* LIGAND DATABASE FILE (OPLS2005)
*
001     116   121    236    396     723
    1     0 S   NP   _N1_     1    29.04379    94.04368   -19.11845
    2     1 S   H    _HN1     2     1.02956   103.99882    29.15629
    3     1 S   H    _H1_     3     1.02842    32.88403   128.98545
    4     1 S   H    _H2_     4     1.02778    78.28069   -77.06315
    5     1 S   CT   _CA1     5     1.50044   137.48493   172.72031
    6     5 S   HC   _HA1     6     1.09573   105.31236    35.47184
    7     5 S   CO3  _C1_     7     1.53767   112.43483   -84.89817
    8     7 S   O2Z  _O11     8     1.26372   115.02467   -45.07351
    9     7 S   O2Z  _O12     9     1.26230   114.76352   134.51110
   10     5 S   CT   _CB1    10     1.53067   107.51932   153.44147
   11    10 S   HC   HB11    11     1.09812   109.38908   -51.56935
   12    10 S   HC   HB12    12     1.09836   110.36754    64.96379
   13    10 S   CT   _CG1    13     1.53022   112.65214  -172.80860
   14    13 S   HC   HG11    14     1.09562   110.23880   -59.90527
   15    13 S   HC   HG12    15     1.09610   110.28478    59.26840
   16    13 S   C    _CD1    16     1.51743   112.00212   179.42427
   17    16 S   O    _OE1    17     1.22739   123.08820   -16.68160
   18    16 S   N    _N2_    18     1.38568   111.78705   164.01156
   19    18 S   H    _HN2    19     1.01587   119.06725     1.56486
   20    18 S   CT1  _CA2    20     1.46192   123.37588  -177.25655
   21    20 S   HC   _HA2    21     1.09736   109.36377   -16.43594
   22    20 S   C    _C2_    22     1.53403   108.14174  -132.17234
   23    22 S   O    _O2_    23     1.23003   122.31405  -144.88715
   24    20 S   CT   _CB2    32     1.53713   111.40082   105.72275
   25    24 S   HC   HB21    33     1.09230   109.16018    55.87691
   26    24 S   HC   HB22    34     1.09420   109.64749   174.19579
   27    22 S   N    _N3_    24     1.38530   113.28989    42.39513
   28    27 S   H    _HN3    25     1.01533   118.92279    -0.45370
   29    24 S   S    _SG2    35     1.83026   111.33660   -66.61841
   30    27 S   CT   _CA3    26     1.45446   123.38121   175.14651
   31    30 S   HC   HA31    27     1.09529   109.14385    25.94649
   32    30 S   HC   HA32    28     1.09494   107.13647   142.94228
   33    29 S   CT   _C27    36     1.87557   103.15677   161.76967
   34    30 S   CO3  _C3_    29     1.52939   113.21656   -97.46350
   35    34 S   O2Z  _O31    30     1.26396   115.46009   -42.99617
   36    34 S   O2Z  _O32    31     1.26364   114.94474   137.95591
   37    33 S   CT   _C28    37     1.53734   108.29847    61.80974
   38    37 S   HC   _H34    38     1.09096   114.42552   -39.80748
   39    37 S   HC   _H35    39     1.09364   113.17178  -164.44571
   40    33 S   CT   _C26    46     1.56621   112.74861   -64.13666
   41    40 S   HC   _H12    47     1.09717   104.55479    61.02394
   42    37 S   CO4  _C29    40     1.49943   103.57342    80.89921
   43    42 S   O    _O35    41     1.22080   125.58046  -162.05824
   44    40 S   CT   _C25    48     1.55574   112.86017   172.50881
   45    44 S   HC   _H32    49     1.09430   112.10000    29.88920
   46    44 S   HC   _H33    50     1.09584   111.41857   -89.95741
   47    42 S   OS   _O36    42     1.36317   109.62895    20.23777
   48    44 S   CT   _C24    51     1.52147   106.89440   149.12296
   49    48 S   HC   _H30    52     1.09413   110.02395    85.63464
   50    48 S   HC   _H31    53     1.09519   109.60057  -155.51815
   51    33 S   CT   _C30    43     1.53318   106.30592   168.54565
   52    51 S   HC   _H36    44     1.09286   114.48377    37.16477
   53    51 S   HC   _H37    45     1.09303   113.63177   161.26824
   54    48 S   CT   _C23    54     1.52972   103.35256   -34.92555
   55    54 S   CT   _C18    55     1.55506   114.65470   168.80398
   56    55 S   HC   _H10    56     1.09807   106.41169   171.46227
   57    54 S   OH   _O37   115     1.43752   106.11650   -71.94896
   58    57 S   HO   _H38   116     0.97207   108.36425  -172.86931
   59    55 S   CT   _C17    57     1.54186   111.68127    56.63621
   60    59 S   HC   _H24    58     1.09620   110.29350    57.40031
   61    59 S   HC   _H25    59     1.09661   110.02096   -60.07907
   62    55 S   CT   _C19    77     1.55260   113.35981   -70.13471
   63    62 S   HC   _H11    78     1.09964   107.24269    63.15683
   64    59 S   CT   _C16    60     1.52560   112.66745   179.04019
   65    64 S   HC   _H22    61     1.09709   108.60288   175.63655
   66    64 S   HC   _H23    62     1.09543   110.19465   -68.40529
   67    62 S   CT   _C20    79     1.53862   109.93723   -52.57399
   68    67 S   HC   _H26    80     1.09402   110.75195   -66.15259
   69    67 S   HC   _H27    81     1.09504   110.36206   176.17449
   70    64 S   CT   _C14    63     1.53103   110.71252    55.09238
   71    70 S   HC   _H9_    64     1.10166   105.96171    59.65100
   72    67 S   CT   _C21    82     1.52730   111.59986    56.59694
   73    72 S   HC   _H28    83     1.09793   107.41131    65.35483
   74    72 S   HC   _H29    84     1.09719   109.01399   179.16257
   75    70 S   CT   _C15    65     1.53319   111.64021   174.81125
   76    75 S   HC   _H20    66     1.09629   109.67983   -51.04768
   77    75 S   HC   _H21    67     1.09731   111.25996    65.17450
   78    40 S   CT   _C22    85     1.59607   123.32368   -60.52576
   79    75 S   CT   _C10    68     1.53170   110.60162  -171.98673
   80    79 S   HC   _H8_    69     1.09770   109.93684    63.87523
   81    78 S   CT   _C31    86     1.53836   117.07838     6.09461
   82    81 S   HC   _H39    87     1.08952   112.84068   -53.83646
   83    81 S   HC   _H40    88     1.09497   111.44299  -172.56468
   84    81 S   HC   _H41    89     1.09242   111.99200    69.10859
   85    79 S   CT   _C11    70     1.52812   110.84852   -55.82647
   86    85 S   HC   _H16    71     1.09665   109.48691   -71.74846
   87    85 S   HC   _H17    72     1.09760   109.16915   174.12037
   88    79 S   OS   _O34    93     1.43033   110.41994  -174.48694
   89    85 S   CT   _C12    73     1.53282   113.25522    52.05803
   90    89 S   HC   _H18    74     1.09799   108.20312    70.11217
   91    89 S   HC   _H19    75     1.09620   107.76529  -175.10491
   92    88 S   CO   _C9_    94     1.42974   114.06793   -84.46048
   93    92 S   HC   _H7_    95     1.09525   109.68714    49.93152
   94    70 S   CT   _C13    76     1.55507   113.00121   -57.37399
   95    92 S   CT   _C8_    96     1.53399   108.78957   168.45117
   96    95 S   HC   _H6_    97     1.09616   111.03503   -52.24716
   97    94 S   CO4  _C32    90     1.54020   110.69237   -64.03690
   98    97 S   O    _O38    91     1.22743   124.94948  -123.68389
   99    97 S   HC   _H42    92     1.10147   116.19098    57.08534
  100    95 S   CT   _C7_    98     1.53178   110.63551    69.23020
  101   100 S   HC   _H5_    99     1.09697   110.08195   -68.64432
  102    95 S   OH   _O39   113     1.42980   109.29521  -170.48143
  103   102 S   HO   _H43   114     0.97238   107.74179    60.48142
  104   100 S   CT   _C6_   100     1.53126   110.80635    52.62501
  105   104 S   HC   _H4_   101     1.09669   109.33652    70.16535
  106   100 S   OH   _O40   111     1.42725   110.43278   173.93279
  107   106 S   HO   _H44   112     0.97211   107.66259    52.97231
  108   104 S   CT   _C5_   102     1.53474   110.30509   -51.56049
  109   108 S   HC   _H3_   103     1.09764   110.20061   -67.14416
  110   104 S   OH   _O41   109     1.42770   109.83647  -172.85117
  111   110 S   HO   _H45   110     0.97229   108.07164    57.45528
  112    92 S   OS   _O33   104     1.43451   113.13926   -68.72669
  113   108 S   CT   _C4_   105     1.52567   111.49331   173.86713
  114   113 S   HC   _H13   106     1.09562   110.89885   -60.95249
  115   113 S   HC   _H14   107     1.09559   110.27910  -178.81982
  116   113 S   HC   _H15   108     1.09397   111.70942    60.52581
  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
  19   2   1   1  12   6   5  24   9   5   2  12   6   5   3  12
   5   4   3   1   1  20  21  10   6   1  13   6   5  20   8  11
   5   4  11   6   5  15   7   8   3   2  12   6   5   4  13   6
   3   2   1   1   9   6   5   9   6   3   2  13   6   3  12   7
   2   1   1  13   7   4   1  12   7   3   1   8   6   3   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    51    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    42    47    51    52    53    40    41    44    78  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    42    43    47    51    52    53    40    41    44    45    46    48    54    72    78    81  
   35    36  
   36  
    0  
   38    39    42    43    47    51    52    53    40    41    44    78  
   39    42    43    47    51    40  
   42    43    47    51    40  
   41    44    45    46    48    49    50    54    55    67    72    73    74    78    81    82    83    84    57    42    47    51    52    53  
   44    45    46    48    54    72    78    81    51  
   43    47    51    52    53  
   47    51  
   45    46    48    49    50    54    55    72    78    81    57    51  
   46    48    49    50    54    78  
   48    49    50    54    78  
   51    52    53  
   49    50    54    55    56    59    62    72    78    81    57    58  
   50    54    55    78    57  
   54    55    78    57  
   52    53    78  
   53  
    0  
   55    56    59    60    61    64    94    62    63    67    72    73    74    78    81    82    83    84    57    58  
   56    59    60    61    64    65    66    70    89    94    62    63    67    68    69    72    78    81    97    57    58  
   59    60    61    64    94    62    63    67    78    57  
   58    59    62    72    78    81  
   78  
   60    61    64    65    66    70    71    75    94    62    63    67    78  
   61    64    65    66    70    62  
   64    65    66    70    62  
   63    67    68    69    72    73    74    78    97    98    99    64    70    71    75    85    89    90    91    94  
   67    68    69    72    97    70    89    94  
   65    66    70    71    75    76    77    79    89    94    97  
   66    70    71    75    94  
   70    71    75    94  
   68    69    72    73    74    78    81    97    70    89    94  
   69    72    73    74    78    94  
   72    73    74    78    94  
   71    75    76    77    79    80    85    89    90    91    94    97    98    99    88  
   75    76    77    79    89    94    97  
   73    74    78    81    82    83    84    94  
   74    78    81  
   78    81  
   76    77    79    80    85    86    87    89    94    97    88    92  
   77    79    80    85    94    88  
   79    80    85    94    88  
   81    82    83    84  
   80    85    86    87    89    90    91    94    88    92    93    95   112  
   85    86    87    89    88    92  
   82    83    84  
   83    84  
   84  
    0  
   86    87    89    90    91    94    97    88    92  
   87    89    90    91    94    88  
   89    90    91    94    88  
   92    93    95    96   100   108   112   102    89  
   90    91    94    97    98    99  
   91    94    97  
   94    97  
   93    95    96   100   101   104   108   109   112   113   106   102   103  
   95    96   100   108   112   102  
   97    98    99  
   96   100   101   104   105   108   112   110   106   107   102   103  
  100   101   104   112   106   102   103  
   98    99  
   99  
    0  
  101   104   105   108   109   112   113   110   111   106   107   102   103  
  104   105   108   110   106   107   102  
  103   104   106   112  
    0  
  105   108   109   112   113   114   115   116   110   111   106   107  
  108   109   112   113   110   111   106  
  107   108   110  
    0  
  109   112   113   114   115   116   110   111  
  112   113   114   115   116   110  
  111   112   113  
    0  
  113   114   115   116  
  114   115   116  
  115   116  
  116  
    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   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   39   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   40   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   44   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   48   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   53   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   54   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   55   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   58   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   59   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   79   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   80   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   81   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   89   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   93   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   94   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   95   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   3.7500   0.1050   0.450000   2.1120   1.8750   0.001000000  -0.126889456
   98   2.9600   0.2100  -0.450000   1.6780   1.4800   0.001000000  -0.126889456
   99   2.4200   0.0150   0.000000   1.3810   1.2100   0.008598240   0.268726247
  100   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
  101   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  102   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  103   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  104   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
  105   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  107   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  108   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
  109   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  110   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  111   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  112   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
  113   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  114   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  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
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    51   268.000  1.529
   33    40   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    42   317.000  1.522
   42    43   570.000  1.229
   42    47   214.000  1.327
   47    51   320.000  1.410
   51    52   340.000  1.090
   51    53   340.000  1.090
   40    41   340.000  1.090
   40    44   268.000  1.529
   40    78   268.000  1.529
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    48   268.000  1.529
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    54   268.000  1.529
   54    55   268.000  1.529
   54    78   268.000  1.529
   54    57   320.000  1.410
   55    56   340.000  1.090
   55    59   268.000  1.529
   55    62   268.000  1.529
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    64   268.000  1.529
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    70   268.000  1.529
   70    71   340.000  1.090
   70    75   268.000  1.529
   70    94   268.000  1.529
   75    76   340.000  1.090
   75    77   340.000  1.090
   75    79   268.000  1.529
   79    80   340.000  1.090
   79    85   268.000  1.529
   79    88   320.000  1.410
   85    86   340.000  1.090
   85    87   340.000  1.090
   85    89   268.000  1.529
   89    90   340.000  1.090
   89    91   340.000  1.090
   89    94   268.000  1.529
   94    62   268.000  1.529
   94    97   317.000  1.522
   62    63   340.000  1.090
   62    67   268.000  1.529
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    72   268.000  1.529
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    78   268.000  1.529
   78    81   268.000  1.529
   81    82   340.000  1.090
   81    83   340.000  1.090
   81    84   340.000  1.090
   97    98   570.000  1.229
   97    99   340.000  1.090
   88    92   320.000  1.380
   92    93   340.000  1.090
   92    95   250.000  1.527
   92   112   320.000  1.380
   95    96   340.000  1.090
   95   100   268.000  1.529
   95   102   320.000  1.410
  100   101   340.000  1.090
  100   104   268.000  1.529
  100   106   320.000  1.410
  104   105   340.000  1.090
  104   108   268.000  1.529
  104   110   320.000  1.410
  108   109   340.000  1.090
  108   112   320.000  1.410
  108   113   268.000  1.529
  113   114   340.000  1.090
  113   115   340.000  1.090
  113   116   340.000  1.090
  110   111   553.000  0.945
  106   107   553.000  0.945
  102   103   553.000  0.945
   57    58   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    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    51    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    42    63.00000  111.10000
   33    51    47    50.00000  109.50000
   33    51    52    37.50000  110.70000
   33    51    53    37.50000  110.70000
   33    40    41    37.50000  110.70000
   33    40    44    58.35000  112.70000
   33    40    78    58.35000  112.70000
   37    42    43    80.00000  120.40000
   37    42    47    81.00000  111.40000
   39    37    38    33.00000  107.80000
   42    37    38    35.00000  109.50000
   42    37    39    35.00000  109.50000
   42    47    51    83.00000  116.90000
   47    42    43    83.00000  123.40000
   47    51    52    35.00000  109.50000
   47    51    53    35.00000  109.50000
   51    33    37    58.35000  112.70000
   53    51    52    33.00000  107.80000
   40    33    37    58.35000  112.70000
   40    33    51    58.35000  112.70000
   40    44    45    37.50000  110.70000
   40    44    46    37.50000  110.70000
   40    44    48    58.35000  112.70000
   40    78    54    58.35000  112.70000
   40    78    72    58.35000  112.70000
   40    78    81    58.35000  112.70000
   44    40    41    37.50000  110.70000
   44    48    49    37.50000  110.70000
   44    48    50    37.50000  110.70000
   44    48    54    58.35000  112.70000
   46    44    45    33.00000  107.80000
   48    44    45    37.50000  110.70000
   48    44    46    37.50000  110.70000
   48    54    55    58.35000  112.70000
   48    54    78    58.35000  112.70000
   48    54    57    50.00000  109.50000
   50    48    49    33.00000  107.80000
   54    48    49    37.50000  110.70000
   54    48    50    37.50000  110.70000
   54    55    56    37.50000  110.70000
   54    55    59    58.35000  112.70000
   54    55    62    58.35000  112.70000
   54    78    72    58.35000  112.70000
   54    78    81    58.35000  112.70000
   54    57    58    55.00000  108.50000
   55    59    60    37.50000  110.70000
   55    59    61    37.50000  110.70000
   55    59    64    58.35000  112.70000
   55    62    94    58.35000  112.70000
   55    62    63    37.50000  110.70000
   55    62    67    58.35000  112.70000
   59    55    56    37.50000  110.70000
   59    64    65    37.50000  110.70000
   59    64    66    37.50000  110.70000
   59    64    70    58.35000  112.70000
   61    59    60    33.00000  107.80000
   64    59    60    37.50000  110.70000
   64    59    61    37.50000  110.70000
   64    70    71    37.50000  110.70000
   64    70    75    58.35000  112.70000
   64    70    94    58.35000  112.70000
   66    64    65    33.00000  107.80000
   70    64    65    37.50000  110.70000
   70    64    66    37.50000  110.70000
   70    75    76    37.50000  110.70000
   70    75    77    37.50000  110.70000
   70    75    79    58.35000  112.70000
   70    94    89    58.35000  112.70000
   70    94    62    58.35000  112.70000
   70    94    97    63.00000  111.10000
   75    70    71    37.50000  110.70000
   75    79    80    37.50000  110.70000
   75    79    85    58.35000  112.70000
   75    79    88    50.00000  109.50000
   77    75    76    33.00000  107.80000
   79    75    76    37.50000  110.70000
   79    75    77    37.50000  110.70000
   79    85    86    37.50000  110.70000
   79    85    87    37.50000  110.70000
   79    85    89    58.35000  112.70000
   79    88    92    60.00000  109.50000
   85    79    80    37.50000  110.70000
   85    89    90    37.50000  110.70000
   85    89    91    37.50000  110.70000
   85    89    94    58.35000  112.70000
   87    85    86    33.00000  107.80000
   89    85    86    37.50000  110.70000
   89    85    87    37.50000  110.70000
   89    94    62    58.35000  112.70000
   89    94    97    63.00000  111.10000
   91    89    90    33.00000  107.80000
   94    70    71    37.50000  110.70000
   94    70    75    58.35000  112.70000
   94    89    90    37.50000  110.70000
   94    89    91    37.50000  110.70000
   94    62    63    37.50000  110.70000
   94    62    67    58.35000  112.70000
   94    97    98    80.00000  120.40000
   94    97    99    35.00000  115.00000
   62    55    56    37.50000  110.70000
   62    55    59    58.35000  112.70000
   62    67    68    37.50000  110.70000
   62    67    69    37.50000  110.70000
   62    67    72    58.35000  112.70000
   67    62    63    37.50000  110.70000
   67    72    73    37.50000  110.70000
   67    72    74    37.50000  110.70000
   67    72    78    58.35000  112.70000
   69    67    68    33.00000  107.80000
   72    67    68    37.50000  110.70000
   72    67    69    37.50000  110.70000
   72    78    81    58.35000  112.70000
   74    72    73    33.00000  107.80000
   78    40    41    37.50000  110.70000
   78    40    44    58.35000  112.70000
   78    54    55    58.35000  112.70000
   78    72    73    37.50000  110.70000
   78    72    74    37.50000  110.70000
   78    81    82    37.50000  110.70000
   78    81    83    37.50000  110.70000
   78    81    84    37.50000  110.70000
   83    81    82    33.00000  107.80000
   84    81    82    33.00000  107.80000
   84    81    83    33.00000  107.80000
   97    94    62    63.00000  111.10000
   99    97    98    35.00000  123.00000
   88    79    80    35.00000  109.50000
   88    79    85    50.00000  109.50000
   88    92    93    35.00000  109.50000
   88    92    95    90.00000  108.56700
   88    92   112    92.60000  111.55000
   92    95    96    45.00000  108.72000
   92    95   100    75.00000  109.43000
   92    95   102    90.00000  111.58700
   92   112   108    60.00000  109.50000
   95    92    93    45.00000  112.01100
   95   100   101    37.50000  110.70000
   95   100   104    58.35000  112.70000
   95   100   106    50.00000  109.50000
   95   102   103    55.00000  108.50000
  100    95    96    37.50000  110.70000
  100   104   105    37.50000  110.70000
  100   104   108    58.35000  112.70000
  100   104   110    50.00000  109.50000
  100   106   107    55.00000  108.50000
  104   100   101    37.50000  110.70000
  104   108   109    37.50000  110.70000
  104   108   112    50.00000  109.50000
  104   108   113    58.35000  112.70000
  104   110   111    55.00000  108.50000
  108   104   105    37.50000  110.70000
  108   113   114    37.50000  110.70000
  108   113   115    37.50000  110.70000
  108   113   116    37.50000  110.70000
  112    92    93    35.00000  109.50000
  112    92    95    90.00000  108.56700
  112   108   109    35.00000  109.50000
  113   108   109    37.50000  110.70000
  113   108   112    50.00000  109.50000
  115   113   114    33.00000  107.80000
  116   113   114    33.00000  107.80000
  116   113   115    33.00000  107.80000
  110   104   105    35.00000  109.50000
  110   104   108    50.00000  109.50000
  106   100   101    35.00000  109.50000
  106   100   104    50.00000  109.50000
  102    95    96    35.00000  109.50000
  102    95   100    50.00000  109.50000
   57    54    55    50.00000  109.50000
   57    54    78    50.00000  109.50000
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    51   0.01700  1.0 1.0
   24    29    33    51  -0.23550 -1.0 2.0
   24    29    33    51   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    42   0.56750  1.0 1.0
   29    33    37    42  -0.07550 -1.0 2.0
   29    33    37    42   0.20000  1.0 3.0
   29    33    51    47   0.56750  1.0 1.0
   29    33    51    47  -0.07550 -1.0 2.0
   29    33    51    47   0.20000  1.0 3.0
   29    33    51    52   0.15000  1.0 3.0
   29    33    51    53   0.15000  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    44   0.44750  1.0 1.0
   29    33    40    44  -0.17800 -1.0 2.0
   29    33    40    44   0.20200  1.0 3.0
   29    33    40    78   0.44750  1.0 1.0
   29    33    40    78  -0.17800 -1.0 2.0
   29    33    40    78   0.20200  1.0 3.0
   33    37    42    43   0.30150 -1.0 2.0
   33    37   -42    47   0.36750  1.0 3.0
   33    40    44    45   0.15000  1.0 3.0
   33    40    44    46   0.15000  1.0 3.0
   33    40    44    48   0.56750  1.0 1.0
   33    40    44    48  -0.07550 -1.0 2.0
   33    40    44    48   0.20000  1.0 3.0
   33    40    78    54   0.56750  1.0 1.0
   33    40    78    54  -0.07550 -1.0 2.0
   33    40    78    54   0.20000  1.0 3.0
   33    40    78    72   0.56750  1.0 1.0
   33    40    78    72  -0.07550 -1.0 2.0
   33    40    78    72   0.20000  1.0 3.0
   33    40    78    81   0.56750  1.0 1.0
   33    40    78    81  -0.07550 -1.0 2.0
   33    40    78    81   0.20000  1.0 3.0
   37    33   -51    47   0.62750  1.0 1.0
   37    33   -51    47  -0.30950 -1.0 2.0
   37    33   -51    47   0.27300  1.0 3.0
   37    33    51    52   0.15000  1.0 3.0
   37    33    51    53   0.15000  1.0 3.0
   37    33    40    41   0.15000  1.0 3.0
   37    33    40    44   0.56750  1.0 1.0
   37    33    40    44  -0.07550 -1.0 2.0
   37    33    40    44   0.20000  1.0 3.0
   37    33    40    78   0.56750  1.0 1.0
   37    33    40    78  -0.07550 -1.0 2.0
   37    33    40    78   0.20000  1.0 3.0
   37    42   -47    51   1.63150  1.0 1.0
   37    42   -47    51   2.92000 -1.0 2.0
   38    37    42    43   0.00000  1.0 1.0
   38    37    42    47   0.00000  1.0 1.0
   39    37    42    43   0.00000  1.0 1.0
   39    37    42    47   0.00000  1.0 1.0
   42    47   -51    33  -0.25900  1.0 1.0
   42    47   -51    33  -0.47000 -1.0 2.0
   42    47   -51    33   0.11750  1.0 3.0
   42    47    51    52   0.08050  1.0 3.0
   42    47    51    53   0.08050  1.0 3.0
   43    42    47    51   3.00000 -1.0 2.0
   51    33    37    38   0.15000  1.0 3.0
   51    33    37    39   0.15000  1.0 3.0
   51    33   -37    42  -0.95700  1.0 1.0
   51    33   -37    42  -0.18200 -1.0 2.0
   51    33   -37    42   0.29450  1.0 3.0
   51    33    40    41   0.15000  1.0 3.0
   51    33    40    44   0.56750  1.0 1.0
   51    33    40    44  -0.07550 -1.0 2.0
   51    33    40    44   0.20000  1.0 3.0
   51    33    40    78   0.56750  1.0 1.0
   51    33    40    78  -0.07550 -1.0 2.0
   51    33    40    78   0.20000  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    42  -0.95700  1.0 1.0
   40    33    37    42  -0.18200 -1.0 2.0
   40    33    37    42   0.29450  1.0 3.0
   40    33    51    47   0.62750  1.0 1.0
   40    33    51    47  -0.30950 -1.0 2.0
   40    33    51    47   0.27300  1.0 3.0
   40    33    51    52   0.15000  1.0 3.0
   40    33    51    53   0.15000  1.0 3.0
   40    44    48    49   0.15000  1.0 3.0
   40    44    48    50   0.15000  1.0 3.0
   40    44   -48    54   0.56750  1.0 1.0
   40    44   -48    54  -0.07550 -1.0 2.0
   40    44   -48    54   0.20000  1.0 3.0
   40    78    81    82   0.15000  1.0 3.0
   40    78    81    83   0.15000  1.0 3.0
   40    78    81    84   0.15000  1.0 3.0
   41    40    44    45   0.15000  1.0 3.0
   41    40    44    46   0.15000  1.0 3.0
   41    40    44    48   0.15000  1.0 3.0
   41    40    78    54   0.15000  1.0 3.0
   41    40    78    72   0.15000  1.0 3.0
   41    40    78    81   0.15000  1.0 3.0
   44    40   -78    54   0.56750  1.0 1.0
   44    40   -78    54  -0.07550 -1.0 2.0
   44    40   -78    54   0.20000  1.0 3.0
   44    40    78    72   0.56750  1.0 1.0
   44    40    78    72  -0.07550 -1.0 2.0
   44    40    78    72   0.20000  1.0 3.0
   44    40    78    81   0.56750  1.0 1.0
   44    40    78    81  -0.07550 -1.0 2.0
   44    40    78    81   0.20000  1.0 3.0
   44    48    54    55   0.56750  1.0 1.0
   44    48    54    55  -0.07550 -1.0 2.0
   44    48    54    55   0.20000  1.0 3.0
   44    48   -54    78   0.56750  1.0 1.0
   44    48   -54    78  -0.07550 -1.0 2.0
   44    48   -54    78   0.20000  1.0 3.0
   44    48    54    57   0.86500  1.0 1.0
   44    48    54    57  -0.17500 -1.0 2.0
   44    48    54    57   0.20800  1.0 3.0
   45    44    48    49   0.15000  1.0 3.0
   45    44    48    50   0.15000  1.0 3.0
   45    44    48    54   0.15000  1.0 3.0
   46    44    48    49   0.15000  1.0 3.0
   46    44    48    50   0.15000  1.0 3.0
   46    44    48    54   0.15000  1.0 3.0
   48    54    55    56   0.15000  1.0 3.0
   48    54    55    59   0.56750  1.0 1.0
   48    54    55    59  -0.07550 -1.0 2.0
   48    54    55    59   0.20000  1.0 3.0
   48    54    55    62   0.56750  1.0 1.0
   48    54    55    62  -0.07550 -1.0 2.0
   48    54    55    62   0.20000  1.0 3.0
   48    54   -78    40   0.56750  1.0 1.0
   48    54   -78    40  -0.07550 -1.0 2.0
   48    54   -78    40   0.20000  1.0 3.0
   48    54    78    72   0.56750  1.0 1.0
   48    54    78    72  -0.07550 -1.0 2.0
   48    54    78    72   0.20000  1.0 3.0
   48    54    78    81   0.56750  1.0 1.0
   48    54    78    81  -0.07550 -1.0 2.0
   48    54    78    81   0.20000  1.0 3.0
   48    54    57    58  -0.11600  1.0 1.0
   48    54    57    58  -0.09450 -1.0 2.0
   48    54    57    58   0.21250  1.0 3.0
   49    48    54    55   0.15000  1.0 3.0
   49    48    54    78   0.15000  1.0 3.0
   49    48    54    57   0.23400  1.0 3.0
   50    48    54    55   0.15000  1.0 3.0
   50    48    54    78   0.15000  1.0 3.0
   50    48    54    57   0.23400  1.0 3.0
   54    55    59    60   0.15000  1.0 3.0
   54    55    59    61   0.15000  1.0 3.0
   54    55    59    64   0.56750  1.0 1.0
   54    55    59    64  -0.07550 -1.0 2.0
   54    55    59    64   0.20000  1.0 3.0
   54    55    62    94   0.56750  1.0 1.0
   54    55    62    94  -0.07550 -1.0 2.0
   54    55    62    94   0.20000  1.0 3.0
   54    55    62    63   0.15000  1.0 3.0
   54    55    62    67   0.56750  1.0 1.0
   54    55    62    67  -0.07550 -1.0 2.0
   54    55    62    67   0.20000  1.0 3.0
   54    78    81    82   0.15000  1.0 3.0
   54    78    81    83   0.15000  1.0 3.0
   54    78    81    84   0.15000  1.0 3.0
   55    54    78    40   0.56750  1.0 1.0
   55    54    78    40  -0.07550 -1.0 2.0
   55    54    78    40   0.20000  1.0 3.0
   55    54    78    72   0.56750  1.0 1.0
   55    54    78    72  -0.07550 -1.0 2.0
   55    54    78    72   0.20000  1.0 3.0
   55    54    78    81   0.56750  1.0 1.0
   55    54    78    81  -0.07550 -1.0 2.0
   55    54    78    81   0.20000  1.0 3.0
   55    54    57    58  -0.11600  1.0 1.0
   55    54    57    58  -0.09450 -1.0 2.0
   55    54    57    58   0.21250  1.0 3.0
   55    59    64    65   0.15000  1.0 3.0
   55    59    64    66   0.15000  1.0 3.0
   55    59    64    70   0.56750  1.0 1.0
   55    59    64    70  -0.07550 -1.0 2.0
   55    59    64    70   0.20000  1.0 3.0
   55    62    67    68   0.15000  1.0 3.0
   55    62    67    69   0.15000  1.0 3.0
   55    62   -67    72   0.56750  1.0 1.0
   55    62   -67    72  -0.07550 -1.0 2.0
   55    62   -67    72   0.20000  1.0 3.0
   56    55    59    60   0.15000  1.0 3.0
   56    55    59    61   0.15000  1.0 3.0
   56    55    59    64   0.15000  1.0 3.0
   56    55    62    94   0.15000  1.0 3.0
   56    55    62    63   0.15000  1.0 3.0
   56    55    62    67   0.15000  1.0 3.0
   59    55    62    94   0.56750  1.0 1.0
   59    55    62    94  -0.07550 -1.0 2.0
   59    55    62    94   0.20000  1.0 3.0
   59    55    62    63   0.15000  1.0 3.0
   59    55    62    67   0.56750  1.0 1.0
   59    55    62    67  -0.07550 -1.0 2.0
   59    55    62    67   0.20000  1.0 3.0
   59    64    70    71   0.15000  1.0 3.0
   59    64    70    75   0.56750  1.0 1.0
   59    64    70    75  -0.07550 -1.0 2.0
   59    64    70    75   0.20000  1.0 3.0
   59    64   -70    94   0.56750  1.0 1.0
   59    64   -70    94  -0.07550 -1.0 2.0
   59    64   -70    94   0.20000  1.0 3.0
   60    59    64    65   0.15000  1.0 3.0
   60    59    64    66   0.15000  1.0 3.0
   60    59    64    70   0.15000  1.0 3.0
   61    59    64    65   0.15000  1.0 3.0
   61    59    64    66   0.15000  1.0 3.0
   61    59    64    70   0.15000  1.0 3.0
   64    70    75    76   0.15000  1.0 3.0
   64    70    75    77   0.15000  1.0 3.0
   64    70    75    79   0.56750  1.0 1.0
   64    70    75    79  -0.07550 -1.0 2.0
   64    70    75    79   0.20000  1.0 3.0
   64    70    94    89   0.56750  1.0 1.0
   64    70    94    89  -0.07550 -1.0 2.0
   64    70    94    89   0.20000  1.0 3.0
   64    70    94    62   0.56750  1.0 1.0
   64    70    94    62  -0.07550 -1.0 2.0
   64    70    94    62   0.20000  1.0 3.0
   64    70    94    97  -0.95700  1.0 1.0
   64    70    94    97  -0.18200 -1.0 2.0
   64    70    94    97   0.29450  1.0 3.0
   65    64    70    71   0.15000  1.0 3.0
   65    64    70    75   0.15000  1.0 3.0
   65    64    70    94   0.15000  1.0 3.0
   66    64    70    71   0.15000  1.0 3.0
   66    64    70    75   0.15000  1.0 3.0
   66    64    70    94   0.15000  1.0 3.0
   70    75    79    80   0.15000  1.0 3.0
   70    75    79    85   0.56750  1.0 1.0
   70    75    79    85  -0.07550 -1.0 2.0
   70    75    79    85   0.20000  1.0 3.0
   70    75    79    88   0.62750  1.0 1.0
   70    75    79    88  -0.30950 -1.0 2.0
   70    75    79    88   0.27300  1.0 3.0
   70    94   -62    55   0.56750  1.0 1.0
   70    94   -62    55  -0.07550 -1.0 2.0
   70    94   -62    55   0.20000  1.0 3.0
   70    94    62    63   0.15000  1.0 3.0
   70    94    62    67   0.56750  1.0 1.0
   70    94    62    67  -0.07550 -1.0 2.0
   70    94    62    67   0.20000  1.0 3.0
   70    94    97    98   0.30150 -1.0 2.0
   70    94    97    99   0.74550  1.0 1.0
   70    94    97    99  -0.00500 -1.0 2.0
   71    70    75    76   0.15000  1.0 3.0
   71    70    75    77   0.15000  1.0 3.0
   71    70    75    79   0.15000  1.0 3.0
   71    70    94    89   0.15000  1.0 3.0
   71    70    94    62   0.15000  1.0 3.0
   71    70    94    97  -0.11250  1.0 3.0
   75    70    94    89   0.56750  1.0 1.0
   75    70    94    89  -0.07550 -1.0 2.0
   75    70    94    89   0.20000  1.0 3.0
   75    70    94    62   0.56750  1.0 1.0
   75    70    94    62  -0.07550 -1.0 2.0
   75    70    94    62   0.20000  1.0 3.0
   75    70    94    97  -0.95700  1.0 1.0
   75    70    94    97  -0.18200 -1.0 2.0
   75    70    94    97   0.29450  1.0 3.0
   75    79    85    86   0.15000  1.0 3.0
   75    79    85    87   0.15000  1.0 3.0
   75    79   -85    89   0.56750  1.0 1.0
   75    79   -85    89  -0.07550 -1.0 2.0
   75    79   -85    89   0.20000  1.0 3.0
   75    79    88    92   0.06250  1.0 1.0
   75    79    88    92  -0.01100 -1.0 2.0
   75    79    88    92   0.28050  1.0 3.0
   76    75    79    80   0.15000  1.0 3.0
   76    75    79    85   0.15000  1.0 3.0
   76    75    79    88   0.23400  1.0 3.0
   77    75    79    80   0.15000  1.0 3.0
   77    75    79    85   0.15000  1.0 3.0
   77    75    79    88   0.23400  1.0 3.0
   79    85    89    90   0.15000  1.0 3.0
   79    85    89    91   0.15000  1.0 3.0
   79    85    89    94   0.56750  1.0 1.0
   79    85    89    94  -0.07550 -1.0 2.0
   79    85    89    94   0.20000  1.0 3.0
   79    88    92    93   0.37050  1.0 3.0
   79    88    92    95   0.06250  1.0 1.0
   79    88    92    95  -0.01100 -1.0 2.0
   79    88    92    95   0.28050  1.0 3.0
   79    88    92   112  -0.53350  1.0 1.0
   79    88    92   112  -0.78350 -1.0 2.0
   79    88    92   112   0.33750  1.0 3.0
   80    79    85    86   0.15000  1.0 3.0
   80    79    85    87   0.15000  1.0 3.0
   80    79    85    89   0.15000  1.0 3.0
   80    79    88    92   0.37050  1.0 3.0
   85    79    88    92   0.06250  1.0 1.0
   85    79    88    92  -0.01100 -1.0 2.0
   85    79    88    92   0.28050  1.0 3.0
   85    89   -94    70   0.56750  1.0 1.0
   85    89   -94    70  -0.07550 -1.0 2.0
   85    89   -94    70   0.20000  1.0 3.0
   85    89    94    62   0.56750  1.0 1.0
   85    89    94    62  -0.07550 -1.0 2.0
   85    89    94    62   0.20000  1.0 3.0
   85    89    94    97  -0.95700  1.0 1.0
   85    89    94    97  -0.18200 -1.0 2.0
   85    89    94    97   0.29450  1.0 3.0
   86    85    89    90   0.15000  1.0 3.0
   86    85    89    91   0.15000  1.0 3.0
   86    85    89    94   0.15000  1.0 3.0
   87    85    89    90   0.15000  1.0 3.0
   87    85    89    91   0.15000  1.0 3.0
   87    85    89    94   0.15000  1.0 3.0
   89    94    62    55   0.56750  1.0 1.0
   89    94    62    55  -0.07550 -1.0 2.0
   89    94    62    55   0.20000  1.0 3.0
   89    94    62    63   0.15000  1.0 3.0
   89    94    62    67   0.56750  1.0 1.0
   89    94    62    67  -0.07550 -1.0 2.0
   89    94    62    67   0.20000  1.0 3.0
   89    94    97    98   0.30150 -1.0 2.0
   89    94    97    99   0.74550  1.0 1.0
   89    94    97    99  -0.00500 -1.0 2.0
   90    89    94    70   0.15000  1.0 3.0
   90    89    94    62   0.15000  1.0 3.0
   90    89    94    97  -0.11250  1.0 3.0
   91    89    94    70   0.15000  1.0 3.0
   91    89    94    62   0.15000  1.0 3.0
   91    89    94    97  -0.11250  1.0 3.0
   94    70    75    76   0.15000  1.0 3.0
   94    70    75    77   0.15000  1.0 3.0
   94    70   -75    79   0.56750  1.0 1.0
   94    70   -75    79  -0.07550 -1.0 2.0
   94    70   -75    79   0.20000  1.0 3.0
   94    62    67    68   0.15000  1.0 3.0
   94    62    67    69   0.15000  1.0 3.0
   94    62    67    72   0.56750  1.0 1.0
   94    62    67    72  -0.07550 -1.0 2.0
   94    62    67    72   0.20000  1.0 3.0
   62    55    59    60   0.15000  1.0 3.0
   62    55    59    61   0.15000  1.0 3.0
   62    55   -59    64   0.56750  1.0 1.0
   62    55   -59    64  -0.07550 -1.0 2.0
   62    55   -59    64   0.20000  1.0 3.0
   62    94    97    98   0.30150 -1.0 2.0
   62    94    97    99   0.74550  1.0 1.0
   62    94    97    99  -0.00500 -1.0 2.0
   62    67    72    73   0.15000  1.0 3.0
   62    67    72    74   0.15000  1.0 3.0
   62    67    72    78   0.56750  1.0 1.0
   62    67    72    78  -0.07550 -1.0 2.0
   62    67    72    78   0.20000  1.0 3.0
   63    62    67    68   0.15000  1.0 3.0
   63    62    67    69   0.15000  1.0 3.0
   63    62    67    72   0.15000  1.0 3.0
   67    72    78    40   0.56750  1.0 1.0
   67    72    78    40  -0.07550 -1.0 2.0
   67    72    78    40   0.20000  1.0 3.0
   67    72   -78    54   0.56750  1.0 1.0
   67    72   -78    54  -0.07550 -1.0 2.0
   67    72   -78    54   0.20000  1.0 3.0
   67    72    78    81   0.56750  1.0 1.0
   67    72    78    81  -0.07550 -1.0 2.0
   67    72    78    81   0.20000  1.0 3.0
   68    67    72    73   0.15000  1.0 3.0
   68    67    72    74   0.15000  1.0 3.0
   68    67    72    78   0.15000  1.0 3.0
   69    67    72    73   0.15000  1.0 3.0
   69    67    72    74   0.15000  1.0 3.0
   69    67    72    78   0.15000  1.0 3.0
   72    78    81    82   0.15000  1.0 3.0
   72    78    81    83   0.15000  1.0 3.0
   72    78    81    84   0.15000  1.0 3.0
   73    72    78    40   0.15000  1.0 3.0
   73    72    78    54   0.15000  1.0 3.0
   73    72    78    81   0.15000  1.0 3.0
   74    72    78    40   0.15000  1.0 3.0
   74    72    78    54   0.15000  1.0 3.0
   74    72    78    81   0.15000  1.0 3.0
   78    40    44    45   0.15000  1.0 3.0
   78    40    44    46   0.15000  1.0 3.0
   78    40   -44    48   0.56750  1.0 1.0
   78    40   -44    48  -0.07550 -1.0 2.0
   78    40   -44    48   0.20000  1.0 3.0
   78    54    55    56   0.15000  1.0 3.0
   78    54    55    59   0.56750  1.0 1.0
   78    54    55    59  -0.07550 -1.0 2.0
   78    54    55    59   0.20000  1.0 3.0
   78    54   -55    62   0.56750  1.0 1.0
   78    54   -55    62  -0.07550 -1.0 2.0
   78    54   -55    62   0.20000  1.0 3.0
   78    54    57    58  -0.11600  1.0 1.0
   78    54    57    58  -0.09450 -1.0 2.0
   78    54    57    58   0.21250  1.0 3.0
   97    94    62    55  -0.95700  1.0 1.0
   97    94    62    55  -0.18200 -1.0 2.0
   97    94    62    55   0.29450  1.0 3.0
   97    94    62    63  -0.11250  1.0 3.0
   97    94    62    67  -0.95700  1.0 1.0
   97    94    62    67  -0.18200 -1.0 2.0
   97    94    62    67   0.29450  1.0 3.0
   88    79    85    86   0.23400  1.0 3.0
   88    79    85    87   0.23400  1.0 3.0
   88    79    85    89   0.62750  1.0 1.0
   88    79    85    89  -0.30950 -1.0 2.0
   88    79    85    89   0.27300  1.0 3.0
   88    92    95    96   0.23400  1.0 3.0
   88    92    95   100   0.62750  1.0 1.0
   88    92    95   100  -0.30950 -1.0 2.0
   88    92    95   100   0.27300  1.0 3.0
   88    92    95   102   3.69350  1.0 1.0
   88    92    95   102  -1.82950 -1.0 2.0
   88    92   112   108  -0.81800  1.0 1.0
   92    95   100   101   0.15000  1.0 3.0
   92    95   100   104   3.97050  1.0 1.0
   92    95   100   106   0.86500  1.0 1.0
   92    95   100   106  -0.17500 -1.0 2.0
   92    95   100   106   0.20800  1.0 3.0
   92    95   102   103  -0.11600  1.0 1.0
   92    95   102   103  -0.09450 -1.0 2.0
   92    95   102   103   0.21250  1.0 3.0
   93    92    95    96   0.15000  1.0 3.0
   93    92    95   100   0.15000  1.0 3.0
   93    92    95   102   0.23400  1.0 3.0
   93    92   112   108   0.37050  1.0 3.0
   95    92   112   108   0.06250  1.0 1.0
   95    92   112   108  -0.01100 -1.0 2.0
   95    92   112   108   0.28050  1.0 3.0
   95   100   104   105   0.15000  1.0 3.0
   95   100  -104   108   0.56750  1.0 1.0
   95   100  -104   108  -0.07550 -1.0 2.0
   95   100  -104   108   0.20000  1.0 3.0
   95   100   104   110   0.86500  1.0 1.0
   95   100   104   110  -0.17500 -1.0 2.0
   95   100   104   110   0.20800  1.0 3.0
   95   100   106   107  -0.11600  1.0 1.0
   95   100   106   107  -0.09450 -1.0 2.0
   95   100   106   107   0.21250  1.0 3.0
   96    95   100   101   0.15000  1.0 3.0
   96    95   100   104   0.15000  1.0 3.0
   96    95   100   106   0.23400  1.0 3.0
   96    95   102   103   0.19450  1.0 3.0
  100    95   102   103  -0.11600  1.0 1.0
  100    95   102   103  -0.09450 -1.0 2.0
  100    95   102   103   0.21250  1.0 3.0
  100   104   108   109   0.15000  1.0 3.0
  100   104   108   112   0.62750  1.0 1.0
  100   104   108   112  -0.30950 -1.0 2.0
  100   104   108   112   0.27300  1.0 3.0
  100   104   108   113   0.56750  1.0 1.0
  100   104   108   113  -0.07550 -1.0 2.0
  100   104   108   113   0.20000  1.0 3.0
  100   104   110   111  -0.11600  1.0 1.0
  100   104   110   111  -0.09450 -1.0 2.0
  100   104   110   111   0.21250  1.0 3.0
  101   100   104   105   0.15000  1.0 3.0
  101   100   104   108   0.15000  1.0 3.0
  101   100   104   110   0.23400  1.0 3.0
  101   100   106   107   0.19450  1.0 3.0
  104   100   106   107  -0.11600  1.0 1.0
  104   100   106   107  -0.09450 -1.0 2.0
  104   100   106   107   0.21250  1.0 3.0
  104   108  -112    92   0.06250  1.0 1.0
  104   108  -112    92  -0.01100 -1.0 2.0
  104   108  -112    92   0.28050  1.0 3.0
  104   108   113   114   0.15000  1.0 3.0
  104   108   113   115   0.15000  1.0 3.0
  104   108   113   116   0.15000  1.0 3.0
  105   104   108   109   0.15000  1.0 3.0
  105   104   108   112   0.23400  1.0 3.0
  105   104   108   113   0.15000  1.0 3.0
  105   104   110   111   0.19450  1.0 3.0
  108   104   110   111  -0.11600  1.0 1.0
  108   104   110   111  -0.09450 -1.0 2.0
  108   104   110   111   0.21250  1.0 3.0
  109   108   112    92   0.37050  1.0 3.0
  109   108   113   114   0.15000  1.0 3.0
  109   108   113   115   0.15000  1.0 3.0
  109   108   113   116   0.15000  1.0 3.0
  112    92    95    96   0.23400  1.0 3.0
  112    92   -95   100   0.62750  1.0 1.0
  112    92   -95   100  -0.30950 -1.0 2.0
  112    92   -95   100   0.27300  1.0 3.0
  112    92    95   102   3.69350  1.0 1.0
  112    92    95   102  -1.82950 -1.0 2.0
  112   108   113   114   0.23400  1.0 3.0
  112   108   113   115   0.23400  1.0 3.0
  112   108   113   116   0.23400  1.0 3.0
  113   108   112    92   0.06250  1.0 1.0
  113   108   112    92  -0.01100 -1.0 2.0
  113   108   112    92   0.28050  1.0 3.0
  110   104   108   109   0.23400  1.0 3.0
  110   104   108   112   3.69350  1.0 1.0
  110   104   108   112  -1.82950 -1.0 2.0
  110   104   108   113   0.86500  1.0 1.0
  110   104   108   113  -0.17500 -1.0 2.0
  110   104   108   113   0.20800  1.0 3.0
  106   100   104   105   0.23400  1.0 3.0
  106   100   104   108   0.86500  1.0 1.0
  106   100   104   108  -0.17500 -1.0 2.0
  106   100   104   108   0.20800  1.0 3.0
  106   100   104   110   3.75450  1.0 1.0
  102    95   100   101   0.23400  1.0 3.0
  102    95   100   104   0.86500  1.0 1.0
  102    95   100   104  -0.17500 -1.0 2.0
  102    95   100   104   0.20800  1.0 3.0
  102    95   100   106   3.75450  1.0 1.0
   57    54    55    56   0.23400  1.0 3.0
   57    54    55    59   0.86500  1.0 1.0
   57    54    55    59  -0.17500 -1.0 2.0
   57    54    55    59   0.20800  1.0 3.0
   57    54    55    62   0.86500  1.0 1.0
   57    54    55    62  -0.17500 -1.0 2.0
   57    54    55    62   0.20800  1.0 3.0
   57    54    78    40   0.86500  1.0 1.0
   57    54    78    40  -0.17500 -1.0 2.0
   57    54    78    40   0.20800  1.0 3.0
   57    54    78    72   0.86500  1.0 1.0
   57    54    78    72  -0.17500 -1.0 2.0
   57    54    78    72   0.20800  1.0 3.0
   57    54    78    81   0.86500  1.0 1.0
   57    54    78    81  -0.17500 -1.0 2.0
   57    54    78    81   0.20800  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   37    47    42    43  10.50000 -1.0 2.0
   94    99    97    98  10.50000 -1.0 2.0
END
