* LIGAND DATABASE FILE (OPLS2005)
*
001     118   120    202    326     604
    1     0 S   NP   _N1_     1    29.48683    98.19517   -25.63303
    2     1 S   H    _HN1     2     1.02966    88.94383   -46.46402
    3     1 S   H    _H1_     3     1.02808    21.91241   166.72454
    4     1 S   H    _H2_     4     1.02862   126.53546  -158.23260
    5     1 S   CT   _CA1     5     1.50115   107.81503    64.79003
    6     5 S   HC   _HA1     6     1.09549   105.33402    82.01232
    7     5 S   CO3  _C1_     7     1.53840   112.31956   -38.67881
    8     7 S   O2Z  _O11     8     1.26407   115.09434   -47.36730
    9     7 S   O2Z  _O12     9     1.26237   114.89423   131.76326
   10     5 S   CT   _CB1    10     1.52891   107.36720  -159.82179
   11    10 S   HC   HB11    11     1.09811   109.77807   -48.25486
   12    10 S   HC   HB12    12     1.09620   110.01133    68.23846
   13    10 S   CT   _CG1    13     1.53019   113.08811  -169.14242
   14    13 S   HC   HG11    14     1.09531   111.17410   -59.91661
   15    13 S   HC   HG12    15     1.09587   109.66416    59.49624
   16    13 S   C    _CD1    16     1.51696   110.74940  -178.97664
   17    16 S   O    _OE1    17     1.22884   122.51399    29.08789
   18    16 S   N    _N2_    18     1.38536   112.83279  -151.91617
   19    18 S   H    _HN2    19     1.01525   119.47093     3.36080
   20    18 S   CT1  _CA2    20     1.46004   122.29432   178.39672
   21    20 S   HC   _HA2    21     1.09504   109.39942    24.73866
   22    20 S   C    _C2_    22     1.52996   105.42062   -91.19093
   23    22 S   O    _O2_    23     1.22916   122.91933   -98.15220
   24    20 S   CT   _CB2    32     1.53255   112.00266   148.10524
   25    24 S   HC   HB21    33     1.09644   110.06638    56.84644
   26    24 S   HC   HB22    34     1.09504   110.93542   174.49192
   27    22 S   N    _N3_    24     1.38530   112.55256    79.16870
   28    27 S   H    _HN3    25     1.01763   119.57446    -0.08847
   29    24 S   S    _SG2    35     1.82803   113.38386   -62.08884
   30    27 S   CT   _CA3    26     1.45247   123.04244  -178.07481
   31    30 S   HC   HA31    27     1.09552   107.19256   -69.49466
   32    30 S   HC   HA32    28     1.09548   108.36521    46.92685
   33    29 S   CT   _C31    36     1.84606   100.52048   -72.92573
   34    33 S   HC   _H3_    37     1.09298   107.58046    30.56039
   35    30 S   CO3  _C3_    29     1.52921   114.00678   168.62450
   36    35 S   O2Z  _O31    30     1.26426   116.03061   -17.10816
   37    35 S   O2Z  _O32    31     1.26397   114.52511   163.31568
   38    33 S   CA   _C32    38     1.52030   111.02626   -87.99960
   39    33 S   CM   _C30    51     1.51746   107.73362   147.76955
   40    39 S   HC   _H32    52     1.08566   114.27140    51.23272
   41    38 S   CA   _C33    39     1.40486   119.74388   105.37345
   42    41 S   HA   _H33    40     1.08776   120.26648     0.19180
   43    39 S   CMA  _C29    53     1.35881   126.06929  -128.54378
   44    43 S   OM   _O39    54     1.26325   126.60792    -0.48376
   45    41 S   CA   _C34    41     1.39759   120.90605  -179.89721
   46    45 S   HA   _H34    42     1.08616   119.28845   179.97202
   47    43 S   NE   _N5_    55     1.43407   121.10700  -180.00000
   48    45 S   CA   _C35    43     1.39321   119.77726    -0.33396
   49    47 S   CT   _C16    56     1.48548   124.20979  -175.60239
   50    49 S   HC   _H16    57     1.09669   111.76516   -35.30306
   51    49 S   HC   _H17    58     1.09804   109.64664  -150.99802
   52    47 S   CT   _C17    89     1.48072   122.77447     0.82472
   53    52 S   HC   _H18    90     1.09798   110.48910  -159.10435
   54    52 S   HC   _H19    91     1.09550   110.02101   -44.29794
   55    48 S   CA   _C36    44     1.39080   120.07741     0.13706
   56    48 S   OH   _O38    49     1.36697   120.50907  -179.58931
   57    56 S   HO   _H37    50     0.97195   108.66432     0.29674
   58    49 S   CT   _C15    59     1.53273   110.17367    88.39054
   59    58 S   HC   _H14    60     1.09698   109.52194    61.47286
   60    58 S   HC   _H15    61     1.09638   109.95805   -55.21084
   61    52 S   CT   _C18    92     1.53378   110.94448    80.49369
   62    61 S   HC   _H20    93     1.09602   110.77399   -50.41182
   63    61 S   HC   _H21    94     1.09697   108.97014    66.18389
   64    38 S   CA   _C37    45     1.40474   121.88555   -74.28272
   65    64 S   HA   _H35    46     1.08472   119.85265     0.38206
   66    55 S   OH   _O37    47     1.36768   119.60889  -179.02301
   67    66 S   HO   _H36    48     0.97364   108.58425   171.61395
   68    58 S   CT   _C14    62     1.53061   111.46642  -177.02053
   69    68 S   HC   _H12    63     1.09677   109.46390    63.06514
   70    68 S   HC   _H13    64     1.09663   109.31681   -54.02554
   71    61 S   CT   _C19    95     1.52881   112.24172  -172.97049
   72    71 S   HC   _H22    96     1.09536   109.64006  -174.97204
   73    71 S   HC   _H23    97     1.09482   110.85615   -55.51568
   74    68 S   CT   _C13    65     1.52778   112.36894  -174.48786
   75    74 S   HC   _H10    66     1.09554   109.51558   175.18643
   76    74 S   HC   _H11    67     1.09507   110.69848    56.28535
   77    71 S   N    _N6_    98     1.45307   111.89366    64.48366
   78    77 S   H    _H24    99     1.01503   117.19058   -92.30597
   79    74 S   N    _N4_    68     1.45116   112.57805   -63.82933
   80    79 S   H    _H9_    69     1.01593   117.33454    92.13620
   81    77 S   C    _C20   100     1.38288   122.83238    83.98493
   82    81 S   O    _O34   101     1.22653   125.57969     4.54627
   83    79 S   C    _C12    70     1.38261   122.76913   -88.20028
   84    83 S   O    _O33    71     1.22617   125.54078     0.24147
   85    81 S   CM   _C21   102     1.48920   111.84742  -173.82629
   86    85 S   HC   _H25   103     1.08439   118.16045    -0.39067
   87    83 S   CM   _C11    72     1.48745   111.83519  -179.03714
   88    87 S   HC   _H8_    73     1.08389   118.18205    -8.34431
   89    85 S   CM   _C22   104     1.34097   119.90993   178.46609
   90    89 S   HC   _H26   105     1.08713   120.66053     2.50554
   91    87 S   CM   _C10    74     1.34007   120.09132   169.83928
   92    91 S   HC   _H7_    75     1.08621   121.81197    -0.48214
   93    89 S   CA   _C23   106     1.47126   123.97760  -177.98074
   94    91 S   CA   _C9_    76     1.46639   121.90760  -176.86125
   95    93 S   CA   _C24   107     1.40385   122.31585    35.95068
   96    95 S   HA   _H27   108     1.08767   120.94115    -0.99426
   97    94 S   CA   _C4_    77     1.40237   118.75592   119.83932
   98    97 S   HA   _H4_    78     1.08808   120.49828     0.34035
   99    95 S   CA   _C25   109     1.39767   120.71040   178.26946
  100    99 S   HA   _H28   110     1.08629   119.31286   179.82641
  101    97 S   CA   _C5_    79     1.39599   120.53956  -178.84852
  102   101 S   HA   _H5_    80     1.08619   119.38959   179.35472
  103    99 S   CA   _C26   111     1.39265   119.74761    -0.54393
  104   101 S   CA   _C6_    81     1.39262   119.60939    -0.43431
  105   103 S   CA   _C27   112     1.39186   120.10294    -0.28531
  106   103 S   OH   _O36   117     1.36690   120.50410  -179.98022
  107   106 S   HO   _H31   118     0.97206   108.75753    -0.18345
  108   104 S   CA   _C7_    82     1.39342   120.24747    -0.65072
  109   104 S   OH   _O41    87     1.36711   120.40506   179.31959
  110   109 S   HO   _H39    88     0.97211   108.82534     3.06190
  111    93 S   CA   _C28   113     1.40300   118.73925  -147.16076
  112   111 S   HA   _H29   114     1.08787   120.02047     1.92945
  113   105 S   OH   _O35   115     1.36763   119.26722  -179.61336
  114   113 S   HO   _H30   116     0.97203   108.78342   179.67979
  115    94 S   CA   _C8_    83     1.40215   121.79546   -60.41960
  116   115 S   HA   _H6_    84     1.08797   120.34644    -0.55178
  117   108 S   OH   _O40    85     1.36667   118.94885  -179.90109
  118   117 S   HO   _H38    86     0.97716   109.48344   169.07865
  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   8   5   4   3
  13   6   2   1   1  12   8   3   8   4  10   3   7   3  14   7
  13   6   5  10   5   4   6   3   1   9   5   4   8   5   4   3
   1   1   1   8   5   4   7   4   3   7   4   3   6   3   6   3
   6   3   6   3   6   3   6   3   8   3   8   3   9   9   8   4
   8   4   7   3   7   3   7   7   6   3   1   6   3   1   3   1
   1   1   3   1   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    64    39    40    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    45    55    64    65    39    40    43    44    47  
   38    41    64    39    40    43  
   36    37  
   37  
    0  
   41    42    45    46    48    55    64    65    66    39    40    43  
   40    43    44    47    49    52    41    64  
   43    44    47  
   42    45    46    48    55    64    65    56  
   45    46    48    64  
   44    47    49    50    51    58    52    53    54    61  
   47    49    52  
   46    48    55    64    66    56    57  
   48    55    56  
   49    50    51    58    59    60    68    52    53    54    61    62    63    71  
   55    64    65    66    67    56    57  
   50    51    58    59    60    68    69    70    74    52    53    54    61  
   51    58    59    60    68    52  
   58    59    60    68    52  
   53    54    61    62    63    71    72    73    77    58  
   54    61    62    63    71  
   61    62    63    71  
   64    65    66    67    56    57  
   57    64    66  
    0  
   59    60    68    69    70    74    75    76    79  
   60    68    69    70    74  
   68    69    70    74  
   62    63    71    72    73    77    78    81  
   63    71    72    73    77  
   71    72    73    77  
   65    66    67  
   66  
   67  
    0  
   69    70    74    75    76    79    80    83  
   70    74    75    76    79  
   74    75    76    79  
   72    73    77    78    81    82    85  
   73    77    78    81  
   77    78    81  
   75    76    79    80    83    84    87  
   76    79    80    83  
   79    80    83  
   78    81    82    85    86    89  
   81    82    85  
   80    83    84    87    88    91  
   83    84    87  
   82    85    86    89    90    93  
   85    86    89  
   84    87    88    91    92    94  
   87    88    91  
   86    89    90    93    95   111  
   89    90    93  
   88    91    92    94    97   115  
   91    92    94  
   90    93    95    96    99   105   111   112  
   93    95   111  
   92    94    97    98   101   108   115   116  
   94    97   115  
   95    96    99   100   103   105   111   112   113  
   97    98   101   102   104   108   115   116   117  
   96    99   100   103   105   111   112   106  
   99   100   103   111  
   98   101   102   104   108   115   116   109  
  101   102   104   115  
  100   103   105   111   113   106   107  
  103   105   106  
  102   104   108   115   117   109   110  
  104   108   109  
  105   111   112   113   114   106   107  
  108   115   116   117   118   109   110  
  111   112   113   114   106   107  
  107   111   113  
    0  
  115   116   117   118   109   110  
  110   115   117  
    0  
  112   113   114  
  113  
  114  
    0  
  116   117   118  
  117  
  118  
    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   0.222500   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   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   40   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   42   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   43   3.5500   0.0760   0.497600   2.0020   1.7750   0.023028004  -0.852763146
   44   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   3.2500   0.1700  -0.993100   1.9050   1.6860   0.051222218  -2.220205820
   48   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   49   3.5000   0.0660   0.115300   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660   0.115300   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   56   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   57   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   58   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   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   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   65   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   66   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   67   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   68   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5000   0.0660   0.080000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   74   3.5000   0.0660   0.080000   1.9750   1.7500   0.005000000  -0.741685710
   75   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   76   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   77   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   78   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   79   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   80   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   81   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
   82   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   83   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
   84   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   85   3.5500   0.0760  -0.171700   2.0020   1.7750   0.023028004  -0.852763146
   86   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   87   3.5500   0.0760  -0.171700   2.0020   1.7750   0.023028004  -0.852763146
   88   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   89   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   90   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   91   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   92   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   93   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   94   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   95   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   96   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   97   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   98   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   99   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
  100   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
  101   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
  102   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
  103   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
  104   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
  105   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
  106   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
  107   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
  108   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
  109   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
  110   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
  111   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
  112   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
  113   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
  114   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
  115   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
  116   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
  117   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
  118   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    39   317.000  1.510
   38    41   469.000  1.400
   38    64   469.000  1.400
   41    42   367.000  1.080
   41    45   469.000  1.400
   45    46   367.000  1.080
   45    48   469.000  1.400
   48    55   469.000  1.400
   48    56   450.000  1.364
   55    64   469.000  1.400
   55    66   450.000  1.364
   64    65   367.000  1.080
   66    67   553.000  0.945
   56    57   553.000  0.945
   39    40   340.000  1.080
   39    43   465.000  1.376
   43    44   745.000  1.250
   43    47   415.000  1.382
   47    49   382.000  1.448
   47    52   382.000  1.448
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    58   268.000  1.529
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    68   268.000  1.529
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    74   268.000  1.529
   74    75   340.000  1.090
   74    76   340.000  1.090
   74    79   337.000  1.449
   79    80   434.000  1.010
   79    83   490.000  1.335
   83    84   570.000  1.229
   83    87   410.000  1.444
   87    88   340.000  1.080
   87    91   549.000  1.340
   91    92   340.000  1.080
   91    94   320.000  1.460
   94    97   469.000  1.400
   94   115   469.000  1.400
   97    98   367.000  1.080
   97   101   469.000  1.400
  101   102   367.000  1.080
  101   104   469.000  1.400
  104   108   469.000  1.400
  104   109   450.000  1.364
  108   115   469.000  1.400
  108   117   450.000  1.364
  115   116   367.000  1.080
  117   118   553.000  0.945
  109   110   553.000  0.945
   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    71   268.000  1.529
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    77   337.000  1.449
   77    78   434.000  1.010
   77    81   490.000  1.335
   81    82   570.000  1.229
   81    85   410.000  1.444
   85    86   340.000  1.080
   85    89   549.000  1.340
   89    90   340.000  1.080
   89    93   320.000  1.460
   93    95   469.000  1.400
   93   111   469.000  1.400
   95    96   367.000  1.080
   95    99   469.000  1.400
   99   100   367.000  1.080
   99   103   469.000  1.400
  103   105   469.000  1.400
  103   106   450.000  1.364
  105   111   469.000  1.400
  105   113   450.000  1.364
  111   112   367.000  1.080
  113   114   553.000  0.945
  106   107   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    80.00000  109.48900
   29    33    39    75.00000  112.20000
   33    38    41    70.00000  120.00000
   33    38    64    70.00000  120.00000
   33    39    40    35.00000  117.00000
   33    39    43    70.00000  124.00000
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    45    63.00000  120.00000
   38    64    55    63.00000  120.00000
   38    64    65    35.00000  120.00000
   41    45    46    35.00000  120.00000
   41    45    48    63.00000  120.00000
   45    41    42    35.00000  120.00000
   45    48    55    63.00000  120.00000
   45    48    56    70.00000  120.00000
   48    45    46    35.00000  120.00000
   48    55    64    63.00000  120.00000
   48    55    66    70.00000  120.00000
   48    56    57    35.00000  113.00000
   55    64    65    35.00000  120.00000
   55    66    67    35.00000  113.00000
   64    38    41    63.00000  120.00000
   66    55    64    70.00000  120.00000
   56    48    55    70.00000  120.00000
   39    33    34    35.00000  109.50000
   39    33    38    70.00000  112.99600
   39    43    44    65.00000  137.10300
   39    43    47    75.00000  114.40000
   43    39    40    40.00000  120.50800
   43    47    49    50.00000  121.00000
   43    47    52    50.00000  121.00000
   47    43    44   105.00000  113.92000
   47    49    50    35.00000  109.50000
   47    49    51    35.00000  109.50000
   47    49    58    80.00000  111.61500
   47    52    53    35.00000  109.50000
   47    52    54    35.00000  109.50000
   47    52    61    80.00000  111.61500
   49    58    59    37.50000  110.70000
   49    58    60    37.50000  110.70000
   49    58    68    58.35000  112.70000
   51    49    50    33.00000  107.80000
   58    49    50    37.50000  110.70000
   58    49    51    37.50000  110.70000
   58    68    69    37.50000  110.70000
   58    68    70    37.50000  110.70000
   58    68    74    58.35000  112.70000
   60    58    59    33.00000  107.80000
   68    58    59    37.50000  110.70000
   68    58    60    37.50000  110.70000
   68    74    75    37.50000  110.70000
   68    74    76    37.50000  110.70000
   68    74    79    70.00000  110.72300
   70    68    69    33.00000  107.80000
   74    68    69    37.50000  110.70000
   74    68    70    37.50000  110.70000
   74    79    80    38.00000  118.40000
   74    79    83    50.00000  121.90000
   76    74    75    33.00000  107.80000
   79    74    75    35.00000  109.50000
   79    74    76    35.00000  109.50000
   79    83    84    80.00000  122.90000
   79    83    87    80.00000  111.56200
   83    79    80    35.00000  119.80000
   83    87    88    35.00000  119.70000
   83    87    91    70.00000  118.70000
   87    83    84    80.00000  125.30000
   87    91    92    35.00000  120.00000
   87    91    94    60.00000  123.20500
   91    87    88    35.00000  120.00000
   91    94    97    60.00000  120.93500
   91    94   115    60.00000  120.93500
   94    91    92    40.00000  117.26300
   94    97    98    35.00000  120.00000
   94    97   101    63.00000  120.00000
   94   115   108    63.00000  120.00000
   94   115   116    35.00000  120.00000
   97   101   102    35.00000  120.00000
   97   101   104    63.00000  120.00000
  101    97    98    35.00000  120.00000
  101   104   108    63.00000  120.00000
  101   104   109    70.00000  120.00000
  104   101   102    35.00000  120.00000
  104   108   115    63.00000  120.00000
  104   108   117    70.00000  120.00000
  104   109   110    35.00000  113.00000
  108   115   116    35.00000  120.00000
  108   117   118    35.00000  113.00000
  115    94    97    63.00000  120.00000
  117   108   115    70.00000  120.00000
  109   104   108    70.00000  120.00000
   52    47    49    50.00000  115.00000
   52    61    62    37.50000  110.70000
   52    61    63    37.50000  110.70000
   52    61    71    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    71    72    37.50000  110.70000
   61    71    73    37.50000  110.70000
   61    71    77    70.00000  110.72300
   63    61    62    33.00000  107.80000
   71    61    62    37.50000  110.70000
   71    61    63    37.50000  110.70000
   71    77    78    38.00000  118.40000
   71    77    81    50.00000  121.90000
   73    71    72    33.00000  107.80000
   77    71    72    35.00000  109.50000
   77    71    73    35.00000  109.50000
   77    81    82    80.00000  122.90000
   77    81    85    80.00000  111.56200
   81    77    78    35.00000  119.80000
   81    85    86    35.00000  119.70000
   81    85    89    70.00000  118.70000
   85    81    82    80.00000  125.30000
   85    89    90    35.00000  120.00000
   85    89    93    60.00000  123.20500
   89    85    86    35.00000  120.00000
   89    93    95    60.00000  120.93500
   89    93   111    60.00000  120.93500
   93    89    90    40.00000  117.26300
   93    95    96    35.00000  120.00000
   93    95    99    63.00000  120.00000
   93   111   105    63.00000  120.00000
   93   111   112    35.00000  120.00000
   95    99   100    35.00000  120.00000
   95    99   103    63.00000  120.00000
   99    95    96    35.00000  120.00000
   99   103   105    63.00000  120.00000
   99   103   106    70.00000  120.00000
  103    99   100    35.00000  120.00000
  103   105   111    63.00000  120.00000
  103   105   113    70.00000  120.00000
  103   106   107    35.00000  113.00000
  105   111   112    35.00000  120.00000
  105   113   114    35.00000  113.00000
  111    93    95    63.00000  120.00000
  113   105   111    70.00000  120.00000
  106   103   105    70.00000  120.00000
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  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  1.0 3.0
   24    29    33    39  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  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    41  -0.16000  1.0 1.0
   29    33    38    41  -0.03200 -1.0 2.0
   29    33    38    41   0.04500  1.0 3.0
   29    33    38    64  -0.16000  1.0 1.0
   29    33    38    64  -0.03200 -1.0 2.0
   29    33    38    64   0.04500  1.0 3.0
   29    33    39    40   0.00000  1.0 1.0
   29    33    39    43   0.42700  1.0 1.0
   29    33    39    43  -0.70350 -1.0 2.0
   29    33    39    43  -0.43150  1.0 3.0
   33    38    41    42   3.62500 -1.0 2.0
   33    38    41    45   3.62500 -1.0 2.0
   33    38    64    55   3.62500 -1.0 2.0
   33    38    64    65   3.62500 -1.0 2.0
   33    39    43    44   7.00000 -1.0 2.0
   33    39    43    47   7.00000 -1.0 2.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    64   0.00000  1.0 1.0
   34    33    39    40   0.33100  1.0 3.0
   34    33    39    43   0.00000  1.0 1.0
   38    33    39    40   0.00000  1.0 1.0
   38    33    39    43   1.44450  1.0 1.0
   38    33    39    43   0.06600 -1.0 2.0
   38    33    39    43   0.29250  1.0 3.0
   38    41    45    46   3.62500 -1.0 2.0
   38    41    45    48   3.62500 -1.0 2.0
   41    38    64    55   3.62500 -1.0 2.0
   41    38    64    65   3.62500 -1.0 2.0
   41    45   -48    55   3.62500 -1.0 2.0
   41    45    48    56   3.62500 -1.0 2.0
   42    41    45    46   3.62500 -1.0 2.0
   42    41    45    48   3.62500 -1.0 2.0
   45    48    55    64   3.62500 -1.0 2.0
   45    48    55    66   3.62500 -1.0 2.0
   45    48    56    57   0.84100 -1.0 2.0
   46    45    48    55   3.62500 -1.0 2.0
   46    45    48    56   3.62500 -1.0 2.0
   48    55   -64    38   3.62500 -1.0 2.0
   48    55    64    65   3.62500 -1.0 2.0
   48    55    66    67   0.84100 -1.0 2.0
   55    48    56    57   0.84100 -1.0 2.0
   64    38    41    42   3.62500 -1.0 2.0
   64    38   -41    45   3.62500 -1.0 2.0
   64    55    66    67   0.84100 -1.0 2.0
   66    55    64    38   3.62500 -1.0 2.0
   66    55    64    65   3.62500 -1.0 2.0
   56    48    55    64   3.62500 -1.0 2.0
   56    48    55    66   3.62500 -1.0 2.0
   39    33    38    41   0.18050 -1.0 2.0
   39    33    38    64   0.18050 -1.0 2.0
   39    43    47    49  -0.54700  1.0 1.0
   39    43    47    49   1.23000 -1.0 2.0
   39    43    47    52  -0.54700  1.0 1.0
   39    43    47    52   1.23000 -1.0 2.0
   40    39    43    44   7.00000 -1.0 2.0
   40    39    43    47   7.00000 -1.0 2.0
   43    47    49    50   0.00000  1.0 1.0
   43    47    49    51   0.00000  1.0 1.0
   43    47    49    58   0.25450  1.0 1.0
   43    47    49    58  -0.61700 -1.0 2.0
   43    47    49    58  -0.23550  1.0 3.0
   43    47    52    53   0.00000  1.0 1.0
   43    47    52    54   0.00000  1.0 1.0
   43    47    52    61   0.25450  1.0 1.0
   43    47    52    61  -0.61700 -1.0 2.0
   43    47    52    61  -0.23550  1.0 3.0
   44    43    47    49   1.00000 -1.0 2.0
   44    43    47    52   1.00000 -1.0 2.0
   47    49    58    59   0.22950  1.0 3.0
   47    49    58    60   0.22950  1.0 3.0
   47    49    58    68   1.26750  1.0 1.0
   47    49    58    68  -0.00950 -1.0 2.0
   47    49    58    68   0.30600  1.0 3.0
   47    52    61    62   0.22950  1.0 3.0
   47    52    61    63   0.22950  1.0 3.0
   47    52    61    71   1.26750  1.0 1.0
   47    52    61    71  -0.00950 -1.0 2.0
   47    52    61    71   0.30600  1.0 3.0
   49    47    52    53   0.00000  1.0 1.0
   49    47    52    54   0.00000  1.0 1.0
   49    47    52    61   0.00000  1.0 1.0
   49    58    68    69   0.15000  1.0 3.0
   49    58    68    70   0.15000  1.0 3.0
   49    58    68    74   0.56750  1.0 1.0
   49    58    68    74  -0.07550 -1.0 2.0
   49    58    68    74   0.20000  1.0 3.0
   50    49    58    59   0.15000  1.0 3.0
   50    49    58    60   0.15000  1.0 3.0
   50    49    58    68   0.15000  1.0 3.0
   51    49    58    59   0.15000  1.0 3.0
   51    49    58    60   0.15000  1.0 3.0
   51    49    58    68   0.15000  1.0 3.0
   58    68    74    75   0.15000  1.0 3.0
   58    68    74    76   0.15000  1.0 3.0
   58    68    74    79   0.43900  1.0 1.0
   58    68    74    79   0.49100 -1.0 2.0
   58    68    74    79   0.28400  1.0 3.0
   59    58    68    69   0.15000  1.0 3.0
   59    58    68    70   0.15000  1.0 3.0
   59    58    68    74   0.15000  1.0 3.0
   60    58    68    69   0.15000  1.0 3.0
   60    58    68    70   0.15000  1.0 3.0
   60    58    68    74   0.15000  1.0 3.0
   68    74    79    80   0.00000  1.0 1.0
   68    74    79    83  -0.43950  1.0 1.0
   68    74    79    83  -0.08100 -1.0 2.0
   68    74    79    83   0.03350  1.0 3.0
   69    68    74    75   0.15000  1.0 3.0
   69    68    74    76   0.15000  1.0 3.0
   69    68    74    79   0.15000  1.0 3.0
   70    68    74    75   0.15000  1.0 3.0
   70    68    74    76   0.15000  1.0 3.0
   70    68    74    79   0.15000  1.0 3.0
   74    79    83    84   3.04450 -1.0 2.0
   74    79    83    87   1.49850  1.0 1.0
   74    79    83    87   1.53950 -1.0 2.0
   75    74    79    80   0.00000  1.0 1.0
   75    74    79    83   0.00000  1.0 1.0
   76    74    79    80   0.00000  1.0 1.0
   76    74    79    83   0.00000  1.0 1.0
   79    83    87    88   0.65100 -1.0 2.0
   79    83    87    91   0.49500  1.0 1.0
   79    83    87    91   1.31600 -1.0 2.0
   79    83    87    91  -0.02300  1.0 3.0
   80    79    83    84   2.45000 -1.0 2.0
   80    79    83    87   2.56700 -1.0 2.0
   83    87    91    92   7.00000 -1.0 2.0
   83    87    91    94   7.00000 -1.0 2.0
   84    83    87    88   0.00000  1.0 1.0
   84    83    87    91   1.00000 -1.0 2.0
   87    91    94    97   0.15800  1.0 1.0
   87    91    94    97   1.85350 -1.0 2.0
   87    91    94    97  -0.48700  1.0 3.0
   87    91    94   115   0.15800  1.0 1.0
   87    91    94   115   1.85350 -1.0 2.0
   87    91    94   115  -0.48700  1.0 3.0
   88    87    91    92   7.00000 -1.0 2.0
   88    87    91    94   7.00000 -1.0 2.0
   91    94    97    98   3.62500 -1.0 2.0
   91    94    97   101   3.62500 -1.0 2.0
   91    94   115   108   3.62500 -1.0 2.0
   91    94   115   116   3.62500 -1.0 2.0
   92    91    94    97   0.56550  1.0 3.0
   92    91    94   115   0.56550  1.0 3.0
   94    97   101   102   3.62500 -1.0 2.0
   94    97   101   104   3.62500 -1.0 2.0
   97    94   115   108   3.62500 -1.0 2.0
   97    94   115   116   3.62500 -1.0 2.0
   97   101  -104   108   3.62500 -1.0 2.0
   97   101   104   109   3.62500 -1.0 2.0
   98    97   101   102   3.62500 -1.0 2.0
   98    97   101   104   3.62500 -1.0 2.0
  101   104   108   115   3.62500 -1.0 2.0
  101   104   108   117   3.62500 -1.0 2.0
  101   104   109   110   0.84100 -1.0 2.0
  102   101   104   108   3.62500 -1.0 2.0
  102   101   104   109   3.62500 -1.0 2.0
  104   108  -115    94   3.62500 -1.0 2.0
  104   108   115   116   3.62500 -1.0 2.0
  104   108   117   118   0.84100 -1.0 2.0
  108   104   109   110   0.84100 -1.0 2.0
  115    94    97    98   3.62500 -1.0 2.0
  115    94   -97   101   3.62500 -1.0 2.0
  115   108   117   118   0.84100 -1.0 2.0
  117   108   115    94   3.62500 -1.0 2.0
  117   108   115   116   3.62500 -1.0 2.0
  109   104   108   115   3.62500 -1.0 2.0
  109   104   108   117   3.62500 -1.0 2.0
   52    47    49    50   0.00000  1.0 1.0
   52    47    49    51   0.00000  1.0 1.0
   52    47    49    58   0.00000  1.0 1.0
   52    61    71    72   0.15000  1.0 3.0
   52    61    71    73   0.15000  1.0 3.0
   52    61    71    77   0.43900  1.0 1.0
   52    61    71    77   0.49100 -1.0 2.0
   52    61    71    77   0.28400  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    71   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    71   0.15000  1.0 3.0
   61    71    77    78   0.00000  1.0 1.0
   61    71    77    81  -0.43950  1.0 1.0
   61    71    77    81  -0.08100 -1.0 2.0
   61    71    77    81   0.03350  1.0 3.0
   62    61    71    72   0.15000  1.0 3.0
   62    61    71    73   0.15000  1.0 3.0
   62    61    71    77   0.15000  1.0 3.0
   63    61    71    72   0.15000  1.0 3.0
   63    61    71    73   0.15000  1.0 3.0
   63    61    71    77   0.15000  1.0 3.0
   71    77    81    82   3.04450 -1.0 2.0
   71    77    81    85   1.49850  1.0 1.0
   71    77    81    85   1.53950 -1.0 2.0
   72    71    77    78   0.00000  1.0 1.0
   72    71    77    81   0.00000  1.0 1.0
   73    71    77    78   0.00000  1.0 1.0
   73    71    77    81   0.00000  1.0 1.0
   77    81    85    86   0.65100 -1.0 2.0
   77    81    85    89   0.49500  1.0 1.0
   77    81    85    89   1.31600 -1.0 2.0
   77    81    85    89  -0.02300  1.0 3.0
   78    77    81    82   2.45000 -1.0 2.0
   78    77    81    85   2.56700 -1.0 2.0
   81    85    89    90   7.00000 -1.0 2.0
   81    85    89    93   7.00000 -1.0 2.0
   82    81    85    86   0.00000  1.0 1.0
   82    81    85    89   1.00000 -1.0 2.0
   85    89    93    95   0.15800  1.0 1.0
   85    89    93    95   1.85350 -1.0 2.0
   85    89    93    95  -0.48700  1.0 3.0
   85    89    93   111   0.15800  1.0 1.0
   85    89    93   111   1.85350 -1.0 2.0
   85    89    93   111  -0.48700  1.0 3.0
   86    85    89    90   7.00000 -1.0 2.0
   86    85    89    93   7.00000 -1.0 2.0
   89    93    95    96   3.62500 -1.0 2.0
   89    93    95    99   3.62500 -1.0 2.0
   89    93   111   105   3.62500 -1.0 2.0
   89    93   111   112   3.62500 -1.0 2.0
   90    89    93    95   0.56550  1.0 3.0
   90    89    93   111   0.56550  1.0 3.0
   93    95    99   100   3.62500 -1.0 2.0
   93    95    99   103   3.62500 -1.0 2.0
   95    93   111   105   3.62500 -1.0 2.0
   95    93   111   112   3.62500 -1.0 2.0
   95    99  -103   105   3.62500 -1.0 2.0
   95    99   103   106   3.62500 -1.0 2.0
   96    95    99   100   3.62500 -1.0 2.0
   96    95    99   103   3.62500 -1.0 2.0
   99   103   105   111   3.62500 -1.0 2.0
   99   103   105   113   3.62500 -1.0 2.0
   99   103   106   107   0.84100 -1.0 2.0
  100    99   103   105   3.62500 -1.0 2.0
  100    99   103   106   3.62500 -1.0 2.0
  103   105  -111    93   3.62500 -1.0 2.0
  103   105   111   112   3.62500 -1.0 2.0
  103   105   113   114   0.84100 -1.0 2.0
  105   103   106   107   0.84100 -1.0 2.0
  111    93    95    96   3.62500 -1.0 2.0
  111    93   -95    99   3.62500 -1.0 2.0
  111   105   113   114   0.84100 -1.0 2.0
  113   105   111    93   3.62500 -1.0 2.0
  113   105   111   112   3.62500 -1.0 2.0
  106   103   105   111   3.62500 -1.0 2.0
  106   103   105   113   3.62500 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   41    64    38    33   4.00000 -1.0 2.0
   45    42    41    38   1.10000 -1.0 2.0
   48    46    45    41   1.10000 -1.0 2.0
   55    56    48    45   4.00000 -1.0 2.0
   64    66    55    48   4.00000 -1.0 2.0
   55    65    64    38   1.10000 -1.0 2.0
   33    40    39    43  15.00000 -1.0 2.0
   47    44    43    39  15.00000 -1.0 2.0
   52    43    47    49   1.00000 -1.0 2.0
   80    83    79    74   1.00000 -1.0 2.0
   79    87    83    84  10.50000 -1.0 2.0
   83    88    87    91  15.00000 -1.0 2.0
   94    92    91    87  15.00000 -1.0 2.0
   97   115    94    91   4.00000 -1.0 2.0
  101    98    97    94   1.10000 -1.0 2.0
  104   102   101    97   1.10000 -1.0 2.0
  108   109   104   101   4.00000 -1.0 2.0
  115   117   108   104   4.00000 -1.0 2.0
  108   116   115    94   1.10000 -1.0 2.0
   78    81    77    71   1.00000 -1.0 2.0
   77    85    81    82  10.50000 -1.0 2.0
   81    86    85    89  15.00000 -1.0 2.0
   93    90    89    85  15.00000 -1.0 2.0
   95   111    93    89   4.00000 -1.0 2.0
   99    96    95    93   1.10000 -1.0 2.0
  103   100    99    95   1.10000 -1.0 2.0
  105   106   103    99   4.00000 -1.0 2.0
  111   113   105   103   4.00000 -1.0 2.0
  105   112   111    93   1.10000 -1.0 2.0
END
