* LIGAND DATABASE FILE (OPLS2005)
*
001     109   111    195    317     584
    1     0 S   NP   _N1_     1    28.67547    95.02662   -24.58413
    2     1 S   H    _HN1     2     1.02949    83.71358     4.13034
    3     1 S   H    _H1_     3     1.02828    24.08048   170.16165
    4     1 S   H    _H2_     4     1.02787   111.14931  -103.17282
    5     1 S   CT   _CA1     5     1.50122   126.35196   114.87125
    6     5 S   HC   _HA1     6     1.09573   105.17764    80.26670
    7     5 S   CO3  _C1_     7     1.53782   112.48926   -39.93813
    8     7 S   O2Z  _O11     8     1.26373   115.00230   -41.77702
    9     7 S   O2Z  _O12     9     1.26242   114.94787   137.31805
   10     5 S   CT   _CB1    10     1.53076   107.41287  -161.75686
   11    10 S   HC   HB11    11     1.09834   109.33994   -49.63713
   12    10 S   HC   HB12    12     1.09812   110.45791    66.96546
   13    10 S   CT   _CG1    13     1.52995   112.62490  -170.61175
   14    13 S   HC   HG11    14     1.09578   110.64955   -66.47223
   15    13 S   HC   HG12    15     1.09672   109.76161    52.76138
   16    13 S   C    _CD1    16     1.51806   112.19053   173.20252
   17    16 S   O    _OE1    17     1.22734   123.27437     8.28399
   18    16 S   N    _N2_    18     1.38657   111.70066  -171.76675
   19    18 S   H    _HN2    19     1.01577   118.92326     1.49436
   20    18 S   CT1  _CA2    20     1.46190   123.38031   176.99613
   21    20 S   HC   _HA2    21     1.09737   109.36744     3.80117
   22    20 S   C    _C2_    22     1.53581   108.60292  -111.66774
   23    22 S   O    _O2_    23     1.23063   122.26704  -147.68043
   24    20 S   CT   _CB2    32     1.53351   111.62711   125.85940
   25    24 S   HC   HB21    33     1.09477   109.93701    56.27212
   26    24 S   HC   HB22    34     1.09510   110.04502   175.28457
   27    22 S   N    _N3_    24     1.38323   113.73617    39.74830
   28    27 S   H    _HN3    25     1.01577   119.60221    -3.23277
   29    24 S   S    _SG2    35     1.82737   111.48532   -64.97862
   30    27 S   CT   _CA3    26     1.45289   123.23623   177.16800
   31    30 S   HC   HA31    27     1.09549   107.50453   -64.77411
   32    30 S   HC   HA32    28     1.09557   107.99524    51.67091
   33    29 S   CT   _C20    36     1.85244    99.84035  -174.80205
   34    33 S   HC   _H3_    37     1.09956   106.45173    40.76804
   35    30 S   CO3  _C3_    29     1.52968   114.06745   173.67244
   36    35 S   O2Z  _O31    30     1.26378   116.06897    -0.68414
   37    35 S   O2Z  _O32    31     1.26428   114.41363   179.37693
   38    33 S   CT   _C21    38     1.53329   110.26273   -75.87046
   39    38 S   HC   _H4_    39     1.09554   110.52631    58.81068
   40    38 S   CO4  _C22    40     1.51614   109.81979   177.54441
   41    40 S   O    _O34    41     1.23194   120.90288  -145.25770
   42    38 S   OH   _O35   108     1.41793   112.65244   -63.25155
   43    42 S   HO   _H24   109     0.97285   107.67125   172.59260
   44    40 S   CM   _C17    42     1.49837   118.78457    38.37827
   45    44 S   CM   _C18    43     1.34226   118.54132    -8.28309
   46    45 S   HC   _H23    44     1.08635   119.47263   174.59195
   47    44 S   N    _N4_    75     1.38223   114.98433   169.94865
   48    47 S   H    _H22    76     1.01838   113.87059    -0.44367
   49    33 S   CT   _C19    45     1.55836   112.54845   158.27609
   50    47 S   C    _C16    77     1.38775   128.40379   178.57673
   51    50 S   O    _O33    78     1.22558   127.27449    -0.75692
   52    49 S   CM   _C23    46     1.52542   109.86789   -65.36305
   53    52 S   HC   _H25    47     1.09034   114.88933    79.16240
   54    49 S   OH   _O39    73     1.43300   110.41645    52.84443
   55    54 S   HO   _H36    74     0.97266   108.29640  -175.22513
   56    50 S   CM   _C15    79     1.49302   111.28943   179.60933
   57    56 S   HC   _H21    80     1.08510   118.59421    -0.46855
   58    52 S   CM   _C24    48     1.34384   127.06779   -99.68490
   59    58 S   HC   _H26    49     1.08671   120.34688     0.12972
   60    56 S   CM   _C14    81     1.34073   120.19844   179.58316
   61    60 S   HC   _H20    82     1.08751   120.43836    -0.00000
   62    58 S   CM   _C25    50     1.44682   122.95030   179.53480
   63    62 S   HC   _H27    51     1.08792   117.09956     0.06256
   64    60 S   CM   _C13    83     1.44712   122.73463   179.98022
   65    64 S   HC   _H19    84     1.08790   117.08488    -0.00000
   66    62 S   CM   _C26    52     1.34172   122.95956  -179.95154
   67    66 S   HC   _H28    53     1.08789   119.96915    -0.00000
   68    64 S   CM   _C12    85     1.34170   122.98580   180.00000
   69    68 S   HC   _H18    86     1.08786   119.99650     0.00000
   70    66 S   CM   _C27    54     1.44706   122.97929  -179.97202
   71    70 S   HC   _H29    55     1.08752   116.86703    -0.03956
   72    68 S   CM   _C11    87     1.44593   122.98141   179.97202
   73    72 S   HC   _H17    88     1.08724   117.34159     0.00000
   74    70 S   CM   _C28    56     1.34082   122.74909   179.93744
   75    74 S   HC   _H30    57     1.08501   121.17593     0.00000
   76    72 S   CM   _C10    89     1.34176   123.09656  -180.00000
   77    76 S   HC   _H16    90     1.08851   119.73853    -0.00000
   78    74 S   C    _C29    58     1.49489   120.25514  -179.97202
   79    78 S   O    _O36    59     1.22444   120.95482    -0.02798
   80    76 S   CT   _C7_    91     1.50918   123.60006   180.00000
   81    80 S   HC   _H11    92     1.09897   109.42796     0.00000
   82    78 S   N    _N5_    60     1.38597   110.98318   179.97202
   83    82 S   H    _H31    61     1.01730   117.55157     0.00000
   84    80 S   CT   _C6_    93     1.53623   110.36195   118.63860
   85    84 S   HC   _H9_    94     1.09820   110.17845    56.11809
   86    84 S   HC   _H10    95     1.09712   110.08272   -61.27216
   87    82 S   CM   _C30    62     1.37115   129.00531  -179.98022
   88    84 S   CT   _C5_    96     1.52751   111.57088   177.37222
   89    88 S   HC   _H7_    97     1.09584   109.63014  -176.59377
   90    88 S   HC   _H8_    98     1.09697   109.41457    66.43534
   91    87 S   CMA  _C31    63     1.34407   134.16795     0.00000
   92    91 S   OM   _O38    64     1.25832   135.90524     0.00000
   93    88 S   CT   _C4_    99     1.52563   111.65225   -54.88572
   94    93 S   HC   _H5_   100     1.09580   109.67088   176.20532
   95    93 S   HC   _H6_   101     1.09698   109.41190   -66.78231
   96    91 S   CT   _C32    65     1.52072   111.88106   179.97202
   97    96 S   HC   _H32    66     1.09832   111.67850   119.70314
   98    96 S   HC   _H33    67     1.09832   111.67809  -119.70187
   99    93 S   CT   _C9_   102     1.52562   111.61415    54.45987
  100    99 S   HC   _H14   103     1.09697   109.45383    66.84007
  101    99 S   HC   _H15   104     1.09584   109.64261  -176.15916
  102    96 S   CT   _C33    68     1.52212   106.48577     0.00000
  103   102 S   HC   _H34    69     1.09348   111.63223  -117.90446
  104   102 S   HC   _H35    70     1.09347   111.63187   117.90237
  105    80 S   CT   _C8_   105     1.53623   110.36002  -118.59231
  106   105 S   HC   _H12   106     1.09713   110.08273    61.27042
  107   105 S   HC   _H13   107     1.09820   110.17771   -56.11928
  108    87 S   CO4  _C34    71     1.48051   118.54314  -179.97202
  109   108 S   O    _O37    72     1.22352   123.63813     0.02798
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  10   5   4   3
  16   8   2   1   1  11   6  10   4   3   1  10  10   4   7   3
   7   6   3   8   4   2   1   6   3   6   3   6   3   6   3   6
   3   6   3   6   3   6   3   7   3   6   3  11   4   6   3  14
   8   8   3  12   6   5  10   9   5   4   9   5   8   5   4   7
   5   4   5   4   3   4   3   2   2   1   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    49    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    45    49    52    54    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    44    45    46    49    52    53    58    54    55    42    43  
   38    39    40    45    49    52    54    42  
   36    37  
   37  
    0  
   39    40    41    44    45    49    52    54    47    42    43  
   40    41    44    49    42    43  
   41    44    45    46    49    47    48    50    42    43  
   44    45    47    42  
   43    44    49  
    0  
   45    46    49    52    54    47    48    50    51    56  
   46    49    52    53    58    54    55    47    48    50  
   49    52    54    47  
   48    50    51    56    57    60    49  
   50    51    56  
   52    53    58    59    62    54    55  
   51    56    57    60    61    64  
   56    57    60  
   53    58    59    62    63    66    54    55  
   58    59    62    54  
   55    58  
    0  
   57    60    61    64    65    68  
   60    61    64  
   59    62    63    66    67    70  
   62    63    66  
   61    64    65    68    69    72  
   64    65    68  
   63    66    67    70    71    74  
   66    67    70  
   65    68    69    72    73    76  
   68    69    72  
   67    70    71    74    75    78  
   70    71    74  
   69    72    73    76    77    80  
   72    73    76  
   71    74    75    78    79    82  
   74    75    78  
   73    76    77    80    81    84   105  
   76    77    80  
   75    78    79    82    83    87  
   78    79    82  
   77    80    81    84    85    86    88    99   105   106   107  
   80    81    84   105  
   79    82    83    87    91   108  
   82    83    87  
   81    84    85    86    88    89    90    93    99   100   101   105   106   107  
   84    85    86    88    99   105   106   107  
   83    87    91    92    96   102   108   109  
   87    91   108  
   85    86    88    89    90    93    94    95    99   105   106   107  
   86    88    89    90    93   105  
   88    89    90    93   105  
   91    92    96    97    98   102   103   104   108   109  
   89    90    93    94    95    99   100   101   105  
   90    93    94    95    99  
   93    94    95    99  
   92    96    97    98   102   103   104   108   109  
   96    97    98   102   108  
   94    95    99   100   101   105   106   107  
   95    99   100   101   105  
   99   100   101   105  
   97    98   102   103   104   108   109  
   98   102   103   104   108  
  102   103   104   108  
  100   101   105   106   107  
  101   105   106   107  
  105   106   107  
  103   104   108   109  
  104   108   109  
  108   109  
  106   107  
  107  
    0  
  109  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   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   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   40   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   41   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   42   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   43   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   44   3.5500   0.0760   0.051300   2.0020   1.7750   0.023028004  -0.852763146
   45   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   46   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   47   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
   48   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   49   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   50   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
   51   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   52   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   53   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   54   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   55   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   56   3.5500   0.0760  -0.171700   2.0020   1.7750   0.023028004  -0.852763146
   57   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   59   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   61   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   63   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   65   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   67   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   69   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   71   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   72   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   73   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   74   3.5500   0.0760  -0.171700   2.0020   1.7750   0.023028004  -0.852763146
   75   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   76   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   77   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   78   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
   79   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   80   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
   83   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   84   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   3.5500   0.0760  -0.549900   2.0020   1.7750   0.023028004  -0.852763146
   88   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   92   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   93   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   94   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   99   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  100   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  101   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  102   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  103   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  104   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  105   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  106   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  108   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
  109   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
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   268.000  1.529
   33    49   268.000  1.529
   38    39   340.000  1.090
   38    40   317.000  1.522
   38    42   320.000  1.410
   40    41   570.000  1.229
   40    44   320.000  1.462
   44    45   549.000  1.340
   44    47   400.000  1.384
   45    46   340.000  1.080
   45    49   317.000  1.510
   49    52   317.000  1.510
   49    54   320.000  1.410
   52    53   340.000  1.080
   52    58   549.000  1.340
   58    59   340.000  1.080
   58    62   380.000  1.444
   62    63   340.000  1.080
   62    66   549.000  1.340
   66    67   340.000  1.080
   66    70   380.000  1.444
   70    71   340.000  1.080
   70    74   549.000  1.340
   74    75   340.000  1.080
   74    78   410.000  1.444
   78    79   570.000  1.229
   78    82   490.000  1.335
   82    83   434.000  1.010
   82    87   400.000  1.384
   87    91   465.000  1.376
   87   108   320.000  1.462
   91    92   745.000  1.250
   91    96   270.000  1.512
   96    97   340.000  1.090
   96    98   340.000  1.090
   96   102   268.000  1.529
  102   103   340.000  1.090
  102   104   340.000  1.090
  102   108   317.000  1.522
  108   109   570.000  1.229
   54    55   553.000  0.945
   47    48   434.000  1.010
   47    50   490.000  1.335
   50    51   570.000  1.229
   50    56   410.000  1.444
   56    57   340.000  1.080
   56    60   549.000  1.340
   60    61   340.000  1.080
   60    64   380.000  1.444
   64    65   340.000  1.080
   64    68   549.000  1.340
   68    69   340.000  1.080
   68    72   380.000  1.444
   72    73   340.000  1.080
   72    76   549.000  1.340
   76    77   340.000  1.080
   76    80   317.000  1.510
   80    81   340.000  1.090
   80    84   268.000  1.529
   80   105   268.000  1.529
   84    85   340.000  1.090
   84    86   340.000  1.090
   84    88   268.000  1.529
   88    89   340.000  1.090
   88    90   340.000  1.090
   88    93   268.000  1.529
   93    94   340.000  1.090
   93    95   340.000  1.090
   93    99   268.000  1.529
   99   100   340.000  1.090
   99   101   340.000  1.090
   99   105   268.000  1.529
  105   106   340.000  1.090
  105   107   340.000  1.090
   42    43   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    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  111.63000
   29    33    49    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    63.00000  111.10000
   33    38    42    50.00000  109.50000
   33    49    45    70.00000  112.02700
   33    49    52    70.00000  112.02700
   33    49    54    50.00000  109.50000
   38    33    34    37.50000  110.70000
   38    40    41    80.00000  120.40000
   38    40    44    65.00000  118.62400
   38    42    43    55.00000  108.50000
   40    38    39    35.00000  109.50000
   40    44    45    65.00000  118.96000
   40    44    47    70.00000  117.92000
   44    40    41    80.00000  123.72100
   44    45    46    35.00000  120.00000
   44    45    49    70.00000  124.00000
   44    47    48    45.00000  117.55000
   44    47    50    70.00000  120.89900
   45    49    52    70.00000  110.12100
   45    49    54    90.00000  110.39200
   49    33    34    37.50000  110.70000
   49    33    38    58.35000  112.70000
   49    45    46    35.00000  117.00000
   49    52    53    35.00000  117.00000
   49    52    58    70.00000  124.00000
   49    54    55    55.00000  108.50000
   52    58    59    35.00000  120.00000
   52    58    62    70.00000  123.01800
   58    52    53    35.00000  120.00000
   58    62    63    35.00000  120.00000
   58    62    66    70.00000  123.01800
   62    58    59    35.00000  120.00000
   62    66    67    35.00000  120.00000
   62    66    70    70.00000  123.01800
   66    62    63    35.00000  120.00000
   66    70    71    35.00000  120.00000
   66    70    74    70.00000  123.01800
   70    66    67    35.00000  120.00000
   70    74    75    35.00000  120.00000
   70    74    78    70.00000  118.70000
   74    70    71    35.00000  120.00000
   74    78    79    80.00000  125.30000
   74    78    82    80.00000  111.56200
   78    74    75    35.00000  119.70000
   78    82    83    35.00000  119.80000
   78    82    87    70.00000  120.89900
   82    78    79    80.00000  122.90000
   82    87    91    75.00000  120.83300
   82    87   108    70.00000  117.92000
   87    82    83    45.00000  117.55000
   87    91    92    65.00000  137.10300
   87    91    96    65.00000  122.18000
   87   108   102    65.00000  118.62400
   87   108   109    80.00000  123.72100
   91    96    97    45.00000  110.52000
   91    96    98    45.00000  110.52000
   91    96   102    70.00000  112.02700
   96    91    92    85.00000  112.85300
   96   102   103    37.50000  110.70000
   96   102   104    37.50000  110.70000
   96   102   108    63.00000  111.10000
   98    96    97    33.00000  107.80000
  102    96    97    37.50000  110.70000
  102    96    98    37.50000  110.70000
  102   108   109    80.00000  120.40000
  104   102   103    33.00000  107.80000
  108    87    91    60.00000  125.92000
  108   102   103    35.00000  109.50000
  108   102   104    35.00000  109.50000
   54    49    52    90.00000  110.39200
   47    44    45    75.00000  120.83300
   47    50    51    80.00000  122.90000
   47    50    56    80.00000  111.56200
   50    47    48    35.00000  119.80000
   50    56    57    35.00000  119.70000
   50    56    60    70.00000  118.70000
   56    50    51    80.00000  125.30000
   56    60    61    35.00000  120.00000
   56    60    64    70.00000  123.01800
   60    56    57    35.00000  120.00000
   60    64    65    35.00000  120.00000
   60    64    68    70.00000  123.01800
   64    60    61    35.00000  120.00000
   64    68    69    35.00000  120.00000
   64    68    72    70.00000  123.01800
   68    64    65    35.00000  120.00000
   68    72    73    35.00000  120.00000
   68    72    76    70.00000  123.01800
   72    68    69    35.00000  120.00000
   72    76    77    35.00000  120.00000
   72    76    80    70.00000  124.00000
   76    72    73    35.00000  120.00000
   76    80    81    35.00000  109.50000
   76    80    84    70.00000  112.02700
   76    80   105    70.00000  112.02700
   80    76    77    35.00000  117.00000
   80    84    85    37.50000  110.70000
   80    84    86    37.50000  110.70000
   80    84    88    58.35000  112.70000
   80   105    99    58.35000  112.70000
   80   105   106    37.50000  110.70000
   80   105   107    37.50000  110.70000
   84    80    81    37.50000  110.70000
   84    88    89    37.50000  110.70000
   84    88    90    37.50000  110.70000
   84    88    93    58.35000  112.70000
   86    84    85    33.00000  107.80000
   88    84    85    37.50000  110.70000
   88    84    86    37.50000  110.70000
   88    93    94    37.50000  110.70000
   88    93    95    37.50000  110.70000
   88    93    99    58.35000  112.70000
   90    88    89    33.00000  107.80000
   93    88    89    37.50000  110.70000
   93    88    90    37.50000  110.70000
   93    99   100    37.50000  110.70000
   93    99   101    37.50000  110.70000
   93    99   105    58.35000  112.70000
   95    93    94    33.00000  107.80000
   99    93    94    37.50000  110.70000
   99    93    95    37.50000  110.70000
   99   105   106    37.50000  110.70000
   99   105   107    37.50000  110.70000
  101    99   100    33.00000  107.80000
  105    80    81    37.50000  110.70000
  105    80    84    58.35000  112.70000
  105    99   100    37.50000  110.70000
  105    99   101    37.50000  110.70000
  107   105   106    33.00000  107.80000
   42    38    39    35.00000  109.50000
   42    38    40    90.00000  109.61100
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   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    49   0.01700  1.0 1.0
   24    29    33    49  -0.23550 -1.0 2.0
   24    29    33    49   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.56750  1.0 1.0
   29    33    38    40  -0.07550 -1.0 2.0
   29    33    38    40   0.20000  1.0 3.0
   29    33    38    42   0.56750  1.0 1.0
   29    33    38    42  -0.07550 -1.0 2.0
   29    33    38    42   0.20000  1.0 3.0
   29    33    49    45   0.56750  1.0 1.0
   29    33    49    45  -0.07550 -1.0 2.0
   29    33    49    45   0.20000  1.0 3.0
   29    33    49    52   0.56750  1.0 1.0
   29    33    49    52  -0.07550 -1.0 2.0
   29    33    49    52   0.20000  1.0 3.0
   29    33    49    54   0.56750  1.0 1.0
   29    33    49    54  -0.07550 -1.0 2.0
   29    33    49    54   0.20000  1.0 3.0
   33    38    40    41   0.30150 -1.0 2.0
   33    38    40    44   0.65300  1.0 1.0
   33    38    40    44  -0.03850 -1.0 2.0
   33    38    40    44   0.33900  1.0 3.0
   33    38    42    43  -0.11600  1.0 1.0
   33    38    42    43  -0.09450 -1.0 2.0
   33    38    42    43   0.21250  1.0 3.0
   33    49    52    53   0.00000  1.0 1.0
   33    49    52    58   0.09850  1.0 1.0
   33    49    52    58   0.15250 -1.0 2.0
   33    49    52    58  -0.50650  1.0 3.0
   33    49    54    55  -0.11600  1.0 1.0
   33    49    54    55  -0.09450 -1.0 2.0
   33    49    54    55   0.21250  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40  -0.11250  1.0 3.0
   34    33    38    42   0.23400  1.0 3.0
   34    33    49    45   0.15000  1.0 3.0
   34    33    49    52   0.15000  1.0 3.0
   34    33    49    54   0.23400  1.0 3.0
   38    33    49    45   0.34400  1.0 1.0
   38    33    49    45   0.09450 -1.0 2.0
   38    33    49    45   0.11100  1.0 3.0
   38    33    49    52   0.34400  1.0 1.0
   38    33    49    52   0.09450 -1.0 2.0
   38    33    49    52   0.11100  1.0 3.0
   38    33    49    54   0.86500  1.0 1.0
   38    33    49    54  -0.17500 -1.0 2.0
   38    33    49    54   0.20800  1.0 3.0
   38    40   -44    45  -0.33500  1.0 1.0
   38    40   -44    45   1.06600 -1.0 2.0
   38    40   -44    45  -0.14000  1.0 3.0
   38    40    44    47   1.50000 -1.0 2.0
   39    38    40    41   0.00000  1.0 1.0
   39    38    40    44   0.00000  1.0 1.0
   39    38    42    43   0.19450  1.0 3.0
   40    38    42    43   0.91850  1.0 1.0
   40    38    42    43   0.57950  1.0 3.0
   40    44    45    46   7.00000 -1.0 2.0
   40    44    45    49   7.00000 -1.0 2.0
   40    44    47    48   1.00000 -1.0 2.0
   40    44    47    50  -0.56400  1.0 1.0
   40    44    47    50   0.77500 -1.0 2.0
   40    44    47    50   0.18700  1.0 3.0
   41    40    44    45   1.00000 -1.0 2.0
   41    40    44    47  -0.52200  1.0 1.0
   41    40    44    47   0.82950 -1.0 2.0
   44    45   -49    33   0.09850  1.0 1.0
   44    45   -49    33   0.15250 -1.0 2.0
   44    45   -49    33  -0.50650  1.0 3.0
   44    45    49    52  -0.28300  1.0 1.0
   44    45    49    52   0.26700 -1.0 2.0
   44    45    49    52  -0.63300  1.0 3.0
   44    45    49    54   0.67800  1.0 1.0
   44    45    49    54   0.47050 -1.0 2.0
   44    45    49    54  -0.62500  1.0 3.0
   44    47    50    51   2.67200 -1.0 2.0
   44    47    50    56   2.45000 -1.0 2.0
   45    44    47    48   0.78350 -1.0 2.0
   45    44    47    50  -0.18900  1.0 1.0
   45    44    47    50   1.70900 -1.0 2.0
   45    49    52    53   0.00000  1.0 1.0
   45    49    52    58  -0.28300  1.0 1.0
   45    49    52    58   0.26700 -1.0 2.0
   45    49    52    58  -0.63300  1.0 3.0
   45    49    54    55  -0.07800  1.0 1.0
   45    49    54    55  -0.21500 -1.0 2.0
   45    49    54    55  -0.03150  1.0 3.0
   46    45    49    33   0.00000  1.0 1.0
   46    45    49    52   0.00000  1.0 1.0
   46    45    49    54   0.00000  1.0 1.0
   49    33    38    39   0.15000  1.0 3.0
   49    33   -38    40  -0.95700  1.0 1.0
   49    33   -38    40  -0.18200 -1.0 2.0
   49    33   -38    40   0.29450  1.0 3.0
   49    33    38    42   0.86500  1.0 1.0
   49    33    38    42  -0.17500 -1.0 2.0
   49    33    38    42   0.20800  1.0 3.0
   49    52    58    59   7.00000 -1.0 2.0
   49    52    58    62   7.00000 -1.0 2.0
   52    49    54    55  -0.07800  1.0 1.0
   52    49    54    55  -0.21500 -1.0 2.0
   52    49    54    55  -0.03150  1.0 3.0
   52    58    62    63  -0.18600  1.0 3.0
   52    58    62    66   0.28850  1.0 1.0
   52    58    62    66   2.61350 -1.0 2.0
   52    58    62    66   0.78400  1.0 3.0
   53    52    58    59   7.00000 -1.0 2.0
   53    52    58    62   7.00000 -1.0 2.0
   58    62    66    67   7.00000 -1.0 2.0
   58    62    66    70   7.00000 -1.0 2.0
   59    58    62    63   0.00000  1.0 1.0
   59    58    62    66  -0.18600  1.0 3.0
   62    66    70    71  -0.18600  1.0 3.0
   62    66    70    74   0.28850  1.0 1.0
   62    66    70    74   2.61350 -1.0 2.0
   62    66    70    74   0.78400  1.0 3.0
   63    62    66    67   7.00000 -1.0 2.0
   63    62    66    70   7.00000 -1.0 2.0
   66    70    74    75   7.00000 -1.0 2.0
   66    70    74    78   7.00000 -1.0 2.0
   67    66    70    71   0.00000  1.0 1.0
   67    66    70    74  -0.18600  1.0 3.0
   70    74    78    79   1.00000 -1.0 2.0
   70    74    78    82   0.49500  1.0 1.0
   70    74    78    82   1.31600 -1.0 2.0
   70    74    78    82  -0.02300  1.0 3.0
   71    70    74    75   7.00000 -1.0 2.0
   71    70    74    78   7.00000 -1.0 2.0
   74    78    82    83   2.56700 -1.0 2.0
   74    78    82    87   2.45000 -1.0 2.0
   75    74    78    79   0.00000  1.0 1.0
   75    74    78    82   0.65100 -1.0 2.0
   78    82    87    91  -0.18900  1.0 1.0
   78    82    87    91   1.70900 -1.0 2.0
   78    82    87   108  -0.56400  1.0 1.0
   78    82    87   108   0.77500 -1.0 2.0
   78    82    87   108   0.18700  1.0 3.0
   79    78    82    83   2.45000 -1.0 2.0
   79    78    82    87   2.67200 -1.0 2.0
   82    87    91    92   7.00000 -1.0 2.0
   82    87    91    96   7.00000 -1.0 2.0
   82    87   108   102   1.50000 -1.0 2.0
   82    87   108   109  -0.52200  1.0 1.0
   82    87   108   109   0.82950 -1.0 2.0
   83    82    87    91   0.78350 -1.0 2.0
   83    82    87   108   1.00000 -1.0 2.0
   87    91    96    97   0.00000  1.0 1.0
   87    91    96    98   0.00000  1.0 1.0
   87    91   -96   102   0.09850  1.0 1.0
   87    91   -96   102   0.15250 -1.0 2.0
   87    91   -96   102  -0.50650  1.0 3.0
   91    87  -108   102  -0.33500  1.0 1.0
   91    87  -108   102   1.06600 -1.0 2.0
   91    87  -108   102  -0.14000  1.0 3.0
   91    87   108   109   1.00000 -1.0 2.0
   91    96   102   103   0.15000  1.0 3.0
   91    96   102   104   0.15000  1.0 3.0
   91    96  -102   108  -0.98800  1.0 1.0
   91    96  -102   108   0.48800 -1.0 2.0
   91    96  -102   108   0.76800  1.0 3.0
   92    91    96    97   0.00000  1.0 1.0
   92    91    96    98   0.00000  1.0 1.0
   92    91    96   102   0.09700  1.0 1.0
   92    91    96   102   0.15600 -1.0 2.0
   92    91    96   102  -0.50800  1.0 3.0
   96   102  -108    87   0.65300  1.0 1.0
   96   102  -108    87  -0.03850 -1.0 2.0
   96   102  -108    87   0.33900  1.0 3.0
   96   102   108   109   0.30150 -1.0 2.0
   97    96   102   103   0.15000  1.0 3.0
   97    96   102   104   0.15000  1.0 3.0
   97    96   102   108  -0.11250  1.0 3.0
   98    96   102   103   0.15000  1.0 3.0
   98    96   102   104   0.15000  1.0 3.0
   98    96   102   108  -0.11250  1.0 3.0
  103   102   108    87   0.00000  1.0 1.0
  103   102   108   109   0.00000  1.0 1.0
  104   102   108    87   0.00000  1.0 1.0
  104   102   108   109   0.00000  1.0 1.0
  108    87    91    92   7.00000 -1.0 2.0
  108    87   -91    96   7.00000 -1.0 2.0
   54    49    52    53   0.00000  1.0 1.0
   54    49    52    58   0.67800  1.0 1.0
   54    49    52    58   0.47050 -1.0 2.0
   54    49    52    58  -0.62500  1.0 3.0
   47    44    45    46   7.00000 -1.0 2.0
   47    44    45    49   7.00000 -1.0 2.0
   47    50    56    57   0.65100 -1.0 2.0
   47    50    56    60   0.49500  1.0 1.0
   47    50    56    60   1.31600 -1.0 2.0
   47    50    56    60  -0.02300  1.0 3.0
   48    47    50    51   2.45000 -1.0 2.0
   48    47    50    56   2.56700 -1.0 2.0
   50    56    60    61   7.00000 -1.0 2.0
   50    56    60    64   7.00000 -1.0 2.0
   51    50    56    57   0.00000  1.0 1.0
   51    50    56    60   1.00000 -1.0 2.0
   56    60    64    65  -0.18600  1.0 3.0
   56    60    64    68   0.28850  1.0 1.0
   56    60    64    68   2.61350 -1.0 2.0
   56    60    64    68   0.78400  1.0 3.0
   57    56    60    61   7.00000 -1.0 2.0
   57    56    60    64   7.00000 -1.0 2.0
   60    64    68    69   7.00000 -1.0 2.0
   60    64    68    72   7.00000 -1.0 2.0
   61    60    64    65   0.00000  1.0 1.0
   61    60    64    68  -0.18600  1.0 3.0
   64    68    72    73  -0.18600  1.0 3.0
   64    68    72    76   0.28850  1.0 1.0
   64    68    72    76   2.61350 -1.0 2.0
   64    68    72    76   0.78400  1.0 3.0
   65    64    68    69   7.00000 -1.0 2.0
   65    64    68    72   7.00000 -1.0 2.0
   68    72    76    77   7.00000 -1.0 2.0
   68    72    76    80   7.00000 -1.0 2.0
   69    68    72    73   0.00000  1.0 1.0
   69    68    72    76  -0.18600  1.0 3.0
   72    76    80    81   0.00000  1.0 1.0
   72    76    80    84   0.09850  1.0 1.0
   72    76    80    84   0.15250 -1.0 2.0
   72    76    80    84  -0.50650  1.0 3.0
   72    76    80   105   0.09850  1.0 1.0
   72    76    80   105   0.15250 -1.0 2.0
   72    76    80   105  -0.50650  1.0 3.0
   73    72    76    77   7.00000 -1.0 2.0
   73    72    76    80   7.00000 -1.0 2.0
   76    80    84    85   0.15000  1.0 3.0
   76    80    84    86   0.15000  1.0 3.0
   76    80    84    88   0.34400  1.0 1.0
   76    80    84    88   0.09450 -1.0 2.0
   76    80    84    88   0.11100  1.0 3.0
   76    80   105    99   0.34400  1.0 1.0
   76    80   105    99   0.09450 -1.0 2.0
   76    80   105    99   0.11100  1.0 3.0
   76    80   105   106   0.15000  1.0 3.0
   76    80   105   107   0.15000  1.0 3.0
   77    76    80    81   0.33100  1.0 3.0
   77    76    80    84   0.00000  1.0 1.0
   77    76    80   105   0.00000  1.0 1.0
   80    84    88    89   0.15000  1.0 3.0
   80    84    88    90   0.15000  1.0 3.0
   80    84    88    93   0.56750  1.0 1.0
   80    84    88    93  -0.07550 -1.0 2.0
   80    84    88    93   0.20000  1.0 3.0
   81    80    84    85   0.15000  1.0 3.0
   81    80    84    86   0.15000  1.0 3.0
   81    80    84    88   0.15000  1.0 3.0
   81    80   105    99   0.15000  1.0 3.0
   81    80   105   106   0.15000  1.0 3.0
   81    80   105   107   0.15000  1.0 3.0
   84    80   105    99   0.56750  1.0 1.0
   84    80   105    99  -0.07550 -1.0 2.0
   84    80   105    99   0.20000  1.0 3.0
   84    80   105   106   0.15000  1.0 3.0
   84    80   105   107   0.15000  1.0 3.0
   84    88    93    94   0.15000  1.0 3.0
   84    88    93    95   0.15000  1.0 3.0
   84    88   -93    99   0.56750  1.0 1.0
   84    88   -93    99  -0.07550 -1.0 2.0
   84    88   -93    99   0.20000  1.0 3.0
   85    84    88    89   0.15000  1.0 3.0
   85    84    88    90   0.15000  1.0 3.0
   85    84    88    93   0.15000  1.0 3.0
   86    84    88    89   0.15000  1.0 3.0
   86    84    88    90   0.15000  1.0 3.0
   86    84    88    93   0.15000  1.0 3.0
   88    93    99   100   0.15000  1.0 3.0
   88    93    99   101   0.15000  1.0 3.0
   88    93    99   105   0.56750  1.0 1.0
   88    93    99   105  -0.07550 -1.0 2.0
   88    93    99   105   0.20000  1.0 3.0
   89    88    93    94   0.15000  1.0 3.0
   89    88    93    95   0.15000  1.0 3.0
   89    88    93    99   0.15000  1.0 3.0
   90    88    93    94   0.15000  1.0 3.0
   90    88    93    95   0.15000  1.0 3.0
   90    88    93    99   0.15000  1.0 3.0
   93    99  -105    80   0.56750  1.0 1.0
   93    99  -105    80  -0.07550 -1.0 2.0
   93    99  -105    80   0.20000  1.0 3.0
   93    99   105   106   0.15000  1.0 3.0
   93    99   105   107   0.15000  1.0 3.0
   94    93    99   100   0.15000  1.0 3.0
   94    93    99   101   0.15000  1.0 3.0
   94    93    99   105   0.15000  1.0 3.0
   95    93    99   100   0.15000  1.0 3.0
   95    93    99   101   0.15000  1.0 3.0
   95    93    99   105   0.15000  1.0 3.0
  100    99   105    80   0.15000  1.0 3.0
  100    99   105   106   0.15000  1.0 3.0
  100    99   105   107   0.15000  1.0 3.0
  101    99   105    80   0.15000  1.0 3.0
  101    99   105   106   0.15000  1.0 3.0
  101    99   105   107   0.15000  1.0 3.0
  105    80    84    85   0.15000  1.0 3.0
  105    80    84    86   0.15000  1.0 3.0
  105    80   -84    88   0.56750  1.0 1.0
  105    80   -84    88  -0.07550 -1.0 2.0
  105    80   -84    88   0.20000  1.0 3.0
   42    38    40    41   0.30150 -1.0 2.0
   42    38    40    44   0.65300  1.0 1.0
   42    38    40    44  -0.03850 -1.0 2.0
   42    38    40    44   0.33900  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   38    44    40    41  10.50000 -1.0 2.0
   40    47    44    45   1.10000 -1.0 2.0
   49    46    45    44   1.10000 -1.0 2.0
   49    53    52    58  15.00000 -1.0 2.0
   62    59    58    52  15.00000 -1.0 2.0
   58    63    62    66  15.00000 -1.0 2.0
   70    67    66    62  15.00000 -1.0 2.0
   66    71    70    74  15.00000 -1.0 2.0
   78    75    74    70  15.00000 -1.0 2.0
   74    82    78    79  10.50000 -1.0 2.0
   83    78    82    87   1.00000 -1.0 2.0
   82   108    87    91   1.10000 -1.0 2.0
   96    92    91    87   1.10000 -1.0 2.0
   87   102   108   109  10.50000 -1.0 2.0
   48    50    47    44   1.00000 -1.0 2.0
   47    56    50    51  10.50000 -1.0 2.0
   50    57    56    60  15.00000 -1.0 2.0
   64    61    60    56  15.00000 -1.0 2.0
   60    65    64    68  15.00000 -1.0 2.0
   72    69    68    64  15.00000 -1.0 2.0
   68    73    72    76  15.00000 -1.0 2.0
   80    77    76    72  15.00000 -1.0 2.0
END
