* LIGAND DATABASE FILE (OPLS2005)
*
001     103   106    196    317     591
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02088    44.47557  -136.58393
    3     1 S   H    _H1_     3     1.02065   104.46709   -34.53548
    4     1 S   H    _H2_     4     1.02077    68.49049    70.21799
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.05972   107.41041    47.01581
    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     1.34015   114.76575   162.47883
   19    18 S   H    _HN2    19     1.04748   118.84952     8.59078
   20    18 S   CT1  _CA2    20     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    21     1.08457   106.27517   -11.11459
   22    20 S   C    _C2_    22     1.54037   112.60135  -130.27230
   23    22 S   O    _O2_    23     1.23085   119.01196  -169.64989
   24    20 S   CT   _CB2    32     1.54652   109.46586   105.32505
   25    24 S   HC   HB21    33     1.08519   110.56213    58.83396
   26    24 S   HC   HB22    34     1.08612   109.94660   179.13182
   27    22 S   N    _N3_    24     1.34263   118.97450    10.45203
   28    27 S   H    _HN3    25     1.03492   120.05970     5.06895
   29    24 S   S    _SG2    35     1.81647   112.43692   -61.22030
   30    27 S   CT   _CA3    26     1.46098   124.53040  -172.10347
   31    30 S   HC   HA31    27     1.12298   109.15732    14.31073
   32    30 S   HC   HA32    28     1.12301   109.23063   127.81991
   33    29 S   CT   _C21    36     1.83857    97.61163   161.85831
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CO4  _C12    37     1.52494   102.83873   -80.02591
   38    37 S   O    _O33    38     1.22408   125.99079    68.95029
   39    33 S   CT   _C15    60     1.55745   112.15239    33.84137
   40    39 S   HC   _H45    61     1.10000   110.25203   -33.21857
   41    39 S   HC   _H46    62     1.10155   106.15014  -145.07610
   42    37 S   OS   _O36    39     1.35605   110.50792  -109.25421
   43    42 S   CO4  _C11    40     1.35527   111.60194    -4.93602
   44    43 S   O    _O30    41     1.22159   123.76196   176.72464
   45    33 S   CT   _C17    42     1.54336   117.76971   168.97002
   46    45 S   HC   _H48    43     1.09927   108.74300  -155.00417
   47    45 S   CT   _C19    44     1.54932   123.11314   -28.34638
   48    47 S   HC   _H50    45     1.09870   106.38036   173.44515
   49    47 S   CT   _C16    46     1.55169   115.75848   -69.16676
   50    49 S   HC   _H47    47     1.08950   107.79617   -43.24187
   51    47 S   OH   _O37   102     1.42518   112.67104    58.90150
   52    51 S   HO   _H67   103     0.96985   106.54525    49.05594
   53    49 S   CM   _C7_    48     1.50399   114.75681    78.16503
   54    49 S   CT   _C28    79     1.54096   110.17476  -155.30027
   55    54 S   HC   _H65    80     1.08962   108.73842   -48.40655
   56    53 S   CM   _C6_    49     1.33622   130.01933  -100.13591
   57    54 S   CT   _C27    81     1.52530   110.58071    73.30700
   58    57 S   HC   _H63    82     1.09787   109.89396    80.00868
   59    57 S   HC   _H64    83     1.09709   109.88395   -38.16593
   60    54 S   OH   _O38   100     1.41868   108.12970  -166.39886
   61    60 S   HO   _H68   101     0.97205   106.89481  -179.96574
   62    56 S   CO4  _C9_    50     1.47178   107.69272  -177.36745
   63    62 S   O    _O28    51     1.21767   126.68145   178.86771
   64    56 S   CT   _C14    55     1.49302   133.51922     3.49003
   65    64 S   HC   _H43    56     1.09854   108.38723   154.82747
   66    64 S   HC   _H44    57     1.09931   106.32614   -92.34170
   67    57 S   CT   _C26    84     1.53350   111.51396  -159.61906
   68    67 S   HC   _H61    85     1.09579   109.39928   -59.67177
   69    67 S   HC   _H62    86     1.09612   109.45276    57.66245
   70    62 S   OS   _O34    52     1.35030   107.44715    -0.99780
   71    64 S   CT   _C18    58     1.54074   120.39539    31.64731
   72    71 S   HC   _H49    59     1.08960   110.41678   -59.28324
   73    67 S   CT   _C25    87     1.53133   111.16788   178.85005
   74    73 S   HC   _H59    88     1.09662   109.74218    58.33114
   75    73 S   HC   _H60    89     1.09714   108.99570   -58.26007
   76    53 S   CO4  _C10    53     1.47426   122.91619    81.30439
   77    76 S   O    _O29    54     1.21807   127.28403    -2.91625
   78    71 S   CT   _C29    63     1.54351   107.40355  -173.17663
   79    78 S   HC   _H66    64     1.08800   108.32057    40.03901
   80    73 S   CT   _C24    90     1.53101   113.38411  -178.76109
   81    80 S   HC   _H57    91     1.09714   109.61975   -60.03875
   82    80 S   HC   _H58    92     1.09686   108.11895    55.93089
   83    78 S   CT   _C20    65     1.52220   111.08542   161.58208
   84    83 S   HC   _H51    66     1.09716   108.36009    62.04493
   85    78 S   OH   _O39    77     1.41597   108.37284   -77.31557
   86    85 S   HO   _H69    78     0.97200   107.08623  -179.97202
   87    80 S   CT   _C23    93     1.52898   113.40952   176.95972
   88    87 S   HC   _H55    94     1.09597   109.91553   -55.98140
   89    87 S   HC   _H56    95     1.09544   110.41145    62.21100
   90    83 S   CT   _C13    67     1.52288   111.47275   -60.22953
   91    90 S   HC   _H41    68     1.09578   109.83725    68.92358
   92    90 S   HC   _H42    69     1.09589   111.62352   -50.69228
   93    87 S   CT   _C22    96     1.52121   111.40335  -177.02086
   94    93 S   HC   _H52    97     1.09544   110.97586   -58.48507
   95    93 S   HC   _H53    98     1.09391   110.26876    61.18152
   96    93 S   HC   _H54    99     1.09445   111.02872  -179.01146
   97    90 S   CM   _C5_    70     1.49111   108.86005  -170.46080
   98    97 S   HC   _H40    71     1.08504   118.49239  -153.60025
   99    97 S   CM   _C4_    72     1.33613   121.77177    26.61671
  100    99 S   HC   _H39    73     1.08349   121.26105   179.23434
  101    99 S   CO4  _C8_    74     1.47488   120.56247     3.86026
  102   101 S   O    _O27    75     1.22567   120.82456   167.90151
  103    83 S   OS   _O35    76     1.44425   107.91351   178.22513
  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  12   5   4   3
  18   2   1   1  11   4  17   6   5   5   7   3  10   4  12   6
  18   8   3   1  14  12   6  11  11   6   5   2   1   8   3  10
   4   3   9   5   4   2   9   4   9   5   4   1   1  11   6   9
   5   4  12   7   3   1   6   5   4   8   5   4   3   2   1   1
   6   3   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    45    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    42    43    45    46    47    71    39    40    41  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    42    43    44    45    46    47    48    49    64    71    72    39    40    41    78    51  
   35    36  
   36  
    0  
   38    42    43    44    45    46    47    71    39    40    41  
   42    43    45    39  
   40    41    78    79    83    85    42    43    45    46    47    56    64    65    66    71    72  
   41    78    45    64    71    72  
   78    45    64    71    72  
   43    44    45    46    47  
   44    45    46    47    48    49    51  
   45    46    47  
   46    47    48    49    50    53    71    54    51    52  
   47    48    49    51  
   48    49    50    53    56    76    54    55    57    60    51    52  
   49    50    53    54    51    52  
   50    53    56    62    70    76    77    64    54    55    57    58    59    67    60    61    51    52  
   53    56    76    54    55    57    60    51  
   52    53    54  
    0  
   56    62    63    70    76    77    64    65    66    71    54    55    57    60  
   55    57    58    59    67    68    69    73    60    61    56    76  
   57    58    59    67    60    61  
   62    63    70    76    77    64    65    66    71    72    78  
   58    59    67    68    69    73    74    75    80    60    61  
   59    67    68    69    73    60  
   67    68    69    73    60  
   61    67  
    0  
   63    70    76    77    64    65    66    71  
   70    76    64  
   65    66    71    72    78    79    83    85    70    76  
   66    71    72    78  
   71    72    78  
   68    69    73    74    75    80    81    82    87  
   69    73    74    75    80  
   73    74    75    80  
   76    77  
   72    78    79    83    84    90   103    85    86  
   78    79    83    85  
   74    75    80    81    82    87    88    89    93  
   75    80    81    82    87  
   80    81    82    87  
   77  
    0  
   79    83    84    90    91    92    97   101   103    85    86  
   83    84    90   103    85    86  
   81    82    87    88    89    93    94    95    96  
   82    87    88    89    93  
   87    88    89    93  
   84    90    91    92    97    98    99   101   102   103    85    86  
   90    91    92    97   101   103    85  
   86    90   103  
    0  
   88    89    93    94    95    96  
   89    93    94    95    96  
   93    94    95    96  
   91    92    97    98    99   100   101   103  
   92    97    98    99   103  
   97    98    99   103  
   94    95    96  
   95    96  
   96  
    0  
   98    99   100   101   102   103  
   99   100   101  
  100   101   102   103  
  101   102   103  
  102   103  
  103  
    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   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   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   3.0000   0.1700  -0.160000   1.5900   1.4000   0.020110767  -0.896042159
   43   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   45   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   47   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   52   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   53   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   54   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   57   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   61   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   62   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   63   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   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   3.0000   0.1700  -0.160000   1.5900   1.4000   0.020110767  -0.896042159
   71   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   77   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   78   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   79   2.5000   0.0300   0.060000   1.4250   1.2500   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   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   84   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   85   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   86   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   87   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   88   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   94   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   98   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   99   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
  100   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  101   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
  102   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
  103   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
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   317.000  1.522
   33    45   268.000  1.529
   33    39   268.000  1.529
   37    38   570.000  1.229
   37    42   214.000  1.327
   42    43   214.000  1.327
   43    44   570.000  1.229
   43    45   317.000  1.522
   45    46   340.000  1.090
   45    47   268.000  1.529
   47    48   340.000  1.090
   47    49   268.000  1.529
   47    51   320.000  1.410
   49    50   340.000  1.090
   49    53   317.000  1.510
   49    54   268.000  1.529
   53    56   549.000  1.340
   53    76   320.000  1.462
   56    62   320.000  1.462
   56    64   317.000  1.510
   62    63   570.000  1.229
   62    70   214.000  1.327
   70    76   214.000  1.327
   76    77   570.000  1.229
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    71   268.000  1.529
   71    72   340.000  1.090
   71    39   268.000  1.529
   71    78   268.000  1.529
   39    40   340.000  1.090
   39    41   340.000  1.090
   78    79   340.000  1.090
   78    83   268.000  1.529
   78    85   320.000  1.410
   83    84   340.000  1.090
   83    90   268.000  1.529
   83   103   320.000  1.410
   90    91   340.000  1.090
   90    92   340.000  1.090
   90    97   317.000  1.510
   97    98   340.000  1.080
   97    99   549.000  1.340
   99   100   340.000  1.080
   99   101   320.000  1.462
  101   102   570.000  1.229
  101   103   214.000  1.327
   85    86   553.000  0.945
   54    55   340.000  1.090
   54    57   268.000  1.529
   54    60   320.000  1.410
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    67   268.000  1.529
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    73   268.000  1.529
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    80   268.000  1.529
   80    81   340.000  1.090
   80    82   340.000  1.090
   80    87   268.000  1.529
   87    88   340.000  1.090
   87    89   340.000  1.090
   87    93   268.000  1.529
   93    94   340.000  1.090
   93    95   340.000  1.090
   93    96   340.000  1.090
   60    61   553.000  0.945
   51    52   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  110.18000
   29    33    45    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    80.00000  120.40000
   33    37    42    81.00000  111.40000
   33    45    43    63.00000  111.10000
   33    45    46    37.50000  110.70000
   33    45    47    58.35000  112.70000
   33    39    71    58.35000  112.70000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   37    42    43   105.00000  110.06700
   42    37    38    83.00000  123.40000
   42    43    44    83.00000  123.40000
   42    43    45    81.00000  111.40000
   43    45    46    35.00000  109.50000
   43    45    47    63.00000  111.10000
   45    33    37    63.00000  111.10000
   45    43    44    80.00000  120.40000
   45    47    48    37.50000  110.70000
   45    47    49    58.35000  112.70000
   45    47    51    50.00000  109.50000
   47    45    46    37.50000  110.70000
   47    49    50    37.50000  110.70000
   47    49    53    70.00000  112.02700
   47    49    54    58.35000  112.70000
   47    51    52    55.00000  108.50000
   49    47    48    37.50000  110.70000
   49    53    56    70.00000  124.00000
   49    53    76    65.00000  116.34900
   49    54    55    37.50000  110.70000
   49    54    57    58.35000  112.70000
   49    54    60    50.00000  109.50000
   53    49    50    35.00000  109.50000
   53    56    62    65.00000  118.96000
   53    56    64    70.00000  124.00000
   53    76    70    90.00000  111.29400
   53    76    77    80.00000  123.72100
   56    62    63    80.00000  123.72100
   56    62    70    90.00000  111.29400
   56    64    65    35.00000  109.50000
   56    64    66    35.00000  109.50000
   56    64    71    70.00000  112.02700
   62    70    76   105.00000  110.06700
   70    62    63    83.00000  123.40000
   70    76    77    83.00000  123.40000
   76    53    56    65.00000  118.96000
   64    56    62    65.00000  116.34900
   64    71    72    37.50000  110.70000
   64    71    39    58.35000  112.70000
   64    71    78    58.35000  112.70000
   66    64    65    33.00000  107.80000
   71    64    65    37.50000  110.70000
   71    64    66    37.50000  110.70000
   71    39    40    37.50000  110.70000
   71    39    41    37.50000  110.70000
   71    78    79    37.50000  110.70000
   71    78    83    58.35000  112.70000
   71    78    85    50.00000  109.50000
   39    33    37    63.00000  111.10000
   39    33    45    58.35000  112.70000
   39    71    72    37.50000  110.70000
   41    39    40    33.00000  107.80000
   78    71    72    37.50000  110.70000
   78    71    39    58.35000  112.70000
   78    83    84    37.50000  110.70000
   78    83    90    58.35000  112.70000
   78    83   103    50.00000  109.50000
   78    85    86    55.00000  108.50000
   83    78    79    37.50000  110.70000
   83    90    91    37.50000  110.70000
   83    90    92    37.50000  110.70000
   83    90    97    70.00000  112.02700
   83   103   101    83.00000  116.90000
   90    83    84    37.50000  110.70000
   90    97    98    35.00000  117.00000
   90    97    99    70.00000  124.00000
   92    90    91    33.00000  107.80000
   97    90    91    35.00000  109.50000
   97    90    92    35.00000  109.50000
   97    99   100    35.00000  120.00000
   97    99   101    65.00000  118.96000
   99    97    98    35.00000  120.00000
   99   101   102    80.00000  123.72100
   99   101   103    90.00000  111.29400
  101    99   100    40.00000  117.72500
  103    83    84    35.00000  109.50000
  103    83    90    50.00000  109.50000
  103   101   102    83.00000  123.40000
   85    78    79    35.00000  109.50000
   85    78    83    50.00000  109.50000
   54    49    50    37.50000  110.70000
   54    49    53    70.00000  112.02700
   54    57    58    37.50000  110.70000
   54    57    59    37.50000  110.70000
   54    57    67    58.35000  112.70000
   54    60    61    55.00000  108.50000
   57    54    55    37.50000  110.70000
   57    67    68    37.50000  110.70000
   57    67    69    37.50000  110.70000
   57    67    73    58.35000  112.70000
   59    57    58    33.00000  107.80000
   67    57    58    37.50000  110.70000
   67    57    59    37.50000  110.70000
   67    73    74    37.50000  110.70000
   67    73    75    37.50000  110.70000
   67    73    80    58.35000  112.70000
   69    67    68    33.00000  107.80000
   73    67    68    37.50000  110.70000
   73    67    69    37.50000  110.70000
   73    80    81    37.50000  110.70000
   73    80    82    37.50000  110.70000
   73    80    87    58.35000  112.70000
   75    73    74    33.00000  107.80000
   80    73    74    37.50000  110.70000
   80    73    75    37.50000  110.70000
   80    87    88    37.50000  110.70000
   80    87    89    37.50000  110.70000
   80    87    93    58.35000  112.70000
   82    80    81    33.00000  107.80000
   87    80    81    37.50000  110.70000
   87    80    82    37.50000  110.70000
   87    93    94    37.50000  110.70000
   87    93    95    37.50000  110.70000
   87    93    96    37.50000  110.70000
   89    87    88    33.00000  107.80000
   93    87    88    37.50000  110.70000
   93    87    89    37.50000  110.70000
   95    93    94    33.00000  107.80000
   96    93    94    33.00000  107.80000
   96    93    95    33.00000  107.80000
   60    54    55    35.00000  109.50000
   60    54    57    50.00000  109.50000
   51    47    48    35.00000  109.50000
   51    47    49    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    45   0.01700  1.0 1.0
   24    29    33    45  -0.23550 -1.0 2.0
   24    29    33    45   0.21350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   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   0.30150 -1.0 2.0
   29    33    37    42   0.40000  1.0 3.0
   29    33    45    43   0.56750  1.0 1.0
   29    33    45    43  -0.07550 -1.0 2.0
   29    33    45    43   0.20000  1.0 3.0
   29    33    45    46   0.15000  1.0 3.0
   29    33    45    47   0.44750  1.0 1.0
   29    33    45    47  -0.17800 -1.0 2.0
   29    33    45    47   0.20200  1.0 3.0
   29    33    39    71   0.44750  1.0 1.0
   29    33    39    71  -0.17800 -1.0 2.0
   29    33    39    71   0.20200  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   33    37   -42    43   2.00000 -1.0 2.0
   33    45    47    48   0.15000  1.0 3.0
   33    45    47    49   0.56750  1.0 1.0
   33    45    47    49  -0.07550 -1.0 2.0
   33    45    47    49   0.20000  1.0 3.0
   33    45    47    51   0.86500  1.0 1.0
   33    45    47    51  -0.17500 -1.0 2.0
   33    45    47    51   0.20800  1.0 3.0
   37    33   -45    43   0.11950  1.0 1.0
   37    33   -45    43   0.20300 -1.0 2.0
   37    33   -45    43  -0.70800  1.0 3.0
   37    33    45    46  -0.11250  1.0 3.0
   37    33    45    47  -0.95700  1.0 1.0
   37    33    45    47  -0.18200 -1.0 2.0
   37    33    45    47   0.29450  1.0 3.0
   37    33    39    71  -0.95700  1.0 1.0
   37    33    39    71  -0.18200 -1.0 2.0
   37    33    39    71   0.29450  1.0 3.0
   37    33    39    40  -0.11250  1.0 3.0
   37    33    39    41  -0.11250  1.0 3.0
   37    42    43    44   3.00000 -1.0 2.0
   37    42   -43    45   2.00000 -1.0 2.0
   38    37    42    43   3.00000 -1.0 2.0
   42    43   -45    33   0.36750  1.0 3.0
   42    43    45    46   0.00000  1.0 1.0
   42    43    45    47   0.36750  1.0 3.0
   43    45    47    48  -0.11250  1.0 3.0
   43    45    47    49  -0.95700  1.0 1.0
   43    45    47    49  -0.18200 -1.0 2.0
   43    45    47    49   0.29450  1.0 3.0
   43    45    47    51  -0.09450  1.0 1.0
   43    45    47    51  -1.12950 -1.0 2.0
   43    45    47    51   0.54000  1.0 3.0
   44    43    45    33   0.30150 -1.0 2.0
   44    43    45    46   0.00000  1.0 1.0
   44    43    45    47   0.30150 -1.0 2.0
   45    33    37    38   0.30150 -1.0 2.0
   45    33   -37    42   0.36750  1.0 3.0
   45    33    39    71   0.56750  1.0 1.0
   45    33    39    71  -0.07550 -1.0 2.0
   45    33    39    71   0.20000  1.0 3.0
   45    33    39    40   0.15000  1.0 3.0
   45    33    39    41   0.15000  1.0 3.0
   45    47    49    50   0.15000  1.0 3.0
   45    47    49    53   0.34400  1.0 1.0
   45    47    49    53   0.09450 -1.0 2.0
   45    47    49    53   0.11100  1.0 3.0
   45    47    49    54   0.56750  1.0 1.0
   45    47    49    54  -0.07550 -1.0 2.0
   45    47    49    54   0.20000  1.0 3.0
   45    47    51    52  -0.11600  1.0 1.0
   45    47    51    52  -0.09450 -1.0 2.0
   45    47    51    52   0.21250  1.0 3.0
   46    45    47    48   0.15000  1.0 3.0
   46    45    47    49   0.15000  1.0 3.0
   46    45    47    51   0.23400  1.0 3.0
   47    49    53    56   0.09850  1.0 1.0
   47    49    53    56   0.15250 -1.0 2.0
   47    49    53    56  -0.50650  1.0 3.0
   47    49    53    76   0.09700  1.0 1.0
   47    49    53    76   0.15600 -1.0 2.0
   47    49    53    76  -0.50800  1.0 3.0
   47    49    54    55   0.15000  1.0 3.0
   47    49    54    57   0.56750  1.0 1.0
   47    49    54    57  -0.07550 -1.0 2.0
   47    49    54    57   0.20000  1.0 3.0
   47    49    54    60   0.86500  1.0 1.0
   47    49    54    60  -0.17500 -1.0 2.0
   47    49    54    60   0.20800  1.0 3.0
   48    47    49    50   0.15000  1.0 3.0
   48    47    49    53   0.15000  1.0 3.0
   48    47    49    54   0.15000  1.0 3.0
   48    47    51    52   0.19450  1.0 3.0
   49    47    51    52  -0.11600  1.0 1.0
   49    47    51    52  -0.09450 -1.0 2.0
   49    47    51    52   0.21250  1.0 3.0
   49    53    56    62   7.00000 -1.0 2.0
   49    53    56    64   7.00000 -1.0 2.0
   49    53    76    70  -0.15000  1.0 1.0
   49    53    76    70   0.89550 -1.0 2.0
   49    53    76    70  -0.06900  1.0 3.0
   49    53    76    77  -0.64400  1.0 1.0
   49    53    76    77   0.26850 -1.0 2.0
   49    54    57    58   0.15000  1.0 3.0
   49    54    57    59   0.15000  1.0 3.0
   49    54    57    67   0.56750  1.0 1.0
   49    54    57    67  -0.07550 -1.0 2.0
   49    54    57    67   0.20000  1.0 3.0
   49    54    60    61  -0.11600  1.0 1.0
   49    54    60    61  -0.09450 -1.0 2.0
   49    54    60    61   0.21250  1.0 3.0
   50    49    53    56   0.00000  1.0 1.0
   50    49    53    76   0.15000  1.0 3.0
   50    49    54    55   0.15000  1.0 3.0
   50    49    54    57   0.15000  1.0 3.0
   50    49    54    60   0.23400  1.0 3.0
   53    49    54    55   0.15000  1.0 3.0
   53    49    54    57   0.34400  1.0 1.0
   53    49    54    57   0.09450 -1.0 2.0
   53    49    54    57   0.11100  1.0 3.0
   53    49    54    60   1.05650  1.0 1.0
   53    49    54    60   0.15600 -1.0 2.0
   53    49    54    60   0.53150  1.0 3.0
   53    56    62    63   1.00000 -1.0 2.0
   53    56   -62    70  -0.56150  1.0 1.0
   53    56   -62    70   2.19150 -1.0 2.0
   53    56    64    65   0.00000  1.0 1.0
   53    56    64    66   0.00000  1.0 1.0
   53    56    64    71   0.09850  1.0 1.0
   53    56    64    71   0.15250 -1.0 2.0
   53    56    64    71  -0.50650  1.0 3.0
   56    53   -76    70  -0.56150  1.0 1.0
   56    53   -76    70   2.19150 -1.0 2.0
   56    53    76    77   1.00000 -1.0 2.0
   56    62   -70    76   2.00000 -1.0 2.0
   56    64    71    72   0.15000  1.0 3.0
   56    64    71    39   0.34400  1.0 1.0
   56    64    71    39   0.09450 -1.0 2.0
   56    64    71    39   0.11100  1.0 3.0
   56    64    71    78   0.34400  1.0 1.0
   56    64    71    78   0.09450 -1.0 2.0
   56    64    71    78   0.11100  1.0 3.0
   62    56    64    65   0.15000  1.0 3.0
   62    56    64    66   0.15000  1.0 3.0
   62    56    64    71   0.09700  1.0 1.0
   62    56    64    71   0.15600 -1.0 2.0
   62    56    64    71  -0.50800  1.0 3.0
   62    70   -76    53   2.00000 -1.0 2.0
   62    70    76    77   3.00000 -1.0 2.0
   63    62    70    76   3.00000 -1.0 2.0
   76    53   -56    62   7.00000 -1.0 2.0
   76    53    56    64   7.00000 -1.0 2.0
   64    56    62    63  -0.64400  1.0 1.0
   64    56    62    63   0.26850 -1.0 2.0
   64    56    62    70  -0.15000  1.0 1.0
   64    56    62    70   0.89550 -1.0 2.0
   64    56    62    70  -0.06900  1.0 3.0
   64    71    39    33   0.56750  1.0 1.0
   64    71    39    33  -0.07550 -1.0 2.0
   64    71    39    33   0.20000  1.0 3.0
   64    71    39    40   0.15000  1.0 3.0
   64    71    39    41   0.15000  1.0 3.0
   64    71    78    79   0.15000  1.0 3.0
   64    71    78    83   0.56750  1.0 1.0
   64    71    78    83  -0.07550 -1.0 2.0
   64    71    78    83   0.20000  1.0 3.0
   64    71    78    85   0.86500  1.0 1.0
   64    71    78    85  -0.17500 -1.0 2.0
   64    71    78    85   0.20800  1.0 3.0
   65    64    71    72   0.15000  1.0 3.0
   65    64    71    39   0.15000  1.0 3.0
   65    64    71    78   0.15000  1.0 3.0
   66    64    71    72   0.15000  1.0 3.0
   66    64    71    39   0.15000  1.0 3.0
   66    64    71    78   0.15000  1.0 3.0
   71    78    83    84   0.15000  1.0 3.0
   71    78    83    90   0.56750  1.0 1.0
   71    78    83    90  -0.07550 -1.0 2.0
   71    78    83    90   0.20000  1.0 3.0
   71    78    83   103   0.62750  1.0 1.0
   71    78    83   103  -0.30950 -1.0 2.0
   71    78    83   103   0.27300  1.0 3.0
   71    78    85    86  -0.11600  1.0 1.0
   71    78    85    86  -0.09450 -1.0 2.0
   71    78    85    86   0.21250  1.0 3.0
   72    71    39    33   0.15000  1.0 3.0
   72    71    39    40   0.15000  1.0 3.0
   72    71    39    41   0.15000  1.0 3.0
   72    71    78    79   0.15000  1.0 3.0
   72    71    78    83   0.15000  1.0 3.0
   72    71    78    85   0.23400  1.0 3.0
   39    33    37    38   0.30150 -1.0 2.0
   39    33    37    42   0.36750  1.0 3.0
   39    33    45    43  -0.95700  1.0 1.0
   39    33    45    43  -0.18200 -1.0 2.0
   39    33    45    43   0.29450  1.0 3.0
   39    33    45    46   0.15000  1.0 3.0
   39    33    45    47   0.56750  1.0 1.0
   39    33    45    47  -0.07550 -1.0 2.0
   39    33    45    47   0.20000  1.0 3.0
   39    71    78    79   0.15000  1.0 3.0
   39    71    78    83   0.56750  1.0 1.0
   39    71    78    83  -0.07550 -1.0 2.0
   39    71    78    83   0.20000  1.0 3.0
   39    71    78    85   0.86500  1.0 1.0
   39    71    78    85  -0.17500 -1.0 2.0
   39    71    78    85   0.20800  1.0 3.0
   78    71    39    33   0.56750  1.0 1.0
   78    71    39    33  -0.07550 -1.0 2.0
   78    71    39    33   0.20000  1.0 3.0
   78    71    39    40   0.15000  1.0 3.0
   78    71    39    41   0.15000  1.0 3.0
   78    83    90    91   0.15000  1.0 3.0
   78    83    90    92   0.15000  1.0 3.0
   78    83    90    97   0.34400  1.0 1.0
   78    83    90    97   0.09450 -1.0 2.0
   78    83    90    97   0.11100  1.0 3.0
   78    83   103   101  -0.25900  1.0 1.0
   78    83   103   101  -0.47000 -1.0 2.0
   78    83   103   101   0.11750  1.0 3.0
   79    78    83    84   0.15000  1.0 3.0
   79    78    83    90   0.15000  1.0 3.0
   79    78    83   103   0.23400  1.0 3.0
   79    78    85    86   0.19450  1.0 3.0
   83    78    85    86  -0.11600  1.0 1.0
   83    78    85    86  -0.09450 -1.0 2.0
   83    78    85    86   0.21250  1.0 3.0
   83    90    97    98   0.00000  1.0 1.0
   83    90    97    99   0.09850  1.0 1.0
   83    90    97    99   0.15250 -1.0 2.0
   83    90    97    99  -0.50650  1.0 3.0
   84    83    90    91   0.15000  1.0 3.0
   84    83    90    92   0.15000  1.0 3.0
   84    83    90    97   0.15000  1.0 3.0
   84    83   103   101   0.08050  1.0 3.0
   90    83   103   101  -0.25900  1.0 1.0
   90    83   103   101  -0.47000 -1.0 2.0
   90    83   103   101   0.11750  1.0 3.0
   90    97    99   100   7.00000 -1.0 2.0
   90    97   -99   101   7.00000 -1.0 2.0
   91    90    97    98   0.33100  1.0 3.0
   91    90    97    99   0.00000  1.0 1.0
   92    90    97    98   0.33100  1.0 3.0
   92    90    97    99   0.00000  1.0 1.0
   97    99   101   102   1.00000 -1.0 2.0
   97    99   101   103  -0.56150  1.0 1.0
   97    99   101   103   2.19150 -1.0 2.0
   98    97    99   100   7.00000 -1.0 2.0
   98    97    99   101   7.00000 -1.0 2.0
   99   101  -103    83   2.00000 -1.0 2.0
  100    99   101   102   0.00000  1.0 1.0
  100    99   101   103   1.63100 -1.0 2.0
  102   101   103    83   3.00000 -1.0 2.0
  103    83    90    91   0.23400  1.0 3.0
  103    83    90    92   0.23400  1.0 3.0
  103    83   -90    97   0.61850  1.0 1.0
  103    83   -90    97  -0.22750 -1.0 2.0
  103    83   -90    97   0.15300  1.0 3.0
   85    78    83    84   0.23400  1.0 3.0
   85    78    83    90   0.86500  1.0 1.0
   85    78    83    90  -0.17500 -1.0 2.0
   85    78    83    90   0.20800  1.0 3.0
   85    78    83   103   3.69350  1.0 1.0
   85    78    83   103  -1.82950 -1.0 2.0
   54    49    53    56   0.09850  1.0 1.0
   54    49    53    56   0.15250 -1.0 2.0
   54    49    53    56  -0.50650  1.0 3.0
   54    49    53    76   0.09700  1.0 1.0
   54    49    53    76   0.15600 -1.0 2.0
   54    49    53    76  -0.50800  1.0 3.0
   54    57    67    68   0.15000  1.0 3.0
   54    57    67    69   0.15000  1.0 3.0
   54    57    67    73   0.56750  1.0 1.0
   54    57    67    73  -0.07550 -1.0 2.0
   54    57    67    73   0.20000  1.0 3.0
   55    54    57    58   0.15000  1.0 3.0
   55    54    57    59   0.15000  1.0 3.0
   55    54    57    67   0.15000  1.0 3.0
   55    54    60    61   0.19450  1.0 3.0
   57    54    60    61  -0.11600  1.0 1.0
   57    54    60    61  -0.09450 -1.0 2.0
   57    54    60    61   0.21250  1.0 3.0
   57    67    73    74   0.15000  1.0 3.0
   57    67    73    75   0.15000  1.0 3.0
   57    67    73    80   0.56750  1.0 1.0
   57    67    73    80  -0.07550 -1.0 2.0
   57    67    73    80   0.20000  1.0 3.0
   58    57    67    68   0.15000  1.0 3.0
   58    57    67    69   0.15000  1.0 3.0
   58    57    67    73   0.15000  1.0 3.0
   59    57    67    68   0.15000  1.0 3.0
   59    57    67    69   0.15000  1.0 3.0
   59    57    67    73   0.15000  1.0 3.0
   67    73    80    81   0.15000  1.0 3.0
   67    73    80    82   0.15000  1.0 3.0
   67    73    80    87   0.56750  1.0 1.0
   67    73    80    87  -0.07550 -1.0 2.0
   67    73    80    87   0.20000  1.0 3.0
   68    67    73    74   0.15000  1.0 3.0
   68    67    73    75   0.15000  1.0 3.0
   68    67    73    80   0.15000  1.0 3.0
   69    67    73    74   0.15000  1.0 3.0
   69    67    73    75   0.15000  1.0 3.0
   69    67    73    80   0.15000  1.0 3.0
   73    80    87    88   0.15000  1.0 3.0
   73    80    87    89   0.15000  1.0 3.0
   73    80    87    93   0.56750  1.0 1.0
   73    80    87    93  -0.07550 -1.0 2.0
   73    80    87    93   0.20000  1.0 3.0
   74    73    80    81   0.15000  1.0 3.0
   74    73    80    82   0.15000  1.0 3.0
   74    73    80    87   0.15000  1.0 3.0
   75    73    80    81   0.15000  1.0 3.0
   75    73    80    82   0.15000  1.0 3.0
   75    73    80    87   0.15000  1.0 3.0
   80    87    93    94   0.15000  1.0 3.0
   80    87    93    95   0.15000  1.0 3.0
   80    87    93    96   0.15000  1.0 3.0
   81    80    87    88   0.15000  1.0 3.0
   81    80    87    89   0.15000  1.0 3.0
   81    80    87    93   0.15000  1.0 3.0
   82    80    87    88   0.15000  1.0 3.0
   82    80    87    89   0.15000  1.0 3.0
   82    80    87    93   0.15000  1.0 3.0
   88    87    93    94   0.15000  1.0 3.0
   88    87    93    95   0.15000  1.0 3.0
   88    87    93    96   0.15000  1.0 3.0
   89    87    93    94   0.15000  1.0 3.0
   89    87    93    95   0.15000  1.0 3.0
   89    87    93    96   0.15000  1.0 3.0
   60    54    57    58   0.23400  1.0 3.0
   60    54    57    59   0.23400  1.0 3.0
   60    54    57    67   0.86500  1.0 1.0
   60    54    57    67  -0.17500 -1.0 2.0
   60    54    57    67   0.20800  1.0 3.0
   51    47    49    50   0.23400  1.0 3.0
   51    47    49    53   1.05650  1.0 1.0
   51    47    49    53   0.15600 -1.0 2.0
   51    47    49    53   0.53150  1.0 3.0
   51    47    49    54   0.86500  1.0 1.0
   51    47    49    54  -0.17500 -1.0 2.0
   51    47    49    54   0.20800  1.0 3.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    34    35  10.50000 -1.0 2.0
   33    42    37    38  10.50000 -1.0 2.0
   42    45    43    44  10.50000 -1.0 2.0
   49    76    53    56   1.10000 -1.0 2.0
   62    64    56    53   1.10000 -1.0 2.0
   56    70    62    63  10.50000 -1.0 2.0
   53    70    76    77  10.50000 -1.0 2.0
   90    98    97    99   1.10000 -1.0 2.0
  101   100    99    97   1.10000 -1.0 2.0
   99   103   101   102  10.50000 -1.0 2.0
END
