* LIGAND DATABASE FILE (OPLS2005)
*
001     102   105    193    310     579
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02033    61.82564    79.01990
    3     1 S   H    _H1_     3     1.02091    50.43235  -125.05725
    4     1 S   H    _H2_     4     1.02104   106.14401   -23.93045
    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   167.74441
   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    57.98762
   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     8.59078
   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   105.32505
   25    24 S   HC   HB21    33     1.08519   110.61667    58.77943
   26    24 S   HC   HB22    34     1.08547   109.95733   179.17291
   27    22 S   N    _N3_    24     1.34263   118.97450    10.45203
   28    27 S   H    _HN3    25     1.03492   120.05970     5.06895
   29    24 S   S    _SG2    35     1.81647   112.43692   -61.22030
   30    27 S   CT   _CA3    26     1.46098   124.53040  -172.10347
   31    30 S   HC   HA31    27     1.12298   109.15732    14.31073
   32    30 S   HC   HA32    28     1.12301   109.23063   127.81991
   33    29 S   CT   _C21    36     1.84408    97.06269  -178.13072
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CM   _C8_    37     1.50666   108.77262    59.95797
   38    33 S   CT   _C19    60     1.57489   113.64357  -167.66599
   39    38 S   HC   _H49    61     1.09990   106.46462   -63.19383
   40    37 S   CMA  _C9_    38     1.35122   111.70315  -115.85228
   41    40 S   OM   _O27    39     1.26416   128.51870   180.00000
   42    37 S   CT   _C16    43     1.52172   124.07105    61.20154
   43    42 S   HC   _H45    44     1.09431   108.10279   167.71122
   44    42 S   HC   _H46    45     1.09405   107.97917   -79.87333
   45    38 S   CT   _C29    62     1.54699   113.30974    50.89036
   46    45 S   HC   _H65    63     1.08834   108.40608    50.84282
   47    40 S   OS   _O34    40     1.42216   109.60205     1.16163
   48    42 S   CT   _C18    46     1.54452   119.54954    41.88524
   49    48 S   HC   _H48    47     1.05752   107.57576   -60.83930
   50    45 S   CT   _C27    64     1.52240   110.38267   172.66527
   51    50 S   HC   _H62    65     1.09840   109.96799    39.99096
   52    50 S   HC   _H63    66     1.09716   110.02370   -78.27215
   53    45 S   OH   _O39    83     1.41789   107.86628   -67.02132
   54    53 S   HO   _H68    84     0.97183   106.96786   -60.01073
   55    33 S   CO4  _C13    41     1.51670   105.83851   -45.07602
   56    55 S   O    _O33    42     1.22423   125.82762   -59.88554
   57    48 S   CT   _C15    48     1.54837   117.45599    60.63727
   58    57 S   HC   _H43    49     1.10107   108.76112  -134.48242
   59    57 S   HC   _H44    50     1.10561   107.81657   114.39146
   60    50 S   CT   _C26    67     1.53343   111.30740   160.24659
   61    60 S   HC   _H60    68     1.09477   109.41061   -59.58054
   62    60 S   HC   _H61    69     1.09641   109.42758    57.76739
   63    48 S   CT   _C28    87     1.53866   108.92705  -174.57436
   64    63 S   HC   _H64    88     1.09192   109.01412    50.55694
   65    57 S   CM   _C6_    51     1.49015   117.98315    -8.15748
   66    60 S   CT   _C25    70     1.53076   111.17770   178.86927
   67    66 S   HC   _H58    71     1.09664   109.72222    58.31922
   68    66 S   HC   _H59    72     1.09694   109.02733   -58.21545
   69    63 S   CT   _C20    89     1.52269   111.49072   172.05890
   70    69 S   HC   _H50    90     1.09701   108.45419    61.28951
   71    63 S   OH   _O38   101     1.42075   108.88219   -66.86620
   72    71 S   HO   _H67   102     0.97074   106.74009    59.97034
   73    65 S   CM   _C7_    52     1.33690   130.69711   -83.75128
   74    66 S   CT   _C24    73     1.53108   113.42952  -178.70487
   75    74 S   HC   _H56    74     1.09709   109.58049   -60.00787
   76    74 S   HC   _H57    75     1.09794   108.11861    55.90512
   77    69 S   CT   _C14    91     1.52267   111.50184   -60.99166
   78    77 S   HC   _H41    92     1.09465   109.80560    68.91500
   79    77 S   HC   _H42    93     1.09658   111.58937   -50.68355
   80    73 S   CO4  _C12    53     1.47351   106.49033  -176.18659
   81    80 S   O    _O30    54     1.21749   127.20212   178.25954
   82    73 S   CT   _C17    58     1.50469   130.14208     4.35321
   83    82 S   HC   _H47    59     1.08227   106.06013   -82.93728
   84    74 S   CT   _C23    76     1.52932   113.44968   176.96430
   85    84 S   HC   _H54    77     1.09584   109.84413   -55.97669
   86    84 S   HC   _H55    78     1.09454   110.37939    62.25522
   87    77 S   CM   _C5_    94     1.49030   108.86407  -170.42234
   88    87 S   HC   _H40    95     1.08529   118.48605  -153.64555
   89    80 S   OS   _O35    55     1.35557   107.73669    -1.41927
   90    84 S   CT   _C22    79     1.52050   111.37181  -177.03496
   91    90 S   HC   _H51    80     1.09539   111.05191   -58.50073
   92    90 S   HC   _H52    81     1.09459   110.27368    61.18306
   93    90 S   HC   _H53    82     1.09478   110.99498  -179.07974
   94    82 S   OH   _O37    85     1.42955   109.50107   162.76523
   95    94 S   HO   _H66    86     0.96832   106.16188    60.01060
   96    87 S   CM   _C4_    96     1.33617   121.76667    26.59390
   97    96 S   HC   _H39    97     1.08425   121.20654   179.23332
   98    65 S   CO4  _C11    56     1.46544   120.78752    98.83770
   99    98 S   O    _O29    57     1.21692   126.69988    -3.23580
  100    96 S   CO4  _C10    98     1.47443   120.57534     3.86082
  101   100 S   O    _O28    99     1.22675   120.83246   167.85045
  102    69 S   OS   _O36   100     1.44454   107.85017   177.43578
  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
  20   2   1   1  16  21   9   8   3  14   5   4  15   7   2  15
   8  12   6   5   3   1   2   1  13   5   4   9   5   4  12   6
   9   9   5   4  12   7   3   1   9   9   5   4   8   5   4   7
   3   5   2   6   5   4   6   3   2   3   2   1   1   1   1   4
   3   1   1   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    55    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    47    55    56    42    82    38    39    45  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    41    47    55    56    42    43    44    48    73    82    83    38    39    45    46    50    53    94  
   35    36  
   36  
    0  
   40    41    47    55    56    42    43    44    48    49    57    82    38    39    45    63  
   39    45    46    50    51    52    60    53    54    94    95    40    42    47    55    56    65    73    80    82    83  
   45    46    50    53    94    55    73    82    83  
   41    47    55    56    42    43    44    48  
   47    55    42  
   43    44    48    49    57    58    59    65    63    64    69    71    47    55  
   44    48    49    57    63  
   48    49    57    63  
   46    50    51    52    60    61    62    66    53    54    94    55    73    82    83  
   50    51    52    60    53    54    82  
   55    56  
   49    57    58    59    65    73    98    63    64    69    70    77   102    71    72  
   57    58    59    65    63    64    69    71  
   51    52    60    61    62    66    67    68    74    53    54    82  
   52    60    61    62    66    53  
   60    61    62    66    53  
   54    60    82  
    0  
   56    82  
    0  
   58    59    65    73    80    89    98    99    82    63    64    69    71  
   59    65    73    98    63  
   65    73    98    63  
   61    62    66    67    68    74    75    76    84  
   62    66    67    68    74  
   66    67    68    74  
   64    69    70    77    78    79    87   100   102    71    72    65  
   69    70    77   102    71    72  
   73    80    81    89    98    99    82    83    94  
   67    68    74    75    76    84    85    86    90  
   68    74    75    76    84  
   74    75    76    84  
   70    77    78    79    87    88    96   100   101   102    71    72  
   77    78    79    87   100   102    71  
   72    77   102  
    0  
   80    81    89    98    99    82    83    94    95  
   75    76    84    85    86    90    91    92    93  
   76    84    85    86    90  
   84    85    86    90  
   78    79    87    88    96    97   100   102  
   79    87    88    96   102  
   87    88    96   102  
   81    89    98    99    82    83    94  
   89    98    82  
   83    94    95    89    98  
   94    95  
   85    86    90    91    92    93  
   86    90    91    92    93  
   90    91    92    93  
   88    96    97   100   101   102  
   96    97   100  
   98    99  
   91    92    93  
   92    93  
   93  
    0  
   95  
    0  
   97   100   101   102  
  100   101   102  
   99  
    0  
  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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.8500   0.1400  -0.565000   1.5900   1.4000   0.020110767  -0.896042159
   48   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.1200   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   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   56   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   57   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   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   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   71   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   72   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   73   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   74   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   81   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   82   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   88   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   89   3.0000   0.1700  -0.160000   1.5900   1.4000   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   95   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   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   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   99   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
  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    55   317.000  1.522
   33    38   268.000  1.529
   37    40   465.000  1.376
   37    42   317.000  1.510
   40    41   745.000  1.250
   40    47   440.000  1.360
   47    55   214.000  1.327
   55    56   570.000  1.229
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    48   268.000  1.529
   48    49   340.000  1.090
   48    57   268.000  1.529
   48    63   268.000  1.529
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    65   317.000  1.510
   65    73   549.000  1.340
   65    98   320.000  1.462
   73    80   320.000  1.462
   73    82   317.000  1.510
   80    81   570.000  1.229
   80    89   214.000  1.327
   89    98   214.000  1.327
   98    99   570.000  1.229
   82    83   340.000  1.090
   82    38   268.000  1.529
   82    94   320.000  1.410
   38    39   340.000  1.090
   38    45   268.000  1.529
   45    46   340.000  1.090
   45    50   268.000  1.529
   45    53   320.000  1.410
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    60   268.000  1.529
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    66   268.000  1.529
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    74   268.000  1.529
   74    75   340.000  1.090
   74    76   340.000  1.090
   74    84   268.000  1.529
   84    85   340.000  1.090
   84    86   340.000  1.090
   84    90   268.000  1.529
   90    91   340.000  1.090
   90    92   340.000  1.090
   90    93   340.000  1.090
   53    54   553.000  0.945
   94    95   553.000  0.945
   63    64   340.000  1.090
   63    69   268.000  1.529
   63    71   320.000  1.410
   69    70   340.000  1.090
   69    77   268.000  1.529
   69   102   320.000  1.410
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    87   317.000  1.510
   87    88   340.000  1.080
   87    96   549.000  1.340
   96    97   340.000  1.080
   96   100   320.000  1.462
  100   101   570.000  1.229
  100   102   214.000  1.327
   71    72   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    55    75.00000  110.18000
   29    33    38    75.00000  111.63000
   33    37    40    70.00000  124.00000
   33    37    42    65.00000  117.92700
   33    55    47    81.00000  111.40000
   33    55    56    80.00000  120.40000
   33    38    82    58.35000  112.70000
   33    38    39    37.50000  110.70000
   33    38    45    58.35000  112.70000
   37    40    41    65.00000  137.10300
   37    40    47    80.00000  120.01400
   37    42    43    35.00000  109.50000
   37    42    44    35.00000  109.50000
   37    42    48    70.00000  112.02700
   40    47    55    90.00000  114.22900
   47    40    41    65.00000  121.00000
   47    55    56    83.00000  123.40000
   55    33    37    70.00000  109.06800
   42    37    40    70.00000  124.00000
   42    48    49    37.50000  110.70000
   42    48    57    58.35000  112.70000
   42    48    63    58.35000  112.70000
   44    42    43    33.00000  107.80000
   48    42    43    37.50000  110.70000
   48    42    44    37.50000  110.70000
   48    57    58    37.50000  110.70000
   48    57    59    37.50000  110.70000
   48    57    65    70.00000  112.02700
   48    63    64    37.50000  110.70000
   48    63    69    58.35000  112.70000
   48    63    71    50.00000  109.50000
   57    48    49    37.50000  110.70000
   57    65    73    70.00000  124.00000
   57    65    98    65.00000  116.34900
   59    57    58    33.00000  107.80000
   65    57    58    35.00000  109.50000
   65    57    59    35.00000  109.50000
   65    73    80    65.00000  118.96000
   65    73    82    70.00000  124.00000
   65    98    89    90.00000  111.29400
   65    98    99    80.00000  123.72100
   73    80    81    80.00000  123.72100
   73    80    89    90.00000  111.29400
   73    82    83    35.00000  109.50000
   73    82    38    70.00000  112.02700
   73    82    94    90.00000  110.39200
   80    89    98   105.00000  110.06700
   89    80    81    83.00000  123.40000
   89    98    99    83.00000  123.40000
   98    65    73    65.00000  118.96000
   82    73    80    65.00000  116.34900
   82    38    39    37.50000  110.70000
   82    38    45    58.35000  112.70000
   82    94    95    55.00000  108.50000
   38    33    37    70.00000  112.02700
   38    33    55    63.00000  111.10000
   38    82    83    37.50000  110.70000
   38    45    46    37.50000  110.70000
   38    45    50    58.35000  112.70000
   38    45    53    50.00000  109.50000
   45    38    39    37.50000  110.70000
   45    50    51    37.50000  110.70000
   45    50    52    37.50000  110.70000
   45    50    60    58.35000  112.70000
   45    53    54    55.00000  108.50000
   50    45    46    37.50000  110.70000
   50    60    61    37.50000  110.70000
   50    60    62    37.50000  110.70000
   50    60    66    58.35000  112.70000
   52    50    51    33.00000  107.80000
   60    50    51    37.50000  110.70000
   60    50    52    37.50000  110.70000
   60    66    67    37.50000  110.70000
   60    66    68    37.50000  110.70000
   60    66    74    58.35000  112.70000
   62    60    61    33.00000  107.80000
   66    60    61    37.50000  110.70000
   66    60    62    37.50000  110.70000
   66    74    75    37.50000  110.70000
   66    74    76    37.50000  110.70000
   66    74    84    58.35000  112.70000
   68    66    67    33.00000  107.80000
   74    66    67    37.50000  110.70000
   74    66    68    37.50000  110.70000
   74    84    85    37.50000  110.70000
   74    84    86    37.50000  110.70000
   74    84    90    58.35000  112.70000
   76    74    75    33.00000  107.80000
   84    74    75    37.50000  110.70000
   84    74    76    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
   86    84    85    33.00000  107.80000
   90    84    85    37.50000  110.70000
   90    84    86    37.50000  110.70000
   92    90    91    33.00000  107.80000
   93    90    91    33.00000  107.80000
   93    90    92    33.00000  107.80000
   53    45    46    35.00000  109.50000
   53    45    50    50.00000  109.50000
   94    82    83    35.00000  109.50000
   94    82    38    50.00000  109.50000
   63    48    49    37.50000  110.70000
   63    48    57    58.35000  112.70000
   63    69    70    37.50000  110.70000
   63    69    77    58.35000  112.70000
   63    69   102    50.00000  109.50000
   63    71    72    55.00000  108.50000
   69    63    64    37.50000  110.70000
   69    77    78    37.50000  110.70000
   69    77    79    37.50000  110.70000
   69    77    87    70.00000  112.02700
   69   102   100    83.00000  116.90000
   77    69    70    37.50000  110.70000
   77    87    88    35.00000  117.00000
   77    87    96    70.00000  124.00000
   79    77    78    33.00000  107.80000
   87    77    78    35.00000  109.50000
   87    77    79    35.00000  109.50000
   87    96    97    35.00000  120.00000
   87    96   100    65.00000  118.96000
   96    87    88    35.00000  120.00000
   96   100   101    80.00000  123.72100
   96   100   102    90.00000  111.29400
  100    96    97    40.00000  117.72500
  102    69    70    35.00000  109.50000
  102    69    77    50.00000  109.50000
  102   100   101    83.00000  123.40000
   71    63    64    35.00000  109.50000
   71    63    69    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    55   0.01700  1.0 1.0
   24    29    33    55  -0.23550 -1.0 2.0
   24    29    33    55   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    40   0.42700  1.0 1.0
   29    33    37    40  -0.70350 -1.0 2.0
   29    33    37    40  -0.43150  1.0 3.0
   29    33    37    42   0.30250  1.0 1.0
   29    33    37    42  -0.14950 -1.0 2.0
   29    33    37    42   0.36900  1.0 3.0
   29    33    55    47   0.40000  1.0 3.0
   29    33    55    56   0.30150 -1.0 2.0
   29    33    38    82   0.44750  1.0 1.0
   29    33    38    82  -0.17800 -1.0 2.0
   29    33    38    82   0.20200  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    45   0.44750  1.0 1.0
   29    33    38    45  -0.17800 -1.0 2.0
   29    33    38    45   0.20200  1.0 3.0
   33    37    40    41   7.00000 -1.0 2.0
   33    37   -40    47   7.00000 -1.0 2.0
   33    37    42    43   0.34800  1.0 3.0
   33    37    42    44   0.34800  1.0 3.0
   33    37    42    48   0.46850  1.0 1.0
   33    37    42    48   0.08550 -1.0 2.0
   33    37    42    48   0.09800  1.0 3.0
   33    38    45    46   0.15000  1.0 3.0
   33    38    45    50   0.56750  1.0 1.0
   33    38    45    50  -0.07550 -1.0 2.0
   33    38    45    50   0.20000  1.0 3.0
   33    38    45    53   0.86500  1.0 1.0
   33    38    45    53  -0.17500 -1.0 2.0
   33    38    45    53   0.20800  1.0 3.0
   37    33   -55    47   0.40000  1.0 3.0
   37    33    55    56   0.30150 -1.0 2.0
   37    33    38    82   0.34400  1.0 1.0
   37    33    38    82   0.09450 -1.0 2.0
   37    33    38    82   0.11100  1.0 3.0
   37    33    38    39   0.15000  1.0 3.0
   37    33    38    45   0.34400  1.0 1.0
   37    33    38    45   0.09450 -1.0 2.0
   37    33    38    45   0.11100  1.0 3.0
   37    40   -47    55  -1.93650  1.0 1.0
   37    40   -47    55   2.17750 -1.0 2.0
   37    40   -47    55  -0.40250  1.0 3.0
   37    42    48    49   0.15000  1.0 3.0
   37    42    48    57   0.34400  1.0 1.0
   37    42    48    57   0.09450 -1.0 2.0
   37    42    48    57   0.11100  1.0 3.0
   37    42    48    63   0.34400  1.0 1.0
   37    42    48    63   0.09450 -1.0 2.0
   37    42    48    63   0.11100  1.0 3.0
   40    37    42    43   0.00000  1.0 1.0
   40    37    42    44   0.00000  1.0 1.0
   40    37    42    48   0.09850  1.0 1.0
   40    37    42    48   0.15250 -1.0 2.0
   40    37    42    48  -0.50650  1.0 3.0
   40    47   -55    33   0.82650  1.0 1.0
   40    47   -55    33   1.69000 -1.0 2.0
   40    47    55    56   3.00000 -1.0 2.0
   41    40    47    55   2.00000 -1.0 2.0
   55    33   -37    40  -0.51250  1.0 1.0
   55    33   -37    40  -0.88800 -1.0 2.0
   55    33   -37    40   0.08850  1.0 3.0
   55    33    37    42   0.17250  1.0 1.0
   55    33    37    42  -0.04100 -1.0 2.0
   55    33    37    42  -0.33850  1.0 3.0
   55    33    38    82  -0.95700  1.0 1.0
   55    33    38    82  -0.18200 -1.0 2.0
   55    33    38    82   0.29450  1.0 3.0
   55    33    38    39  -0.11250  1.0 3.0
   55    33    38    45  -0.95700  1.0 1.0
   55    33    38    45  -0.18200 -1.0 2.0
   55    33    38    45   0.29450  1.0 3.0
   42    37    40    41   7.00000 -1.0 2.0
   42    37    40    47   7.00000 -1.0 2.0
   42    48    57    58   0.15000  1.0 3.0
   42    48    57    59   0.15000  1.0 3.0
   42    48    57    65   0.34400  1.0 1.0
   42    48    57    65   0.09450 -1.0 2.0
   42    48    57    65   0.11100  1.0 3.0
   42    48    63    64   0.15000  1.0 3.0
   42    48    63    69   0.56750  1.0 1.0
   42    48    63    69  -0.07550 -1.0 2.0
   42    48    63    69   0.20000  1.0 3.0
   42    48    63    71   0.86500  1.0 1.0
   42    48    63    71  -0.17500 -1.0 2.0
   42    48    63    71   0.20800  1.0 3.0
   43    42    48    49   0.15000  1.0 3.0
   43    42    48    57   0.15000  1.0 3.0
   43    42    48    63   0.15000  1.0 3.0
   44    42    48    49   0.15000  1.0 3.0
   44    42    48    57   0.15000  1.0 3.0
   44    42    48    63   0.15000  1.0 3.0
   48    57    65    73   0.09850  1.0 1.0
   48    57    65    73   0.15250 -1.0 2.0
   48    57    65    73  -0.50650  1.0 3.0
   48    57    65    98   0.09700  1.0 1.0
   48    57    65    98   0.15600 -1.0 2.0
   48    57    65    98  -0.50800  1.0 3.0
   48    63    69    70   0.15000  1.0 3.0
   48    63    69    77   0.56750  1.0 1.0
   48    63    69    77  -0.07550 -1.0 2.0
   48    63    69    77   0.20000  1.0 3.0
   48    63    69   102   0.62750  1.0 1.0
   48    63    69   102  -0.30950 -1.0 2.0
   48    63    69   102   0.27300  1.0 3.0
   48    63    71    72  -0.11600  1.0 1.0
   48    63    71    72  -0.09450 -1.0 2.0
   48    63    71    72   0.21250  1.0 3.0
   49    48    57    58   0.15000  1.0 3.0
   49    48    57    59   0.15000  1.0 3.0
   49    48    57    65   0.15000  1.0 3.0
   49    48    63    64   0.15000  1.0 3.0
   49    48    63    69   0.15000  1.0 3.0
   49    48    63    71   0.23400  1.0 3.0
   57    48    63    64   0.15000  1.0 3.0
   57    48    63    69   0.56750  1.0 1.0
   57    48    63    69  -0.07550 -1.0 2.0
   57    48    63    69   0.20000  1.0 3.0
   57    48    63    71   0.86500  1.0 1.0
   57    48    63    71  -0.17500 -1.0 2.0
   57    48    63    71   0.20800  1.0 3.0
   57    65    73    80   7.00000 -1.0 2.0
   57    65    73    82   7.00000 -1.0 2.0
   57    65    98    89  -0.15000  1.0 1.0
   57    65    98    89   0.89550 -1.0 2.0
   57    65    98    89  -0.06900  1.0 3.0
   57    65    98    99  -0.64400  1.0 1.0
   57    65    98    99   0.26850 -1.0 2.0
   58    57    65    73   0.00000  1.0 1.0
   58    57    65    98   0.15000  1.0 3.0
   59    57    65    73   0.00000  1.0 1.0
   59    57    65    98   0.15000  1.0 3.0
   65    73    80    81   1.00000 -1.0 2.0
   65    73   -80    89  -0.56150  1.0 1.0
   65    73   -80    89   2.19150 -1.0 2.0
   65    73    82    83   0.00000  1.0 1.0
   65    73    82    38   0.09850  1.0 1.0
   65    73    82    38   0.15250 -1.0 2.0
   65    73    82    38  -0.50650  1.0 3.0
   65    73    82    94   0.67800  1.0 1.0
   65    73    82    94   0.47050 -1.0 2.0
   65    73    82    94  -0.62500  1.0 3.0
   73    65   -98    89  -0.56150  1.0 1.0
   73    65   -98    89   2.19150 -1.0 2.0
   73    65    98    99   1.00000 -1.0 2.0
   73    80   -89    98   2.00000 -1.0 2.0
   73    82    38    33   0.34400  1.0 1.0
   73    82    38    33   0.09450 -1.0 2.0
   73    82    38    33   0.11100  1.0 3.0
   73    82    38    39   0.15000  1.0 3.0
   73    82    38    45   0.34400  1.0 1.0
   73    82    38    45   0.09450 -1.0 2.0
   73    82    38    45   0.11100  1.0 3.0
   73    82    94    95  -0.07800  1.0 1.0
   73    82    94    95  -0.21500 -1.0 2.0
   73    82    94    95  -0.03150  1.0 3.0
   80    73    82    83   0.15000  1.0 3.0
   80    73    82    38   0.09700  1.0 1.0
   80    73    82    38   0.15600 -1.0 2.0
   80    73    82    38  -0.50800  1.0 3.0
   80    73    82    94   0.09700  1.0 1.0
   80    73    82    94   0.15600 -1.0 2.0
   80    73    82    94  -0.50800  1.0 3.0
   80    89   -98    65   2.00000 -1.0 2.0
   80    89    98    99   3.00000 -1.0 2.0
   81    80    89    98   3.00000 -1.0 2.0
   98    65   -73    80   7.00000 -1.0 2.0
   98    65    73    82   7.00000 -1.0 2.0
   82    73    80    81  -0.64400  1.0 1.0
   82    73    80    81   0.26850 -1.0 2.0
   82    73    80    89  -0.15000  1.0 1.0
   82    73    80    89   0.89550 -1.0 2.0
   82    73    80    89  -0.06900  1.0 3.0
   82    38    45    46   0.15000  1.0 3.0
   82    38    45    50   0.56750  1.0 1.0
   82    38    45    50  -0.07550 -1.0 2.0
   82    38    45    50   0.20000  1.0 3.0
   82    38    45    53   0.86500  1.0 1.0
   82    38    45    53  -0.17500 -1.0 2.0
   82    38    45    53   0.20800  1.0 3.0
   83    82    38    33   0.15000  1.0 3.0
   83    82    38    39   0.15000  1.0 3.0
   83    82    38    45   0.15000  1.0 3.0
   83    82    94    95   0.19450  1.0 3.0
   38    33    37    40   0.09850  1.0 1.0
   38    33    37    40   0.15250 -1.0 2.0
   38    33    37    40  -0.50650  1.0 3.0
   38    33    37    42   0.46850  1.0 1.0
   38    33    37    42   0.08550 -1.0 2.0
   38    33    37    42   0.09800  1.0 3.0
   38    33    55    47   0.36750  1.0 3.0
   38    33    55    56   0.30150 -1.0 2.0
   38    82    94    95  -0.11600  1.0 1.0
   38    82    94    95  -0.09450 -1.0 2.0
   38    82    94    95   0.21250  1.0 3.0
   38    45    50    51   0.15000  1.0 3.0
   38    45    50    52   0.15000  1.0 3.0
   38    45    50    60   0.56750  1.0 1.0
   38    45    50    60  -0.07550 -1.0 2.0
   38    45    50    60   0.20000  1.0 3.0
   38    45    53    54  -0.11600  1.0 1.0
   38    45    53    54  -0.09450 -1.0 2.0
   38    45    53    54   0.21250  1.0 3.0
   39    38    45    46   0.15000  1.0 3.0
   39    38    45    50   0.15000  1.0 3.0
   39    38    45    53   0.23400  1.0 3.0
   45    50    60    61   0.15000  1.0 3.0
   45    50    60    62   0.15000  1.0 3.0
   45    50    60    66   0.56750  1.0 1.0
   45    50    60    66  -0.07550 -1.0 2.0
   45    50    60    66   0.20000  1.0 3.0
   46    45    50    51   0.15000  1.0 3.0
   46    45    50    52   0.15000  1.0 3.0
   46    45    50    60   0.15000  1.0 3.0
   46    45    53    54   0.19450  1.0 3.0
   50    45    53    54  -0.11600  1.0 1.0
   50    45    53    54  -0.09450 -1.0 2.0
   50    45    53    54   0.21250  1.0 3.0
   50    60    66    67   0.15000  1.0 3.0
   50    60    66    68   0.15000  1.0 3.0
   50    60    66    74   0.56750  1.0 1.0
   50    60    66    74  -0.07550 -1.0 2.0
   50    60    66    74   0.20000  1.0 3.0
   51    50    60    61   0.15000  1.0 3.0
   51    50    60    62   0.15000  1.0 3.0
   51    50    60    66   0.15000  1.0 3.0
   52    50    60    61   0.15000  1.0 3.0
   52    50    60    62   0.15000  1.0 3.0
   52    50    60    66   0.15000  1.0 3.0
   60    66    74    75   0.15000  1.0 3.0
   60    66    74    76   0.15000  1.0 3.0
   60    66    74    84   0.56750  1.0 1.0
   60    66    74    84  -0.07550 -1.0 2.0
   60    66    74    84   0.20000  1.0 3.0
   61    60    66    67   0.15000  1.0 3.0
   61    60    66    68   0.15000  1.0 3.0
   61    60    66    74   0.15000  1.0 3.0
   62    60    66    67   0.15000  1.0 3.0
   62    60    66    68   0.15000  1.0 3.0
   62    60    66    74   0.15000  1.0 3.0
   66    74    84    85   0.15000  1.0 3.0
   66    74    84    86   0.15000  1.0 3.0
   66    74    84    90   0.56750  1.0 1.0
   66    74    84    90  -0.07550 -1.0 2.0
   66    74    84    90   0.20000  1.0 3.0
   67    66    74    75   0.15000  1.0 3.0
   67    66    74    76   0.15000  1.0 3.0
   67    66    74    84   0.15000  1.0 3.0
   68    66    74    75   0.15000  1.0 3.0
   68    66    74    76   0.15000  1.0 3.0
   68    66    74    84   0.15000  1.0 3.0
   74    84    90    91   0.15000  1.0 3.0
   74    84    90    92   0.15000  1.0 3.0
   74    84    90    93   0.15000  1.0 3.0
   75    74    84    85   0.15000  1.0 3.0
   75    74    84    86   0.15000  1.0 3.0
   75    74    84    90   0.15000  1.0 3.0
   76    74    84    85   0.15000  1.0 3.0
   76    74    84    86   0.15000  1.0 3.0
   76    74    84    90   0.15000  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
   86    84    90    91   0.15000  1.0 3.0
   86    84    90    92   0.15000  1.0 3.0
   86    84    90    93   0.15000  1.0 3.0
   53    45    50    51   0.23400  1.0 3.0
   53    45    50    52   0.23400  1.0 3.0
   53    45    50    60   0.86500  1.0 1.0
   53    45    50    60  -0.17500 -1.0 2.0
   53    45    50    60   0.20800  1.0 3.0
   94    82    38    33   0.86500  1.0 1.0
   94    82    38    33  -0.17500 -1.0 2.0
   94    82    38    33   0.20800  1.0 3.0
   94    82    38    39   0.23400  1.0 3.0
   94    82    38    45   0.86500  1.0 1.0
   94    82    38    45  -0.17500 -1.0 2.0
   94    82    38    45   0.20800  1.0 3.0
   63    48    57    58   0.15000  1.0 3.0
   63    48    57    59   0.15000  1.0 3.0
   63    48    57    65   0.34400  1.0 1.0
   63    48    57    65   0.09450 -1.0 2.0
   63    48    57    65   0.11100  1.0 3.0
   63    69    77    78   0.15000  1.0 3.0
   63    69    77    79   0.15000  1.0 3.0
   63    69    77    87   0.34400  1.0 1.0
   63    69    77    87   0.09450 -1.0 2.0
   63    69    77    87   0.11100  1.0 3.0
   63    69   102   100  -0.25900  1.0 1.0
   63    69   102   100  -0.47000 -1.0 2.0
   63    69   102   100   0.11750  1.0 3.0
   64    63    69    70   0.15000  1.0 3.0
   64    63    69    77   0.15000  1.0 3.0
   64    63    69   102   0.23400  1.0 3.0
   64    63    71    72   0.19450  1.0 3.0
   69    63    71    72  -0.11600  1.0 1.0
   69    63    71    72  -0.09450 -1.0 2.0
   69    63    71    72   0.21250  1.0 3.0
   69    77    87    88   0.00000  1.0 1.0
   69    77    87    96   0.09850  1.0 1.0
   69    77    87    96   0.15250 -1.0 2.0
   69    77    87    96  -0.50650  1.0 3.0
   70    69    77    78   0.15000  1.0 3.0
   70    69    77    79   0.15000  1.0 3.0
   70    69    77    87   0.15000  1.0 3.0
   70    69   102   100   0.08050  1.0 3.0
   77    69   102   100  -0.25900  1.0 1.0
   77    69   102   100  -0.47000 -1.0 2.0
   77    69   102   100   0.11750  1.0 3.0
   77    87    96    97   7.00000 -1.0 2.0
   77    87   -96   100   7.00000 -1.0 2.0
   78    77    87    88   0.33100  1.0 3.0
   78    77    87    96   0.00000  1.0 1.0
   79    77    87    88   0.33100  1.0 3.0
   79    77    87    96   0.00000  1.0 1.0
   87    96   100   101   1.00000 -1.0 2.0
   87    96   100   102  -0.56150  1.0 1.0
   87    96   100   102   2.19150 -1.0 2.0
   88    87    96    97   7.00000 -1.0 2.0
   88    87    96   100   7.00000 -1.0 2.0
   96   100  -102    69   2.00000 -1.0 2.0
   97    96   100   101   0.00000  1.0 1.0
   97    96   100   102   1.63100 -1.0 2.0
  101   100   102    69   3.00000 -1.0 2.0
  102    69    77    78   0.23400  1.0 3.0
  102    69    77    79   0.23400  1.0 3.0
  102    69   -77    87   0.61850  1.0 1.0
  102    69   -77    87  -0.22750 -1.0 2.0
  102    69   -77    87   0.15300  1.0 3.0
   71    63    69    70   0.23400  1.0 3.0
   71    63    69    77   0.86500  1.0 1.0
   71    63    69    77  -0.17500 -1.0 2.0
   71    63    69    77   0.20800  1.0 3.0
   71    63    69   102   3.69350  1.0 1.0
   71    63    69   102  -1.82950 -1.0 2.0
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    42    37    40   1.10000 -1.0 2.0
   41    47    40    37   1.10000 -1.0 2.0
   33    47    55    56  10.50000 -1.0 2.0
   57    98    65    73   1.10000 -1.0 2.0
   80    82    73    65   1.10000 -1.0 2.0
   73    89    80    81  10.50000 -1.0 2.0
   65    89    98    99  10.50000 -1.0 2.0
   77    88    87    96   1.10000 -1.0 2.0
  100    97    96    87   1.10000 -1.0 2.0
   96   102   100   101  10.50000 -1.0 2.0
END
