* LIGAND DATABASE FILE (OPLS2005)
*
001     105   107    189    284     554
    1     0 S   NP   _N1_     1    29.57215    93.43348   -24.38925
    2     1 S   H    _HN1     2     1.02761   107.55897  -104.73229
    3     1 S   H    _H1_     3     1.02967    91.25187     5.01059
    4     1 S   H    _H2_     4     1.02812    17.27518   160.81346
    5     1 S   CT   _CA1     5     1.50214   124.52579   120.72743
    6     5 S   HC   _HA1     6     1.09593   105.08255    70.86808
    7     5 S   CO3  _C1_     7     1.53940   112.64544   -48.60869
    8     7 S   O2Z  _O11     8     1.26337   115.09064   -33.68602
    9     7 S   O2Z  _O12     9     1.26363   115.02724   145.18810
   10     5 S   CT   _CB1    10     1.53127   107.22010  -171.57606
   11    10 S   HC   HB11    11     1.09807   109.23941   -51.91573
   12    10 S   HC   HB12    12     1.09810   110.30980    64.59083
   13    10 S   CT   _CG1    13     1.52813   112.72456  -173.24390
   14    13 S   HC   HG11    14     1.09445   109.71320   -66.64428
   15    13 S   HC   HG12    15     1.09623   110.32098    52.64432
   16    13 S   C    _CD1    16     1.51602   112.88361   173.47018
   17    16 S   O    _OE1    17     1.22771   123.55520    -7.57621
   18    16 S   N    _N2_    18     1.38620   111.52289   172.51675
   19    18 S   H    _HN2    19     1.01653   119.35442     4.55406
   20    18 S   CT1  _CA2    20     1.45431   122.47664  -177.19014
   21    20 S   HC   _HA2    21     1.09416   108.64261    19.80353
   22    20 S   C    _C2_    22     1.52617   106.86629   -97.14967
   23    22 S   O    _O2_    23     1.22976   122.70223   -42.69203
   24    20 S   CT   _CB2    32     1.53105   112.43825   142.39847
   25    24 S   HC   HB21    33     1.09657   109.93192    67.05924
   26    24 S   HC   HB22    34     1.09565   110.51123  -175.89468
   27    22 S   N    _N3_    24     1.38490   112.72736   138.86727
   28    27 S   H    _HN3    25     1.01564   120.35163    -0.74860
   29    24 S   S    _SG2    35     1.83052   114.56339   -52.38745
   30    27 S   CT   _CA3    26     1.45368   122.52745  -179.95154
   31    30 S   HC   HA31    27     1.09559   107.13735   -70.30694
   32    30 S   HC   HA32    28     1.09555   108.38435    46.08466
   33    29 S   CT   _C11    36     1.83469   100.49678   -59.26545
   34    33 S   HC   _H4_    37     1.09346   108.60332    54.26406
   35    30 S   CO3  _C3_    29     1.52897   114.20506   167.91675
   36    35 S   O2Z  _O31    30     1.26376   116.02924   -15.03615
   37    35 S   O2Z  _O32    31     1.26390   114.52689   165.14020
   38    33 S   CM   _C8_    38     1.53235   110.40342   173.23108
   39    38 S   CT   _C7_    39     1.53523   114.25439   107.30890
   40    39 S   HC   _H3_    40     1.09603   109.06043   163.42919
   41    38 S   CMA  _C9_    99     1.36965   122.14442   -77.73828
   42    41 S   OM   _O33   100     1.26986   125.05540     0.87603
   43    39 S   CM   _C6_    41     1.52574   110.75334    46.82954
   44    39 S   CT   _C19    74     1.54036   111.25984   -77.62432
   45    44 S   HC   _H24    75     1.09721   111.49884   169.65716
   46    44 S   HC   _H25    76     1.09554   112.53700    51.62568
   47    41 S   OS   _O34   101     1.41879   111.65105  -178.39978
   48    43 S   CO   _C12    42     1.51315   116.07023   -23.73577
   49    48 S   HC   _H5_    43     1.09709   108.76206  -145.70225
   50    43 S   CM   _C5_    68     1.34920   124.31155   156.36561
   51    50 S   HC   _H14    69     1.08927   118.10362  -179.57204
   52    44 S   CO4  _C20    77     1.51053   110.87869   -72.06519
   53    52 S   O    _O42    78     1.22519   123.45628   -71.00813
   54    47 S   CT   _C10   102     1.42644   115.13851  -151.70380
   55    54 S   HC   _H15   103     1.09400   107.74375   172.36565
   56    54 S   HC   _H16   104     1.09477   111.16204    54.26298
   57    54 S   HC   _H17   105     1.09480   110.99667   -69.70840
   58    33 S   OS   _O35    44     1.43212   108.82226   -62.65566
   59    48 S   OS1  _O36    45     1.43107   109.75353    95.14272
   60    50 S   CT   _C4_    70     1.49482   127.69886     0.13417
   61    60 S   HC   _H11    71     1.09440   109.66713  -118.95639
   62    60 S   HC   _H12    72     1.09457   109.55400   122.52766
   63    60 S   HC   _H13    73     1.09208   113.68242     2.00954
   64    52 S   OS   _O43    79     1.36344   110.70424   108.36569
   65    59 S   CO1  _C13    46     1.43319   112.45129   171.82274
   66    65 S   HC   _H6_    47     1.09703   108.73422    50.70715
   67    64 S   CT   _C21    80     1.43684   115.01366  -177.66292
   68    67 S   HC   _H26    81     1.09501   109.39602    61.69408
   69    67 S   HC   _H27    82     1.09674   108.61138   -56.81384
   70    65 S   CT   _C14    48     1.53224   108.22100   169.84166
   71    70 S   HC   _H7_    49     1.09675   109.88070    56.19889
   72    67 S   CT   _C22    83     1.52876   109.64107  -175.23046
   73    72 S   HC   _H28    84     1.09695   109.31240   169.63413
   74    72 S   HC   _H29    85     1.09727   108.46383    53.40919
   75    70 S   CT   _C15    50     1.53211   110.55955   177.67392
   76    75 S   HC   _H8_    51     1.09661   110.26677    73.17606
   77    70 S   OH5  _O41    66     1.42740   110.52263   -60.72045
   78    77 S   HO   _H23    67     0.97369   108.94809   -62.64551
   79    72 S   CA   _C23    86     1.51153   114.90702   -69.24276
   80    75 S   CT   _C16    52     1.53310   111.31981   -49.62308
   81    80 S   HC   _H9_    53     1.09711   108.82583   -72.57382
   82    75 S   OH5  _O40    64     1.43027   109.54105  -170.91239
   83    82 S   HO   _H22    65     0.97217   108.06449    60.16654
   84    79 S   CA   _C24    87     1.40310   121.19716   -56.18185
   85    84 S   HA   _H30    88     1.08693   120.53492     1.46914
   86    80 S   CT   _C17    54     1.53369   111.20384    48.60986
   87    86 S   HC   _H10    55     1.09732   111.20010    65.54025
   88    80 S   OH5  _O39    62     1.42591   109.62640   170.87977
   89    88 S   HO   _H21    63     0.97727   107.99864   -64.25637
   90    84 S   CA   _C25    89     1.39752   120.82403  -178.04616
   91    90 S   HA   _H31    90     1.08643   119.33125  -179.69226
   92    65 S   OS1  _O37    56     1.42941   110.97700   -70.23465
   93    86 S   CT   _C18    57     1.52945   111.45737  -173.76036
   94    93 S   HC   _H18    58     1.09496   111.00718    68.58926
   95    93 S   HC   _H19    59     1.09407   111.45418   -53.74843
   96    90 S   CA   _C26    91     1.39245   119.76241     0.63427
   97    93 S   OH5  _O38    60     1.42522   109.14577  -172.77998
   98    97 S   HO   _H20    61     0.97232   106.97120   179.63096
   99    96 S   CA   _C27    92     1.39147   120.04782    -0.41918
  100    96 S   OH   _O45    97     1.36714   120.60745   179.17742
  101   100 S   HO   _H34    98     0.97666   108.92242     1.73269
  102    79 S   CA   _C28    93     1.40339   120.02229   126.60725
  103   102 S   HA   _H32    94     1.08708   119.82329    -2.17655
  104    99 S   OH   _O44    95     1.36785   119.28844  -179.49255
  105   104 S   HO   _H33    96     0.97187   108.62984   178.81667
  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   7   5   4   3
  13   5   2   1   1  14  18   8   9   2  15   8   4   3   4  10
   4   7   4   6   2   3   2   1   1   2   8   3   2   1   1   7
  13   6   8   5   4  12   7   9   4   3  13   7   4   1   9  12
   7   3   1   8   4   9   6   3   1   7   3   4   4   3   2   7
   1   1   6   3   1   3   1   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    58    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    48    58    41  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    43    48    49    58    59    44    41    42    47  
   38    39    48    58    41  
   36    37  
   37  
    0  
   39    40    43    48    58    50    44    45    46    52    41    42    47    54  
   40    43    48    49    58    59    50    51    60    44    45    46    52    53    64    41    42    47  
   43    48    50    44    45    46    52    41  
   42    47    54    55    56    57    43    44    58  
   47    54  
   48    49    58    59    65    50    51    60    61    62    63    44    45    46    52  
   45    46    52    53    64    67    48    50  
   46    52    53    64  
   52    53    64  
   54    55    56    57  
   49    58    59    65    66    70    92    50    51    60  
   58    59    65    50  
   51    60    61    62    63    58    59  
   60    61    62    63  
   53    64    67    68    69    72  
   64    67  
   55    56    57  
   56    57  
   57  
    0  
   59    65  
   65    66    70    71    75    86    92    77  
   61    62    63  
   62    63  
   63  
    0  
   67    68    69    72    73    74    79  
   66    70    71    75    76    80    86    87    92    93    82    77    78  
   70    71    75    86    92    77  
   68    69    72    73    74    79    84   102  
   69    72    73    74    79  
   72    73    74    79  
   71    75    76    80    81    86    92    88    82    83    77    78  
   75    76    80    92    82    77    78  
   73    74    79    84    85    90    99   102   103  
   74    79    84   102  
   79    84   102  
   76    80    81    86    87    92    93    88    89    82    83    77    78  
   80    81    86    88    82    83    77  
   78    80    82    92  
    0  
   84    85    90    91    96    99   102   103   104  
   81    86    87    92    93    94    95    97    88    89    82    83  
   86    87    92    93    88    89    82  
   83    86    88  
    0  
   85    90    91    96    99   102   103   100  
   90    91    96   102  
   87    92    93    94    95    97    98    88    89  
   92    93    94    95    97    88  
   89    92    93  
    0  
   91    96    99   102   104   100   101  
   96    99   100  
   93    94    95    97  
   94    95    97    98  
   95    97    98  
   97    98  
   99   102   103   104   105   100   101  
   98  
    0  
  102   103   104   105   100   101  
  101   102   104  
    0  
  103   104   105  
  104  
  105  
    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  -0.316400   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   0.387900   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0760  -0.670200   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   43   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   44   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   46   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   47   2.8500   0.1400  -0.685000   1.5900   1.4000   0.020110767  -0.896042159
   48   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   51   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   52   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   53   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   54   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   58   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   59   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   60   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   65   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   69   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   70   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   78   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   79   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   80   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   83   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   84   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   85   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   86   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   88   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   89   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   90   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   91   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   92   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   93   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   94   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   97   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   98   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   99   3.5500   0.0700   0.150000   2.0020   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
  102   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
  103   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
  104   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
  105   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   340.000  1.090
   33    38   317.000  1.510
   33    58   320.000  1.410
   38    39   317.000  1.510
   38    41   465.000  1.376
   39    40   340.000  1.090
   39    43   317.000  1.510
   39    44   268.000  1.529
   43    48   317.000  1.510
   43    50   549.000  1.340
   48    49   340.000  1.090
   48    58   320.000  1.380
   48    59   320.000  1.380
   59    65   370.000  1.399
   65    66   360.000  1.097
   65    70   255.000  1.525
   65    92   370.000  1.399
   70    71   340.000  1.090
   70    75   268.000  1.529
   70    77   355.000  1.421
   75    76   340.000  1.090
   75    80   268.000  1.529
   75    82   355.000  1.421
   80    81   340.000  1.090
   80    86   268.000  1.529
   80    88   355.000  1.421
   86    87   340.000  1.090
   86    92   335.000  1.422
   86    93   268.000  1.529
   93    94   340.000  1.090
   93    95   340.000  1.090
   93    97   355.000  1.421
   97    98   580.000  0.967
   88    89   580.000  0.967
   82    83   580.000  0.967
   77    78   580.000  0.967
   50    51   340.000  1.080
   50    60   317.000  1.510
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   340.000  1.090
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    52   317.000  1.522
   52    53   570.000  1.229
   52    64   214.000  1.327
   64    67   320.000  1.410
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    72   268.000  1.529
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    79   317.000  1.510
   79    84   469.000  1.400
   79   102   469.000  1.400
   84    85   367.000  1.080
   84    90   469.000  1.400
   90    91   367.000  1.080
   90    96   469.000  1.400
   96    99   469.000  1.400
   96   100   450.000  1.364
   99   102   469.000  1.400
   99   104   450.000  1.364
  102   103   367.000  1.080
  104   105   553.000  0.945
  100   101   553.000  0.945
   41    42   745.000  1.250
   41    47   440.000  1.360
   47    54   320.000  1.410
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   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    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    58    85.00000  114.68000
   33    38    39    65.00000  117.92700
   33    38    41    70.00000  124.00000
   33    58    48    60.00000  109.50000
   38    33    34    35.00000  109.50000
   38    39    40    35.00000  109.50000
   38    39    43    70.00000  110.12100
   38    39    44    70.00000  112.02700
   38    41    42    65.00000  137.10300
   38    41    47    80.00000  120.01400
   39    43    48    65.00000  117.92700
   39    43    50    70.00000  124.00000
   39    44    45    37.50000  110.70000
   39    44    46    37.50000  110.70000
   39    44    52    63.00000  111.10000
   43    39    40    35.00000  109.50000
   43    48    49    35.00000  109.50000
   43    48    58    85.00000  110.90400
   43    48    59    85.00000  110.90400
   43    50    51    35.00000  120.00000
   43    50    60    70.00000  124.00000
   48    59    65    90.00000  112.10700
   58    33    34    35.00000  109.50000
   58    33    38    85.00000  110.90400
   58    48    49    35.00000  109.50000
   59    48    49    35.00000  109.50000
   59    48    58    92.60000  111.55000
   59    65    66    60.00000  105.75400
   59    65    70    90.00000  109.70700
   59    65    92   110.00000  113.16000
   65    70    71    45.00000  109.54000
   65    70    75    70.00000  111.10000
   65    70    77    90.00000  109.42000
   65    92    86    90.00000  112.10700
   70    65    66    45.00000  111.65000
   70    75    76    37.50000  110.70000
   70    75    80    58.35000  112.70000
   70    75    82    90.00000  111.45300
   70    77    78    65.00000  108.53500
   75    70    71    37.50000  110.70000
   75    80    81    37.50000  110.70000
   75    80    86    58.35000  112.70000
   75    80    88    90.00000  111.45300
   75    82    83    65.00000  108.53500
   80    75    76    37.50000  110.70000
   80    86    87    37.50000  110.70000
   80    86    92    95.00000  107.88500
   80    86    93    58.35000  112.70000
   80    88    89    65.00000  108.53500
   86    80    81    37.50000  110.70000
   86    93    94    37.50000  110.70000
   86    93    95    37.50000  110.70000
   86    93    97    90.00000  111.45300
   92    65    66    60.00000  105.75400
   92    65    70    90.00000  109.70700
   92    86    87    55.00000  108.98800
   93    86    87    37.50000  110.70000
   93    86    92    95.00000  107.88500
   93    97    98    65.00000  108.53500
   95    93    94    33.00000  107.80000
   97    93    94    60.00000  109.39000
   97    93    95    60.00000  109.39000
   88    80    81    60.00000  109.39000
   88    80    86    90.00000  111.45300
   82    75    76    60.00000  109.39000
   82    75    80    90.00000  111.45300
   77    70    71    60.00000  109.39000
   77    70    75    90.00000  111.45300
   50    43    48    70.00000  124.00000
   50    60    61    35.00000  109.50000
   50    60    62    35.00000  109.50000
   50    60    63    35.00000  109.50000
   60    50    51    35.00000  117.00000
   62    60    61    33.00000  107.80000
   63    60    61    33.00000  107.80000
   63    60    62    33.00000  107.80000
   44    39    40    37.50000  110.70000
   44    39    43    70.00000  112.02700
   44    52    53    80.00000  120.40000
   44    52    64    81.00000  111.40000
   46    44    45    33.00000  107.80000
   52    44    45    35.00000  109.50000
   52    44    46    35.00000  109.50000
   52    64    67    83.00000  116.90000
   64    52    53    83.00000  123.40000
   64    67    68    35.00000  109.50000
   64    67    69    35.00000  109.50000
   64    67    72    50.00000  109.50000
   67    72    73    37.50000  110.70000
   67    72    74    37.50000  110.70000
   67    72    79    70.00000  112.17500
   69    67    68    33.00000  107.80000
   72    67    68    37.50000  110.70000
   72    67    69    37.50000  110.70000
   72    79    84    70.00000  120.00000
   72    79   102    70.00000  120.00000
   74    72    73    33.00000  107.80000
   79    72    73    35.00000  109.50000
   79    72    74    35.00000  109.50000
   79    84    85    35.00000  120.00000
   79    84    90    63.00000  120.00000
   79   102    99    63.00000  120.00000
   79   102   103    35.00000  120.00000
   84    90    91    35.00000  120.00000
   84    90    96    63.00000  120.00000
   90    84    85    35.00000  120.00000
   90    96    99    63.00000  120.00000
   90    96   100    70.00000  120.00000
   96    90    91    35.00000  120.00000
   96    99   102    63.00000  120.00000
   96    99   104    70.00000  120.00000
   96   100   101    35.00000  113.00000
   99   102   103    35.00000  120.00000
   99   104   105    35.00000  113.00000
  102    79    84    63.00000  120.00000
  104    99   102    70.00000  120.00000
  100    96    99    70.00000  120.00000
   41    38    39    70.00000  124.00000
   41    47    54    90.00000  111.18400
   47    41    42    65.00000  121.00000
   47    54    55    35.00000  109.50000
   47    54    56    35.00000  109.50000
   47    54    57    35.00000  109.50000
   56    54    55    33.00000  107.80000
   57    54    55    33.00000  107.80000
   57    54    56    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   0.32350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    58   0.13850  1.0 1.0
   24    29    33    58  -1.34450 -1.0 2.0
   24    29    33    58   0.57400  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   0.30250  1.0 1.0
   29    33    38    39  -0.14950 -1.0 2.0
   29    33    38    39   0.36900  1.0 3.0
   29    33    38    41   0.42700  1.0 1.0
   29    33    38    41  -0.70350 -1.0 2.0
   29    33    38    41  -0.43150  1.0 3.0
   29    33    58    48   0.14700  1.0 1.0
   29    33    58    48  -1.16150 -1.0 2.0
   29    33    58    48   0.48700  1.0 3.0
   33    38    39    40   0.34800  1.0 3.0
   33    38    39    43   0.09700  1.0 1.0
   33    38    39    43   0.15600 -1.0 2.0
   33    38    39    43  -0.50800  1.0 3.0
   33    38    39    44   0.46850  1.0 1.0
   33    38    39    44   0.08550 -1.0 2.0
   33    38    39    44   0.09800  1.0 3.0
   33    38    41    42   7.00000 -1.0 2.0
   33    38    41    47   7.00000 -1.0 2.0
   34    33    38    39   0.34800  1.0 3.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    58    48   0.37050  1.0 3.0
   38    33    58    48  -0.77900  1.0 1.0
   38    33    58    48  -0.36900 -1.0 2.0
   38    33    58    48   0.40400  1.0 3.0
   38    39   -43    48   0.09700  1.0 1.0
   38    39   -43    48   0.15600 -1.0 2.0
   38    39   -43    48  -0.50800  1.0 3.0
   38    39    43    50  -0.28300  1.0 1.0
   38    39    43    50   0.26700 -1.0 2.0
   38    39    43    50  -0.63300  1.0 3.0
   38    39    44    45   0.15000  1.0 3.0
   38    39    44    46   0.15000  1.0 3.0
   38    39    44    52  -0.98800  1.0 1.0
   38    39    44    52   0.48800 -1.0 2.0
   38    39    44    52   0.76800  1.0 3.0
   38    41    47    54  -2.26850  1.0 1.0
   38    41    47    54   3.39050 -1.0 2.0
   39    38    41    42   7.00000 -1.0 2.0
   39    38    41    47   7.00000 -1.0 2.0
   39    43    48    49   0.34800  1.0 3.0
   39    43    48    58   0.09700  1.0 1.0
   39    43    48    58   0.15600 -1.0 2.0
   39    43    48    58  -0.50800  1.0 3.0
   39    43    48    59   0.09700  1.0 1.0
   39    43    48    59   0.15600 -1.0 2.0
   39    43    48    59  -0.50800  1.0 3.0
   39    43    50    51   7.00000 -1.0 2.0
   39    43    50    60   7.00000 -1.0 2.0
   39    44    52    53   0.30150 -1.0 2.0
   39    44    52    64   0.36750  1.0 3.0
   40    39    43    48   0.34800  1.0 3.0
   40    39    43    50   0.00000  1.0 1.0
   40    39    44    45   0.15000  1.0 3.0
   40    39    44    46   0.15000  1.0 3.0
   40    39    44    52  -0.11250  1.0 3.0
   43    39    44    45   0.15000  1.0 3.0
   43    39    44    46   0.15000  1.0 3.0
   43    39    44    52  -0.98800  1.0 1.0
   43    39    44    52   0.48800 -1.0 2.0
   43    39    44    52   0.76800  1.0 3.0
   43    48   -58    33  -0.77900  1.0 1.0
   43    48   -58    33  -0.36900 -1.0 2.0
   43    48   -58    33   0.40400  1.0 3.0
   43    48    59    65  -0.77900  1.0 1.0
   43    48    59    65  -0.36900 -1.0 2.0
   43    48    59    65   0.40400  1.0 3.0
   43    50    60    61   0.00000  1.0 1.0
   43    50    60    62   0.00000  1.0 1.0
   43    50    60    63   0.00000  1.0 1.0
   48    43    50    51   7.00000 -1.0 2.0
   48    43    50    60   7.00000 -1.0 2.0
   48    59    65    66   0.37050  1.0 3.0
   48    59    65    70   0.06250  1.0 1.0
   48    59    65    70  -0.01100 -1.0 2.0
   48    59    65    70   0.28050  1.0 3.0
   48    59    65    92  -0.12700  1.0 1.0
   48    59    65    92  -1.16200 -1.0 2.0
   48    59    65    92   0.58800  1.0 3.0
   49    48    58    33   0.37050  1.0 3.0
   49    48    59    65   0.37050  1.0 3.0
   58    33   -38    39   0.09700  1.0 1.0
   58    33   -38    39   0.15600 -1.0 2.0
   58    33   -38    39  -0.50800  1.0 3.0
   58    33    38    41   0.39000  1.0 1.0
   58    33    38    41  -0.05800 -1.0 2.0
   58    33    38    41  -0.55150  1.0 3.0
   58    48    59    65  -0.53350  1.0 1.0
   58    48    59    65  -0.78350 -1.0 2.0
   58    48    59    65   0.33750  1.0 3.0
   59    48    58    33  -0.81800  1.0 1.0
   59    65    70    71   0.23400  1.0 3.0
   59    65    70    75   0.62750  1.0 1.0
   59    65    70    75  -0.30950 -1.0 2.0
   59    65    70    75   0.27300  1.0 3.0
   59    65    70    77   1.51850  1.0 1.0
   59    65    92    86  -0.70400  1.0 1.0
   59    65    92    86  -0.90350 -1.0 2.0
   65    70    75    76   0.15000  1.0 3.0
   65    70    75    80   0.56750  1.0 1.0
   65    70    75    80  -0.07550 -1.0 2.0
   65    70    75    80   0.20000  1.0 3.0
   65    70    75    82  -0.47750  1.0 1.0
   65    70    77    78   0.29150  1.0 1.0
   65    70    77    78  -0.28350 -1.0 2.0
   65    70    77    78   0.43600  1.0 3.0
   66    65    70    71   0.15000  1.0 3.0
   66    65    70    75   0.15000  1.0 3.0
   66    65    70    77   0.23400  1.0 3.0
   66    65    92    86   0.37050  1.0 3.0
   70    65    92    86   0.06250  1.0 1.0
   70    65    92    86  -0.01100 -1.0 2.0
   70    65    92    86   0.28050  1.0 3.0
   70    75    80    81   0.15000  1.0 3.0
   70    75   -80    86   0.56750  1.0 1.0
   70    75   -80    86  -0.07550 -1.0 2.0
   70    75   -80    86   0.20000  1.0 3.0
   70    75    80    88  -0.47750  1.0 1.0
   70    75    82    83   0.29150  1.0 1.0
   70    75    82    83  -0.28350 -1.0 2.0
   70    75    82    83   0.43600  1.0 3.0
   71    70    75    76   0.15000  1.0 3.0
   71    70    75    80   0.15000  1.0 3.0
   71    70    75    82   0.23400  1.0 3.0
   71    70    77    78   0.19450  1.0 3.0
   75    70    77    78   0.29150  1.0 1.0
   75    70    77    78  -0.28350 -1.0 2.0
   75    70    77    78   0.43600  1.0 3.0
   75    80    86    87   0.15000  1.0 3.0
   75    80    86    92   0.62750  1.0 1.0
   75    80    86    92  -0.30950 -1.0 2.0
   75    80    86    92   0.27300  1.0 3.0
   75    80    86    93   0.56750  1.0 1.0
   75    80    86    93  -0.07550 -1.0 2.0
   75    80    86    93   0.20000  1.0 3.0
   75    80    88    89   0.29150  1.0 1.0
   75    80    88    89  -0.28350 -1.0 2.0
   75    80    88    89   0.43600  1.0 3.0
   76    75    80    81   0.15000  1.0 3.0
   76    75    80    86   0.15000  1.0 3.0
   76    75    80    88   0.23400  1.0 3.0
   76    75    82    83   0.19450  1.0 3.0
   80    75    82    83   0.29150  1.0 1.0
   80    75    82    83  -0.28350 -1.0 2.0
   80    75    82    83   0.43600  1.0 3.0
   80    86   -92    65   0.06250  1.0 1.0
   80    86   -92    65  -0.01100 -1.0 2.0
   80    86   -92    65   0.28050  1.0 3.0
   80    86    93    94   0.15000  1.0 3.0
   80    86    93    95   0.15000  1.0 3.0
   80    86    93    97  -0.47750  1.0 1.0
   81    80    86    87   0.15000  1.0 3.0
   81    80    86    92   0.23400  1.0 3.0
   81    80    86    93   0.15000  1.0 3.0
   81    80    88    89   0.19450  1.0 3.0
   86    80    88    89   0.29150  1.0 1.0
   86    80    88    89  -0.28350 -1.0 2.0
   86    80    88    89   0.43600  1.0 3.0
   86    93    97    98   0.29150  1.0 1.0
   86    93    97    98  -0.28350 -1.0 2.0
   86    93    97    98   0.43600  1.0 3.0
   87    86    92    65   0.37050  1.0 3.0
   87    86    93    94   0.15000  1.0 3.0
   87    86    93    95   0.15000  1.0 3.0
   87    86    93    97   0.23400  1.0 3.0
   92    65    70    71   0.23400  1.0 3.0
   92    65   -70    75   0.62750  1.0 1.0
   92    65   -70    75  -0.30950 -1.0 2.0
   92    65   -70    75   0.27300  1.0 3.0
   92    65    70    77   1.51850  1.0 1.0
   92    86    93    94   0.23400  1.0 3.0
   92    86    93    95   0.23400  1.0 3.0
   92    86    93    97   1.51850  1.0 1.0
   93    86    92    65   0.06250  1.0 1.0
   93    86    92    65  -0.01100 -1.0 2.0
   93    86    92    65   0.28050  1.0 3.0
   94    93    97    98   0.19450  1.0 3.0
   95    93    97    98   0.19450  1.0 3.0
   88    80    86    87   0.23400  1.0 3.0
   88    80    86    92   1.51850  1.0 1.0
   88    80    86    93  -0.47750  1.0 1.0
   82    75    80    81   0.23400  1.0 3.0
   82    75    80    86  -0.47750  1.0 1.0
   82    75    80    88   3.77950  1.0 1.0
   77    70    75    76   0.23400  1.0 3.0
   77    70    75    80  -0.47750  1.0 1.0
   77    70    75    82   3.77950  1.0 1.0
   50    43    48    49   0.00000  1.0 1.0
   50    43    48    58   0.39000  1.0 1.0
   50    43    48    58  -0.05800 -1.0 2.0
   50    43    48    58  -0.55150  1.0 3.0
   50    43    48    59   0.39000  1.0 1.0
   50    43    48    59  -0.05800 -1.0 2.0
   50    43    48    59  -0.55150  1.0 3.0
   51    50    60    61   0.33100  1.0 3.0
   51    50    60    62   0.33100  1.0 3.0
   51    50    60    63   0.33100  1.0 3.0
   44    39    43    48   0.46850  1.0 1.0
   44    39    43    48   0.08550 -1.0 2.0
   44    39    43    48   0.09800  1.0 3.0
   44    39    43    50   0.09850  1.0 1.0
   44    39    43    50   0.15250 -1.0 2.0
   44    39    43    50  -0.50650  1.0 3.0
   44    52    64    67   1.63150  1.0 1.0
   44    52    64    67   2.92000 -1.0 2.0
   45    44    52    53   0.00000  1.0 1.0
   45    44    52    64   0.00000  1.0 1.0
   46    44    52    53   0.00000  1.0 1.0
   46    44    52    64   0.00000  1.0 1.0
   52    64    67    68   0.08050  1.0 3.0
   52    64    67    69   0.08050  1.0 3.0
   52    64    67    72  -0.25900  1.0 1.0
   52    64    67    72  -0.47000 -1.0 2.0
   52    64    67    72   0.11750  1.0 3.0
   53    52    64    67   3.00000 -1.0 2.0
   64    67    72    73   0.23400  1.0 3.0
   64    67    72    74   0.23400  1.0 3.0
   64    67    72    79  -0.64350  1.0 1.0
   64    67    72    79  -0.04200 -1.0 2.0
   64    67    72    79   0.19800  1.0 3.0
   67    72    79    84   0.04150 -1.0 2.0
   67    72    79   102   0.04150 -1.0 2.0
   68    67    72    73   0.15000  1.0 3.0
   68    67    72    74   0.15000  1.0 3.0
   68    67    72    79   0.43200  1.0 3.0
   69    67    72    73   0.15000  1.0 3.0
   69    67    72    74   0.15000  1.0 3.0
   69    67    72    79   0.43200  1.0 3.0
   72    79    84    85   3.62500 -1.0 2.0
   72    79    84    90   3.62500 -1.0 2.0
   72    79   102    99   3.62500 -1.0 2.0
   72    79   102   103   3.62500 -1.0 2.0
   73    72    79    84   0.00000  1.0 1.0
   73    72    79   102   0.00000  1.0 1.0
   74    72    79    84   0.00000  1.0 1.0
   74    72    79   102   0.00000  1.0 1.0
   79    84    90    91   3.62500 -1.0 2.0
   79    84    90    96   3.62500 -1.0 2.0
   84    79   102    99   3.62500 -1.0 2.0
   84    79   102   103   3.62500 -1.0 2.0
   84    90   -96    99   3.62500 -1.0 2.0
   84    90    96   100   3.62500 -1.0 2.0
   85    84    90    91   3.62500 -1.0 2.0
   85    84    90    96   3.62500 -1.0 2.0
   90    96    99   102   3.62500 -1.0 2.0
   90    96    99   104   3.62500 -1.0 2.0
   90    96   100   101   0.84100 -1.0 2.0
   91    90    96    99   3.62500 -1.0 2.0
   91    90    96   100   3.62500 -1.0 2.0
   96    99  -102    79   3.62500 -1.0 2.0
   96    99   102   103   3.62500 -1.0 2.0
   96    99   104   105   0.84100 -1.0 2.0
   99    96   100   101   0.84100 -1.0 2.0
  102    79    84    85   3.62500 -1.0 2.0
  102    79   -84    90   3.62500 -1.0 2.0
  102    99   104   105   0.84100 -1.0 2.0
  104    99   102    79   3.62500 -1.0 2.0
  104    99   102   103   3.62500 -1.0 2.0
  100    96    99   102   3.62500 -1.0 2.0
  100    96    99   104   3.62500 -1.0 2.0
   41    38    39    40   0.00000  1.0 1.0
   41    38    39    43  -0.28300  1.0 1.0
   41    38    39    43   0.26700 -1.0 2.0
   41    38    39    43  -0.63300  1.0 3.0
   41    38    39    44   0.09850  1.0 1.0
   41    38    39    44   0.15250 -1.0 2.0
   41    38    39    44  -0.50650  1.0 3.0
   41    47    54    55   0.08050  1.0 3.0
   41    47    54    56   0.08050  1.0 3.0
   41    47    54    57   0.08050  1.0 3.0
   42    41    47    54   2.00000 -1.0 2.0
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
   33    39    38    41   1.10000 -1.0 2.0
   39    48    43    50   1.10000 -1.0 2.0
   60    51    50    43   1.10000 -1.0 2.0
   44    64    52    53  10.50000 -1.0 2.0
   84   102    79    72   4.00000 -1.0 2.0
   90    85    84    79   1.10000 -1.0 2.0
   96    91    90    84   1.10000 -1.0 2.0
   99   100    96    90   4.00000 -1.0 2.0
  102   104    99    96   4.00000 -1.0 2.0
   99   103   102    79   1.10000 -1.0 2.0
   42    47    41    38   1.10000 -1.0 2.0
END
