* LIGAND DATABASE FILE (OPLS2005)
*
001     105   105    187    275     543
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02098    90.78728    39.15793
    3     1 S   H    _H1_     3     1.02054    32.89643   163.85196
    4     1 S   H    _H2_     4     1.02067    89.75079   -69.52123
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08611   110.49349    58.84143
   26    24 S   HC   HB22    34     1.08575   109.90351   179.01802
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CM   _C24    36     1.72889    99.66308  -178.18792
   34    33 S   HC   _H29    37     1.08496   113.94658     1.21225
   35    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   36    35 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   37    35 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   38    33 S   CM   _C23    38     1.34792   126.76780   179.95154
   39    38 S   CT   _C25    39     1.51921   124.61964     1.53735
   40    39 S   HC   _H30    40     1.09473   111.18914    29.96866
   41    39 S   HC   _H31    41     1.09720   109.11707   144.51052
   42    38 S   CT   _C22    51     1.52395   121.38252  -178.17758
   43    42 S   HC   _H27    52     1.09688   109.31995   120.03828
   44    42 S   HC   _H28    53     1.09805   107.58172     6.30413
   45    39 S   CT   _C26    42     1.53377   111.84881   -94.13072
   46    45 S   HC   _H32    43     1.09793   109.15988   -59.99967
   47    45 S   HC   _H33    44     1.09739   109.94588    56.79986
   48    42 S   CT   _C21    54     1.54093   118.18706  -116.73469
   49    48 S   HC   _H25    55     1.09670   109.53687   179.93744
   50    48 S   HC   _H26    56     1.09908   107.58237   -65.81175
   51    45 S   CT   _C27    45     1.52930   112.67756   179.78060
   52    51 S   HC   _H34    46     1.09624   110.09704    63.74609
   53    51 S   HC   _H35    47     1.09720   108.73276  -179.59170
   54    48 S   CT   _C19    57     1.54419   115.27715    56.19717
   55    54 S   HC   _H4_    58     1.09730   108.80113   -57.37288
   56    51 S   CZ   _C28    48     1.46948   112.10188   -59.22576
   57    54 S   CM   _C18    59     1.50868   111.95163    63.87426
   58    57 S   HC   _H21    60     1.08763   117.21394    60.13957
   59    54 S   CT   _C20   102     1.53065   109.85924  -174.16820
   60    59 S   HC   _H22   103     1.09614   111.61349   -62.08976
   61    59 S   HC   _H23   104     1.09540   111.02961    58.33819
   62    59 S   HC   _H24   105     1.09619   110.65528   177.78071
   63    56 S   CZ   _C29    49     1.20010   179.54716    49.37212
   64    63 S   Br   Br1_    50     1.89877   179.46368    10.66132
   65    57 S   CM   _C17    61     1.34250   123.42873  -120.81633
   66    65 S   HC   _H20    62     1.08736   119.11437     0.82898
   67    65 S   CT   _C16    63     1.50206   123.99437  -179.14499
   68    67 S   HC   _H18    64     1.09696   108.72368     0.00000
   69    67 S   HC   _H19    65     1.09697   110.11045   116.36030
   70    67 S   CT   _C15    66     1.52845   112.12706  -122.59393
   71    70 S   HC   _H16    67     1.09678   110.16879   -60.03380
   72    70 S   HC   _H17    68     1.09718   108.91099  -177.48783
   73    70 S   C    _C14    69     1.52042   113.90001    63.39163
   74    73 S   O    _O35    70     1.22770   123.28312     1.41250
   75    73 S   N    _N5_    71     1.38689   111.87077  -179.98022
   76    75 S   H    _H15    72     1.01595   119.05631     1.39409
   77    75 S   CT   _C13    73     1.44290   121.95686  -178.56988
   78    77 S   HC   _H13    74     1.09499   107.61689  -146.16001
   79    77 S   HC   _H14    75     1.09500   106.83920   -30.38115
   80    77 S   CT   _C12    76     1.52841   112.65386    90.02151
   81    80 S   HC   _H11    77     1.09721   109.05170  -177.78742
   82    80 S   HC   _H12    78     1.09815   109.27547   -62.14639
   83    80 S   CM   _C11    79     1.50852   113.29511    61.39346
   84    83 S   CM   _C10    80     1.34050   122.32431  -118.74821
   85    84 S   HC   _H10    81     1.08392   121.74780  -179.75055
   86    83 S   OS   _O36    97     1.38279   115.96770    62.64955
   87    84 S   C    _C9_    82     1.47521   121.43632    -0.11869
   88    87 S   O    _O34    83     1.22998   118.75917   -61.36728
   89    86 S   CT   _C30    98     1.40563   112.51976  -121.46582
   90    89 S   HC   _H36    99     1.09305   109.52977   179.96574
   91    89 S   HC   _H37   100     1.09353   109.54755    59.27814
   92    89 S   HC   _H38   101     1.09231   109.01276   -60.41421
   93    87 S   N    _N4_    84     1.40375   116.54071   120.05689
   94    93 S   C    _C8_    85     1.41816   129.50044    -1.54497
   95    94 S   O    _O33    86     1.22041   130.24471    -8.54528
   96    94 S   CM   _C7_    87     1.47383   107.42723   170.64380
   97    96 S   HC   _H9_    88     1.07595   125.00624  -179.49837
   98    96 S   CM   _C6_    89     1.33227   107.16882    -0.62838
   99    98 S   HC   _H8_    90     1.08254   123.47815  -178.93743
  100    93 S   CT   _C5_    91     1.45897   119.86412   168.58860
  101   100 S   HC   _H3_    92     1.09535   109.12371   -53.19184
  102   100 S   CT   _C4_    93     1.52589   112.54641    69.60990
  103   102 S   HC   _H5_    94     1.08947   109.91609    57.86974
  104   102 S   HC   _H6_    95     1.08900   109.90840   -62.11569
  105   102 S   HC   _H7_    96     1.08932   109.93341   177.88123
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   7   3   2   7   4   5   5   4   3
  10   3   2   1   1  14  13   6   5  10   5   4   7   5   4  11
   5   4   5   3   2  10   7   2  11   4   4   2   1   1   1   1
   8   4   8   5   4   7   4   3   7   3   8   4   8   5   4   8
   4   3  10   8   4   5   9   3   3   2   1   1  12   8   4   6
   3   7   3   5   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    45    42    43    44    48  
   38    39    42  
   36    37  
   37  
    0  
   39    40    41    45    46    47    51    42    43    44    48    49    50    54  
   40    41    45    46    47    51    52    53    56    42    43    44    48  
   41    45    46    47    51    42  
   45    46    47    51    42  
   43    44    48    49    50    54    55    57    59    45  
   44    48    49    50    54  
   48    49    50    54  
   46    47    51    52    53    56    63  
   47    51    52    53    56  
   51    52    53    56  
   49    50    54    55    57    58    65    59    60    61    62  
   50    54    55    57    59  
   54    55    57    59  
   52    53    56    63    64  
   53    56    63  
   56    63  
   55    57    58    65    66    67    59    60    61    62  
   57    58    65    59    60    61    62  
   63    64  
   58    65    66    67    68    69    70    59    60    61    62  
   65    66    67    59  
   60    61    62    65  
   61    62  
   62  
    0  
   64  
    0  
   66    67    68    69    70    71    72    73  
   67    68    69    70  
   68    69    70    71    72    73    74    75  
   69    70    71    72    73  
   70    71    72    73  
   71    72    73    74    75    76    77  
   72    73    74    75  
   73    74    75  
   74    75    76    77    78    79    80  
   75    76    77  
   76    77    78    79    80    81    82    83  
   77    78    79    80  
   78    79    80    81    82    83    84    86  
   79    80    81    82    83  
   80    81    82    83  
   81    82    83    84    85    87    86    89  
   82    83    84    86  
   83    84    86  
   84    85    87    88    93    86    89    90    91    92  
   85    87    88    93    94   100    86    89  
   87    88    93    86  
   89    90    91    92    87  
   88    93    94    95    96    98   100   101   102  
   93    94   100  
   90    91    92  
   91    92  
   92  
    0  
   94    95    96    97    98    99   100   101   102   103   104   105  
   95    96    97    98    99   100   101   102  
   96    97    98   100  
   97    98    99   100   101   102  
   98    99   100  
   99   100   101   102   103   104   105  
  100   101   102  
  101   102   103   104   105  
  102   103   104   105  
  103   104   105  
  104   105  
  105  
    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  -0.175000   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   3.5500   0.0760  -0.107500   2.0020   1.7750   0.023028004  -0.852763146
   34   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.6500   0.1500   0.000000   2.0580   1.8250   0.025318638  -1.264311570
   57   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   58   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.6500   0.1500  -0.078600   2.0580   1.8250   0.025318638  -1.264311570
   64   3.4700   0.4700   0.078600   2.8000   2.5000   0.001000000  -0.686339560
   65   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   66   2.4200   0.0300   0.115000   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   74   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   75   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   76   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   77   3.5000   0.0660   0.080000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   79   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   80   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   3.5500   0.0760   0.085000   2.0020   1.7750   0.023028004  -0.852763146
   84   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   85   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   86   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   87   3.7500   0.1050   0.630500   1.9250   1.7000   0.001000000  -0.126889456
   88   2.9600   0.2100  -0.508000   1.5250   1.4250   0.001000000  -1.480495490
   89   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   90   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   91   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   92   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   93   3.2500   0.1700  -0.315000   1.8100   1.6000   0.054801302  -1.445846770
   94   3.7500   0.1050   0.630500   1.9250   1.7000   0.001000000  -0.126889456
   95   2.9600   0.2100  -0.508000   1.5250   1.4250   0.001000000  -1.480495490
   96   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   97   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   98   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   99   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  100   3.5000   0.0660   0.010000   1.9750   1.7500   0.005000000  -0.741685710
  101   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
  102   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  103   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  104   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   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    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   240.000  1.763
   33    34   340.000  1.080
   33    38   549.000  1.340
   38    39   317.000  1.510
   38    42   317.000  1.510
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    45   268.000  1.529
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    51   268.000  1.529
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    56   390.000  1.470
   56    63   985.000  1.221
   63    64   265.000  1.829
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    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   340.000  1.090
   54    57   317.000  1.510
   54    59   268.000  1.529
   57    58   340.000  1.080
   57    65   549.000  1.340
   65    66   340.000  1.080
   65    67   317.000  1.510
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   268.000  1.529
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   317.000  1.522
   73    74   570.000  1.229
   73    75   490.000  1.335
   75    76   434.000  1.010
   75    77   337.000  1.449
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    80   268.000  1.529
   80    81   340.000  1.090
   80    82   340.000  1.090
   80    83   317.000  1.510
   83    84   549.000  1.340
   83    86   440.000  1.360
   84    85   340.000  1.080
   84    87   410.000  1.444
   87    88   570.000  1.229
   87    93   490.000  1.335
   93    94   490.000  1.335
   93   100   337.000  1.449
   94    95   570.000  1.229
   94    96   410.000  1.444
   96    97   340.000  1.080
   96    98   549.000  1.340
   98    99   340.000  1.080
   98   100   317.000  1.510
  100   101   340.000  1.090
  100   102   268.000  1.529
  102   103   340.000  1.090
  102   104   340.000  1.090
  102   105   340.000  1.090
   86    89   320.000  1.410
   89    90   340.000  1.090
   89    91   340.000  1.090
   89    92   340.000  1.090
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    85.00000  102.41200
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    40.00000  115.49800
   29    33    38    65.00000  122.11800
   33    38    39    70.00000  124.00000
   33    38    42    70.00000  124.00000
   38    33    34    35.00000  120.00000
   38    39    40    35.00000  109.50000
   38    39    41    35.00000  109.50000
   38    39    45    70.00000  112.02700
   38    42    43    35.00000  109.50000
   38    42    44    35.00000  109.50000
   38    42    48    70.00000  112.02700
   39    45    46    37.50000  110.70000
   39    45    47    37.50000  110.70000
   39    45    51    58.35000  112.70000
   41    39    40    33.00000  107.80000
   45    39    40    37.50000  110.70000
   45    39    41    37.50000  110.70000
   45    51    52    37.50000  110.70000
   45    51    53    37.50000  110.70000
   45    51    56    58.35000  112.70000
   47    45    46    33.00000  107.80000
   51    45    46    37.50000  110.70000
   51    45    47    37.50000  110.70000
   51    56    63    30.00000  179.48800
   53    51    52    33.00000  107.80000
   56    51    52    35.00000  108.50000
   56    51    53    35.00000  108.50000
   56    63    64    30.00000  180.00000
   42    38    39    65.00000  117.92700
   42    48    49    37.50000  110.70000
   42    48    50    37.50000  110.70000
   42    48    54    58.35000  112.70000
   44    42    43    33.00000  107.80000
   48    42    43    37.50000  110.70000
   48    42    44    37.50000  110.70000
   48    54    55    37.50000  110.70000
   48    54    57    70.00000  112.02700
   48    54    59    58.35000  112.70000
   50    48    49    33.00000  107.80000
   54    48    49    37.50000  110.70000
   54    48    50    37.50000  110.70000
   54    57    58    35.00000  117.00000
   54    57    65    70.00000  124.00000
   54    59    60    37.50000  110.70000
   54    59    61    37.50000  110.70000
   54    59    62    37.50000  110.70000
   57    54    55    35.00000  109.50000
   57    65    66    35.00000  120.00000
   57    65    67    70.00000  124.00000
   65    57    58    35.00000  120.00000
   65    67    68    35.00000  109.50000
   65    67    69    35.00000  109.50000
   65    67    70    70.00000  112.02700
   67    65    66    35.00000  117.00000
   67    70    71    37.50000  110.70000
   67    70    72    37.50000  110.70000
   67    70    73    63.00000  111.10000
   69    67    68    33.00000  107.80000
   70    67    68    37.50000  110.70000
   70    67    69    37.50000  110.70000
   70    73    74    80.00000  120.40000
   70    73    75    70.00000  116.60000
   72    70    71    33.00000  107.80000
   73    70    71    35.00000  109.50000
   73    70    72    35.00000  109.50000
   73    75    76    35.00000  119.80000
   73    75    77    50.00000  121.90000
   75    73    74    80.00000  122.90000
   75    77    78    35.00000  109.50000
   75    77    79    35.00000  109.50000
   75    77    80    70.00000  110.72300
   77    75    76    38.00000  118.40000
   77    80    81    37.50000  110.70000
   77    80    82    37.50000  110.70000
   77    80    83    70.00000  112.02700
   79    77    78    33.00000  107.80000
   80    77    78    37.50000  110.70000
   80    77    79    37.50000  110.70000
   80    83    84    70.00000  124.00000
   80    83    86    85.00000  112.85300
   82    80    81    33.00000  107.80000
   83    80    81    35.00000  109.50000
   83    80    82    35.00000  109.50000
   83    84    85    35.00000  120.00000
   83    84    87    70.00000  118.70000
   83    86    89    90.00000  111.18400
   84    87    88    80.00000  125.30000
   84    87    93    80.00000  111.56200
   87    84    85    35.00000  119.70000
   87    93    94    70.00000  121.37400
   87    93   100    50.00000  121.90000
   93    87    88    80.00000  122.90000
   93    94    95    80.00000  122.90000
   93    94    96    80.00000  111.56200
   93   100    98    75.00000  110.78400
   93   100   101    35.00000  109.50000
   93   100   102    70.00000  110.72300
   94    96    97    35.00000  119.70000
   94    96    98    70.00000  118.70000
   96    94    95    80.00000  125.30000
   96    98    99    35.00000  120.00000
   96    98   100    70.00000  124.00000
   98    96    97    35.00000  120.00000
   98   100   101    35.00000  109.50000
   98   100   102    70.00000  112.02700
  100    93    94    50.00000  121.90000
  100    98    99    35.00000  117.00000
  100   102   103    37.50000  110.70000
  100   102   104    37.50000  110.70000
  100   102   105    37.50000  110.70000
  102   100   101    37.50000  110.70000
  104   102   103    33.00000  107.80000
  105   102   103    33.00000  107.80000
  105   102   104    33.00000  107.80000
   86    83    84    80.00000  120.01400
   86    89    90    35.00000  109.50000
   86    89    91    35.00000  109.50000
   86    89    92    35.00000  109.50000
   91    89    90    33.00000  107.80000
   92    89    90    33.00000  107.80000
   92    89    91    33.00000  107.80000
   59    54    55    37.50000  110.70000
   59    54    57    70.00000  112.02700
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.00000  1.0 1.0
   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   1.00000 -1.0 2.0
   24    29    33    38   1.00000 -1.0 2.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    38    39   7.00000 -1.0 2.0
   29    33    38    42   7.00000 -1.0 2.0
   33    38    39    40   0.00000  1.0 1.0
   33    38    39    41   0.00000  1.0 1.0
   33    38    39    45   0.09850  1.0 1.0
   33    38    39    45   0.15250 -1.0 2.0
   33    38    39    45  -0.50650  1.0 3.0
   33    38    42    43   0.00000  1.0 1.0
   33    38    42    44   0.00000  1.0 1.0
   33    38    42    48   0.09850  1.0 1.0
   33    38    42    48   0.15250 -1.0 2.0
   33    38    42    48  -0.50650  1.0 3.0
   34    33    38    39   7.00000 -1.0 2.0
   34    33    38    42   7.00000 -1.0 2.0
   38    39    45    46   0.15000  1.0 3.0
   38    39    45    47   0.15000  1.0 3.0
   38    39    45    51   0.34400  1.0 1.0
   38    39    45    51   0.09450 -1.0 2.0
   38    39    45    51   0.11100  1.0 3.0
   38    42    48    49   0.15000  1.0 3.0
   38    42    48    50   0.15000  1.0 3.0
   38    42    48    54   0.34400  1.0 1.0
   38    42    48    54   0.09450 -1.0 2.0
   38    42    48    54   0.11100  1.0 3.0
   39    38    42    43   0.34800  1.0 3.0
   39    38    42    44   0.34800  1.0 3.0
   39    38    42    48   0.46850  1.0 1.0
   39    38    42    48   0.08550 -1.0 2.0
   39    38    42    48   0.09800  1.0 3.0
   39    45    51    52   0.15000  1.0 3.0
   39    45    51    53   0.15000  1.0 3.0
   39    45    51    56  -0.74000  1.0 1.0
   39    45    51    56   0.24050 -1.0 2.0
   39    45    51    56   0.24650  1.0 3.0
   40    39    45    46   0.15000  1.0 3.0
   40    39    45    47   0.15000  1.0 3.0
   40    39    45    51   0.15000  1.0 3.0
   41    39    45    46   0.15000  1.0 3.0
   41    39    45    47   0.15000  1.0 3.0
   41    39    45    51   0.15000  1.0 3.0
   45    51    56    63   0.00000  1.0 1.0
   46    45    51    52   0.15000  1.0 3.0
   46    45    51    53   0.15000  1.0 3.0
   46    45    51    56   0.15000  1.0 3.0
   47    45    51    52   0.15000  1.0 3.0
   47    45    51    53   0.15000  1.0 3.0
   47    45    51    56   0.15000  1.0 3.0
   51    56    63    64   0.00000  1.0 1.0
   52    51    56    63   0.00000  1.0 1.0
   53    51    56    63   0.00000  1.0 1.0
   42    38    39    40   0.34800  1.0 3.0
   42    38    39    41   0.34800  1.0 3.0
   42    38    39    45   0.46850  1.0 1.0
   42    38    39    45   0.08550 -1.0 2.0
   42    38    39    45   0.09800  1.0 3.0
   42    48    54    55   0.15000  1.0 3.0
   42    48    54    57   0.34400  1.0 1.0
   42    48    54    57   0.09450 -1.0 2.0
   42    48    54    57   0.11100  1.0 3.0
   42    48    54    59   0.56750  1.0 1.0
   42    48    54    59  -0.07550 -1.0 2.0
   42    48    54    59   0.20000  1.0 3.0
   43    42    48    49   0.15000  1.0 3.0
   43    42    48    50   0.15000  1.0 3.0
   43    42    48    54   0.15000  1.0 3.0
   44    42    48    49   0.15000  1.0 3.0
   44    42    48    50   0.15000  1.0 3.0
   44    42    48    54   0.15000  1.0 3.0
   48    54    57    58   0.00000  1.0 1.0
   48    54    57    65   0.09850  1.0 1.0
   48    54    57    65   0.15250 -1.0 2.0
   48    54    57    65  -0.50650  1.0 3.0
   48    54    59    60   0.15000  1.0 3.0
   48    54    59    61   0.15000  1.0 3.0
   48    54    59    62   0.15000  1.0 3.0
   49    48    54    55   0.15000  1.0 3.0
   49    48    54    57   0.15000  1.0 3.0
   49    48    54    59   0.15000  1.0 3.0
   50    48    54    55   0.15000  1.0 3.0
   50    48    54    57   0.15000  1.0 3.0
   50    48    54    59   0.15000  1.0 3.0
   54    57    65    66   7.00000 -1.0 2.0
   54    57    65    67   7.00000 -1.0 2.0
   55    54    57    58   0.33100  1.0 3.0
   55    54    57    65   0.00000  1.0 1.0
   55    54    59    60   0.15000  1.0 3.0
   55    54    59    61   0.15000  1.0 3.0
   55    54    59    62   0.15000  1.0 3.0
   57    54    59    60   0.15000  1.0 3.0
   57    54    59    61   0.15000  1.0 3.0
   57    54    59    62   0.15000  1.0 3.0
   57    65    67    68   0.00000  1.0 1.0
   57    65    67    69   0.00000  1.0 1.0
   57    65    67    70   0.09850  1.0 1.0
   57    65    67    70   0.15250 -1.0 2.0
   57    65    67    70  -0.50650  1.0 3.0
   58    57    65    66   7.00000 -1.0 2.0
   58    57    65    67   7.00000 -1.0 2.0
   65    67    70    71   0.15000  1.0 3.0
   65    67    70    72   0.15000  1.0 3.0
   65    67    70    73  -0.98800  1.0 1.0
   65    67    70    73   0.48800 -1.0 2.0
   65    67    70    73   0.76800  1.0 3.0
   66    65    67    68   0.33100  1.0 3.0
   66    65    67    69   0.33100  1.0 3.0
   66    65    67    70   0.00000  1.0 1.0
   67    70    73    74   0.30150 -1.0 2.0
   67    70    73    75   1.39750  1.0 1.0
   67    70    73    75  -0.07950 -1.0 2.0
   67    70    73    75  -0.18750  1.0 3.0
   68    67    70    71   0.15000  1.0 3.0
   68    67    70    72   0.15000  1.0 3.0
   68    67    70    73  -0.11250  1.0 3.0
   69    67    70    71   0.15000  1.0 3.0
   69    67    70    72   0.15000  1.0 3.0
   69    67    70    73  -0.11250  1.0 3.0
   70    73    75    76   2.45000 -1.0 2.0
   70    73    75    77   1.49850  1.0 1.0
   70    73    75    77   1.53950 -1.0 2.0
   71    70    73    74   0.00000  1.0 1.0
   71    70    73    75   0.00000  1.0 1.0
   72    70    73    74   0.00000  1.0 1.0
   72    70    73    75   0.00000  1.0 1.0
   73    75    77    78   0.00000  1.0 1.0
   73    75    77    79   0.00000  1.0 1.0
   73    75    77    80  -0.43950  1.0 1.0
   73    75    77    80  -0.08100 -1.0 2.0
   73    75    77    80   0.03350  1.0 3.0
   74    73    75    76   2.45000 -1.0 2.0
   74    73    75    77   3.04450 -1.0 2.0
   75    77    80    81   0.15000  1.0 3.0
   75    77    80    82   0.15000  1.0 3.0
   75    77    80    83   0.21700  1.0 1.0
   75    77    80    83   0.68550 -1.0 2.0
   75    77    80    83  -0.27950  1.0 3.0
   76    75    77    78   0.00000  1.0 1.0
   76    75    77    79   0.00000  1.0 1.0
   76    75    77    80   0.00000  1.0 1.0
   77    80    83    84   0.09850  1.0 1.0
   77    80    83    84   0.15250 -1.0 2.0
   77    80    83    84  -0.50650  1.0 3.0
   77    80    83    86   0.09700  1.0 1.0
   77    80    83    86   0.15600 -1.0 2.0
   77    80    83    86  -0.50800  1.0 3.0
   78    77    80    81   0.15000  1.0 3.0
   78    77    80    82   0.15000  1.0 3.0
   78    77    80    83   0.15000  1.0 3.0
   79    77    80    81   0.15000  1.0 3.0
   79    77    80    82   0.15000  1.0 3.0
   79    77    80    83   0.15000  1.0 3.0
   80    83    84    85   7.00000 -1.0 2.0
   80    83    84    87   7.00000 -1.0 2.0
   80    83    86    89   2.00000 -1.0 2.0
   81    80    83    84   0.00000  1.0 1.0
   81    80    83    86   0.00000  1.0 1.0
   82    80    83    84   0.00000  1.0 1.0
   82    80    83    86   0.00000  1.0 1.0
   83    84    87    88   1.00000 -1.0 2.0
   83    84    87    93   0.49500  1.0 1.0
   83    84    87    93   1.31600 -1.0 2.0
   83    84    87    93  -0.02300  1.0 3.0
   83    86    89    90   0.08050  1.0 3.0
   83    86    89    91   0.08050  1.0 3.0
   83    86    89    92   0.08050  1.0 3.0
   84    83    86    89  -2.26850  1.0 1.0
   84    83    86    89   3.39050 -1.0 2.0
   84    87    93    94   2.45000 -1.0 2.0
   84    87    93   100   1.49850  1.0 1.0
   84    87    93   100   1.53950 -1.0 2.0
   85    84    87    88   0.00000  1.0 1.0
   85    84    87    93   0.65100 -1.0 2.0
   87    93    94    95   2.22250 -1.0 2.0
   87    93    94    96   2.45000 -1.0 2.0
   87    93   100    98  -0.19250  1.0 1.0
   87    93   100    98  -0.00500 -1.0 2.0
   87    93   100    98   0.17000  1.0 3.0
   87    93   100   101   0.00000  1.0 1.0
   87    93   100   102  -0.43950  1.0 1.0
   87    93   100   102  -0.08100 -1.0 2.0
   87    93   100   102   0.03350  1.0 3.0
   88    87    93    94   2.22250 -1.0 2.0
   88    87    93   100   3.04450 -1.0 2.0
   93    94    96    97   0.65100 -1.0 2.0
   93    94   -96    98   0.49500  1.0 1.0
   93    94   -96    98   1.31600 -1.0 2.0
   93    94   -96    98  -0.02300  1.0 3.0
   93   100   102   103   0.15000  1.0 3.0
   93   100   102   104   0.15000  1.0 3.0
   93   100   102   105   0.15000  1.0 3.0
   94    93  -100    98  -0.19250  1.0 1.0
   94    93  -100    98  -0.00500 -1.0 2.0
   94    93  -100    98   0.17000  1.0 3.0
   94    93   100   101   0.00000  1.0 1.0
   94    93   100   102  -0.43950  1.0 1.0
   94    93   100   102  -0.08100 -1.0 2.0
   94    93   100   102   0.03350  1.0 3.0
   94    96    98    99   7.00000 -1.0 2.0
   94    96   -98   100   7.00000 -1.0 2.0
   95    94    96    97   0.00000  1.0 1.0
   95    94    96    98   1.00000 -1.0 2.0
   96    98  -100    93   0.62150  1.0 1.0
   96    98  -100    93   0.42850 -1.0 2.0
   96    98  -100    93  -0.68200  1.0 3.0
   96    98   100   101   0.00000  1.0 1.0
   96    98   100   102   0.09850  1.0 1.0
   96    98   100   102   0.15250 -1.0 2.0
   96    98   100   102  -0.50650  1.0 3.0
   97    96    98    99   7.00000 -1.0 2.0
   97    96    98   100   7.00000 -1.0 2.0
   98   100   102   103   0.15000  1.0 3.0
   98   100   102   104   0.15000  1.0 3.0
   98   100   102   105   0.15000  1.0 3.0
   99    98   100    93   0.00000  1.0 1.0
   99    98   100   101   0.33100  1.0 3.0
   99    98   100   102   0.00000  1.0 1.0
  100    93    94    95   3.04450 -1.0 2.0
  100    93   -94    96   1.49850  1.0 1.0
  100    93   -94    96   1.53950 -1.0 2.0
  101   100   102   103   0.15000  1.0 3.0
  101   100   102   104   0.15000  1.0 3.0
  101   100   102   105   0.15000  1.0 3.0
   86    83    84    85   7.00000 -1.0 2.0
   86    83    84    87   7.00000 -1.0 2.0
   59    54    57    58   0.00000  1.0 1.0
   59    54    57    65   0.09850  1.0 1.0
   59    54    57    65   0.15250 -1.0 2.0
   59    54    57    65  -0.50650  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   29    34    33    38  15.00000 -1.0 2.0
   39    42    38    33  15.00000 -1.0 2.0
   54    58    57    65  15.00000 -1.0 2.0
   67    66    65    57  15.00000 -1.0 2.0
   70    75    73    74  10.50000 -1.0 2.0
   76    73    75    77   1.00000 -1.0 2.0
   80    86    83    84  15.00000 -1.0 2.0
   87    85    84    83  15.00000 -1.0 2.0
   84    93    87    88  10.50000 -1.0 2.0
  100    87    93    94   1.00000 -1.0 2.0
   93    96    94    95  10.50000 -1.0 2.0
   94    97    96    98   1.10000 -1.0 2.0
  100    99    98    96   1.10000 -1.0 2.0
END
