* LIGAND DATABASE FILE (OPLS2005)
*
001     101   105    191    307     569
    1     0 S   NP   _N1_     1    28.88025    98.30700   -24.08235
    2     1 S   H    _HN1     2     1.02792   110.98946   -85.33269
    3     1 S   H    _H1_     3     1.02947    57.22691    13.57163
    4     1 S   H    _H2_     4     1.02824    51.30021   178.08603
    5     1 S   CT   _CA1     5     1.50148   136.74204    98.99719
    6     5 S   HC   _HA1     6     1.09574   105.13855   114.31452
    7     5 S   CO3  _C1_     7     1.53768   112.44960    -5.82948
    8     7 S   O2Z  _O11     8     1.26379   114.99632   -41.98993
    9     7 S   O2Z  _O12     9     1.26235   114.94750   136.90717
   10     5 S   CT   _CB1    10     1.53050   107.37695  -127.75008
   11    10 S   HC   HB11    11     1.09842   109.28849   -49.28945
   12    10 S   HC   HB12    12     1.09810   110.48813    67.29460
   13    10 S   CT   _CG1    13     1.53017   112.66881  -170.23028
   14    13 S   HC   HG11    14     1.09570   110.72205   -68.06011
   15    13 S   HC   HG12    15     1.09671   109.70727    51.19432
   16    13 S   C    _CD1    16     1.51822   111.96679   171.63308
   17    16 S   O    _OE1    17     1.22765   123.17648    12.45305
   18    16 S   N    _N2_    18     1.38619   111.83629  -167.46235
   19    18 S   H    _HN2    19     1.01576   119.07412     0.47230
   20    18 S   CT1  _CA2    20     1.46248   123.43111   176.84787
   21    20 S   HC   _HA2    21     1.09748   109.23432     8.47253
   22    20 S   C    _C2_    22     1.53714   109.05211  -107.06407
   23    22 S   O    _O2_    23     1.23095   122.23685  -150.16122
   24    20 S   CT   _CB2    32     1.53469   111.54226   130.45243
   25    24 S   HC   HB21    33     1.09461   109.46018    57.72075
   26    24 S   HC   HB22    34     1.09403   109.38188   176.65684
   27    22 S   N    _N3_    24     1.38318   113.95018    37.42570
   28    27 S   H    _HN3    25     1.01533   119.62226    -3.31310
   29    24 S   S    _SG2    35     1.82916   110.91352   -64.60867
   30    27 S   CT   _CA3    26     1.45273   123.26581   177.18144
   31    30 S   HC   HA31    27     1.09547   107.53243   -64.50782
   32    30 S   HC   HA32    28     1.09557   107.97080    51.93929
   33    29 S   CT   _C25    36     1.87085   103.20297   160.77894
   34    33 S   OM   _O41    37     1.32197   109.53065   -62.24614
   35    30 S   CO3  _C3_    29     1.52972   114.06717   173.96217
   36    35 S   O2Z  _O31    30     1.26382   116.10385     0.73887
   37    35 S   O2Z  _O32    31     1.26429   114.41001  -179.22646
   38    33 S   CT   _C26    38     1.56453   108.79038  -179.68847
   39    38 S   HC   _H9_    39     1.10221   108.92021  -179.28509
   40    33 S   CT   _C24    68     1.57347   114.18313    61.18505
   41    40 S   HC   _H8_    69     1.10047   108.56967   179.85735
   42    38 S   CO4  _C27    40     1.53051   110.60158   -65.06021
   43    42 S   O    _O39    41     1.23425   121.32582   127.64376
   44    40 S   OS   _O42    70     1.43943   112.43282   -60.01548
   45    38 S   CO4  _C28    96     1.54327   115.28529    63.55450
   46    45 S   O    _O40    97     1.23146   123.15179   -73.01366
   47    42 S   CT   _C10    42     1.56159   116.95315   -55.79330
   48    44 S   CT   _C30    71     1.42089   113.94089  -104.40447
   49    48 S   HC   _H25    72     1.09336   108.09785   179.92867
   50    48 S   HC   _H26    73     1.09253   111.43552    60.99598
   51    48 S   HC   _H27    74     1.09336   110.57849   -61.64595
   52    45 S   CT   _C29    98     1.50941   116.52097   108.60031
   53    52 S   HC   _H22    99     1.09283   109.42987    63.61195
   54    52 S   HC   _H23   100     1.09213   110.13166   -57.65836
   55    52 S   HC   _H24   101     1.09366   109.62702  -177.05417
   56    47 S   CMA  _C23    43     1.57948   110.50266   -76.41235
   57    56 S   OM   _O35    44     1.26803   110.98961   -38.67788
   58    47 S   OS   _O34    75     1.44704   109.13525   169.27890
   59    56 S   CM   _C22    45     1.36609   119.33241   141.73364
   60    58 S   CO   _C9_    76     1.42931   117.96047   -64.21191
   61    60 S   HC   _H6_    77     1.09585   111.08547    27.32912
   62    59 S   CM   _C13    46     1.46067   123.19783     2.24437
   63    59 S   CO4  _C21    57     1.51947   119.70477  -178.75118
   64    63 S   O    _O36    58     1.22626   123.84904   -13.22142
   65    60 S   CT   _C8_    78     1.52612   107.16456   147.09047
   66    65 S   HC   _H13    79     1.09874   109.92426    57.22022
   67    65 S   HC   _H14    80     1.09683   110.78595   -58.52901
   68    62 S   CM   _C14    47     1.34150   122.09212  -171.33755
   69    68 S   HC   _H17    48     1.08616   120.58074   179.58363
   70    62 S   CT   _C12    63     1.50078   117.62493     8.15382
   71    70 S   HC   _H15    64     1.09719   108.24165    80.96576
   72    70 S   HC   _H16    65     1.09679   111.44537  -163.27111
   73    65 S   CT   _C7_    81     1.52449   110.81138   178.36195
   74    73 S   HC   _H5_    82     1.09675   110.32803    70.15941
   75    68 S   CA   _C15    49     1.46028   121.76086    -0.10087
   76    47 S   CT   _C11    66     1.55695   109.04305    47.68289
   77    76 S   HC   _H7_    67     1.09523   110.35669    73.11155
   78    73 S   CT   _C6_    83     1.53250   110.73950   -51.80736
   79    78 S   HC   _H4_    84     1.09711   108.85788   -72.09248
   80    73 S   OH   _O43    94     1.42580   109.43859  -172.25271
   81    80 S   HO   _H28    95     0.97256   107.48897   -57.80475
   82    75 S   CA   _C16    50     1.40316   119.22671   175.38293
   83    82 S   HA   _H18    51     1.08755   120.22954    -0.60555
   84    78 S   CT   _C5_    85     1.53460   110.80072    49.21302
   85    84 S   HC   _H3_    86     1.09815   110.46421    66.96626
   86    78 S   OH   _O44    92     1.42677   109.83892   171.09839
   87    86 S   HO   _H29    93     0.97240   108.01561   -59.17123
   88    82 S   CA   _C17    52     1.39311   119.97637   179.42291
   89    60 S   OS   _O33    87     1.43102   111.11616   -94.38876
   90    84 S   CT   _C4_    88     1.52470   111.72475  -173.35368
   91    90 S   HC   _H10    89     1.09560   110.93634    60.46567
   92    90 S   HC   _H11    90     1.09394   111.67603   -61.04313
   93    90 S   HC   _H12    91     1.09564   110.24088   178.30626
   94    88 S   CA   _C18    53     1.38919   120.73214    -0.14804
   95    94 S   HA   _H19    54     1.08668   120.24578  -180.00000
   96    88 S   OH   _O38    61     1.36622   121.08416   179.89347
   97    96 S   HO   _H21    62     0.97236   108.70474    -0.04423
   98    94 S   CA   _C19    55     1.39504   119.46507    -0.00000
   99    75 S   CA   _C20    56     1.40264   120.92599    -5.38896
  100    98 S   OH   _O37    59     1.36956   115.81223   179.86583
  101   100 S   HO   _H20    60     0.97442   108.65688   178.53593
  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  10   5   4   3
  16   8   2   1   1  16   7  17   6  13   5   8   6   4  15   4
   2   1   1   3   2   1   1  12   5  12  12  13   6  12   9   3
  11   6   5  11   4   5   3   2  11   6   8   1   1  12   7   3
   1   8   4   8   6   3   1   7   4   3   2   1   1   7   4   2
   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    42    76    40    41    44    45  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    42    43    47    70    76    77    40    41    44    48    45    46    52  
   38    39    42    76    40    41    44    45  
   36    37  
   37  
    0  
   39    42    43    47    56    76    40    41    44    58    45    46    52    53    54    55  
   42    43    47    40    45    46    52  
   41    44    48    49    50    51    58    45    42    47    56    62    70    71    72    76    77  
   44    48    47    70    76    77  
   43    47    56    57    59    70    76    77    58    60    45    46    52  
   47    56    76    58    45  
   48    49    50    51    47    70    76    77  
   46    52    53    54    55    47  
   52    53    54    55  
   56    57    59    62    63    70    71    72    76    77    58    60    61    65    89  
   49    50    51    76  
   50    51  
   51  
    0  
   53    54    55  
   54    55  
   55  
    0  
   57    59    62    68    99    63    64    70    76    77    58    60  
   59    62    63    76    58  
   60    61    65    66    67    73    84    89    59    70    76    77  
   62    68    69    75    98    99    63    64    70    71    72    76  
   61    65    66    67    73    74    78    84    85    89    90    80    76  
   65    66    67    73    84    89  
   68    69    75    82    99    63    64    70    71    72    76    77  
   64   100    70    68    75    82    94    98    99  
   75    98    99  
   66    67    73    74    78    79    84    89    86    80    81  
   67    73    74    78    89    80  
   73    74    78    89    80  
   69    75    82    83    88    98    99    70    71    72    76  
   75    82    99    70  
   71    72    76    77    75  
   72    76    77  
   76    77  
   74    78    79    84    85    89    90    86    87    80    81  
   78    79    84    86    80    81  
   82    83    88    94    98    99   100    96  
   77  
    0  
   79    84    85    89    90    91    92    93    86    87    80    81  
   84    85    89    90    86    87    80  
   81    84    86  
    0  
   83    88    94    95    98    99    96    97  
   88    94    99    96  
   85    89    90    91    92    93    86    87  
   89    90    91    92    93    86  
   87    89    90  
    0  
   94    95    98    99   100    96    97  
   90    91    92    93  
   91    92    93  
   92    93  
   93  
    0  
   95    98    99   100   101    96    97  
   98    99   100    96  
   97    98  
    0  
   99   100   101  
  100   101  
  101  
    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  -0.175000   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   4.2000   0.3000  -0.012500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   40   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   42   3.7500   0.1050   0.422000   2.1120   1.8750   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   44   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   45   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   47   3.5000   0.0660   0.248000   1.9750   1.7500   0.005000000  -0.741685710
   48   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   57   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   58   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   59   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   60   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   63   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   64   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   65   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   69   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   76   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   77   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   78   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   81   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   82   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   83   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   84   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   86   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   87   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   88   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   89   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   90   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   95   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   96   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   97   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   98   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   99   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
  100   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
  101   0.5000   0.0300   0.435000   0.9960   0.8600   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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   570.000  1.307
   33    38   268.000  1.529
   33    40   268.000  1.529
   38    39   340.000  1.090
   38    42   317.000  1.522
   38    45   317.000  1.522
   42    43   570.000  1.229
   42    47   317.000  1.522
   47    56   270.000  1.512
   47    76   268.000  1.529
   47    58   320.000  1.410
   56    57   745.000  1.250
   56    59   465.000  1.376
   59    62   380.000  1.444
   59    63   320.000  1.462
   62    68   549.000  1.340
   62    70   317.000  1.510
   68    69   340.000  1.080
   68    75   320.000  1.460
   75    82   469.000  1.400
   75    99   469.000  1.400
   82    83   367.000  1.080
   82    88   469.000  1.400
   88    94   469.000  1.400
   88    96   450.000  1.364
   94    95   367.000  1.080
   94    98   469.000  1.400
   98    99   469.000  1.400
   98   100   450.000  1.364
   99    63   310.000  1.470
   63    64   570.000  1.229
  100   101   553.000  0.945
   96    97   553.000  0.945
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    76   268.000  1.529
   76    77   340.000  1.090
   76    40   268.000  1.529
   40    41   340.000  1.090
   40    44   320.000  1.410
   44    48   320.000  1.410
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   340.000  1.090
   58    60   320.000  1.380
   60    61   340.000  1.090
   60    65   250.000  1.527
   60    89   320.000  1.380
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    73   268.000  1.529
   73    74   340.000  1.090
   73    78   268.000  1.529
   73    80   320.000  1.410
   78    79   340.000  1.090
   78    84   268.000  1.529
   78    86   320.000  1.410
   84    85   340.000  1.090
   84    89   320.000  1.410
   84    90   268.000  1.529
   90    91   340.000  1.090
   90    92   340.000  1.090
   90    93   340.000  1.090
   86    87   553.000  0.945
   80    81   553.000  0.945
   45    46   570.000  1.229
   45    52   317.000  1.522
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    85.00000  114.68000
   29    33    38    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    42    63.00000  111.10000
   33    38    45    63.00000  111.10000
   33    40    76    58.35000  112.70000
   33    40    41    37.50000  110.70000
   33    40    44    50.00000  109.50000
   38    33    34    50.00000  109.50000
   38    42    43    80.00000  120.40000
   38    42    47    70.00000  116.00000
   38    45    46    80.00000  120.40000
   38    45    52    70.00000  116.00000
   42    38    39    35.00000  109.50000
   42    47    56    70.00000  109.06800
   42    47    76    63.00000  111.10000
   42    47    58    90.00000  108.74100
   47    42    43    80.00000  120.40000
   47    56    57    85.00000  112.85300
   47    56    59    65.00000  122.18000
   47    76    70    58.35000  112.70000
   47    76    77    37.50000  110.70000
   47    76    40    58.35000  112.70000
   47    58    60    60.00000  109.50000
   56    59    62    70.00000  117.34000
   56    59    63    60.00000  125.92000
   59    56    57    65.00000  137.10300
   59    62    68    70.00000  123.01800
   59    62    70    70.00000  124.00000
   59    63    99    65.00000  117.02400
   59    63    64    80.00000  123.72100
   62    68    69    35.00000  120.00000
   62    68    75    60.00000  123.20500
   62    70    71    35.00000  109.50000
   62    70    72    35.00000  109.50000
   62    70    76    70.00000  112.02700
   68    75    82    60.00000  120.93500
   68    75    99    60.00000  120.93500
   75    68    69    40.00000  117.26300
   75    82    83    35.00000  120.00000
   75    82    88    63.00000  120.00000
   75    99    98    63.00000  120.00000
   75    99    63    60.00000  119.52600
   82    88    94    63.00000  120.00000
   82    88    96    70.00000  120.00000
   88    82    83    35.00000  120.00000
   88    94    95    35.00000  120.00000
   88    94    98    63.00000  120.00000
   88    96    97    35.00000  113.00000
   94    98    99    63.00000  120.00000
   94    98   100    70.00000  120.00000
   98    94    95    35.00000  120.00000
   98    99    63    60.00000  119.52600
   98   100   101    35.00000  113.00000
   99    75    82    63.00000  120.00000
   99    63    64    75.00000  123.78400
   63    59    62    65.00000  118.96000
  100    98    99    70.00000  120.00000
   96    88    94    70.00000  120.00000
   70    62    68    70.00000  124.00000
   70    76    77    37.50000  110.70000
   70    76    40    58.35000  112.70000
   72    70    71    33.00000  107.80000
   76    47    56    70.00000  112.02700
   76    70    71    37.50000  110.70000
   76    70    72    37.50000  110.70000
   76    40    41    37.50000  110.70000
   76    40    44    50.00000  109.50000
   40    33    34    50.00000  109.50000
   40    33    38    58.35000  112.70000
   40    76    77    37.50000  110.70000
   40    44    48    60.00000  109.50000
   44    40    41    35.00000  109.50000
   44    48    49    35.00000  109.50000
   44    48    50    35.00000  109.50000
   44    48    51    35.00000  109.50000
   50    48    49    33.00000  107.80000
   51    48    49    33.00000  107.80000
   51    48    50    33.00000  107.80000
   58    47    56    85.00000  110.90400
   58    47    76    50.00000  109.50000
   58    60    61    35.00000  109.50000
   58    60    65    90.00000  108.56700
   58    60    89    92.60000  111.55000
   60    65    66    45.00000  108.72000
   60    65    67    45.00000  108.72000
   60    65    73    75.00000  109.43000
   60    89    84    60.00000  109.50000
   65    60    61    45.00000  112.01100
   65    73    74    37.50000  110.70000
   65    73    78    58.35000  112.70000
   65    73    80    50.00000  109.50000
   67    65    66    33.00000  107.80000
   73    65    66    37.50000  110.70000
   73    65    67    37.50000  110.70000
   73    78    79    37.50000  110.70000
   73    78    84    58.35000  112.70000
   73    78    86    50.00000  109.50000
   73    80    81    55.00000  108.50000
   78    73    74    37.50000  110.70000
   78    84    85    37.50000  110.70000
   78    84    89    50.00000  109.50000
   78    84    90    58.35000  112.70000
   78    86    87    55.00000  108.50000
   84    78    79    37.50000  110.70000
   84    90    91    37.50000  110.70000
   84    90    92    37.50000  110.70000
   84    90    93    37.50000  110.70000
   89    60    61    35.00000  109.50000
   89    60    65    90.00000  108.56700
   89    84    85    35.00000  109.50000
   90    84    85    37.50000  110.70000
   90    84    89    50.00000  109.50000
   92    90    91    33.00000  107.80000
   93    90    91    33.00000  107.80000
   93    90    92    33.00000  107.80000
   86    78    79    35.00000  109.50000
   86    78    84    50.00000  109.50000
   80    73    74    35.00000  109.50000
   80    73    78    50.00000  109.50000
   45    38    39    35.00000  109.50000
   45    38    42    75.00000  107.99600
   45    52    53    35.00000  109.50000
   45    52    54    35.00000  109.50000
   45    52    55    35.00000  109.50000
   52    45    46    80.00000  120.40000
   54    52    53    33.00000  107.80000
   55    52    53    33.00000  107.80000
   55    52    54    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    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -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    35    36   0.00000  1.0 1.0
   27    30    35    37   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    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   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    34   0.13850  1.0 1.0
   24    29    33    34  -1.34450 -1.0 2.0
   24    29    33    34   0.57400  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
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   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    38    39   0.15000  1.0 3.0
   29    33    38    42   0.56750  1.0 1.0
   29    33    38    42  -0.07550 -1.0 2.0
   29    33    38    42   0.20000  1.0 3.0
   29    33    38    45   0.56750  1.0 1.0
   29    33    38    45  -0.07550 -1.0 2.0
   29    33    38    45   0.20000  1.0 3.0
   29    33    40    76   0.44750  1.0 1.0
   29    33    40    76  -0.17800 -1.0 2.0
   29    33    40    76   0.20200  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    44   0.56750  1.0 1.0
   29    33    40    44  -0.07550 -1.0 2.0
   29    33    40    44   0.20000  1.0 3.0
   33    38    42    43   0.30150 -1.0 2.0
   33    38    42    47   0.60050  1.0 1.0
   33    38    42    47   0.05600 -1.0 2.0
   33    38    42    47   0.26150  1.0 3.0
   33    38    45    46   0.30150 -1.0 2.0
   33    38    45    52   0.60050  1.0 1.0
   33    38    45    52   0.05600 -1.0 2.0
   33    38    45    52   0.26150  1.0 3.0
   33    40    44    48   0.06250  1.0 1.0
   33    40    44    48  -0.01100 -1.0 2.0
   33    40    44    48   0.28050  1.0 3.0
   34    33    38    39   0.23400  1.0 3.0
   34    33    38    42  -0.09450  1.0 1.0
   34    33    38    42  -1.12950 -1.0 2.0
   34    33    38    42   0.54000  1.0 3.0
   34    33    38    45  -0.09450  1.0 1.0
   34    33    38    45  -1.12950 -1.0 2.0
   34    33    38    45   0.54000  1.0 3.0
   34    33    40    76   0.62750  1.0 1.0
   34    33    40    76  -0.30950 -1.0 2.0
   34    33    40    76   0.27300  1.0 3.0
   34    33    40    41   0.23400  1.0 3.0
   34    33    40    44   1.11900  1.0 1.0
   34    33    40    44  -1.16350 -1.0 2.0
   34    33    40    44  -0.34150  1.0 3.0
   38    33    40    76   0.56750  1.0 1.0
   38    33    40    76  -0.07550 -1.0 2.0
   38    33    40    76   0.20000  1.0 3.0
   38    33    40    41   0.15000  1.0 3.0
   38    33    40    44   0.62750  1.0 1.0
   38    33    40    44  -0.30950 -1.0 2.0
   38    33    40    44   0.27300  1.0 3.0
   38    42    47    56   0.65300  1.0 1.0
   38    42    47    56  -0.03850 -1.0 2.0
   38    42    47    56   0.33900  1.0 3.0
   38    42   -47    76   0.60050  1.0 1.0
   38    42   -47    76   0.05600 -1.0 2.0
   38    42   -47    76   0.26150  1.0 3.0
   38    42    47    58   0.55300  1.0 1.0
   38    42    47    58   1.25850 -1.0 2.0
   38    42    47    58  -0.23600  1.0 3.0
   38    45    52    53   0.00000  1.0 1.0
   38    45    52    54   0.00000  1.0 1.0
   38    45    52    55   0.00000  1.0 1.0
   39    38    42    43   0.00000  1.0 1.0
   39    38    42    47   0.00000  1.0 1.0
   39    38    45    46   0.00000  1.0 1.0
   39    38    45    52   0.00000  1.0 1.0
   42    38    45    46   0.30150 -1.0 2.0
   42    38    45    52   0.65300  1.0 1.0
   42    38    45    52  -0.03850 -1.0 2.0
   42    38    45    52   0.33900  1.0 3.0
   42    47    56    57   0.09700  1.0 1.0
   42    47    56    57   0.15600 -1.0 2.0
   42    47    56    57  -0.50800  1.0 3.0
   42    47    56    59  -0.51250  1.0 1.0
   42    47    56    59  -0.88800 -1.0 2.0
   42    47    56    59   0.08850  1.0 3.0
   42    47    76    70  -0.95700  1.0 1.0
   42    47    76    70  -0.18200 -1.0 2.0
   42    47    76    70   0.29450  1.0 3.0
   42    47    76    77  -0.11250  1.0 3.0
   42    47    76    40  -0.95700  1.0 1.0
   42    47    76    40  -0.18200 -1.0 2.0
   42    47    76    40   0.29450  1.0 3.0
   42    47    58    60  -1.11000  1.0 1.0
   42    47    58    60   0.50250 -1.0 2.0
   42    47    58    60   0.47450  1.0 3.0
   43    42    47    56   0.30150 -1.0 2.0
   43    42    47    76   0.30150 -1.0 2.0
   43    42    47    58   0.30150 -1.0 2.0
   47    56    59    62   7.00000 -1.0 2.0
   47    56    59    63   7.00000 -1.0 2.0
   47    76   -40    33   0.56750  1.0 1.0
   47    76   -40    33  -0.07550 -1.0 2.0
   47    76   -40    33   0.20000  1.0 3.0
   47    76    40    41   0.15000  1.0 3.0
   47    76    40    44   0.62750  1.0 1.0
   47    76    40    44  -0.30950 -1.0 2.0
   47    76    40    44   0.27300  1.0 3.0
   47    58    60    61   0.37050  1.0 3.0
   47    58    60    65   0.06250  1.0 1.0
   47    58    60    65  -0.01100 -1.0 2.0
   47    58    60    65   0.28050  1.0 3.0
   47    58    60    89  -0.53350  1.0 1.0
   47    58    60    89  -0.78350 -1.0 2.0
   47    58    60    89   0.33750  1.0 3.0
   56    47    76    70   0.34400  1.0 1.0
   56    47    76    70   0.09450 -1.0 2.0
   56    47    76    70   0.11100  1.0 3.0
   56    47    76    77   0.15000  1.0 3.0
   56    47    76    40   0.34400  1.0 1.0
   56    47    76    40   0.09450 -1.0 2.0
   56    47    76    40   0.11100  1.0 3.0
   56    47    58    60  -0.77900  1.0 1.0
   56    47    58    60  -0.36900 -1.0 2.0
   56    47    58    60   0.40400  1.0 3.0
   56    59    62    68   0.28850  1.0 1.0
   56    59    62    68   2.61350 -1.0 2.0
   56    59    62    68   0.78400  1.0 3.0
   56    59   -62    70  -0.18600  1.0 3.0
   56    59    63    99  -1.65800  1.0 1.0
   56    59    63    99   0.77650 -1.0 2.0
   56    59    63    64   1.00000 -1.0 2.0
   57    56    59    62   7.00000 -1.0 2.0
   57    56    59    63   7.00000 -1.0 2.0
   59    62    68    69   7.00000 -1.0 2.0
   59    62    68    75   7.00000 -1.0 2.0
   59    62    70    71   0.00000  1.0 1.0
   59    62    70    72   0.00000  1.0 1.0
   59    62    70    76   0.98200  1.0 1.0
   59    62    70    76  -0.11900 -1.0 2.0
   59    62    70    76   0.24250  1.0 3.0
   62    59    63    99  -1.65800  1.0 1.0
   62    59    63    99   0.77650 -1.0 2.0
   62    59    63    64   1.00000 -1.0 2.0
   62    68    75    82   0.15800  1.0 1.0
   62    68    75    82   1.85350 -1.0 2.0
   62    68    75    82  -0.48700  1.0 3.0
   62    68   -75    99   0.15800  1.0 1.0
   62    68   -75    99   1.85350 -1.0 2.0
   62    68   -75    99  -0.48700  1.0 3.0
   62    70   -76    47   0.34400  1.0 1.0
   62    70   -76    47   0.09450 -1.0 2.0
   62    70   -76    47   0.11100  1.0 3.0
   62    70    76    77   0.15000  1.0 3.0
   62    70    76    40   0.34400  1.0 1.0
   62    70    76    40   0.09450 -1.0 2.0
   62    70    76    40   0.11100  1.0 3.0
   68    62    70    71   0.00000  1.0 1.0
   68    62    70    72   0.00000  1.0 1.0
   68    62    70    76   0.09850  1.0 1.0
   68    62    70    76   0.15250 -1.0 2.0
   68    62    70    76  -0.50650  1.0 3.0
   68    75    82    83   3.62500 -1.0 2.0
   68    75    82    88   3.62500 -1.0 2.0
   68    75    99    98   3.62500 -1.0 2.0
   68    75    99    63   3.62500 -1.0 2.0
   69    68    75    82   0.56550  1.0 3.0
   69    68    75    99   0.56550  1.0 3.0
   75    82    88    94   3.62500 -1.0 2.0
   75    82    88    96   3.62500 -1.0 2.0
   75    99   -63    59  -0.11500  1.0 1.0
   75    99   -63    59   1.10450 -1.0 2.0
   75    99   -63    59  -0.48050  1.0 3.0
   75    99    63    64   1.05000 -1.0 2.0
   82    75    99    98   3.62500 -1.0 2.0
   82    75    99    63   3.62500 -1.0 2.0
   82    88    94    95   3.62500 -1.0 2.0
   82    88   -94    98   3.62500 -1.0 2.0
   82    88    96    97   0.84100 -1.0 2.0
   83    82    88    94   3.62500 -1.0 2.0
   83    82    88    96   3.62500 -1.0 2.0
   88    94    98    99   3.62500 -1.0 2.0
   88    94    98   100   3.62500 -1.0 2.0
   94    88    96    97   0.84100 -1.0 2.0
   94    98   -99    75   3.62500 -1.0 2.0
   94    98    99    63   3.62500 -1.0 2.0
   94    98   100   101   0.84100 -1.0 2.0
   95    94    98    99   3.62500 -1.0 2.0
   95    94    98   100   3.62500 -1.0 2.0
   98    99    63    59  -0.11500  1.0 1.0
   98    99    63    59   1.10450 -1.0 2.0
   98    99    63    59  -0.48050  1.0 3.0
   98    99    63    64   1.05000 -1.0 2.0
   99    75    82    83   3.62500 -1.0 2.0
   99    75   -82    88   3.62500 -1.0 2.0
   99    98   100   101   0.84100 -1.0 2.0
   63    59   -62    68  -0.18600  1.0 3.0
   63    59    62    70   1.08500 -1.0 2.0
  100    98    99    75   3.62500 -1.0 2.0
  100    98    99    63   3.62500 -1.0 2.0
   96    88    94    95   3.62500 -1.0 2.0
   96    88    94    98   3.62500 -1.0 2.0
   70    62    68    69   7.00000 -1.0 2.0
   70    62    68    75   7.00000 -1.0 2.0
   70    76    40    33   0.56750  1.0 1.0
   70    76    40    33  -0.07550 -1.0 2.0
   70    76    40    33   0.20000  1.0 3.0
   70    76    40    41   0.15000  1.0 3.0
   70    76    40    44   0.62750  1.0 1.0
   70    76    40    44  -0.30950 -1.0 2.0
   70    76    40    44   0.27300  1.0 3.0
   71    70    76    47   0.15000  1.0 3.0
   71    70    76    77   0.15000  1.0 3.0
   71    70    76    40   0.15000  1.0 3.0
   72    70    76    47   0.15000  1.0 3.0
   72    70    76    77   0.15000  1.0 3.0
   72    70    76    40   0.15000  1.0 3.0
   76    47    56    57   0.09700  1.0 1.0
   76    47    56    57   0.15600 -1.0 2.0
   76    47    56    57  -0.50800  1.0 3.0
   76    47   -56    59   0.09850  1.0 1.0
   76    47   -56    59   0.15250 -1.0 2.0
   76    47   -56    59  -0.50650  1.0 3.0
   76    47    58    60   0.06250  1.0 1.0
   76    47    58    60  -0.01100 -1.0 2.0
   76    47    58    60   0.28050  1.0 3.0
   76    40    44    48   0.06250  1.0 1.0
   76    40    44    48  -0.01100 -1.0 2.0
   76    40    44    48   0.28050  1.0 3.0
   77    76    40    33   0.15000  1.0 3.0
   77    76    40    41   0.15000  1.0 3.0
   77    76    40    44   0.23400  1.0 3.0
   40    33    38    39   0.15000  1.0 3.0
   40    33   -38    42  -0.95700  1.0 1.0
   40    33   -38    42  -0.18200 -1.0 2.0
   40    33   -38    42   0.29450  1.0 3.0
   40    33    38    45  -0.95700  1.0 1.0
   40    33    38    45  -0.18200 -1.0 2.0
   40    33    38    45   0.29450  1.0 3.0
   40    44    48    49   0.37050  1.0 3.0
   40    44    48    50   0.37050  1.0 3.0
   40    44    48    51   0.37050  1.0 3.0
   41    40    44    48   0.37050  1.0 3.0
   58    47    56    57   0.09700  1.0 1.0
   58    47    56    57   0.15600 -1.0 2.0
   58    47    56    57  -0.50800  1.0 3.0
   58    47    56    59   0.39000  1.0 1.0
   58    47    56    59  -0.05800 -1.0 2.0
   58    47    56    59  -0.55150  1.0 3.0
   58    47    76    70   0.62750  1.0 1.0
   58    47    76    70  -0.30950 -1.0 2.0
   58    47    76    70   0.27300  1.0 3.0
   58    47    76    77   0.23400  1.0 3.0
   58    47    76    40   0.62750  1.0 1.0
   58    47    76    40  -0.30950 -1.0 2.0
   58    47    76    40   0.27300  1.0 3.0
   58    60    65    66   0.23400  1.0 3.0
   58    60    65    67   0.23400  1.0 3.0
   58    60    65    73   0.62750  1.0 1.0
   58    60    65    73  -0.30950 -1.0 2.0
   58    60    65    73   0.27300  1.0 3.0
   58    60    89    84  -0.81800  1.0 1.0
   60    65    73    74   0.15000  1.0 3.0
   60    65    73    78   3.97050  1.0 1.0
   60    65    73    80   0.86500  1.0 1.0
   60    65    73    80  -0.17500 -1.0 2.0
   60    65    73    80   0.20800  1.0 3.0
   61    60    65    66   0.15000  1.0 3.0
   61    60    65    67   0.15000  1.0 3.0
   61    60    65    73   0.15000  1.0 3.0
   61    60    89    84   0.37050  1.0 3.0
   65    60    89    84   0.06250  1.0 1.0
   65    60    89    84  -0.01100 -1.0 2.0
   65    60    89    84   0.28050  1.0 3.0
   65    73    78    79   0.15000  1.0 3.0
   65    73   -78    84   0.56750  1.0 1.0
   65    73   -78    84  -0.07550 -1.0 2.0
   65    73   -78    84   0.20000  1.0 3.0
   65    73    78    86   0.86500  1.0 1.0
   65    73    78    86  -0.17500 -1.0 2.0
   65    73    78    86   0.20800  1.0 3.0
   65    73    80    81  -0.11600  1.0 1.0
   65    73    80    81  -0.09450 -1.0 2.0
   65    73    80    81   0.21250  1.0 3.0
   66    65    73    74   0.15000  1.0 3.0
   66    65    73    78   0.15000  1.0 3.0
   66    65    73    80   0.23400  1.0 3.0
   67    65    73    74   0.15000  1.0 3.0
   67    65    73    78   0.15000  1.0 3.0
   67    65    73    80   0.23400  1.0 3.0
   73    78    84    85   0.15000  1.0 3.0
   73    78    84    89   0.62750  1.0 1.0
   73    78    84    89  -0.30950 -1.0 2.0
   73    78    84    89   0.27300  1.0 3.0
   73    78    84    90   0.56750  1.0 1.0
   73    78    84    90  -0.07550 -1.0 2.0
   73    78    84    90   0.20000  1.0 3.0
   73    78    86    87  -0.11600  1.0 1.0
   73    78    86    87  -0.09450 -1.0 2.0
   73    78    86    87   0.21250  1.0 3.0
   74    73    78    79   0.15000  1.0 3.0
   74    73    78    84   0.15000  1.0 3.0
   74    73    78    86   0.23400  1.0 3.0
   74    73    80    81   0.19450  1.0 3.0
   78    73    80    81  -0.11600  1.0 1.0
   78    73    80    81  -0.09450 -1.0 2.0
   78    73    80    81   0.21250  1.0 3.0
   78    84   -89    60   0.06250  1.0 1.0
   78    84   -89    60  -0.01100 -1.0 2.0
   78    84   -89    60   0.28050  1.0 3.0
   78    84    90    91   0.15000  1.0 3.0
   78    84    90    92   0.15000  1.0 3.0
   78    84    90    93   0.15000  1.0 3.0
   79    78    84    85   0.15000  1.0 3.0
   79    78    84    89   0.23400  1.0 3.0
   79    78    84    90   0.15000  1.0 3.0
   79    78    86    87   0.19450  1.0 3.0
   84    78    86    87  -0.11600  1.0 1.0
   84    78    86    87  -0.09450 -1.0 2.0
   84    78    86    87   0.21250  1.0 3.0
   85    84    89    60   0.37050  1.0 3.0
   85    84    90    91   0.15000  1.0 3.0
   85    84    90    92   0.15000  1.0 3.0
   85    84    90    93   0.15000  1.0 3.0
   89    60    65    66   0.23400  1.0 3.0
   89    60    65    67   0.23400  1.0 3.0
   89    60   -65    73   0.62750  1.0 1.0
   89    60   -65    73  -0.30950 -1.0 2.0
   89    60   -65    73   0.27300  1.0 3.0
   89    84    90    91   0.23400  1.0 3.0
   89    84    90    92   0.23400  1.0 3.0
   89    84    90    93   0.23400  1.0 3.0
   90    84    89    60   0.06250  1.0 1.0
   90    84    89    60  -0.01100 -1.0 2.0
   90    84    89    60   0.28050  1.0 3.0
   86    78    84    85   0.23400  1.0 3.0
   86    78    84    89   3.69350  1.0 1.0
   86    78    84    89  -1.82950 -1.0 2.0
   86    78    84    90   0.86500  1.0 1.0
   86    78    84    90  -0.17500 -1.0 2.0
   86    78    84    90   0.20800  1.0 3.0
   80    73    78    79   0.23400  1.0 3.0
   80    73    78    84   0.86500  1.0 1.0
   80    73    78    84  -0.17500 -1.0 2.0
   80    73    78    84   0.20800  1.0 3.0
   80    73    78    86   3.75450  1.0 1.0
   45    38    42    43   0.30150 -1.0 2.0
   45    38    42    47   0.65300  1.0 1.0
   45    38    42    47  -0.03850 -1.0 2.0
   45    38    42    47   0.33900  1.0 3.0
   46    45    52    53   0.00000  1.0 1.0
   46    45    52    54   0.00000  1.0 1.0
   46    45    52    55   0.00000  1.0 1.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   38    47    42    43  10.50000 -1.0 2.0
   47    57    56    59   1.10000 -1.0 2.0
   62    63    59    56   1.10000 -1.0 2.0
   59    70    62    68   1.10000 -1.0 2.0
   75    69    68    62   1.10000 -1.0 2.0
   82    99    75    68   4.00000 -1.0 2.0
   88    83    82    75   1.10000 -1.0 2.0
   94    96    88    82   4.00000 -1.0 2.0
   98    95    94    88   1.10000 -1.0 2.0
   99   100    98    94   4.00000 -1.0 2.0
   98    63    99    75   4.00000 -1.0 2.0
   59    99    63    64  10.50000 -1.0 2.0
   38    52    45    46  10.50000 -1.0 2.0
END
