102  
  102  
    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   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660  -0.120000   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   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   43   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.8500   0.1400  -0.565000   1.5900   1.4000   0.020110767  -0.896042159
   46   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   51   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   52   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   53   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   54   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   55   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   59   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   60   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   61   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   65   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   66   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   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   3.0000   0.1700  -0.160000   1.5900   1.4000   0.020110767  -0.896042159
   73   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   78   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   79   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   80   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   86   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   87   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   88   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   89   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   94   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   97   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   98   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   99   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  100   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
  101   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
  102   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
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    50   317.000  1.522
   33    38   268.000  1.529
   37    41   465.000  1.376
   37    43   317.000  1.510
   41    42   745.000  1.250
   41    45   440.000  1.360
   45    50   214.000  1.327
   50    51   570.000  1.229
   43    44   340.000  1.090
   43    46   268.000  1.529
   43    48   268.000  1.529
   46    47   340.000  1.090
   46    52   317.000  1.510
   46    53   320.000  1.410
   52    60   549.000  1.340
   52    78   320.000  1.462
   60    64   320.000  1.462
   60    66   317.000  1.510
   64    65   570.000  1.229
   64    72   214.000  1.327
   72    78   214.000  1.327
   78    79   570.000  1.229
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    73   268.000  1.529
   73    74   340.000  1.090
   73    38   268.000  1.529
   73    80   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   80    81   340.000  1.090
   80    85   268.000  1.529
   80    87   320.000  1.410
   85    86   340.000  1.090
   85    93   268.000  1.529
   85   102   320.000  1.410
   93    94   340.000  1.090
   93    95   340.000  1.090
   93    96   317.000  1.510
   96    97   340.000  1.080
   96    98   549.000  1.340
   98    99   340.000  1.080
   98   100   320.000  1.462
  100   101   570.000  1.229
  100   102   214.000  1.327
   87    88   553.000  0.945
   53    54   553.000  0.945
   48    49   340.000  1.090
   48    55   268.000  1.529
   48    58   320.000  1.410
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    61   268.000  1.529
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    69   268.000  1.529
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    75   268.000  1.529
   75    76   340.000  1.090
   75    77   340.000  1.090
   75    82   268.000  1.529
   82    83   340.000  1.090
   82    84   340.000  1.090
   82    89   268.000  1.529
   89    90   340.000  1.090
   89    91   340.000  1.090
   89    92   340.000  1.090
   58    59   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    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    50    75.00000  110.18000
   29    33    38    75.00000  111.63000
   33    37    41    70.00000  124.00000
   33    37    43    65.00000  117.92700
   33    50    45    81.00000  111.40000
   33    50    51    80.00000  120.40000
   33    38    73    58.35000  112.70000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   37    41    42    65.00000  137.10300
   37    41    45    80.00000  120.01400
   37    43    44    35.00000  109.50000
   37    43    46    70.00000  112.02700
   37    43    48    70.00000  112.02700
   41    45    50    90.00000  114.22900
   45    41    42    65.00000  121.00000
   45    50    51    83.00000  123.40000
   50    33    37    70.00000  109.06800
   43    37    41    70.00000  124.00000
   43    46    47    37.50000  110.70000
   43    46    52    70.00000  112.02700
   43    46    53    50.00000  109.50000
   43    48    49    37.50000  110.70000
   43    48    55    58.35000  112.70000
   43    48    58    50.00000  109.50000
   46    43    44    37.50000  110.70000
   46    52    60    70.00000  124.00000
   46    52    78    65.00000  116.34900
   46    53    54    55.00000  108.50000
   52    46    47    35.00000  109.50000
   52    60    64    65.00000  118.96000
   52    60    66    70.00000  124.00000
   52    78    72    90.00000  111.29400
   52    78    79    80.00000  123.72100
   60    64    65    80.00000  123.72100
   60    64    72    90.00000  111.29400
   60    66    67    35.00000  109.50000
   60    66    68    35.00000  109.50000
   60    66    73    70.00000  112.02700
   64    72    78   105.00000  110.06700
   72    64    65    83.00000  123.40000
   72    78    79    83.00000  123.40000
   78    52    60    65.00000  118.96000
   66    60    64    65.00000  116.34900
   66    73    74    37.50000  110.70000
   66    73    38    58.35000  112.70000
   66    73    80    58.35000  112.70000
   68    66    67    33.00000  107.80000
   73    66    67    37.50000  110.70000
   73    66    68    37.50000  110.70000
   73    38    39    37.50000  110.70000
   73    38    40    37.50000  110.70000
   73    80    81    37.50000  110.70000
   73    80    85    58.35000  112.70000
   73    80    87    50.00000  109.50000
   38    33    37    70.00000  112.02700
   38    33    50    63.00000  111.10000
   38    73    74    37.50000  110.70000
   40    38    39    33.00000  107.80000
   80    73    74    37.50000  110.70000
   80    73    38    58.35000  112.70000
   80    85    86    37.50000  110.70000
   80    85    93    58.35000  112.70000
   80    85   102    50.00000  109.50000
   80    87    88    55.00000  108.50000
   85    80    81    37.50000  110.70000
   85    93    94    37.50000  110.70000
   85    93    95    37.50000  110.70000
   85    93    96    70.00000  112.02700
   85   102   100    83.00000  116.90000
   93    85    86    37.50000  110.70000
   93    96    97    35.00000  117.00000
   93    96    98    70.00000  124.00000
   95    93    94    33.00000  107.80000
   96    93    94    35.00000  109.50000
   96    93    95    35.00000  109.50000
   96    98    99    35.00000  120.00000
   96    98   100    65.00000  118.96000
   98    96    97    35.00000  120.00000
   98   100   101    80.00000  123.72100
   98   100   102    90.00000  111.29400
  100    98    99    40.00000  117.72500
  102    85    86    35.00000  109.50000
  102    85    93    50.00000  109.50000
  102   100   101    83.00000  123.40000
   87    80    81    35.00000  109.50000
   87    80    85    50.00000  109.50000
   53    46    47    35.00000  109.50000
   53    46    52    90.00000  110.39200
   48    43    44    37.50000  110.70000
   48    43    46    58.35000  112.70000
   48    55    56    37.50000  110.70000
   48    55    57    37.50000  110.70000
   48    55    61    58.35000  112.70000
   48    58    59    55.00000  108.50000
   55    48    49    37.50000  110.70000
   55    61    62    37.50000  110.70000
   55    61    63    37.50000  110.70000
   55    61    69    58.35000  112.70000
   57    55    56    33.00000  107.80000
   61    55    56    37.50000  110.70000
   61    55    57    37.50000  110.70000
   61    69    70    37.50000  110.70000
   61    69    71    37.50000  110.70000
   61    69    75    58.35000  112.70000
   63    61    62    33.00000  107.80000
   69    61    62    37.50000  110.70000
   69    61    63    37.50000  110.70000
   69    75    76    37.50000  110.70000
   69    75    77    37.50000  110.70000
   69    75    82    58.35000  112.70000
   71    69    70    33.00000  107.80000
   75    69    70    37.50000  110.70000
   75    69    71    37.50000  110.70000
   75    82    83    37.50000  110.70000
   75    82    84    37.50000  110.70000
   75    82    89    58.35000  112.70000
   77    75    76    33.00000  107.80000
   82    75    76    37.50000  110.70000
   82    75    77    37.50000  110.70000
   82    89    90    37.50000  110.70000
   82    89    91    37.50000  110.70000
   82    89    92    37.50000  110.70000
   84    82    83    33.00000  107.80000
   89    82    83    37.50000  110.70000
   89    82    84    37.50000  110.70000
   91    89    90    33.00000  107.80000
   92    89    90    33.00000  107.80000
   92    89    91    33.00000  107.80000
   58    48    49    35.00000  109.50000
   58    48    55    50.00000  109.50000
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    50   0.01700  1.0 1.0
   24    29    33    50  -0.23550 -1.0 2.0
   24    29    33    50   0.21350  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    41   0.42700  1.0 1.0
   29    33    37    41  -0.70350 -1.0 2.0
   29    33    37    41  -0.43150  1.0 3.0
   29    33    37    43   0.30250  1.0 1.0
   29    33    37    43  -0.14950 -1.0 2.0
   29    33    37    43   0.36900  1.0 3.0
   29    33    50    45   0.40000  1.0 3.0
   29    33    50    51   0.30150 -1.0 2.0
   29    33    38    73   0.44750  1.0 1.0
   29    33    38    73  -0.17800 -1.0 2.0
   29    33    38    73   0.20200  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   33    37    41    42   7.00000 -1.0 2.0
   33    37   -41    45   7.00000 -1.0 2.0
   33    37    43    44   0.34800  1.0 3.0
   33    37    43    46   0.46850  1.0 1.0
   33    37    43    46   0.08550 -1.0 2.0
   33    37    43    46   0.09800  1.0 3.0
   33    37    43    48   0.46850  1.0 1.0
   33    37    43    48   0.08550 -1.0 2.0
   33    37    43    48   0.09800  1.0 3.0
   37    33   -50    45   0.40000  1.0 3.0
   37    33    50    51   0.30150 -1.0 2.0
   37    33    38    73   0.34400  1.0 1.0
   37    33    38    73   0.09450 -1.0 2.0
   37    33    38    73   0.11100  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    41   -45    50  -1.93650  1.0 1.0
   37    41   -45    50   2.17750 -1.0 2.0
   37    41   -45    50  -0.40250  1.0 3.0
   37    43    46    47   0.15000  1.0 3.0
   37    43    46    52   0.31000  1.0 1.0
   37    43    46    52   0.14700 -1.0 2.0
   37    43    46    52   0.07550  1.0 3.0
   37    43    46    53   1.05650  1.0 1.0
   37    43    46    53   0.15600 -1.0 2.0
   37    43    46    53   0.53150  1.0 3.0
   37    43    48    49   0.15000  1.0 3.0
   37    43    48    55   0.34400  1.0 1.0
   37    43    48    55   0.09450 -1.0 2.0
   37    43    48    55   0.11100  1.0 3.0
   37    43    48    58   1.05650  1.0 1.0
   37    43    48    58   0.15600 -1.0 2.0
   37    43    48    58   0.53150  1.0 3.0
   41    37    43    44   0.00000  1.0 1.0
   41    37    43    46   0.09850  1.0 1.0
   41    37    43    46   0.15250 -1.0 2.0
   41    37    43    46  -0.50650  1.0 3.0
   41    37    43    48   0.09850  1.0 1.0
   41    37    43    48   0.15250 -1.0 2.0
   41    37    43    48  -0.50650  1.0 3.0
   41    45   -50    33   0.82650  1.0 1.0
   41    45   -50    33   1.69000 -1.0 2.0
   41    45    50    51   3.00000 -1.0 2.0
   42    41    45    50   2.00000 -1.0 2.0
   50    33   -37    41  -0.51250  1.0 1.0
   50    33   -37    41  -0.88800 -1.0 2.0
   50    33   -37    41   0.08850  1.0 3.0
   50    33    37    43   0.17250  1.0 1.0
   50    33    37    43  -0.04100 -1.0 2.0
   50    33    37    43  -0.33850  1.0 3.0
   50    33    38    73  -0.95700  1.0 1.0
   50    33    38    73  -0.18200 -1.0 2.0
   50    33    38    73   0.29450  1.0 3.0
   50    33    38    39  -0.11250  1.0 3.0
   50    33    38    40  -0.11250  1.0 3.0
   43    37    41    42   7.00000 -1.0 2.0
   43    37    41    45   7.00000 -1.0 2.0
   43    46    52    60   0.09850  1.0 1.0
   43    46    52    60   0.15250 -1.0 2.0
   43    46    52    60  -0.50650  1.0 3.0
   43    46    52    78   0.09700  1.0 1.0
   43    46    52    78   0.15600 -1.0 2.0
   43    46    52    78  -0.50800  1.0 3.0
   43    46    53    54  -0.11600  1.0 1.0
   43    46    53    54  -0.09450 -1.0 2.0
   43    46    53    54   0.21250  1.0 3.0
   43    48    55    56   0.15000  1.0 3.0
   43    48    55    57   0.15000  1.0 3.0
   43    48    55    61   0.56750  1.0 1.0
   43    48    55    61  -0.07550 -1.0 2.0
   43    48    55    61   0.20000  1.0 3.0
   43    48    58    59  -0.11600  1.0 1.0
   43    48    58    59  -0.09450 -1.0 2.0
   43    48    58    59   0.21250  1.0 3.0
   44    43    46    47   0.15000  1.0 3.0
   44    43    46    52   0.15000  1.0 3.0
   44    43    46    53   0.23400  1.0 3.0
   44    43    48    49   0.15000  1.0 3.0
   44    43    48    55   0.15000  1.0 3.0
   44    43    48    58   0.23400  1.0 3.0
   46    43    48    49   0.15000  1.0 3.0
   46    43    48    55   0.56750  1.0 1.0
   46    43    48    55  -0.07550 -1.0 2.0
   46    43    48    55   0.20000  1.0 3.0
   46    43    48    58   0.86500  1.0 1.0
   46    43    48    58  -0.17500 -1.0 2.0
   46    43    48    58   0.20800  1.0 3.0
   46    52    60    64   7.00000 -1.0 2.0
   46    52    60    66   7.00000 -1.0 2.0
   46    52    78    72  -0.15000  1.0 1.0
   46    52    78    72   0.89550 -1.0 2.0
   46    52    78    72  -0.06900  1.0 3.0
   46    52    78    79  -0.64400  1.0 1.0
   46    52    78    79   0.26850 -1.0 2.0
   47    46    52    60   0.00000  1.0 1.0
   47    46    52    78   0.15000  1.0 3.0
   47    46    53    54   0.19450  1.0 3.0
   52    46    53    54  -0.07800  1.0 1.0
   52    46    53    54  -0.21500 -1.0 2.0
   52    46    53    54  -0.03150  1.0 3.0
   52    60    64    65   1.00000 -1.0 2.0
   52    60   -64    72  -0.56150  1.0 1.0
   52    60   -64    72   2.19150 -1.0 2.0
   52    60    66    67   0.00000  1.0 1.0
   52    60    66    68   0.00000  1.0 1.0
   52    60    66    73   0.09850  1.0 1.0
   52    60    66    73   0.15250 -1.0 2.0
   52    60    66    73  -0.50650  1.0 3.0
   60    52   -78    72  -0.56150  1.0 1.0
   60    52   -78    72   2.19150 -1.0 2.0
   60    52    78    79   1.00000 -1.0 2.0
   60    64   -72    78   2.00000 -1.0 2.0
   60    66    73    74   0.15000  1.0 3.0
   60    66    73    38   0.34400  1.0 1.0
   60    66    73    38   0.09450 -1.0 2.0
   60    66    73    38   0.11100  1.0 3.0
   60    66    73    80   0.34400  1.0 1.0
   60    66    73    80   0.09450 -1.0 2.0
   60    66    73    80   0.11100  1.0 3.0
   64    60    66    67   0.15000  1.0 3.0
   64    60    66    68   0.15000  1.0 3.0
   64    60    66    73   0.09700  1.0 1.0
   64    60    66    73   0.15600 -1.0 2.0
   64    60    66    73  -0.50800  1.0 3.0
   64    72   -78    52   2.00000 -1.0 2.0
   64    72    78    79   3.00000 -1.0 2.0
   65    64    72    78   3.00000 -1.0 2.0
   78    52   -60    64   7.00000 -1.0 2.0
   78    52    60    66   7.00000 -1.0 2.0
   66    60    64    65  -0.64400  1.0 1.0
   66    60    64    65   0.26850 -1.0 2.0
   66    60    64    72  -0.15000  1.0 1.0
   66    60    64    72   0.89550 -1.0 2.0
   66    60    64    72  -0.06900  1.0 3.0
   66    73    38    33   0.56750  1.0 1.0
   66    73    38    33  -0.07550 -1.0 2.0
   66    73    38    33   0.20000  1.0 3.0
   66    73    38    39   0.15000  1.0 3.0
   66    73    38    40   0.15000  1.0 3.0
   66    73    80    81   0.15000  1.0 3.0
   66    73    80    85   0.56750  1.0 1.0
   66    73    80    85  -0.07550 -1.0 2.0
   66    73    80    85   0.20000  1.0 3.0
   66    73    80    87   0.86500  1.0 1.0
   66    73    80    87  -0.17500 -1.0 2.0
   66    73    80    87   0.20800  1.0 3.0
   67    66    73    74   0.15000  1.0 3.0
   67    66    73    38   0.15000  1.0 3.0
   67    66    73    80   0.15000  1.0 3.0
   68    66    73    74   0.15000  1.0 3.0
   68    66    73    38   0.15000  1.0 3.0
   68    66    73    80   0.15000  1.0 3.0
   73    80    85    86   0.15000  1.0 3.0
   73    80    85    93   0.56750  1.0 1.0
   73    80    85    93  -0.07550 -1.0 2.0
   73    80    85    93   0.20000  1.0 3.0
   73    80    85   102   0.62750  1.0 1.0
   73    80    85   102  -0.30950 -1.0 2.0
   73    80    85   102   0.27300  1.0 3.0
   73    80    87    88  -0.11600  1.0 1.0
   73    80    87    88  -0.09450 -1.0 2.0
   73    80    87    88   0.21250  1.0 3.0
   74    73    38    33   0.15000  1.0 3.0
   74    73    38    39   0.15000  1.0 3.0
   74    73    38    40   0.15000  1.0 3.0
   74    73    80    81   0.15000  1.0 3.0
   74    73    80    85   0.15000  1.0 3.0
   74    73    80    87   0.23400  1.0 3.0
   38    33    37    41   0.09850  1.0 1.0
   38    33    37    41   0.15250 -1.0 2.0
   38    33    37    41  -0.50650  1.0 3.0
   38    33    37    43   0.46850  1.0 1.0
   38    33    37    43   0.08550 -1.0 2.0
   38    33    37    43   0.09800  1.0 3.0
   38    33    50    45   0.36750  1.0 3.0
   38    33    50    51   0.30150 -1.0 2.0
   38    73    80    81   0.15000  1.0 3.0
   38    73    80    85   0.56750  1.0 1.0
   38    73    80    85  -0.07550 -1.0 2.0
   38    73    80    85   0.20000  1.0 3.0
   38    73    80    87   0.86500  1.0 1.0
   38    73    80    87  -0.17500 -1.0 2.0
   38    73    80    87   0.20800  1.0 3.0
   80    73    38    33   0.56750  1.0 1.0
   80    73    38    33  -0.07550 -1.0 2.0
   80    73    38    33   0.20000  1.0 3.0
   80    73    38    39   0.15000  1.0 3.0
   80    73    38    40   0.15000  1.0 3.0
   80    85    93    94   0.15000  1.0 3.0
   80    85    93    95   0.15000  1.0 3.0
   80    85    93    96   0.34400  1.0 1.0
   80    85    93    96   0.09450 -1.0 2.0
   80    85    93    96   0.11100  1.0 3.0
   80    85   102   100  -0.25900  1.0 1.0
   80    85   102   100  -0.47000 -1.0 2.0
   80    85   102   100   0.11750  1.0 3.0
   81    80    85    86   0.15000  1.0 3.0
   81    80    85    93   0.15000  1.0 3.0
   81    80    85   102   0.23400  1.0 3.0
   81    80    87    88   0.19450  1.0 3.0
   85    80    87    88  -0.11600  1.0 1.0
   85    80    87    88  -0.09450 -1.0 2.0
   85    80    87    88   0.21250  1.0 3.0
   85    93    96    97   0.00000  1.0 1.0
   85    93    96    98   0.09850  1.0 1.0
   85    93    96    98   0.15250 -1.0 2.0
   85    93    96    98  -0.50650  1.0 3.0
   86    85    93    94   0.15000  1.0 3.0
   86    85    93    95   0.15000  1.0 3.0
   86    85    93    96   0.15000  1.0 3.0
   86    85   102   100   0.08050  1.0 3.0
   93    85   102   100  -0.25900  1.0 1.0
   93    85   102   100  -0.47000 -1.0 2.0
   93    85   102   100   0.11750  1.0 3.0
   93    96    98    99   7.00000 -1.0 2.0
   93    96   -98   100   7.00000 -1.0 2.0
   94    93    96    97   0.33100  1.0 3.0
   94    93    96    98   0.00000  1.0 1.0
   95    93    96    97   0.33100  1.0 3.0
   95    93    96    98   0.00000  1.0 1.0
   96    98   100   101   1.00000 -1.0 2.0
   96    98   100   102  -0.56150  1.0 1.0
   96    98   100   102   2.19150 -1.0 2.0
   97    96    98    99   7.00000 -1.0 2.0
   97    96    98   100   7.00000 -1.0 2.0
   98   100  -102    85   2.00000 -1.0 2.0
   99    98   100   101   0.00000  1.0 1.0
   99    98   100   102   1.63100 -1.0 2.0
  101   100   102    85   3.00000 -1.0 2.0
  102    85    93    94   0.23400  1.0 3.0
  102    85    93    95   0.23400  1.0 3.0
  102    85   -93    96   0.61850  1.0 1.0
  102    85   -93    96  -0.22750 -1.0 2.0
  102    85   -93    96   0.15300  1.0 3.0
   87    80    85    86   0.23400  1.0 3.0
   87    80    85    93   0.86500  1.0 1.0
   87    80    85    93  -0.17500 -1.0 2.0
   87    80    85    93   0.20800  1.0 3.0
   87    80    85   102   3.69350  1.0 1.0
   87    80    85   102  -1.82950 -1.0 2.0
   53    46    52    60   0.67800  1.0 1.0
   53    46    52    60   0.47050 -1.0 2.0
   53    46    52    60  -0.62500  1.0 3.0
   53    46    52    78   0.09700  1.0 1.0
   53    46    52    78   0.15600 -1.0 2.0
   53    46    52    78  -0.50800  1.0 3.0
   48    43    46    47   0.15000  1.0 3.0
   48    43    46    52   0.34400  1.0 1.0
   48    43    46    52   0.09450 -1.0 2.0
   48    43    46    52   0.11100  1.0 3.0
   48    43    46    53   0.86500  1.0 1.0
   48    43    46    53  -0.17500 -1.0 2.0
   48    43    46    53   0.20800  1.0 3.0
   48    55    61    62   0.15000  1.0 3.0
   48    55    61    63   0.15000  1.0 3.0
   48    55    61    69   0.56750  1.0 1.0
   48    55    61    69  -0.07550 -1.0 2.0
   48    55    61    69   0.20000  1.0 3.0
   49    48    55    56   0.15000  1.0 3.0
   49    48    55    57   0.15000  1.0 3.0
   49    48    55    61   0.15000  1.0 3.0
   49    48    58    59   0.19450  1.0 3.0
   55    48    58    59  -0.11600  1.0 1.0
   55    48    58    59  -0.09450 -1.0 2.0
   55    48    58    59   0.21250  1.0 3.0
   55    61    69    70   0.15000  1.0 3.0
   55    61    69    71   0.15000  1.0 3.0
   55    61    69    75   0.56750  1.0 1.0
   55    61    69    75  -0.07550 -1.0 2.0
   55    61    69    75   0.20000  1.0 3.0
   56    55    61    62   0.15000  1.0 3.0
   56    55    61    63   0.15000  1.0 3.0
   56    55    61    69   0.15000  1.0 3.0
   57    55    61    62   0.15000  1.0 3.0
   57    55    61    63   0.15000  1.0 3.0
   57    55    61    69   0.15000  1.0 3.0
   61    69    75    76   0.15000  1.0 3.0
   61    69    75    77   0.15000  1.0 3.0
   61    69    75    82   0.56750  1.0 1.0
   61    69    75    82  -0.07550 -1.0 2.0
   61    69    75    82   0.20000  1.0 3.0
   62    61    69    70   0.15000  1.0 3.0
   62    61    69    71   0.15000  1.0 3.0
   62    61    69    75   0.15000  1.0 3.0
   63    61    69    70   0.15000  1.0 3.0
   63    61    69    71   0.15000  1.0 3.0
   63    61    69    75   0.15000  1.0 3.0
   69    75    82    83   0.15000  1.0 3.0
   69    75    82    84   0.15000  1.0 3.0
   69    75    82    89   0.56750  1.0 1.0
   69    75    82    89  -0.07550 -1.0 2.0
   69    75    82    89   0.20000  1.0 3.0
   70    69    75    76   0.15000  1.0 3.0
   70    69    75    77   0.15000  1.0 3.0
   70    69    75    82   0.15000  1.0 3.0
   71    69    75    76   0.15000  1.0 3.0
   71    69    75    77   0.15000  1.0 3.0
   71    69    75    82   0.15000  1.0 3.0
   75    82    89    90   0.15000  1.0 3.0
   75    82    89    91   0.15000  1.0 3.0
   75    82    89    92   0.15000  1.0 3.0
   76    75    82    83   0.15000  1.0 3.0
   76    75    82    84   0.15000  1.0 3.0
   76    75    82    89   0.15000  1.0 3.0
   77    75    82    83   0.15000  1.0 3.0
   77    75    82    84   0.15000  1.0 3.0
   77    75    82    89   0.15000  1.0 3.0
   83    82    89    90   0.15000  1.0 3.0
   83    82    89    91   0.15000  1.0 3.0
   83    82    89    92   0.15000  1.0 3.0
   84    82    89    90   0.15000  1.0 3.0
   84    82    89    91   0.15000  1.0 3.0
   84    82    89    92   0.15000  1.0 3.0
   58    48    55    56   0.23400  1.0 3.0
   58    48    55    57   0.23400  1.0 3.0
   58    48    55    61   0.86500  1.0 1.0
   58    48    55    61  -0.17500 -1.0 2.0
   58    48    55    61   0.20800  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
   33    43    37    41   1.10000 -1.0 2.0
   42    45    41    37   1.10000 -1.0 2.0
   33    45    50    51  10.50000 -1.0 2.0
   46    78    52    60   1.10000 -1.0 2.0
   64    66    60    52   1.10000 -1.0 2.0
   60    72    64    65  10.50000 -1.0 2.0
   52    72    78    79  10.50000 -1.0 2.0
   93    97    96    98   1.10000 -1.0 2.0
  100    99    98    96   1.10000 -1.0 2.0
   98   102   100   101  10.50000 -1.0 2.0
END
