* LIGAND DATABASE FILE (OPLS2005)
*
001     106   108    198    284     566
    1     0 S   NP   _N1_     1    28.36597    96.15926   -20.10905
    2     1 S   H    _HN1     2     1.02776    80.19274   -61.14388
    3     1 S   H    _H1_     3     1.02970    88.51295    47.73065
    4     1 S   H    _H2_     4     1.02834    40.88734   166.29590
    5     1 S   CT   _CA1     5     1.50125   151.09446  -179.95577
    6     5 S   HC   _HA1     6     1.09577   105.24542    49.56255
    7     5 S   CO3  _C1_     7     1.53795   112.31817   -70.60471
    8     7 S   O2Z  _O11     8     1.26346   115.01136   -44.99933
    9     7 S   O2Z  _O12     9     1.26243   114.89943   134.10978
   10     5 S   CT   _CB1    10     1.53076   107.39135   167.38813
   11    10 S   HC   HB11    11     1.09817   109.29641   -51.35058
   12    10 S   HC   HB12    12     1.09831   110.40827    65.16591
   13    10 S   CT   _CG1    13     1.53008   112.71653  -172.56499
   14    13 S   HC   HG11    14     1.09603   110.22410   -62.31417
   15    13 S   HC   HG12    15     1.09625   110.21557    56.90439
   16    13 S   C    _CD1    16     1.51812   112.14841   177.08724
   17    16 S   O    _OE1    17     1.22738   123.17191   -12.05069
   18    16 S   N    _N2_    18     1.38578   111.73267   168.57240
   19    18 S   H    _HN2    19     1.01589   119.01764     1.56985
   20    18 S   CT1  _CA2    20     1.46179   123.36189  -176.54600
   21    20 S   HC   _HA2    21     1.09685   109.27780   -16.10133
   22    20 S   C    _C2_    22     1.53102   107.80403  -131.66596
   23    22 S   O    _O2_    23     1.22963   122.66834  -136.05143
   24    20 S   CT   _CB2    32     1.53221   111.26015   106.01829
   25    24 S   HC   HB21    33     1.09587   109.78054    50.81776
   26    24 S   HC   HB22    34     1.09306   110.75539   169.84042
   27    22 S   N    _N3_    24     1.38599   112.85358    50.87998
   28    27 S   H    _HN3    25     1.01524   119.03718    -1.08948
   29    24 S   S    _SG2    35     1.82426   111.35605   -70.62927
   30    27 S   CT   _CA3    26     1.45383   122.89229   173.44961
   31    30 S   HC   HA31    27     1.09552   108.68443    34.64951
   32    30 S   HC   HA32    28     1.09472   107.25530   151.70366
   33    29 S   CT   _C13    36     1.82493    99.06836   160.80837
   34    33 S   HC   _H6_    37     1.09441   105.86595   -52.24300
   35    30 S   CO3  _C3_    29     1.53064   113.62358   -88.24042
   36    35 S   O2Z  _O31    30     1.26367   115.78692   -34.11037
   37    35 S   O2Z  _O32    31     1.26406   114.72046   146.74458
   38    33 S   CM   _C10    38     1.51927   111.00893  -170.34881
   39    33 S   OS   _O36    52     1.42591   114.51912    61.71052
   40    38 S   CT   _C7_    39     1.51868   114.83753   -91.26599
   41    40 S   HC   _H5_    40     1.09983   108.50025   131.06253
   42    38 S   CMA  _C11   100     1.36800   123.05254    87.76147
   43    42 S   OM   _O34   101     1.26938   125.47041   179.51867
   44    40 S   CT   _C8_    41     1.53454   114.88879  -107.00840
   45    44 S   HC   _H16    42     1.09426   112.72594    40.57635
   46    44 S   HC   _H17    43     1.09284   112.02418   -84.85163
   47    42 S   OS   _O35   102     1.41948   111.83998     0.70221
   48    44 S   CO4  _C9_    44     1.51005   101.85921   157.46744
   49    48 S   O    _O33    45     1.22503   123.65623   166.63225
   50    47 S   CT   _C12   103     1.42834   113.41363  -131.88775
   51    50 S   HC   _H18   104     1.09408   107.73869   170.57677
   52    50 S   HC   _H19   105     1.09549   111.13084    52.41881
   53    50 S   HC   _H20   106     1.09465   111.02204   -71.38742
   54    48 S   CT   _C5_    46     1.51681   112.50107   -13.74610
   55    54 S   HC   _H3_    47     1.09491   109.92534  -129.19943
   56    40 S   CT   _C6_    48     1.53454   113.36999    12.01834
   57    56 S   HC   _H4_    49     1.09768   110.54183    75.48366
   58    54 S   CT   _C4_    96     1.52168   110.04760   109.13631
   59    58 S   HC   _H13    97     1.09500   112.18024   -53.68720
   60    58 S   HC   _H14    98     1.09464   110.71275  -174.73906
   61    58 S   HC   _H15    99     1.09549   110.43351    65.68665
   62    56 S   CO   _C14    50     1.54411   112.48244   -46.81542
   63    62 S   HC   _H7_    51     1.09630   109.03094   -85.62239
   64    62 S   OS   _O37    53     1.43585   107.00711   157.92030
   65    64 S   CO   _C15    54     1.43372   113.31225   169.20922
   66    65 S   HC   _H8_    55     1.09761   108.44663    57.82161
   67    65 S   CT   _C16    56     1.53417   107.57417   177.19300
   68    67 S   HC   _H9_    57     1.09823   109.14191    55.00381
   69    67 S   CT   _C17    58     1.53595   110.64271   176.57177
   70    69 S   HC   _H10    59     1.09785   109.32682    72.09281
   71    67 S   OS   _O45    89     1.44762   108.18279   -64.48563
   72    69 S   CT   _C18    60     1.53599   111.13537   -50.21571
   73    72 S   HC   _H11    61     1.09819   109.16496   -70.40918
   74    69 S   OS   _O43    82     1.44806   107.44913  -169.09180
   75    71 S   CO4  _C27    90     1.36272   117.75423   144.60101
   76    75 S   O    _O46    91     1.22339   126.53904    -1.57991
   77    72 S   CT   _C19    62     1.53322   110.36765    49.89436
   78    77 S   HC   _H12    63     1.09851   111.02355    64.54377
   79    72 S   OS   _O41    75     1.44449   109.09378   168.31578
   80    74 S   CO4  _C25    83     1.36174   118.23017  -138.46356
   81    80 S   O    _O44    84     1.22292   126.57087    -1.75044
   82    75 S   CT   _C28    92     1.49770   109.65496   178.99361
   83    82 S   HC   _H32    93     1.09376   109.35224  -171.34603
   84    82 S   HC   _H33    94     1.09192   109.66842    69.29950
   85    82 S   HC   _H34    95     1.09270   109.93423   -52.82923
   86    65 S   OS   _O38    64     1.42830   110.99362   -63.50134
   87    77 S   CT   _C20    65     1.53133   111.59052  -174.64551
   88    87 S   HC   _H21    66     1.09649   110.38539    67.57799
   89    87 S   HC   _H22    67     1.09525   111.06380   -54.72940
   90    79 S   CO4  _C23    76     1.36235   118.01722   101.68472
   91    90 S   O    _O42    77     1.22291   126.56495     0.07913
   92    80 S   CT   _C26    85     1.49817   109.39831   178.70155
   93    92 S   HC   _H29    86     1.09299   109.82885   -59.87916
   94    92 S   HC   _H30    87     1.09376   109.36325  -178.85431
   95    92 S   HC   _H31    88     1.09287   109.80364    62.03431
   96    87 S   OS   _O39    68     1.44052   108.08377  -173.68782
   97    90 S   CT   _C24    78     1.49830   109.41977  -179.64064
   98    97 S   HC   _H26    79     1.09292   109.83470   -60.27914
   99    97 S   HC   _H27    80     1.09377   109.36126  -179.28948
  100    97 S   HC   _H28    81     1.09288   109.81194    61.64058
  101    96 S   CO4  _C21    69     1.36223   115.56401  -177.21070
  102   101 S   O    _O40    70     1.22328   126.22784    -0.79130
  103   101 S   CT   _C22    71     1.49836   109.58426   179.23383
  104   103 S   HC   _H23    72     1.09298   109.82749   -60.52512
  105   103 S   HC   _H24    73     1.09379   109.36119  -179.54329
  106   103 S   HC   _H25    74     1.09288   109.83324    61.37863
  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  15   9  17   9   8   2  10   5   4   4  10
   4   3   2   1   1  10   7   9   4   4   2   1   1   6   2   8
  13   6  14   7  15   7   9  14   7   8   5   4   9   6   8   5
   4   3   2   1   1   4   6   3   2   5   4   3   2   1   1   6
   3   2   1   1   5   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    40    62    39    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    40    41    44    56    62    63    39    64    42    43    47  
   38    40    62    39    42  
   36    37  
   37  
    0  
   40    41    44    45    46    48    54    56    57    62    39    42    43    47    50  
   64    65    42    40    54    56    57    62    63  
   41    44    45    46    48    49    54    55    56    57    62    63    64    58    42    43    47  
   44    45    46    48    54    56    57    62    42  
   43    47    50    51    52    53    44    56  
   47    50  
   45    46    48    49    54    55    56    57    62    58  
   46    48    49    54    56  
   48    49    54    56  
   50    51    52    53  
   49    54    55    56    57    62    58    59    60    61  
   54    55    56    58  
   51    52    53  
   52    53  
   53  
    0  
   55    56    57    62    63    64    58    59    60    61  
   56    57    62    58    59    60    61  
   57    62    63    64    65    58    59    60    61  
   62    63    64    58  
   59    60    61    62  
   60    61  
   61  
    0  
   63    64    65    66    67    86  
   64    65  
   65    66    67    68    69    77    86    71  
   66    67    68    69    70    72    77    78    86    87    74    71    75  
   67    68    69    77    86    71  
   68    69    70    72    73    77    86    79    74    80    71    75    76    82  
   69    70    72    86    74    71    75  
   70    72    73    77    78    86    87    79    90    74    80    81    92    71    75  
   72    73    77    79    74    80    71  
   75    76    82    83    84    85    72    74    86  
   73    77    78    86    87    88    89    96    79    90    91    97    74    80  
   77    78    86    87    79    90    74  
   80    81    92    93    94    95    77    79  
   76    82    83    84    85  
   82    83    84    85  
   78    86    87    88    89    96   101    79    90  
   86    87    88    89    96    79  
   90    91    97    98    99   100    86    87  
   81    92    93    94    95  
   92    93    94    95  
   83    84    85  
   84    85  
   85  
    0  
   87    88    89    96  
   88    89    96   101   102   103  
   89    96   101  
   96   101  
   91    97    98    99   100  
   97    98    99   100  
   93    94    95  
   94    95  
   95  
    0  
  101   102   103   104   105   106  
   98    99   100  
   99   100  
  100  
    0  
  102   103   104   105   106  
  103   104   105   106  
  104   105   106  
  105   106  
  106  
    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   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   40   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   44   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.8500   0.1400  -0.685000   1.5900   1.4000   0.020110767  -0.896042159
   48   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   49   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   50   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   64   2.9000   0.1400  -0.400000   1.7660   1.5600   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   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.4200   0.0150   0.030000   1.3810   1.2100   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   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   72   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   74   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   75   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   76   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   77   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   79   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   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  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   84   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   85   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   86   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   87   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   88   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   89   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   90   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   91   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   92   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   93   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   94   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   95   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   96   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   97   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   98   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   99   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  100   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  101   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
  102   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
  103   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  104   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  105   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  106   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
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    39   320.000  1.410
   38    40   317.000  1.510
   38    42   465.000  1.376
   40    41   340.000  1.090
   40    44   268.000  1.529
   40    56   268.000  1.529
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    48   317.000  1.522
   48    49   570.000  1.229
   48    54   317.000  1.522
   54    55   340.000  1.090
   54    56   268.000  1.529
   54    58   268.000  1.529
   56    57   340.000  1.090
   56    62   250.000  1.527
   62    63   340.000  1.090
   62    39   320.000  1.380
   62    64   320.000  1.380
   64    65   320.000  1.380
   65    66   340.000  1.090
   65    67   250.000  1.527
   65    86   320.000  1.380
   67    68   340.000  1.090
   67    69   268.000  1.529
   67    71   320.000  1.410
   69    70   340.000  1.090
   69    72   268.000  1.529
   69    74   320.000  1.410
   72    73   340.000  1.090
   72    77   268.000  1.529
   72    79   320.000  1.410
   77    78   340.000  1.090
   77    86   320.000  1.410
   77    87   268.000  1.529
   87    88   340.000  1.090
   87    89   340.000  1.090
   87    96   320.000  1.410
   96   101   214.000  1.327
  101   102   570.000  1.229
  101   103   317.000  1.522
  103   104   340.000  1.090
  103   105   340.000  1.090
  103   106   340.000  1.090
   79    90   214.000  1.327
   90    91   570.000  1.229
   90    97   317.000  1.522
   97    98   340.000  1.090
   97    99   340.000  1.090
   97   100   340.000  1.090
   74    80   214.000  1.327
   80    81   570.000  1.229
   80    92   317.000  1.522
   92    93   340.000  1.090
   92    94   340.000  1.090
   92    95   340.000  1.090
   71    75   214.000  1.327
   75    76   570.000  1.229
   75    82   317.000  1.522
   82    83   340.000  1.090
   82    84   340.000  1.090
   82    85   340.000  1.090
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   340.000  1.090
   42    43   745.000  1.250
   42    47   440.000  1.360
   47    50   320.000  1.410
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   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    39    85.00000  114.68000
   33    38    40    65.00000  117.92700
   33    38    42    70.00000  124.00000
   33    39    62    60.00000  109.50000
   38    33    34    35.00000  109.50000
   38    40    41    35.00000  109.50000
   38    40    44    70.00000  112.02700
   38    40    56    70.00000  112.02700
   38    42    43    65.00000  137.10300
   38    42    47    80.00000  120.01400
   40    44    45    37.50000  110.70000
   40    44    46    37.50000  110.70000
   40    44    48    63.00000  111.10000
   40    56    54    58.35000  112.70000
   40    56    57    37.50000  110.70000
   40    56    62    75.00000  109.43000
   44    40    41    37.50000  110.70000
   44    48    49    80.00000  120.40000
   44    48    54    70.00000  116.00000
   46    44    45    33.00000  107.80000
   48    44    45    35.00000  109.50000
   48    44    46    35.00000  109.50000
   48    54    55    35.00000  109.50000
   48    54    56    63.00000  111.10000
   48    54    58    63.00000  111.10000
   54    48    49    80.00000  120.40000
   54    56    57    37.50000  110.70000
   54    56    62    75.00000  109.43000
   54    58    59    37.50000  110.70000
   54    58    60    37.50000  110.70000
   54    58    61    37.50000  110.70000
   56    40    41    37.50000  110.70000
   56    40    44    58.35000  112.70000
   56    54    55    37.50000  110.70000
   56    62    63    45.00000  112.01100
   56    62    39    90.00000  108.56700
   56    62    64    90.00000  108.56700
   62    56    57    45.00000  108.72000
   62    64    65   100.00000  109.58800
   39    33    34    35.00000  109.50000
   39    33    38    85.00000  110.90400
   39    62    63    35.00000  109.50000
   64    62    63    35.00000  109.50000
   64    62    39    92.60000  111.55000
   64    65    66    35.00000  109.50000
   64    65    67    90.00000  108.56700
   64    65    86    92.60000  111.55000
   65    67    68    45.00000  108.72000
   65    67    69    75.00000  109.43000
   65    67    71    90.00000  109.38000
   65    86    77    60.00000  109.50000
   67    65    66    45.00000  112.01100
   67    69    70    37.50000  110.70000
   67    69    72    58.35000  112.70000
   67    69    74    50.00000  109.50000
   67    71    75    83.00000  116.90000
   69    67    68    37.50000  110.70000
   69    72    73    37.50000  110.70000
   69    72    77    58.35000  112.70000
   69    72    79    50.00000  109.50000
   69    74    80    83.00000  116.90000
   72    69    70    37.50000  110.70000
   72    77    78    37.50000  110.70000
   72    77    86    50.00000  109.50000
   72    77    87    58.35000  112.70000
   72    79    90    83.00000  116.90000
   77    72    73    37.50000  110.70000
   77    87    88    37.50000  110.70000
   77    87    89    37.50000  110.70000
   77    87    96    50.00000  109.50000
   86    65    66    35.00000  109.50000
   86    65    67    90.00000  108.56700
   86    77    78    35.00000  109.50000
   87    77    78    37.50000  110.70000
   87    77    86    50.00000  109.50000
   87    96   101    83.00000  116.90000
   89    87    88    33.00000  107.80000
   96    87    88    35.00000  109.50000
   96    87    89    35.00000  109.50000
   96   101   102    83.00000  123.40000
   96   101   103    81.00000  111.40000
  101   103   104    35.00000  109.50000
  101   103   105    35.00000  109.50000
  101   103   106    35.00000  109.50000
  103   101   102    80.00000  120.40000
  105   103   104    33.00000  107.80000
  106   103   104    33.00000  107.80000
  106   103   105    33.00000  107.80000
   79    72    73    35.00000  109.50000
   79    72    77    50.00000  109.50000
   79    90    91    83.00000  123.40000
   79    90    97    81.00000  111.40000
   90    97    98    35.00000  109.50000
   90    97    99    35.00000  109.50000
   90    97   100    35.00000  109.50000
   97    90    91    80.00000  120.40000
   99    97    98    33.00000  107.80000
  100    97    98    33.00000  107.80000
  100    97    99    33.00000  107.80000
   74    69    70    35.00000  109.50000
   74    69    72    50.00000  109.50000
   74    80    81    83.00000  123.40000
   74    80    92    81.00000  111.40000
   80    92    93    35.00000  109.50000
   80    92    94    35.00000  109.50000
   80    92    95    35.00000  109.50000
   92    80    81    80.00000  120.40000
   94    92    93    33.00000  107.80000
   95    92    93    33.00000  107.80000
   95    92    94    33.00000  107.80000
   71    67    68    35.00000  109.50000
   71    67    69    50.00000  109.50000
   71    75    76    83.00000  123.40000
   71    75    82    81.00000  111.40000
   75    82    83    35.00000  109.50000
   75    82    84    35.00000  109.50000
   75    82    85    35.00000  109.50000
   82    75    76    80.00000  120.40000
   84    82    83    33.00000  107.80000
   85    82    83    33.00000  107.80000
   85    82    84    33.00000  107.80000
   58    54    55    37.50000  110.70000
   58    54    56    58.35000  112.70000
   60    58    59    33.00000  107.80000
   61    58    59    33.00000  107.80000
   61    58    60    33.00000  107.80000
   42    38    40    70.00000  124.00000
   42    47    50    90.00000  111.18400
   47    42    43    65.00000  121.00000
   47    50    51    35.00000  109.50000
   47    50    52    35.00000  109.50000
   47    50    53    35.00000  109.50000
   52    50    51    33.00000  107.80000
   53    50    51    33.00000  107.80000
   53    50    52    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    39   0.13850  1.0 1.0
   24    29    33    39  -1.34450 -1.0 2.0
   24    29    33    39   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    40   0.30250  1.0 1.0
   29    33    38    40  -0.14950 -1.0 2.0
   29    33    38    40   0.36900  1.0 3.0
   29    33    38    42   0.42700  1.0 1.0
   29    33    38    42  -0.70350 -1.0 2.0
   29    33    38    42  -0.43150  1.0 3.0
   29    33    39    62   0.14700  1.0 1.0
   29    33    39    62  -1.16150 -1.0 2.0
   29    33    39    62   0.48700  1.0 3.0
   33    38    40    41   0.34800  1.0 3.0
   33    38    40    44   0.46850  1.0 1.0
   33    38    40    44   0.08550 -1.0 2.0
   33    38    40    44   0.09800  1.0 3.0
   33    38    40    56   0.46850  1.0 1.0
   33    38    40    56   0.08550 -1.0 2.0
   33    38    40    56   0.09800  1.0 3.0
   33    38    42    43   7.00000 -1.0 2.0
   33    38    42    47   7.00000 -1.0 2.0
   34    33    38    40   0.34800  1.0 3.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    39    62   0.37050  1.0 3.0
   38    33    39    62  -0.77900  1.0 1.0
   38    33    39    62  -0.36900 -1.0 2.0
   38    33    39    62   0.40400  1.0 3.0
   38    40    44    45   0.15000  1.0 3.0
   38    40    44    46   0.15000  1.0 3.0
   38    40    44    48  -0.98800  1.0 1.0
   38    40    44    48   0.48800 -1.0 2.0
   38    40    44    48   0.76800  1.0 3.0
   38    40    56    54   0.34400  1.0 1.0
   38    40    56    54   0.09450 -1.0 2.0
   38    40    56    54   0.11100  1.0 3.0
   38    40    56    57   0.15000  1.0 3.0
   38    40   -56    62   0.34400  1.0 1.0
   38    40   -56    62   0.09450 -1.0 2.0
   38    40   -56    62   0.11100  1.0 3.0
   38    42    47    50  -2.26850  1.0 1.0
   38    42    47    50   3.39050 -1.0 2.0
   40    38    42    43   7.00000 -1.0 2.0
   40    38    42    47   7.00000 -1.0 2.0
   40    44    48    49   0.30150 -1.0 2.0
   40    44   -48    54   0.60050  1.0 1.0
   40    44   -48    54   0.05600 -1.0 2.0
   40    44   -48    54   0.26150  1.0 3.0
   40    56    62    63   0.15000  1.0 3.0
   40    56    62    39   0.62750  1.0 1.0
   40    56    62    39  -0.30950 -1.0 2.0
   40    56    62    39   0.27300  1.0 3.0
   40    56    62    64   0.62750  1.0 1.0
   40    56    62    64  -0.30950 -1.0 2.0
   40    56    62    64   0.27300  1.0 3.0
   41    40    44    45   0.15000  1.0 3.0
   41    40    44    46   0.15000  1.0 3.0
   41    40    44    48  -0.11250  1.0 3.0
   41    40    56    54   0.15000  1.0 3.0
   41    40    56    57   0.15000  1.0 3.0
   41    40    56    62   0.15000  1.0 3.0
   44    40   -56    54   0.56750  1.0 1.0
   44    40   -56    54  -0.07550 -1.0 2.0
   44    40   -56    54   0.20000  1.0 3.0
   44    40    56    57   0.15000  1.0 3.0
   44    40    56    62   3.97050  1.0 1.0
   44    48    54    55   0.00000  1.0 1.0
   44    48   -54    56   0.60050  1.0 1.0
   44    48   -54    56   0.05600 -1.0 2.0
   44    48   -54    56   0.26150  1.0 3.0
   44    48    54    58   0.60050  1.0 1.0
   44    48    54    58   0.05600 -1.0 2.0
   44    48    54    58   0.26150  1.0 3.0
   45    44    48    49   0.00000  1.0 1.0
   45    44    48    54   0.00000  1.0 1.0
   46    44    48    49   0.00000  1.0 1.0
   46    44    48    54   0.00000  1.0 1.0
   48    54   -56    40  -0.95700  1.0 1.0
   48    54   -56    40  -0.18200 -1.0 2.0
   48    54   -56    40   0.29450  1.0 3.0
   48    54    56    57  -0.11250  1.0 3.0
   48    54    56    62  -0.95700  1.0 1.0
   48    54    56    62  -0.18200 -1.0 2.0
   48    54    56    62   0.29450  1.0 3.0
   48    54    58    59  -0.11250  1.0 3.0
   48    54    58    60  -0.11250  1.0 3.0
   48    54    58    61  -0.11250  1.0 3.0
   49    48    54    55   0.00000  1.0 1.0
   49    48    54    56   0.30150 -1.0 2.0
   49    48    54    58   0.30150 -1.0 2.0
   54    56    62    63   0.15000  1.0 3.0
   54    56    62    39   0.62750  1.0 1.0
   54    56    62    39  -0.30950 -1.0 2.0
   54    56    62    39   0.27300  1.0 3.0
   54    56    62    64   0.62750  1.0 1.0
   54    56    62    64  -0.30950 -1.0 2.0
   54    56    62    64   0.27300  1.0 3.0
   55    54    56    40   0.15000  1.0 3.0
   55    54    56    57   0.15000  1.0 3.0
   55    54    56    62   0.15000  1.0 3.0
   55    54    58    59   0.15000  1.0 3.0
   55    54    58    60   0.15000  1.0 3.0
   55    54    58    61   0.15000  1.0 3.0
   56    40    44    45   0.15000  1.0 3.0
   56    40    44    46   0.15000  1.0 3.0
   56    40   -44    48  -0.95700  1.0 1.0
   56    40   -44    48  -0.18200 -1.0 2.0
   56    40   -44    48   0.29450  1.0 3.0
   56    54    58    59   0.15000  1.0 3.0
   56    54    58    60   0.15000  1.0 3.0
   56    54    58    61   0.15000  1.0 3.0
   56    62   -39    33   0.06250  1.0 1.0
   56    62   -39    33  -0.01100 -1.0 2.0
   56    62   -39    33   0.28050  1.0 3.0
   56    62    64    65   0.06250  1.0 1.0
   56    62    64    65  -0.01100 -1.0 2.0
   56    62    64    65   0.28050  1.0 3.0
   57    56    62    63   0.15000  1.0 3.0
   57    56    62    39   0.23400  1.0 3.0
   57    56    62    64   0.23400  1.0 3.0
   62    64    65    66   0.37050  1.0 3.0
   62    64    65    67   0.06250  1.0 1.0
   62    64    65    67  -0.01100 -1.0 2.0
   62    64    65    67   0.28050  1.0 3.0
   62    64    65    86  -0.53350  1.0 1.0
   62    64    65    86  -0.78350 -1.0 2.0
   62    64    65    86   0.33750  1.0 3.0
   63    62    39    33   0.37050  1.0 3.0
   63    62    64    65   0.37050  1.0 3.0
   39    33   -38    40   0.09700  1.0 1.0
   39    33   -38    40   0.15600 -1.0 2.0
   39    33   -38    40  -0.50800  1.0 3.0
   39    33    38    42   0.39000  1.0 1.0
   39    33    38    42  -0.05800 -1.0 2.0
   39    33    38    42  -0.55150  1.0 3.0
   39    62    64    65  -0.53350  1.0 1.0
   39    62    64    65  -0.78350 -1.0 2.0
   39    62    64    65   0.33750  1.0 3.0
   64    62    39    33  -0.81800  1.0 1.0
   64    65    67    68   0.23400  1.0 3.0
   64    65    67    69   0.62750  1.0 1.0
   64    65    67    69  -0.30950 -1.0 2.0
   64    65    67    69   0.27300  1.0 3.0
   64    65    67    71   1.11900  1.0 1.0
   64    65    67    71  -1.16350 -1.0 2.0
   64    65    67    71  -0.34150  1.0 3.0
   64    65    86    77  -0.81800  1.0 1.0
   65    67    69    70   0.15000  1.0 3.0
   65    67    69    72   3.97050  1.0 1.0
   65    67    69    74   0.62750  1.0 1.0
   65    67    69    74  -0.30950 -1.0 2.0
   65    67    69    74   0.27300  1.0 3.0
   65    67    71    75  -0.25900  1.0 1.0
   65    67    71    75  -0.47000 -1.0 2.0
   65    67    71    75   0.11750  1.0 3.0
   66    65    67    68   0.15000  1.0 3.0
   66    65    67    69   0.15000  1.0 3.0
   66    65    67    71   0.23400  1.0 3.0
   66    65    86    77   0.37050  1.0 3.0
   67    65    86    77   0.06250  1.0 1.0
   67    65    86    77  -0.01100 -1.0 2.0
   67    65    86    77   0.28050  1.0 3.0
   67    69    72    73   0.15000  1.0 3.0
   67    69   -72    77   0.56750  1.0 1.0
   67    69   -72    77  -0.07550 -1.0 2.0
   67    69   -72    77   0.20000  1.0 3.0
   67    69    72    79   0.62750  1.0 1.0
   67    69    72    79  -0.30950 -1.0 2.0
   67    69    72    79   0.27300  1.0 3.0
   67    69    74    80  -0.25900  1.0 1.0
   67    69    74    80  -0.47000 -1.0 2.0
   67    69    74    80   0.11750  1.0 3.0
   67    71    75    76   3.00000 -1.0 2.0
   67    71    75    82   1.63150  1.0 1.0
   67    71    75    82   2.92000 -1.0 2.0
   68    67    69    70   0.15000  1.0 3.0
   68    67    69    72   0.15000  1.0 3.0
   68    67    69    74   0.23400  1.0 3.0
   68    67    71    75   0.08050  1.0 3.0
   69    67    71    75  -0.25900  1.0 1.0
   69    67    71    75  -0.47000 -1.0 2.0
   69    67    71    75   0.11750  1.0 3.0
   69    72    77    78   0.15000  1.0 3.0
   69    72    77    86   0.62750  1.0 1.0
   69    72    77    86  -0.30950 -1.0 2.0
   69    72    77    86   0.27300  1.0 3.0
   69    72    77    87   0.56750  1.0 1.0
   69    72    77    87  -0.07550 -1.0 2.0
   69    72    77    87   0.20000  1.0 3.0
   69    72    79    90  -0.25900  1.0 1.0
   69    72    79    90  -0.47000 -1.0 2.0
   69    72    79    90   0.11750  1.0 3.0
   69    74    80    81   3.00000 -1.0 2.0
   69    74    80    92   1.63150  1.0 1.0
   69    74    80    92   2.92000 -1.0 2.0
   70    69    72    73   0.15000  1.0 3.0
   70    69    72    77   0.15000  1.0 3.0
   70    69    72    79   0.23400  1.0 3.0
   70    69    74    80   0.08050  1.0 3.0
   72    69    74    80  -0.25900  1.0 1.0
   72    69    74    80  -0.47000 -1.0 2.0
   72    69    74    80   0.11750  1.0 3.0
   72    77   -86    65   0.06250  1.0 1.0
   72    77   -86    65  -0.01100 -1.0 2.0
   72    77   -86    65   0.28050  1.0 3.0
   72    77    87    88   0.15000  1.0 3.0
   72    77    87    89   0.15000  1.0 3.0
   72    77    87    96   0.62750  1.0 1.0
   72    77    87    96  -0.30950 -1.0 2.0
   72    77    87    96   0.27300  1.0 3.0
   72    79    90    91   3.00000 -1.0 2.0
   72    79    90    97   1.63150  1.0 1.0
   72    79    90    97   2.92000 -1.0 2.0
   73    72    77    78   0.15000  1.0 3.0
   73    72    77    86   0.23400  1.0 3.0
   73    72    77    87   0.15000  1.0 3.0
   73    72    79    90   0.08050  1.0 3.0
   77    72    79    90  -0.25900  1.0 1.0
   77    72    79    90  -0.47000 -1.0 2.0
   77    72    79    90   0.11750  1.0 3.0
   77    87    96   101  -0.25900  1.0 1.0
   77    87    96   101  -0.47000 -1.0 2.0
   77    87    96   101   0.11750  1.0 3.0
   78    77    86    65   0.37050  1.0 3.0
   78    77    87    88   0.15000  1.0 3.0
   78    77    87    89   0.15000  1.0 3.0
   78    77    87    96   0.23400  1.0 3.0
   86    65    67    68   0.23400  1.0 3.0
   86    65   -67    69   0.62750  1.0 1.0
   86    65   -67    69  -0.30950 -1.0 2.0
   86    65   -67    69   0.27300  1.0 3.0
   86    65    67    71   1.11900  1.0 1.0
   86    65    67    71  -1.16350 -1.0 2.0
   86    65    67    71  -0.34150  1.0 3.0
   86    77    87    88   0.23400  1.0 3.0
   86    77    87    89   0.23400  1.0 3.0
   86    77    87    96   1.11900  1.0 1.0
   86    77    87    96  -1.16350 -1.0 2.0
   86    77    87    96  -0.34150  1.0 3.0
   87    77    86    65   0.06250  1.0 1.0
   87    77    86    65  -0.01100 -1.0 2.0
   87    77    86    65   0.28050  1.0 3.0
   87    96   101   102   3.00000 -1.0 2.0
   87    96   101   103   1.63150  1.0 1.0
   87    96   101   103   2.92000 -1.0 2.0
   88    87    96   101   0.08050  1.0 3.0
   89    87    96   101   0.08050  1.0 3.0
   96   101   103   104   0.00000  1.0 1.0
   96   101   103   105   0.00000  1.0 1.0
   96   101   103   106   0.00000  1.0 1.0
  102   101   103   104   0.00000  1.0 1.0
  102   101   103   105   0.00000  1.0 1.0
  102   101   103   106   0.00000  1.0 1.0
   79    72    77    78   0.23400  1.0 3.0
   79    72    77    86   1.11900  1.0 1.0
   79    72    77    86  -1.16350 -1.0 2.0
   79    72    77    86  -0.34150  1.0 3.0
   79    72    77    87   0.62750  1.0 1.0
   79    72    77    87  -0.30950 -1.0 2.0
   79    72    77    87   0.27300  1.0 3.0
   79    90    97    98   0.00000  1.0 1.0
   79    90    97    99   0.00000  1.0 1.0
   79    90    97   100   0.00000  1.0 1.0
   91    90    97    98   0.00000  1.0 1.0
   91    90    97    99   0.00000  1.0 1.0
   91    90    97   100   0.00000  1.0 1.0
   74    69    72    73   0.23400  1.0 3.0
   74    69    72    77   0.62750  1.0 1.0
   74    69    72    77  -0.30950 -1.0 2.0
   74    69    72    77   0.27300  1.0 3.0
   74    69    72    79   1.11900  1.0 1.0
   74    69    72    79  -1.16350 -1.0 2.0
   74    69    72    79  -0.34150  1.0 3.0
   74    80    92    93   0.00000  1.0 1.0
   74    80    92    94   0.00000  1.0 1.0
   74    80    92    95   0.00000  1.0 1.0
   81    80    92    93   0.00000  1.0 1.0
   81    80    92    94   0.00000  1.0 1.0
   81    80    92    95   0.00000  1.0 1.0
   71    67    69    70   0.23400  1.0 3.0
   71    67    69    72   0.62750  1.0 1.0
   71    67    69    72  -0.30950 -1.0 2.0
   71    67    69    72   0.27300  1.0 3.0
   71    67    69    74   1.11900  1.0 1.0
   71    67    69    74  -1.16350 -1.0 2.0
   71    67    69    74  -0.34150  1.0 3.0
   71    75    82    83   0.00000  1.0 1.0
   71    75    82    84   0.00000  1.0 1.0
   71    75    82    85   0.00000  1.0 1.0
   76    75    82    83   0.00000  1.0 1.0
   76    75    82    84   0.00000  1.0 1.0
   76    75    82    85   0.00000  1.0 1.0
   58    54    56    40   0.56750  1.0 1.0
   58    54    56    40  -0.07550 -1.0 2.0
   58    54    56    40   0.20000  1.0 3.0
   58    54    56    57   0.15000  1.0 3.0
   58    54    56    62   3.97050  1.0 1.0
   42    38    40    41   0.00000  1.0 1.0
   42    38    40    44   0.09850  1.0 1.0
   42    38    40    44   0.15250 -1.0 2.0
   42    38    40    44  -0.50650  1.0 3.0
   42    38    40    56   0.09850  1.0 1.0
   42    38    40    56   0.15250 -1.0 2.0
   42    38    40    56  -0.50650  1.0 3.0
   42    47    50    51   0.08050  1.0 3.0
   42    47    50    52   0.08050  1.0 3.0
   42    47    50    53   0.08050  1.0 3.0
   43    42    47    50   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    40    38    42   1.10000 -1.0 2.0
   44    54    48    49  10.50000 -1.0 2.0
   96   103   101   102  10.50000 -1.0 2.0
   79    97    90    91  10.50000 -1.0 2.0
   74    92    80    81  10.50000 -1.0 2.0
   71    82    75    76  10.50000 -1.0 2.0
   43    47    42    38   1.10000 -1.0 2.0
END
