* LIGAND DATABASE FILE (OPLS2005)
*
001     117   122    238    387     716
    1     0 S   NP   _N1_     1    28.75891    98.99431   -23.05855
    2     1 S   H    _HN1     2     1.02956    63.27978    18.73728
    3     1 S   H    _H1_     3     1.02835    50.13840   166.84837
    4     1 S   H    _H2_     4     1.02788    98.94299   -87.30986
    5     1 S   CT   _CA1     5     1.50133   148.14011   104.75664
    6     5 S   HC   _HA1     6     1.09584   105.17482   105.62719
    7     5 S   CO3  _C1_     7     1.53676   112.35324   -14.41050
    8     7 S   O2Z  _O11     8     1.26353   115.08072   -45.90226
    9     7 S   O2Z  _O12     9     1.26216   114.90502   133.09082
   10     5 S   CT   _CB1    10     1.53074   107.39318  -136.67458
   11    10 S   HC   HB11    11     1.09827   109.07426   -51.86809
   12    10 S   HC   HB12    12     1.09814   110.52587    64.58700
   13    10 S   CT   _CG1    13     1.53042   112.78490  -173.03255
   14    13 S   HC   HG11    14     1.09559   110.41133   -67.39356
   15    13 S   HC   HG12    15     1.09660   109.94987    51.78107
   16    13 S   C    _CD1    16     1.51890   112.25318   171.93433
   17    16 S   O    _OE1    17     1.22758   123.21912     0.37325
   18    16 S   N    _N2_    18     1.38556   111.81719  -179.38134
   19    18 S   H    _HN2    19     1.01576   118.90164     3.70116
   20    18 S   CT1  _CA2    20     1.45907   122.92914   175.16698
   21    20 S   HC   _HA2    21     1.09718   109.24354    16.89088
   22    20 S   C    _C2_    22     1.52914   106.70613   -99.95246
   23    22 S   O    _O2_    23     1.22975   122.99649   -26.89951
   24    20 S   CT   _CB2    32     1.53306   112.23554   140.34185
   25    24 S   HC   HB21    33     1.09316   109.66343    53.03608
   26    24 S   HC   HB22    34     1.09462   109.60205   171.68719
   27    22 S   N    _N3_    24     1.38472   112.57270   155.94609
   28    27 S   H    _HN3    25     1.01652   120.38800    -2.38983
   29    24 S   S    _SG2    35     1.82738   110.45942   -69.35696
   30    27 S   CT   _CA3    26     1.45361   122.51138   178.46125
   31    30 S   HC   HA31    27     1.09566   107.84435   -55.18368
   32    30 S   HC   HA32    28     1.09560   107.59051    61.17029
   33    29 S   CT   _C29    36     1.93663   104.04940   164.60056
   34    30 S   CO3  _C3_    29     1.52897   114.28033  -177.08839
   35    34 S   O2Z  _O31    30     1.26341   116.03654     0.38664
   36    34 S   O2Z  _O32    31     1.26431   114.42034  -179.65226
   37    33 S   CT   _C15    37     1.53593   108.93288    36.20248
   38    37 S   HC   _H56    38     1.09116   115.67791   -48.93692
   39    37 S   HC   _H57    39     1.09588   110.98690  -167.51748
   40    33 S   CT   _C28    83     1.57325   108.48040   -94.13493
   41    37 S   CT   _C8_    40     1.54571   105.22726    75.31697
   42    41 S   HC   _H42    41     1.09380   108.60276   138.82613
   43    41 S   HC   _H43    42     1.09628   110.69019  -104.02791
   44    40 S   OH   _O37    84     1.43112   108.87727   176.75273
   45    44 S   HO   _H83    85     0.97176   108.76092   -71.97880
   46    41 S   CT   _C18    43     1.56189   107.20264    15.53642
   47    46 S   HC   _H62    44     1.09797   106.58700   -98.47785
   48    46 S   CM   _C5_    45     1.50774   116.04117   146.69906
   49    33 S   CT   _C26    54     1.59707   109.87489   144.20715
   50    48 S   CM   _C4_    46     1.33320   129.06403   -10.87764
   51    50 S   HC   _H39    47     1.07557   129.32093    -2.15241
   52    49 S   CT   _C12    55     1.53966   109.07669    59.62920
   53    52 S   HC   _H50    56     1.09497   111.58163   -66.33408
   54    52 S   HC   _H51    57     1.09521   110.71772   176.67057
   55    49 S   CT   _C31   114     1.56707   116.07562  -179.79923
   56    55 S   HC   _H73   115     1.09366   113.13763    57.96705
   57    55 S   HC   _H74   116     1.09035   113.92238   -64.82301
   58    55 S   HC   _H75   117     1.09688   110.45504   177.43555
   59    50 S   CO4  _C6_    48     1.46312   107.37584   176.99046
   60    59 S   O    _O33    49     1.21852   125.05413   179.38103
   61    52 S   CT   _C9_    58     1.54287   111.70329    56.55630
   62    61 S   HC   _H44    59     1.09345   108.58764    71.93108
   63    61 S   HC   _H45    60     1.09623   107.35063  -174.35500
   64    59 S   OS   _O34    50     1.36106   109.00668    -1.02163
   65    61 S   CT   _C20    61     1.55481   114.92446   -51.96524
   66    65 S   HC   _H64    62     1.09807   104.61777   -66.16426
   67    48 S   CT   _C7_    51     1.48405   120.94234   165.39551
   68    67 S   HC   _H40    52     1.09394   112.21513   -58.73968
   69    67 S   HC   _H41    53     1.09134   112.92709    66.18028
   70    65 S   CT   _C27    63     1.58733   113.13836  -179.07634
   71    70 S   CT   _C13    64     1.56916   107.91860    62.10532
   72    71 S   HC   _H52    65     1.09794   110.57024    26.01496
   73    71 S   HC   _H53    66     1.09706   110.51001   -90.79356
   74    70 S   CT   _C32   110     1.54868   112.85225   -56.33689
   75    74 S   HC   _H76   111     1.09190   112.74158   -63.48949
   76    74 S   HC   _H77   112     1.09674   110.65022   177.27710
   77    74 S   HC   _H78   113     1.09380   112.22430    58.68851
   78    71 S   CT   _C11    67     1.52407   113.14420   146.25968
   79    78 S   HC   _H48    68     1.09706   110.15406    61.06590
   80    78 S   HC   _H49    69     1.09664   109.21782   176.84744
   81    78 S   CT   _C21    70     1.53449   111.52259   -62.39575
   82    81 S   HC   _H65    71     1.09706   110.31179   -86.63298
   83    81 S   CT   _C16    72     1.53851   112.32607    33.02454
   84    83 S   HC   _H58    73     1.09628   109.09264   -92.57402
   85    83 S   HC   _H59    74     1.09693   109.76793   150.69263
   86    81 S   OS   _O38    86     1.43331   110.22678   152.65326
   87    70 S   CT   _C19    75     1.57027   111.42168  -177.51320
   88    87 S   HC   _H63    76     1.10032   108.73073   160.98296
   89    86 S   CO   _C25    87     1.43110   114.16539    78.99891
   90    89 S   HC   _H69    88     1.09691   109.41462    43.72444
   91    87 S   CT   _C10    77     1.53451   113.77976    44.04159
   92    91 S   HC   _H46    78     1.09715   109.80228  -173.38779
   93    91 S   HC   _H47    79     1.09671   109.35296    71.30072
   94    89 S   CT   _C17    89     1.52938   106.98415   162.16901
   95    94 S   HC   _H60    90     1.09811   110.30201    56.76275
   96    94 S   HC   _H61    91     1.09570   109.72269   -58.55557
   97    91 S   CT   _C14    80     1.52508   113.18071   -51.28279
   98    97 S   HC   _H54    81     1.09687   107.95208   179.66780
   99    97 S   HC   _H55    82     1.09271   107.72604   -64.68660
  100    94 S   CT   _C22    92     1.52998   110.47183   178.43464
  101   100 S   HC   _H66    93     1.09853   109.41555    64.84202
  102   100 S   CT   _C23    94     1.53720   109.82631   -53.56861
  103   102 S   HC   _H67    95     1.09616   109.66099   175.65035
  104   100 S   OS   _O39   105     1.43032   112.20669  -174.28337
  105   102 S   CT   _C24    96     1.53654   109.70111    53.22272
  106   105 S   HC   _H68    97     1.09775   109.70700    62.71763
  107   102 S   OH   _O36   103     1.43066   108.90958   -67.45751
  108   107 S   HO   _H82   104     0.97162   107.76194  -167.82351
  109   104 S   CT   _C33   106     1.42066   113.70238   -72.98952
  110   109 S   HC   _H79   107     1.09354   108.10826  -173.53128
  111   109 S   HC   _H80   108     1.09294   110.96857    68.13503
  112   109 S   HC   _H81   109     1.09415   110.84672   -54.83480
  113    89 S   OS   _O35    98     1.42890   111.81033   -77.50864
  114   105 S   CT   _C30    99     1.52381   112.94668  -176.53705
  115   114 S   HC   _H70   100     1.09514   111.63952    66.44494
  116   114 S   HC   _H71   101     1.09400   111.33707   -55.73157
  117   114 S   HC   _H72   102     1.09579   110.00097  -175.96881
  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  13   5   4   3
  28   2   1   1  15   7   6  22  10   5   4  10   2  18   6  11
  14   7   4  12   6   5   4   2   1   1   5   2   9   4   3   3
  17   5   2   1   1  20  16   7   6   8   3   2   1  10   5   4
  12   6  10   5   4   9   7   4  12   6   5   4   3  11   6   5
   2   1   1  14   6  12   7   6   8   6   3   1   3   2   1   1
   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    49    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    41    46    49    52    65    97    40    44    55  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    41    42    43    46    47    48    49    52    53    54    61    65    66    70    91    97    98    99    40    44    45    55    56    57    58  
   35    36  
   36  
    0  
   38    39    41    42    43    46    47    48    49    52    65    97    40    44    55  
   39    41    42    43    46    49    40  
   41    42    43    46    49    40  
   44    45    74    55    41    46    49    52    61    62    63    65    66    70    71    87    91    92    93    97    98    99  
   42    43    46    47    48    50    67    49    52    55  
   43    46    47    48    49  
   46    47    48    49  
   45    49    61    65    66    70    91    97    98    99  
   65    97  
   47    48    50    51    59    64    67    68    69    49    52    53    54    61    55    56    57    58  
   48    50    67    49    52    55  
   50    51    59    60    64    67    68    69    49    52    55  
   52    53    54    61    62    63    65    97    55    56    57    58    50    67  
   51    59    60    64    67    68    69  
   59    60    64    67  
   53    54    61    62    63    65    66    70    55    56    57    58  
   54    61    62    63    65    55  
   61    62    63    65    55  
   56    57    58    61  
   57    58  
   58  
    0  
   60    64    67    68    69  
   64    67  
   62    63    65    66    70    71    87    97    74  
   63    65    66    70  
   65    66    70  
   67    68    69  
   66    70    71    72    73    78    83    87    88    91    97    98    99    74    75    76    77  
   70    71    87    97    74  
   68    69  
   69  
    0  
   71    72    73    78    79    80    81    83    84    85    87    88    91    92    93    97    74    75    76    77  
   72    73    78    79    80    81    82    83    87    88    91    86    74    75    76    77  
   73    78    79    80    81    87    74  
   78    79    80    81    87    74  
   75    76    77    78    83    87    88    91  
   76    77    87  
   77    87  
   87  
   79    80    81    82    83    84    85    87    86    89  
   80    81    82    83    86  
   81    82    83    86  
   82    83    84    85    87    88    91    86    89    90    94   113  
   83    84    85    87    86    89  
   84    85    87    88    91    92    93    97    86    89  
   85    87    88    91    86  
   87    88    91    86  
   89    90    94    95    96   100   105   113    87  
   88    91    92    93    97    98    99  
   91    92    93    97  
   90    94    95    96   100   101   102   105   106   113   114   104  
   94    95    96   100   105   113  
   92    93    97    98    99  
   93    97    98    99  
   97    98    99  
   95    96   100   101   102   103   105   113   107   104   109  
   96   100   101   102   113   104  
  100   101   102   113   104  
   98    99  
   99  
    0  
  101   102   103   105   106   113   114   107   108   104   109   110   111   112  
  102   103   105   107   104   109  
  103   105   106   113   114   115   116   117   107   108   104   109  
  105   106   113   114   107   108   104  
  109   110   111   112   105   107  
  106   113   114   115   116   117   107   108  
  113   114   115   116   117   107  
  108   113   114  
    0  
  110   111   112  
  111   112  
  112  
    0  
  114   115   116   117  
  115   116   117  
  116   117  
  117  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   41   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   45   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   46   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   49   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   50   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   51   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   60   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   61   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   65   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660   0.259000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   69   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   70   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   71   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   78   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   83   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   87   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   88   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   90   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   91   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   98   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  100   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
  101   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  102   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
  103   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  104   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
  105   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
  106   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  107   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  108   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  109   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
  110   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  111   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  112   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  113   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
  114   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  115   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  116   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  117   2.5000   0.0300   0.060000   1.4250   1.2500   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    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   268.000  1.529
   33    49   268.000  1.529
   33    40   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    41   268.000  1.529
   41    42   340.000  1.090
   41    43   340.000  1.090
   41    46   268.000  1.529
   46    47   340.000  1.090
   46    48   317.000  1.510
   46    49   268.000  1.529
   48    50   549.000  1.340
   48    67   317.000  1.510
   50    51   340.000  1.080
   50    59   320.000  1.462
   59    60   570.000  1.229
   59    64   214.000  1.327
   64    67   320.000  1.410
   67    68   340.000  1.090
   67    69   340.000  1.090
   49    52   268.000  1.529
   49    55   268.000  1.529
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    61   268.000  1.529
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    65   268.000  1.529
   65    66   340.000  1.090
   65    70   268.000  1.529
   65    40   268.000  1.529
   70    71   268.000  1.529
   70    87   268.000  1.529
   70    74   268.000  1.529
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    78   268.000  1.529
   78    79   340.000  1.090
   78    80   340.000  1.090
   78    81   268.000  1.529
   81    82   340.000  1.090
   81    83   268.000  1.529
   81    86   320.000  1.410
   83    84   340.000  1.090
   83    85   340.000  1.090
   83    87   268.000  1.529
   87    88   340.000  1.090
   87    91   268.000  1.529
   91    92   340.000  1.090
   91    93   340.000  1.090
   91    97   268.000  1.529
   97    98   340.000  1.090
   97    99   340.000  1.090
   97    40   268.000  1.529
   40    44   320.000  1.410
   44    45   553.000  0.945
   86    89   320.000  1.380
   89    90   340.000  1.090
   89    94   250.000  1.527
   89   113   320.000  1.380
   94    95   340.000  1.090
   94    96   340.000  1.090
   94   100   268.000  1.529
  100   101   340.000  1.090
  100   102   268.000  1.529
  100   104   320.000  1.410
  102   103   340.000  1.090
  102   105   268.000  1.529
  102   107   320.000  1.410
  105   106   340.000  1.090
  105   113   320.000  1.410
  105   114   268.000  1.529
  114   115   340.000  1.090
  114   116   340.000  1.090
  114   117   340.000  1.090
  107   108   553.000  0.945
  104   109   320.000  1.410
  109   110   340.000  1.090
  109   111   340.000  1.090
  109   112   340.000  1.090
   74    75   340.000  1.090
   74    76   340.000  1.090
   74    77   340.000  1.090
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   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    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  111.63000
   29    33    49    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    41    58.35000  112.70000
   33    49    46    58.35000  112.70000
   33    49    52    58.35000  112.70000
   33    49    55    58.35000  112.70000
   33    40    65    58.35000  112.70000
   33    40    97    58.35000  112.70000
   33    40    44    50.00000  109.50000
   37    41    42    37.50000  110.70000
   37    41    43    37.50000  110.70000
   37    41    46    58.35000  112.70000
   39    37    38    33.00000  107.80000
   41    37    38    37.50000  110.70000
   41    37    39    37.50000  110.70000
   41    46    47    37.50000  110.70000
   41    46    48    70.00000  112.02700
   41    46    49    58.35000  112.70000
   43    41    42    33.00000  107.80000
   46    41    42    37.50000  110.70000
   46    41    43    37.50000  110.70000
   46    48    50    70.00000  124.00000
   46    48    67    65.00000  117.92700
   46    49    52    58.35000  112.70000
   46    49    55    58.35000  112.70000
   48    46    47    35.00000  109.50000
   48    50    51    35.00000  120.00000
   48    50    59    65.00000  118.96000
   48    67    64    85.00000  110.90400
   48    67    68    35.00000  109.50000
   48    67    69    35.00000  109.50000
   50    59    60    80.00000  123.72100
   50    59    64    90.00000  111.29400
   59    50    51    40.00000  117.72500
   59    64    67    83.00000  116.90000
   64    59    60    83.00000  123.40000
   64    67    68    35.00000  109.50000
   64    67    69    35.00000  109.50000
   67    48    50    70.00000  124.00000
   69    67    68    33.00000  107.80000
   49    33    37    58.35000  112.70000
   49    46    47    37.50000  110.70000
   49    46    48    70.00000  112.02700
   49    52    53    37.50000  110.70000
   49    52    54    37.50000  110.70000
   49    52    61    58.35000  112.70000
   49    55    56    37.50000  110.70000
   49    55    57    37.50000  110.70000
   49    55    58    37.50000  110.70000
   52    61    62    37.50000  110.70000
   52    61    63    37.50000  110.70000
   52    61    65    58.35000  112.70000
   54    52    53    33.00000  107.80000
   61    52    53    37.50000  110.70000
   61    52    54    37.50000  110.70000
   61    65    66    37.50000  110.70000
   61    65    70    58.35000  112.70000
   61    65    40    58.35000  112.70000
   63    61    62    33.00000  107.80000
   65    61    62    37.50000  110.70000
   65    61    63    37.50000  110.70000
   65    70    71    58.35000  112.70000
   65    70    87    58.35000  112.70000
   65    70    74    58.35000  112.70000
   65    40    97    58.35000  112.70000
   65    40    44    50.00000  109.50000
   70    65    66    37.50000  110.70000
   70    71    72    37.50000  110.70000
   70    71    73    37.50000  110.70000
   70    71    78    58.35000  112.70000
   70    87    83    58.35000  112.70000
   70    87    88    37.50000  110.70000
   70    87    91    58.35000  112.70000
   70    74    75    37.50000  110.70000
   70    74    76    37.50000  110.70000
   70    74    77    37.50000  110.70000
   71    78    79    37.50000  110.70000
   71    78    80    37.50000  110.70000
   71    78    81    58.35000  112.70000
   73    71    72    33.00000  107.80000
   78    71    72    37.50000  110.70000
   78    71    73    37.50000  110.70000
   78    81    82    37.50000  110.70000
   78    81    83    58.35000  112.70000
   78    81    86    50.00000  109.50000
   80    78    79    33.00000  107.80000
   81    78    79    37.50000  110.70000
   81    78    80    37.50000  110.70000
   81    83    84    37.50000  110.70000
   81    83    85    37.50000  110.70000
   81    83    87    58.35000  112.70000
   81    86    89    60.00000  109.50000
   83    81    82    37.50000  110.70000
   83    87    88    37.50000  110.70000
   83    87    91    58.35000  112.70000
   85    83    84    33.00000  107.80000
   87    70    71    58.35000  112.70000
   87    83    84    37.50000  110.70000
   87    83    85    37.50000  110.70000
   87    91    92    37.50000  110.70000
   87    91    93    37.50000  110.70000
   87    91    97    58.35000  112.70000
   91    87    88    37.50000  110.70000
   91    97    98    37.50000  110.70000
   91    97    99    37.50000  110.70000
   91    97    40    58.35000  112.70000
   93    91    92    33.00000  107.80000
   97    91    92    37.50000  110.70000
   97    91    93    37.50000  110.70000
   97    40    44    50.00000  109.50000
   99    97    98    33.00000  107.80000
   40    33    37    58.35000  112.70000
   40    33    49    58.35000  112.70000
   40    65    66    37.50000  110.70000
   40    65    70    58.35000  112.70000
   40    97    98    37.50000  110.70000
   40    97    99    37.50000  110.70000
   40    44    45    55.00000  108.50000
   86    81    82    35.00000  109.50000
   86    81    83    50.00000  109.50000
   86    89    90    35.00000  109.50000
   86    89    94    90.00000  108.56700
   86    89   113    92.60000  111.55000
   89    94    95    45.00000  108.72000
   89    94    96    45.00000  108.72000
   89    94   100    75.00000  109.43000
   89   113   105    60.00000  109.50000
   94    89    90    45.00000  112.01100
   94   100   101    37.50000  110.70000
   94   100   102    58.35000  112.70000
   94   100   104    50.00000  109.50000
   96    94    95    33.00000  107.80000
  100    94    95    37.50000  110.70000
  100    94    96    37.50000  110.70000
  100   102   103    37.50000  110.70000
  100   102   105    58.35000  112.70000
  100   102   107    50.00000  109.50000
  100   104   109    60.00000  109.50000
  102   100   101    37.50000  110.70000
  102   105   106    37.50000  110.70000
  102   105   113    50.00000  109.50000
  102   105   114    58.35000  112.70000
  102   107   108    55.00000  108.50000
  105   102   103    37.50000  110.70000
  105   114   115    37.50000  110.70000
  105   114   116    37.50000  110.70000
  105   114   117    37.50000  110.70000
  113    89    90    35.00000  109.50000
  113    89    94    90.00000  108.56700
  113   105   106    35.00000  109.50000
  114   105   106    37.50000  110.70000
  114   105   113    50.00000  109.50000
  116   114   115    33.00000  107.80000
  117   114   115    33.00000  107.80000
  117   114   116    33.00000  107.80000
  107   102   103    35.00000  109.50000
  107   102   105    50.00000  109.50000
  104   100   101    35.00000  109.50000
  104   100   102    50.00000  109.50000
  104   109   110    35.00000  109.50000
  104   109   111    35.00000  109.50000
  104   109   112    35.00000  109.50000
  111   109   110    33.00000  107.80000
  112   109   110    33.00000  107.80000
  112   109   111    33.00000  107.80000
   74    70    71    58.35000  112.70000
   74    70    87    58.35000  112.70000
   76    74    75    33.00000  107.80000
   77    74    75    33.00000  107.80000
   77    74    76    33.00000  107.80000
   55    49    52    58.35000  112.70000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    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    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   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
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.15000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    41   0.44750  1.0 1.0
   29    33    37    41  -0.17800 -1.0 2.0
   29    33    37    41   0.20200  1.0 3.0
   29    33    49    46   0.44750  1.0 1.0
   29    33    49    46  -0.17800 -1.0 2.0
   29    33    49    46   0.20200  1.0 3.0
   29    33    49    52   0.44750  1.0 1.0
   29    33    49    52  -0.17800 -1.0 2.0
   29    33    49    52   0.20200  1.0 3.0
   29    33    49    55   0.44750  1.0 1.0
   29    33    49    55  -0.17800 -1.0 2.0
   29    33    49    55   0.20200  1.0 3.0
   29    33    40    65   0.44750  1.0 1.0
   29    33    40    65  -0.17800 -1.0 2.0
   29    33    40    65   0.20200  1.0 3.0
   29    33    40    97   0.44750  1.0 1.0
   29    33    40    97  -0.17800 -1.0 2.0
   29    33    40    97   0.20200  1.0 3.0
   29    33    40    44   0.56750  1.0 1.0
   29    33    40    44  -0.07550 -1.0 2.0
   29    33    40    44   0.20000  1.0 3.0
   33    37    41    42   0.15000  1.0 3.0
   33    37    41    43   0.15000  1.0 3.0
   33    37   -41    46   0.56750  1.0 1.0
   33    37   -41    46  -0.07550 -1.0 2.0
   33    37   -41    46   0.20000  1.0 3.0
   33    49    52    53   0.15000  1.0 3.0
   33    49    52    54   0.15000  1.0 3.0
   33    49    52    61   0.56750  1.0 1.0
   33    49    52    61  -0.07550 -1.0 2.0
   33    49    52    61   0.20000  1.0 3.0
   33    49    55    56   0.15000  1.0 3.0
   33    49    55    57   0.15000  1.0 3.0
   33    49    55    58   0.15000  1.0 3.0
   33    40    44    45  -0.11600  1.0 1.0
   33    40    44    45  -0.09450 -1.0 2.0
   33    40    44    45   0.21250  1.0 3.0
   37    33   -49    46   0.56750  1.0 1.0
   37    33   -49    46  -0.07550 -1.0 2.0
   37    33   -49    46   0.20000  1.0 3.0
   37    33    49    52   0.56750  1.0 1.0
   37    33    49    52  -0.07550 -1.0 2.0
   37    33    49    52   0.20000  1.0 3.0
   37    33    49    55   0.56750  1.0 1.0
   37    33    49    55  -0.07550 -1.0 2.0
   37    33    49    55   0.20000  1.0 3.0
   37    33    40    65   0.56750  1.0 1.0
   37    33    40    65  -0.07550 -1.0 2.0
   37    33    40    65   0.20000  1.0 3.0
   37    33    40    97   0.56750  1.0 1.0
   37    33    40    97  -0.07550 -1.0 2.0
   37    33    40    97   0.20000  1.0 3.0
   37    33    40    44   0.86500  1.0 1.0
   37    33    40    44  -0.17500 -1.0 2.0
   37    33    40    44   0.20800  1.0 3.0
   37    41    46    47   0.15000  1.0 3.0
   37    41    46    48   0.34400  1.0 1.0
   37    41    46    48   0.09450 -1.0 2.0
   37    41    46    48   0.11100  1.0 3.0
   37    41   -46    49   0.56750  1.0 1.0
   37    41   -46    49  -0.07550 -1.0 2.0
   37    41   -46    49   0.20000  1.0 3.0
   38    37    41    42   0.15000  1.0 3.0
   38    37    41    43   0.15000  1.0 3.0
   38    37    41    46   0.15000  1.0 3.0
   39    37    41    42   0.15000  1.0 3.0
   39    37    41    43   0.15000  1.0 3.0
   39    37    41    46   0.15000  1.0 3.0
   41    46    48    50   0.09850  1.0 1.0
   41    46    48    50   0.15250 -1.0 2.0
   41    46    48    50  -0.50650  1.0 3.0
   41    46    48    67   0.46850  1.0 1.0
   41    46    48    67   0.08550 -1.0 2.0
   41    46    48    67   0.09800  1.0 3.0
   41    46   -49    33   0.56750  1.0 1.0
   41    46   -49    33  -0.07550 -1.0 2.0
   41    46   -49    33   0.20000  1.0 3.0
   41    46    49    52   0.56750  1.0 1.0
   41    46    49    52  -0.07550 -1.0 2.0
   41    46    49    52   0.20000  1.0 3.0
   41    46    49    55   0.56750  1.0 1.0
   41    46    49    55  -0.07550 -1.0 2.0
   41    46    49    55   0.20000  1.0 3.0
   42    41    46    47   0.15000  1.0 3.0
   42    41    46    48   0.15000  1.0 3.0
   42    41    46    49   0.15000  1.0 3.0
   43    41    46    47   0.15000  1.0 3.0
   43    41    46    48   0.15000  1.0 3.0
   43    41    46    49   0.15000  1.0 3.0
   46    48    50    51   7.00000 -1.0 2.0
   46    48    50    59   7.00000 -1.0 2.0
   46    48    67    64   0.09700  1.0 1.0
   46    48    67    64   0.15600 -1.0 2.0
   46    48    67    64  -0.50800  1.0 3.0
   46    48    67    68   0.34800  1.0 3.0
   46    48    67    69   0.34800  1.0 3.0
   46    49    52    53   0.15000  1.0 3.0
   46    49    52    54   0.15000  1.0 3.0
   46    49    52    61   0.56750  1.0 1.0
   46    49    52    61  -0.07550 -1.0 2.0
   46    49    52    61   0.20000  1.0 3.0
   46    49    55    56   0.15000  1.0 3.0
   46    49    55    57   0.15000  1.0 3.0
   46    49    55    58   0.15000  1.0 3.0
   47    46    48    50   0.00000  1.0 1.0
   47    46    48    67   0.34800  1.0 3.0
   47    46    49    33   0.15000  1.0 3.0
   47    46    49    52   0.15000  1.0 3.0
   47    46    49    55   0.15000  1.0 3.0
   48    46    49    33   0.34400  1.0 1.0
   48    46    49    33   0.09450 -1.0 2.0
   48    46    49    33   0.11100  1.0 3.0
   48    46    49    52   0.34400  1.0 1.0
   48    46    49    52   0.09450 -1.0 2.0
   48    46    49    52   0.11100  1.0 3.0
   48    46    49    55   0.34400  1.0 1.0
   48    46    49    55   0.09450 -1.0 2.0
   48    46    49    55   0.11100  1.0 3.0
   48    50    59    60   1.00000 -1.0 2.0
   48    50   -59    64  -0.56150  1.0 1.0
   48    50   -59    64   2.19150 -1.0 2.0
   50    48   -67    64   0.39000  1.0 1.0
   50    48   -67    64  -0.05800 -1.0 2.0
   50    48   -67    64  -0.55150  1.0 3.0
   50    48    67    68   0.00000  1.0 1.0
   50    48    67    69   0.00000  1.0 1.0
   50    59   -64    67   2.00000 -1.0 2.0
   51    50    59    60   0.00000  1.0 1.0
   51    50    59    64   1.63100 -1.0 2.0
   59    64   -67    48  -0.82050  1.0 1.0
   59    64   -67    48   0.00600 -1.0 2.0
   59    64   -67    48   0.04400  1.0 3.0
   59    64    67    68   0.08050  1.0 3.0
   59    64    67    69   0.08050  1.0 3.0
   60    59    64    67   3.00000 -1.0 2.0
   67    48    50    51   7.00000 -1.0 2.0
   67    48   -50    59   7.00000 -1.0 2.0
   49    33    37    38   0.15000  1.0 3.0
   49    33    37    39   0.15000  1.0 3.0
   49    33   -37    41   0.56750  1.0 1.0
   49    33   -37    41  -0.07550 -1.0 2.0
   49    33   -37    41   0.20000  1.0 3.0
   49    33    40    65   0.56750  1.0 1.0
   49    33    40    65  -0.07550 -1.0 2.0
   49    33    40    65   0.20000  1.0 3.0
   49    33    40    97   0.56750  1.0 1.0
   49    33    40    97  -0.07550 -1.0 2.0
   49    33    40    97   0.20000  1.0 3.0
   49    33    40    44   0.86500  1.0 1.0
   49    33    40    44  -0.17500 -1.0 2.0
   49    33    40    44   0.20800  1.0 3.0
   49    46    48    50   0.09850  1.0 1.0
   49    46    48    50   0.15250 -1.0 2.0
   49    46    48    50  -0.50650  1.0 3.0
   49    46    48    67   0.46850  1.0 1.0
   49    46    48    67   0.08550 -1.0 2.0
   49    46    48    67   0.09800  1.0 3.0
   49    52    61    62   0.15000  1.0 3.0
   49    52    61    63   0.15000  1.0 3.0
   49    52   -61    65   0.56750  1.0 1.0
   49    52   -61    65  -0.07550 -1.0 2.0
   49    52   -61    65   0.20000  1.0 3.0
   52    49    55    56   0.15000  1.0 3.0
   52    49    55    57   0.15000  1.0 3.0
   52    49    55    58   0.15000  1.0 3.0
   52    61    65    66   0.15000  1.0 3.0
   52    61    65    70   0.56750  1.0 1.0
   52    61    65    70  -0.07550 -1.0 2.0
   52    61    65    70   0.20000  1.0 3.0
   52    61    65    40   0.56750  1.0 1.0
   52    61    65    40  -0.07550 -1.0 2.0
   52    61    65    40   0.20000  1.0 3.0
   53    52    61    62   0.15000  1.0 3.0
   53    52    61    63   0.15000  1.0 3.0
   53    52    61    65   0.15000  1.0 3.0
   54    52    61    62   0.15000  1.0 3.0
   54    52    61    63   0.15000  1.0 3.0
   54    52    61    65   0.15000  1.0 3.0
   61    65    70    71   0.56750  1.0 1.0
   61    65    70    71  -0.07550 -1.0 2.0
   61    65    70    71   0.20000  1.0 3.0
   61    65    70    87   0.56750  1.0 1.0
   61    65    70    87  -0.07550 -1.0 2.0
   61    65    70    87   0.20000  1.0 3.0
   61    65    70    74   0.56750  1.0 1.0
   61    65    70    74  -0.07550 -1.0 2.0
   61    65    70    74   0.20000  1.0 3.0
   61    65   -40    33   0.56750  1.0 1.0
   61    65   -40    33  -0.07550 -1.0 2.0
   61    65   -40    33   0.20000  1.0 3.0
   61    65    40    97   0.56750  1.0 1.0
   61    65    40    97  -0.07550 -1.0 2.0
   61    65    40    97   0.20000  1.0 3.0
   61    65    40    44   0.86500  1.0 1.0
   61    65    40    44  -0.17500 -1.0 2.0
   61    65    40    44   0.20800  1.0 3.0
   62    61    65    66   0.15000  1.0 3.0
   62    61    65    70   0.15000  1.0 3.0
   62    61    65    40   0.15000  1.0 3.0
   63    61    65    66   0.15000  1.0 3.0
   63    61    65    70   0.15000  1.0 3.0
   63    61    65    40   0.15000  1.0 3.0
   65    70    71    72   0.15000  1.0 3.0
   65    70    71    73   0.15000  1.0 3.0
   65    70    71    78   0.56750  1.0 1.0
   65    70    71    78  -0.07550 -1.0 2.0
   65    70    71    78   0.20000  1.0 3.0
   65    70    87    83   0.56750  1.0 1.0
   65    70    87    83  -0.07550 -1.0 2.0
   65    70    87    83   0.20000  1.0 3.0
   65    70    87    88   0.15000  1.0 3.0
   65    70    87    91   0.56750  1.0 1.0
   65    70    87    91  -0.07550 -1.0 2.0
   65    70    87    91   0.20000  1.0 3.0
   65    70    74    75   0.15000  1.0 3.0
   65    70    74    76   0.15000  1.0 3.0
   65    70    74    77   0.15000  1.0 3.0
   65    40    44    45  -0.11600  1.0 1.0
   65    40    44    45  -0.09450 -1.0 2.0
   65    40    44    45   0.21250  1.0 3.0
   66    65    70    71   0.15000  1.0 3.0
   66    65    70    87   0.15000  1.0 3.0
   66    65    70    74   0.15000  1.0 3.0
   66    65    40    33   0.15000  1.0 3.0
   66    65    40    97   0.15000  1.0 3.0
   66    65    40    44   0.23400  1.0 3.0
   70    65    40    33   0.56750  1.0 1.0
   70    65    40    33  -0.07550 -1.0 2.0
   70    65    40    33   0.20000  1.0 3.0
   70    65    40    97   0.56750  1.0 1.0
   70    65    40    97  -0.07550 -1.0 2.0
   70    65    40    97   0.20000  1.0 3.0
   70    65    40    44   0.86500  1.0 1.0
   70    65    40    44  -0.17500 -1.0 2.0
   70    65    40    44   0.20800  1.0 3.0
   70    71    78    79   0.15000  1.0 3.0
   70    71    78    80   0.15000  1.0 3.0
   70    71    78    81   0.56750  1.0 1.0
   70    71    78    81  -0.07550 -1.0 2.0
   70    71    78    81   0.20000  1.0 3.0
   70    87    91    92   0.15000  1.0 3.0
   70    87    91    93   0.15000  1.0 3.0
   70    87   -91    97   0.56750  1.0 1.0
   70    87   -91    97  -0.07550 -1.0 2.0
   70    87   -91    97   0.20000  1.0 3.0
   71    70    87    83   0.56750  1.0 1.0
   71    70    87    83  -0.07550 -1.0 2.0
   71    70    87    83   0.20000  1.0 3.0
   71    70    87    88   0.15000  1.0 3.0
   71    70    87    91   0.56750  1.0 1.0
   71    70    87    91  -0.07550 -1.0 2.0
   71    70    87    91   0.20000  1.0 3.0
   71    70    74    75   0.15000  1.0 3.0
   71    70    74    76   0.15000  1.0 3.0
   71    70    74    77   0.15000  1.0 3.0
   71    78    81    82   0.15000  1.0 3.0
   71    78   -81    83   0.56750  1.0 1.0
   71    78   -81    83  -0.07550 -1.0 2.0
   71    78   -81    83   0.20000  1.0 3.0
   71    78    81    86   0.62750  1.0 1.0
   71    78    81    86  -0.30950 -1.0 2.0
   71    78    81    86   0.27300  1.0 3.0
   72    71    78    79   0.15000  1.0 3.0
   72    71    78    80   0.15000  1.0 3.0
   72    71    78    81   0.15000  1.0 3.0
   73    71    78    79   0.15000  1.0 3.0
   73    71    78    80   0.15000  1.0 3.0
   73    71    78    81   0.15000  1.0 3.0
   78    81    83    84   0.15000  1.0 3.0
   78    81    83    85   0.15000  1.0 3.0
   78    81    83    87   0.56750  1.0 1.0
   78    81    83    87  -0.07550 -1.0 2.0
   78    81    83    87   0.20000  1.0 3.0
   78    81    86    89   0.06250  1.0 1.0
   78    81    86    89  -0.01100 -1.0 2.0
   78    81    86    89   0.28050  1.0 3.0
   79    78    81    82   0.15000  1.0 3.0
   79    78    81    83   0.15000  1.0 3.0
   79    78    81    86   0.23400  1.0 3.0
   80    78    81    82   0.15000  1.0 3.0
   80    78    81    83   0.15000  1.0 3.0
   80    78    81    86   0.23400  1.0 3.0
   81    83   -87    70   0.56750  1.0 1.0
   81    83   -87    70  -0.07550 -1.0 2.0
   81    83   -87    70   0.20000  1.0 3.0
   81    83    87    88   0.15000  1.0 3.0
   81    83    87    91   0.56750  1.0 1.0
   81    83    87    91  -0.07550 -1.0 2.0
   81    83    87    91   0.20000  1.0 3.0
   81    86    89    90   0.37050  1.0 3.0
   81    86    89    94   0.06250  1.0 1.0
   81    86    89    94  -0.01100 -1.0 2.0
   81    86    89    94   0.28050  1.0 3.0
   81    86    89   113  -0.53350  1.0 1.0
   81    86    89   113  -0.78350 -1.0 2.0
   81    86    89   113   0.33750  1.0 3.0
   82    81    83    84   0.15000  1.0 3.0
   82    81    83    85   0.15000  1.0 3.0
   82    81    83    87   0.15000  1.0 3.0
   82    81    86    89   0.37050  1.0 3.0
   83    81    86    89   0.06250  1.0 1.0
   83    81    86    89  -0.01100 -1.0 2.0
   83    81    86    89   0.28050  1.0 3.0
   83    87    91    92   0.15000  1.0 3.0
   83    87    91    93   0.15000  1.0 3.0
   83    87    91    97   0.56750  1.0 1.0
   83    87    91    97  -0.07550 -1.0 2.0
   83    87    91    97   0.20000  1.0 3.0
   84    83    87    70   0.15000  1.0 3.0
   84    83    87    88   0.15000  1.0 3.0
   84    83    87    91   0.15000  1.0 3.0
   85    83    87    70   0.15000  1.0 3.0
   85    83    87    88   0.15000  1.0 3.0
   85    83    87    91   0.15000  1.0 3.0
   87    70    71    72   0.15000  1.0 3.0
   87    70    71    73   0.15000  1.0 3.0
   87    70   -71    78   0.56750  1.0 1.0
   87    70   -71    78  -0.07550 -1.0 2.0
   87    70   -71    78   0.20000  1.0 3.0
   87    70    74    75   0.15000  1.0 3.0
   87    70    74    76   0.15000  1.0 3.0
   87    70    74    77   0.15000  1.0 3.0
   87    91    97    98   0.15000  1.0 3.0
   87    91    97    99   0.15000  1.0 3.0
   87    91    97    40   0.56750  1.0 1.0
   87    91    97    40  -0.07550 -1.0 2.0
   87    91    97    40   0.20000  1.0 3.0
   88    87    91    92   0.15000  1.0 3.0
   88    87    91    93   0.15000  1.0 3.0
   88    87    91    97   0.15000  1.0 3.0
   91    97    40    33   0.56750  1.0 1.0
   91    97    40    33  -0.07550 -1.0 2.0
   91    97    40    33   0.20000  1.0 3.0
   91    97   -40    65   0.56750  1.0 1.0
   91    97   -40    65  -0.07550 -1.0 2.0
   91    97   -40    65   0.20000  1.0 3.0
   91    97    40    44   0.86500  1.0 1.0
   91    97    40    44  -0.17500 -1.0 2.0
   91    97    40    44   0.20800  1.0 3.0
   92    91    97    98   0.15000  1.0 3.0
   92    91    97    99   0.15000  1.0 3.0
   92    91    97    40   0.15000  1.0 3.0
   93    91    97    98   0.15000  1.0 3.0
   93    91    97    99   0.15000  1.0 3.0
   93    91    97    40   0.15000  1.0 3.0
   97    40    44    45  -0.11600  1.0 1.0
   97    40    44    45  -0.09450 -1.0 2.0
   97    40    44    45   0.21250  1.0 3.0
   98    97    40    33   0.15000  1.0 3.0
   98    97    40    65   0.15000  1.0 3.0
   98    97    40    44   0.23400  1.0 3.0
   99    97    40    33   0.15000  1.0 3.0
   99    97    40    65   0.15000  1.0 3.0
   99    97    40    44   0.23400  1.0 3.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    41   0.56750  1.0 1.0
   40    33    37    41  -0.07550 -1.0 2.0
   40    33    37    41   0.20000  1.0 3.0
   40    33    49    46   0.56750  1.0 1.0
   40    33    49    46  -0.07550 -1.0 2.0
   40    33    49    46   0.20000  1.0 3.0
   40    33   -49    52   0.56750  1.0 1.0
   40    33   -49    52  -0.07550 -1.0 2.0
   40    33   -49    52   0.20000  1.0 3.0
   40    33    49    55   0.56750  1.0 1.0
   40    33    49    55  -0.07550 -1.0 2.0
   40    33    49    55   0.20000  1.0 3.0
   40    65    70    71   0.56750  1.0 1.0
   40    65    70    71  -0.07550 -1.0 2.0
   40    65    70    71   0.20000  1.0 3.0
   40    65   -70    87   0.56750  1.0 1.0
   40    65   -70    87  -0.07550 -1.0 2.0
   40    65   -70    87   0.20000  1.0 3.0
   40    65    70    74   0.56750  1.0 1.0
   40    65    70    74  -0.07550 -1.0 2.0
   40    65    70    74   0.20000  1.0 3.0
   86    81    83    84   0.23400  1.0 3.0
   86    81    83    85   0.23400  1.0 3.0
   86    81    83    87   0.62750  1.0 1.0
   86    81    83    87  -0.30950 -1.0 2.0
   86    81    83    87   0.27300  1.0 3.0
   86    89    94    95   0.23400  1.0 3.0
   86    89    94    96   0.23400  1.0 3.0
   86    89    94   100   0.62750  1.0 1.0
   86    89    94   100  -0.30950 -1.0 2.0
   86    89    94   100   0.27300  1.0 3.0
   86    89   113   105  -0.81800  1.0 1.0
   89    94   100   101   0.15000  1.0 3.0
   89    94   100   102   3.97050  1.0 1.0
   89    94   100   104   0.62750  1.0 1.0
   89    94   100   104  -0.30950 -1.0 2.0
   89    94   100   104   0.27300  1.0 3.0
   90    89    94    95   0.15000  1.0 3.0
   90    89    94    96   0.15000  1.0 3.0
   90    89    94   100   0.15000  1.0 3.0
   90    89   113   105   0.37050  1.0 3.0
   94    89   113   105   0.06250  1.0 1.0
   94    89   113   105  -0.01100 -1.0 2.0
   94    89   113   105   0.28050  1.0 3.0
   94   100   102   103   0.15000  1.0 3.0
   94   100  -102   105   0.56750  1.0 1.0
   94   100  -102   105  -0.07550 -1.0 2.0
   94   100  -102   105   0.20000  1.0 3.0
   94   100   102   107   0.86500  1.0 1.0
   94   100   102   107  -0.17500 -1.0 2.0
   94   100   102   107   0.20800  1.0 3.0
   94   100   104   109   0.06250  1.0 1.0
   94   100   104   109  -0.01100 -1.0 2.0
   94   100   104   109   0.28050  1.0 3.0
   95    94   100   101   0.15000  1.0 3.0
   95    94   100   102   0.15000  1.0 3.0
   95    94   100   104   0.23400  1.0 3.0
   96    94   100   101   0.15000  1.0 3.0
   96    94   100   102   0.15000  1.0 3.0
   96    94   100   104   0.23400  1.0 3.0
  100   102   105   106   0.15000  1.0 3.0
  100   102   105   113   0.62750  1.0 1.0
  100   102   105   113  -0.30950 -1.0 2.0
  100   102   105   113   0.27300  1.0 3.0
  100   102   105   114   0.56750  1.0 1.0
  100   102   105   114  -0.07550 -1.0 2.0
  100   102   105   114   0.20000  1.0 3.0
  100   102   107   108  -0.11600  1.0 1.0
  100   102   107   108  -0.09450 -1.0 2.0
  100   102   107   108   0.21250  1.0 3.0
  100   104   109   110   0.37050  1.0 3.0
  100   104   109   111   0.37050  1.0 3.0
  100   104   109   112   0.37050  1.0 3.0
  101   100   102   103   0.15000  1.0 3.0
  101   100   102   105   0.15000  1.0 3.0
  101   100   102   107   0.23400  1.0 3.0
  101   100   104   109   0.37050  1.0 3.0
  102   100   104   109   0.06250  1.0 1.0
  102   100   104   109  -0.01100 -1.0 2.0
  102   100   104   109   0.28050  1.0 3.0
  102   105  -113    89   0.06250  1.0 1.0
  102   105  -113    89  -0.01100 -1.0 2.0
  102   105  -113    89   0.28050  1.0 3.0
  102   105   114   115   0.15000  1.0 3.0
  102   105   114   116   0.15000  1.0 3.0
  102   105   114   117   0.15000  1.0 3.0
  103   102   105   106   0.15000  1.0 3.0
  103   102   105   113   0.23400  1.0 3.0
  103   102   105   114   0.15000  1.0 3.0
  103   102   107   108   0.19450  1.0 3.0
  105   102   107   108  -0.11600  1.0 1.0
  105   102   107   108  -0.09450 -1.0 2.0
  105   102   107   108   0.21250  1.0 3.0
  106   105   113    89   0.37050  1.0 3.0
  106   105   114   115   0.15000  1.0 3.0
  106   105   114   116   0.15000  1.0 3.0
  106   105   114   117   0.15000  1.0 3.0
  113    89    94    95   0.23400  1.0 3.0
  113    89    94    96   0.23400  1.0 3.0
  113    89   -94   100   0.62750  1.0 1.0
  113    89   -94   100  -0.30950 -1.0 2.0
  113    89   -94   100   0.27300  1.0 3.0
  113   105   114   115   0.23400  1.0 3.0
  113   105   114   116   0.23400  1.0 3.0
  113   105   114   117   0.23400  1.0 3.0
  114   105   113    89   0.06250  1.0 1.0
  114   105   113    89  -0.01100 -1.0 2.0
  114   105   113    89   0.28050  1.0 3.0
  107   102   105   106   0.23400  1.0 3.0
  107   102   105   113   3.69350  1.0 1.0
  107   102   105   113  -1.82950 -1.0 2.0
  107   102   105   114   0.86500  1.0 1.0
  107   102   105   114  -0.17500 -1.0 2.0
  107   102   105   114   0.20800  1.0 3.0
  104   100   102   103   0.23400  1.0 3.0
  104   100   102   105   0.62750  1.0 1.0
  104   100   102   105  -0.30950 -1.0 2.0
  104   100   102   105   0.27300  1.0 3.0
  104   100   102   107   3.69350  1.0 1.0
  104   100   102   107  -1.82950 -1.0 2.0
   74    70    71    72   0.15000  1.0 3.0
   74    70    71    73   0.15000  1.0 3.0
   74    70    71    78   0.56750  1.0 1.0
   74    70    71    78  -0.07550 -1.0 2.0
   74    70    71    78   0.20000  1.0 3.0
   74    70    87    83   0.56750  1.0 1.0
   74    70    87    83  -0.07550 -1.0 2.0
   74    70    87    83   0.20000  1.0 3.0
   74    70    87    88   0.15000  1.0 3.0
   74    70    87    91   0.56750  1.0 1.0
   74    70    87    91  -0.07550 -1.0 2.0
   74    70    87    91   0.20000  1.0 3.0
   55    49    52    53   0.15000  1.0 3.0
   55    49    52    54   0.15000  1.0 3.0
   55    49    52    61   0.56750  1.0 1.0
   55    49    52    61  -0.07550 -1.0 2.0
   55    49    52    61   0.20000  1.0 3.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    34    35  10.50000 -1.0 2.0
   46    67    48    50   1.10000 -1.0 2.0
   59    51    50    48   1.10000 -1.0 2.0
   50    64    59    60  10.50000 -1.0 2.0
END
