* LIGAND DATABASE FILE (OPLS2005)
*
001      84    87    168    279     511
    1     0 S   NP   _N1_     1    28.73247    93.85336   -21.26483
    2     1 S   H    _HN1     2     1.02960    94.30543    33.91362
    3     1 S   H    _H1_     3     1.02833    25.31751   155.84977
    4     1 S   H    _H2_     4     1.02775    92.27437   -74.66892
    5     1 S   CT   _CA1     5     1.50147   136.02327   159.41314
    6     5 S   HC   _HA1     6     1.09578   105.20544    57.59728
    7     5 S   CO3  _C1_     7     1.53791   112.27447   -62.52361
    8     7 S   O2Z  _O11     8     1.26363   114.98173   -45.08748
    9     7 S   O2Z  _O12     9     1.26237   114.88743   133.79184
   10     5 S   CT   _CB1    10     1.53069   107.38461   175.41431
   11    10 S   HC   HB11    11     1.09823   109.27443   -50.76054
   12    10 S   HC   HB12    12     1.09822   110.44940    65.77185
   13    10 S   CT   _CG1    13     1.53006   112.70901  -171.88978
   14    13 S   HC   HG11    14     1.09563   110.36656   -63.76249
   15    13 S   HC   HG12    15     1.09645   110.06603    55.42246
   16    13 S   C    _CD1    16     1.51830   112.21337   175.58266
   17    16 S   O    _OE1    17     1.22743   123.21356    -5.81214
   18    16 S   N    _N2_    18     1.38624   111.74585   174.69363
   19    18 S   H    _HN2    19     1.01600   118.99150     0.22814
   20    18 S   CT1  _CA2    20     1.46278   123.33420  -179.44893
   21    20 S   HC   _HA2    21     1.09739   109.34889   -12.74110
   22    20 S   C    _C2_    22     1.53430   108.44284  -128.41951
   23    22 S   O    _O2_    23     1.23018   122.17912  -146.72304
   24    20 S   CT   _CB2    32     1.53590   111.40626   109.34868
   25    24 S   HC   HB21    33     1.09260   109.08958    57.11225
   26    24 S   HC   HB22    34     1.09504   110.05710   175.35464
   27    22 S   N    _N3_    24     1.38488   113.39475    40.67244
   28    27 S   H    _HN3    25     1.01532   118.88963    -0.86343
   29    24 S   S    _SG2    35     1.82981   111.06547   -65.83327
   30    27 S   CT   _CA3    26     1.45456   123.57246   175.16045
   31    30 S   HC   HA31    27     1.09515   109.38803    21.27053
   32    30 S   HC   HA32    28     1.09501   107.08393   138.29354
   33    29 S   CT   _C10    36     1.89683   103.93216   156.69628
   34    30 S   CO3  _C3_    29     1.52916   113.01333  -102.31482
   35    34 S   O2Z  _O31    30     1.26412   115.36800   -45.36081
   36    34 S   O2Z  _O32    31     1.26349   115.00823   135.55278
   37    33 S   CT   _C9_    37     1.54849   104.73538   -70.09559
   38    37 S   HC   _H12    38     1.09474   111.89321   173.73446
   39    37 S   HC   _H13    39     1.09446   112.14257    56.53384
   40    33 S   CT   _C11    71     1.54432   108.97982    48.14987
   41    40 S   HC   _H14    72     1.09498   111.95274   -53.57193
   42    40 S   HC   _H15    73     1.09762   109.41759  -168.08547
   43    37 S   CO4  _C8_    40     1.51765   111.79433   -65.06551
   44    43 S   O    _O33    41     1.23183   120.78503   138.13672
   45    43 S   CT   _C7_    42     1.51325   117.97692   -47.47898
   46    45 S   HC   _H10    43     1.09638   108.26971   161.76269
   47    45 S   HC   _H11    44     1.09458   108.03392   -82.77605
   48    45 S   CT   _C6_    45     1.53322   113.46697    40.92046
   49    48 S   HC   _H8_    46     1.09297   106.94861    77.59476
   50    48 S   HC   _H9_    47     1.09459   107.46759  -169.19695
   51    33 S   CT   _C5_    48     1.62326   112.87987   171.10662
   52    51 S   CT   _C14    49     1.62927   112.18759   -70.58250
   53    51 S   CT   _C4_    81     1.57825   109.32087   170.63160
   54    53 S   HC   _H5_    82     1.09102   113.30340    58.44397
   55    53 S   HC   _H6_    83     1.09212   113.31711   -61.72168
   56    53 S   HC   _H7_    84     1.09249   112.08644   179.84677
   57    52 S   CO4  _C15    50     1.57607   114.94678  -171.65463
   58    57 S   O    _O34    51     1.23288   122.48980   -22.59811
   59    52 S   CT   _C13    66     1.59018   107.53478   -52.09733
   60    59 S   HC   _H3_    67     1.09379   108.11153   -58.71020
   61    52 S   S    _S1_    78     1.89388   114.36859    69.39777
   62    57 S   CT   _C16    52     1.53551   118.70885   163.59055
   63    62 S   HC   _H18    53     1.09548   108.97632    73.97273
   64    62 S   HC   _H19    54     1.09694   108.50587  -170.70768
   65    59 S   CT   _C12    68     1.53299   113.17275    56.48694
   66    65 S   HC   _H16    69     1.09658   109.74882  -177.96837
   67    65 S   HC   _H17    70     1.09452   111.42544    64.97923
   68    61 S   CZ   _C23    79     1.69040   102.88630    78.50069
   69    68 S   NZ   _N4_    80     1.15997   179.13861   161.47101
   70    62 S   CT   _C17    55     1.51778   110.82411   -49.32441
   71    70 S   CO4  _C21    56     1.51799   116.67604   165.87989
   72    71 S   O    _O35    57     1.22373   124.68054    38.89790
   73    70 S   CT   _C22    74     1.54135   110.20413   -72.49622
   74    73 S   HC   _H24    75     1.09411   112.57870    55.26894
   75    73 S   HC   _H25    76     1.09712   110.20783   -64.04903
   76    73 S   HC   _H26    77     1.09461   112.62140   177.36887
   77    71 S   CT   _C20    58     1.51902   111.38695  -142.51751
   78    77 S   HC   _H22    59     1.09375   108.85698   119.05855
   79    77 S   HC   _H23    60     1.09201   111.07707  -118.50986
   80    77 S   CT   _C19    61     1.53572   102.95170     1.09593
   81    80 S   HC   _H20    62     1.09459   110.93692   146.57808
   82    80 S   HC   _H21    63     1.09517   111.11664   -93.67987
   83    70 S   CT   _C18    64     1.54493   108.49756    56.40517
   84    83 S   HC   _H4_    65     1.09965   109.22237    53.73100
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  13   5   4   3
  24   2   1   1  15   6   5  13   6   5   8   4   8   5   4  11
   4   3  14  21   6   2   1   1  13   6  16   8   5  13   5   4
   6   2   1   1   1  14  13   6   7   3   2   1   7   5   4   4
   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    51    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    43    48    51    52    65    40    41    42    53  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    43    44    45    48    49    50    51    52    57    59    65    66    67    40    41    42    61    53    54    55    56  
   35    36  
   36  
    0  
   38    39    43    44    45    46    47    48    51    52    65    40    41    42    53  
   39    43    44    45    51    40  
   43    44    45    51    40  
   41    42    53    43    48    51    52    59    60    65    66    67    83  
   42    51    59    65    66    67  
   51    59    65    66    67  
   44    45    46    47    48    49    50    51  
   45    46    47    48  
   46    47    48    49    50    51    52    53  
   47    48    49    50    51  
   48    49    50    51  
   49    50    51    52    57    59    61    53    54    55    56  
   50    51    52    53  
   51    52    53  
   52    57    58    62    83    59    60    65    61    68    53    54    55    56  
   57    58    62    63    64    70    80    83    84    59    60    65    66    67    61    68    69    53    54    55    56  
   54    55    56    57    59    61  
   55    56  
   56  
    0  
   58    62    63    64    70    71    83    59    60    65    73    61    68  
   62    63    64    70    59    61  
   60    65    66    67    73    61    68    62    70    71    77    80    81    82    83    84  
   65    66    67    61    70    80    83    84  
   68    69    62    65    83  
   63    64    70    71    72    77    80    83    84    73    74    75    76  
   64    70    71    83    73  
   70    71    83    73  
   66    67    70    80    83    84  
   67    83  
   83  
   69  
    0  
   71    72    77    78    79    80    81    82    83    84    73    74    75    76  
   72    77    78    79    80    81    82    83    84    73    74    75    76  
   77    78    79    80    83    73  
   74    75    76    77    80    83    84  
   75    76    83  
   76    83  
   83  
   78    79    80    81    82    83    84  
   79    80    81    82    83  
   80    81    82    83  
   81    82    83    84  
   82    83    84  
   83    84  
   84  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   45   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.4200   0.0150   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   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   52   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   53   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   58   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   59   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.6000   0.3550  -0.175000   2.0300   1.8000   0.025682759  -1.666211680
   62   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   64   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   65   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.3000   0.0660   0.130000   2.0580   1.8250   0.025318638  -1.264311570
   69   3.2800   0.1700  -0.122500   2.2500   2.0000   0.024786691  -1.117108600
   70   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   71   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   72   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   73   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   79   2.4200   0.0150   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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   268.000  1.529
   33    51   268.000  1.529
   33    40   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    43   317.000  1.522
   43    44   570.000  1.229
   43    45   317.000  1.522
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   268.000  1.529
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   268.000  1.529
   51    52   268.000  1.529
   51    53   268.000  1.529
   52    57   317.000  1.522
   52    59   268.000  1.529
   52    61   222.000  1.810
   57    58   570.000  1.229
   57    62   317.000  1.522
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    70   268.000  1.529
   70    71   317.000  1.522
   70    83   268.000  1.529
   70    73   268.000  1.529
   71    72   570.000  1.229
   71    77   317.000  1.522
   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   268.000  1.529
   83    84   340.000  1.090
   83    59   268.000  1.529
   59    60   340.000  1.090
   59    65   268.000  1.529
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    40   268.000  1.529
   40    41   340.000  1.090
   40    42   340.000  1.090
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    76   340.000  1.090
   61    68   310.000  1.697
   68    69   650.000  1.157
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  111.63000
   29    33    51    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    43    63.00000  111.10000
   33    51    48    58.35000  112.70000
   33    51    52    58.35000  112.70000
   33    51    53    58.35000  112.70000
   33    40    65    58.35000  112.70000
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   37    43    44    80.00000  120.40000
   37    43    45    70.00000  116.00000
   39    37    38    33.00000  107.80000
   43    37    38    35.00000  109.50000
   43    37    39    35.00000  109.50000
   43    45    46    35.00000  109.50000
   43    45    47    35.00000  109.50000
   43    45    48    63.00000  111.10000
   45    43    44    80.00000  120.40000
   45    48    49    37.50000  110.70000
   45    48    50    37.50000  110.70000
   45    48    51    58.35000  112.70000
   47    45    46    33.00000  107.80000
   48    45    46    37.50000  110.70000
   48    45    47    37.50000  110.70000
   48    51    52    58.35000  112.70000
   48    51    53    58.35000  112.70000
   50    48    49    33.00000  107.80000
   51    33    37    58.35000  112.70000
   51    48    49    37.50000  110.70000
   51    48    50    37.50000  110.70000
   51    52    57    63.00000  111.10000
   51    52    59    58.35000  112.70000
   51    52    61    75.00000  111.63000
   51    53    54    37.50000  110.70000
   51    53    55    37.50000  110.70000
   51    53    56    37.50000  110.70000
   52    57    58    80.00000  120.40000
   52    57    62    70.00000  116.00000
   52    59    83    58.35000  112.70000
   52    59    60    37.50000  110.70000
   52    59    65    58.35000  112.70000
   52    61    68    90.00000   99.90000
   57    62    63    35.00000  109.50000
   57    62    64    35.00000  109.50000
   57    62    70    63.00000  111.10000
   62    57    58    80.00000  120.40000
   62    70    71    63.00000  111.10000
   62    70    83    58.35000  112.70000
   62    70    73    58.35000  112.70000
   64    62    63    33.00000  107.80000
   70    62    63    37.50000  110.70000
   70    62    64    37.50000  110.70000
   70    71    72    80.00000  120.40000
   70    71    77    70.00000  116.00000
   70    83    80    58.35000  112.70000
   70    83    84    37.50000  110.70000
   70    83    59    58.35000  112.70000
   70    73    74    37.50000  110.70000
   70    73    75    37.50000  110.70000
   70    73    76    37.50000  110.70000
   71    77    78    35.00000  109.50000
   71    77    79    35.00000  109.50000
   71    77    80    63.00000  111.10000
   77    71    72    80.00000  120.40000
   77    80    81    37.50000  110.70000
   77    80    82    37.50000  110.70000
   77    80    83    58.35000  112.70000
   79    77    78    33.00000  107.80000
   80    77    78    37.50000  110.70000
   80    77    79    37.50000  110.70000
   80    83    84    37.50000  110.70000
   80    83    59    58.35000  112.70000
   82    80    81    33.00000  107.80000
   83    70    71    63.00000  111.10000
   83    80    81    37.50000  110.70000
   83    80    82    37.50000  110.70000
   83    59    60    37.50000  110.70000
   83    59    65    58.35000  112.70000
   59    52    57    63.00000  111.10000
   59    83    84    37.50000  110.70000
   59    65    66    37.50000  110.70000
   59    65    67    37.50000  110.70000
   59    65    40    58.35000  112.70000
   65    59    60    37.50000  110.70000
   65    40    41    37.50000  110.70000
   65    40    42    37.50000  110.70000
   67    65    66    33.00000  107.80000
   40    33    37    58.35000  112.70000
   40    33    51    58.35000  112.70000
   40    65    66    37.50000  110.70000
   40    65    67    37.50000  110.70000
   42    40    41    33.00000  107.80000
   73    70    71    63.00000  111.10000
   73    70    83    58.35000  112.70000
   75    73    74    33.00000  107.80000
   76    73    74    33.00000  107.80000
   76    73    75    33.00000  107.80000
   61    52    57    75.00000  110.18000
   61    52    59    75.00000  111.63000
   61    68    69    35.00000  177.70900
   53    51    52    58.35000  112.70000
   55    53    54    33.00000  107.80000
   56    53    54    33.00000  107.80000
   56    53    55    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    51   0.01700  1.0 1.0
   24    29    33    51  -0.23550 -1.0 2.0
   24    29    33    51   0.21350  1.0 3.0
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.15000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    43   0.56750  1.0 1.0
   29    33    37    43  -0.07550 -1.0 2.0
   29    33    37    43   0.20000  1.0 3.0
   29    33    51    48   0.44750  1.0 1.0
   29    33    51    48  -0.17800 -1.0 2.0
   29    33    51    48   0.20200  1.0 3.0
   29    33    51    52   0.44750  1.0 1.0
   29    33    51    52  -0.17800 -1.0 2.0
   29    33    51    52   0.20200  1.0 3.0
   29    33    51    53   0.44750  1.0 1.0
   29    33    51    53  -0.17800 -1.0 2.0
   29    33    51    53   0.20200  1.0 3.0
   29    33    40    65   0.44750  1.0 1.0
   29    33    40    65  -0.17800 -1.0 2.0
   29    33    40    65   0.20200  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    42   0.15000  1.0 3.0
   33    37    43    44   0.30150 -1.0 2.0
   33    37    43    45   0.60050  1.0 1.0
   33    37    43    45   0.05600 -1.0 2.0
   33    37    43    45   0.26150  1.0 3.0
   33    51    52    57  -0.95700  1.0 1.0
   33    51    52    57  -0.18200 -1.0 2.0
   33    51    52    57   0.29450  1.0 3.0
   33    51    52    59   0.56750  1.0 1.0
   33    51    52    59  -0.07550 -1.0 2.0
   33    51    52    59   0.20000  1.0 3.0
   33    51    52    61   0.44750  1.0 1.0
   33    51    52    61  -0.17800 -1.0 2.0
   33    51    52    61   0.20200  1.0 3.0
   33    51    53    54   0.15000  1.0 3.0
   33    51    53    55   0.15000  1.0 3.0
   33    51    53    56   0.15000  1.0 3.0
   37    33    51    48   0.56750  1.0 1.0
   37    33    51    48  -0.07550 -1.0 2.0
   37    33    51    48   0.20000  1.0 3.0
   37    33    51    52   0.56750  1.0 1.0
   37    33    51    52  -0.07550 -1.0 2.0
   37    33    51    52   0.20000  1.0 3.0
   37    33    51    53   0.56750  1.0 1.0
   37    33    51    53  -0.07550 -1.0 2.0
   37    33    51    53   0.20000  1.0 3.0
   37    33    40    65   0.56750  1.0 1.0
   37    33    40    65  -0.07550 -1.0 2.0
   37    33    40    65   0.20000  1.0 3.0
   37    33    40    41   0.15000  1.0 3.0
   37    33    40    42   0.15000  1.0 3.0
   37    43    45    46   0.00000  1.0 1.0
   37    43    45    47   0.00000  1.0 1.0
   37    43   -45    48   0.60050  1.0 1.0
   37    43   -45    48   0.05600 -1.0 2.0
   37    43   -45    48   0.26150  1.0 3.0
   38    37    43    44   0.00000  1.0 1.0
   38    37    43    45   0.00000  1.0 1.0
   39    37    43    44   0.00000  1.0 1.0
   39    37    43    45   0.00000  1.0 1.0
   43    45    48    49  -0.11250  1.0 3.0
   43    45    48    50  -0.11250  1.0 3.0
   43    45    48    51  -0.95700  1.0 1.0
   43    45    48    51  -0.18200 -1.0 2.0
   43    45    48    51   0.29450  1.0 3.0
   44    43    45    46   0.00000  1.0 1.0
   44    43    45    47   0.00000  1.0 1.0
   44    43    45    48   0.30150 -1.0 2.0
   45    48   -51    33   0.56750  1.0 1.0
   45    48   -51    33  -0.07550 -1.0 2.0
   45    48   -51    33   0.20000  1.0 3.0
   45    48    51    52   0.56750  1.0 1.0
   45    48    51    52  -0.07550 -1.0 2.0
   45    48    51    52   0.20000  1.0 3.0
   45    48    51    53   0.56750  1.0 1.0
   45    48    51    53  -0.07550 -1.0 2.0
   45    48    51    53   0.20000  1.0 3.0
   46    45    48    49   0.15000  1.0 3.0
   46    45    48    50   0.15000  1.0 3.0
   46    45    48    51   0.15000  1.0 3.0
   47    45    48    49   0.15000  1.0 3.0
   47    45    48    50   0.15000  1.0 3.0
   47    45    48    51   0.15000  1.0 3.0
   48    51    52    57  -0.95700  1.0 1.0
   48    51    52    57  -0.18200 -1.0 2.0
   48    51    52    57   0.29450  1.0 3.0
   48    51    52    59   0.56750  1.0 1.0
   48    51    52    59  -0.07550 -1.0 2.0
   48    51    52    59   0.20000  1.0 3.0
   48    51    52    61   0.44750  1.0 1.0
   48    51    52    61  -0.17800 -1.0 2.0
   48    51    52    61   0.20200  1.0 3.0
   48    51    53    54   0.15000  1.0 3.0
   48    51    53    55   0.15000  1.0 3.0
   48    51    53    56   0.15000  1.0 3.0
   49    48    51    33   0.15000  1.0 3.0
   49    48    51    52   0.15000  1.0 3.0
   49    48    51    53   0.15000  1.0 3.0
   50    48    51    33   0.15000  1.0 3.0
   50    48    51    52   0.15000  1.0 3.0
   50    48    51    53   0.15000  1.0 3.0
   51    33    37    38   0.15000  1.0 3.0
   51    33    37    39   0.15000  1.0 3.0
   51    33   -37    43  -0.95700  1.0 1.0
   51    33   -37    43  -0.18200 -1.0 2.0
   51    33   -37    43   0.29450  1.0 3.0
   51    33    40    65   0.56750  1.0 1.0
   51    33    40    65  -0.07550 -1.0 2.0
   51    33    40    65   0.20000  1.0 3.0
   51    33    40    41   0.15000  1.0 3.0
   51    33    40    42   0.15000  1.0 3.0
   51    52    57    58   0.30150 -1.0 2.0
   51    52    57    62   0.60050  1.0 1.0
   51    52    57    62   0.05600 -1.0 2.0
   51    52    57    62   0.26150  1.0 3.0
   51    52    59    83   0.56750  1.0 1.0
   51    52    59    83  -0.07550 -1.0 2.0
   51    52    59    83   0.20000  1.0 3.0
   51    52    59    60   0.15000  1.0 3.0
   51    52   -59    65   0.56750  1.0 1.0
   51    52   -59    65  -0.07550 -1.0 2.0
   51    52   -59    65   0.20000  1.0 3.0
   51    52    61    68   0.00000  1.0 1.0
   52    51    53    54   0.15000  1.0 3.0
   52    51    53    55   0.15000  1.0 3.0
   52    51    53    56   0.15000  1.0 3.0
   52    57    62    63   0.00000  1.0 1.0
   52    57    62    64   0.00000  1.0 1.0
   52    57    62    70   0.60050  1.0 1.0
   52    57    62    70   0.05600 -1.0 2.0
   52    57    62    70   0.26150  1.0 3.0
   52    59    65    66   0.15000  1.0 3.0
   52    59    65    67   0.15000  1.0 3.0
   52    59    65    40   0.56750  1.0 1.0
   52    59    65    40  -0.07550 -1.0 2.0
   52    59    65    40   0.20000  1.0 3.0
   52    61    68    69   0.00000  1.0 1.0
   57    52    59    83  -0.95700  1.0 1.0
   57    52    59    83  -0.18200 -1.0 2.0
   57    52    59    83   0.29450  1.0 3.0
   57    52    59    60  -0.11250  1.0 3.0
   57    52    59    65  -0.95700  1.0 1.0
   57    52    59    65  -0.18200 -1.0 2.0
   57    52    59    65   0.29450  1.0 3.0
   57    52    61    68   0.00000  1.0 1.0
   57    62    70    71   0.11950  1.0 1.0
   57    62    70    71   0.20300 -1.0 2.0
   57    62    70    71  -0.70800  1.0 3.0
   57    62   -70    83  -0.95700  1.0 1.0
   57    62   -70    83  -0.18200 -1.0 2.0
   57    62   -70    83   0.29450  1.0 3.0
   57    62    70    73  -0.95700  1.0 1.0
   57    62    70    73  -0.18200 -1.0 2.0
   57    62    70    73   0.29450  1.0 3.0
   58    57    62    63   0.00000  1.0 1.0
   58    57    62    64   0.00000  1.0 1.0
   58    57    62    70   0.30150 -1.0 2.0
   62    70    71    72   0.30150 -1.0 2.0
   62    70    71    77   0.60050  1.0 1.0
   62    70    71    77   0.05600 -1.0 2.0
   62    70    71    77   0.26150  1.0 3.0
   62    70    83    80   0.56750  1.0 1.0
   62    70    83    80  -0.07550 -1.0 2.0
   62    70    83    80   0.20000  1.0 3.0
   62    70    83    84   0.15000  1.0 3.0
   62    70    83    59   0.56750  1.0 1.0
   62    70    83    59  -0.07550 -1.0 2.0
   62    70    83    59   0.20000  1.0 3.0
   62    70    73    74   0.15000  1.0 3.0
   62    70    73    75   0.15000  1.0 3.0
   62    70    73    76   0.15000  1.0 3.0
   63    62    70    71  -0.11250  1.0 3.0
   63    62    70    83   0.15000  1.0 3.0
   63    62    70    73   0.15000  1.0 3.0
   64    62    70    71  -0.11250  1.0 3.0
   64    62    70    83   0.15000  1.0 3.0
   64    62    70    73   0.15000  1.0 3.0
   70    71    77    78   0.00000  1.0 1.0
   70    71    77    79   0.00000  1.0 1.0
   70    71   -77    80   0.60050  1.0 1.0
   70    71   -77    80   0.05600 -1.0 2.0
   70    71   -77    80   0.26150  1.0 3.0
   70    83   -59    52   0.56750  1.0 1.0
   70    83   -59    52  -0.07550 -1.0 2.0
   70    83   -59    52   0.20000  1.0 3.0
   70    83    59    60   0.15000  1.0 3.0
   70    83    59    65   0.56750  1.0 1.0
   70    83    59    65  -0.07550 -1.0 2.0
   70    83    59    65   0.20000  1.0 3.0
   71    70   -83    80  -0.95700  1.0 1.0
   71    70   -83    80  -0.18200 -1.0 2.0
   71    70   -83    80   0.29450  1.0 3.0
   71    70    83    84  -0.11250  1.0 3.0
   71    70    83    59  -0.95700  1.0 1.0
   71    70    83    59  -0.18200 -1.0 2.0
   71    70    83    59   0.29450  1.0 3.0
   71    70    73    74  -0.11250  1.0 3.0
   71    70    73    75  -0.11250  1.0 3.0
   71    70    73    76  -0.11250  1.0 3.0
   71    77    80    81  -0.11250  1.0 3.0
   71    77    80    82  -0.11250  1.0 3.0
   71    77   -80    83  -0.95700  1.0 1.0
   71    77   -80    83  -0.18200 -1.0 2.0
   71    77   -80    83   0.29450  1.0 3.0
   72    71    77    78   0.00000  1.0 1.0
   72    71    77    79   0.00000  1.0 1.0
   72    71    77    80   0.30150 -1.0 2.0
   77    80   -83    70   0.56750  1.0 1.0
   77    80   -83    70  -0.07550 -1.0 2.0
   77    80   -83    70   0.20000  1.0 3.0
   77    80    83    84   0.15000  1.0 3.0
   77    80    83    59   0.56750  1.0 1.0
   77    80    83    59  -0.07550 -1.0 2.0
   77    80    83    59   0.20000  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    59    52   0.56750  1.0 1.0
   80    83    59    52  -0.07550 -1.0 2.0
   80    83    59    52   0.20000  1.0 3.0
   80    83    59    60   0.15000  1.0 3.0
   80    83    59    65   0.56750  1.0 1.0
   80    83    59    65  -0.07550 -1.0 2.0
   80    83    59    65   0.20000  1.0 3.0
   81    80    83    70   0.15000  1.0 3.0
   81    80    83    84   0.15000  1.0 3.0
   81    80    83    59   0.15000  1.0 3.0
   82    80    83    70   0.15000  1.0 3.0
   82    80    83    84   0.15000  1.0 3.0
   82    80    83    59   0.15000  1.0 3.0
   83    70    71    72   0.30150 -1.0 2.0
   83    70   -71    77   0.60050  1.0 1.0
   83    70   -71    77   0.05600 -1.0 2.0
   83    70   -71    77   0.26150  1.0 3.0
   83    70    73    74   0.15000  1.0 3.0
   83    70    73    75   0.15000  1.0 3.0
   83    70    73    76   0.15000  1.0 3.0
   83    59    65    66   0.15000  1.0 3.0
   83    59    65    67   0.15000  1.0 3.0
   83    59    65    40   0.56750  1.0 1.0
   83    59    65    40  -0.07550 -1.0 2.0
   83    59    65    40   0.20000  1.0 3.0
   84    83    59    52   0.15000  1.0 3.0
   84    83    59    60   0.15000  1.0 3.0
   84    83    59    65   0.15000  1.0 3.0
   59    52    57    58   0.30150 -1.0 2.0
   59    52   -57    62   0.60050  1.0 1.0
   59    52   -57    62   0.05600 -1.0 2.0
   59    52   -57    62   0.26150  1.0 3.0
   59    52    61    68   0.00000  1.0 1.0
   59    65   -40    33   0.56750  1.0 1.0
   59    65   -40    33  -0.07550 -1.0 2.0
   59    65   -40    33   0.20000  1.0 3.0
   59    65    40    41   0.15000  1.0 3.0
   59    65    40    42   0.15000  1.0 3.0
   60    59    65    66   0.15000  1.0 3.0
   60    59    65    67   0.15000  1.0 3.0
   60    59    65    40   0.15000  1.0 3.0
   66    65    40    33   0.15000  1.0 3.0
   66    65    40    41   0.15000  1.0 3.0
   66    65    40    42   0.15000  1.0 3.0
   67    65    40    33   0.15000  1.0 3.0
   67    65    40    41   0.15000  1.0 3.0
   67    65    40    42   0.15000  1.0 3.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    43  -0.95700  1.0 1.0
   40    33    37    43  -0.18200 -1.0 2.0
   40    33    37    43   0.29450  1.0 3.0
   40    33    51    48   0.56750  1.0 1.0
   40    33    51    48  -0.07550 -1.0 2.0
   40    33    51    48   0.20000  1.0 3.0
   40    33   -51    52   0.56750  1.0 1.0
   40    33   -51    52  -0.07550 -1.0 2.0
   40    33   -51    52   0.20000  1.0 3.0
   40    33    51    53   0.56750  1.0 1.0
   40    33    51    53  -0.07550 -1.0 2.0
   40    33    51    53   0.20000  1.0 3.0
   73    70    71    72   0.30150 -1.0 2.0
   73    70    71    77   0.60050  1.0 1.0
   73    70    71    77   0.05600 -1.0 2.0
   73    70    71    77   0.26150  1.0 3.0
   73    70    83    80   0.56750  1.0 1.0
   73    70    83    80  -0.07550 -1.0 2.0
   73    70    83    80   0.20000  1.0 3.0
   73    70    83    84   0.15000  1.0 3.0
   73    70    83    59   0.56750  1.0 1.0
   73    70    83    59  -0.07550 -1.0 2.0
   73    70    83    59   0.20000  1.0 3.0
   61    52    57    58   0.30150 -1.0 2.0
   61    52    57    62   0.65300  1.0 1.0
   61    52    57    62  -0.03850 -1.0 2.0
   61    52    57    62   0.33900  1.0 3.0
   61    52    59    83   0.44750  1.0 1.0
   61    52    59    83  -0.17800 -1.0 2.0
   61    52    59    83   0.20200  1.0 3.0
   61    52    59    60   0.15000  1.0 3.0
   61    52    59    65   0.44750  1.0 1.0
   61    52    59    65  -0.17800 -1.0 2.0
   61    52    59    65   0.20200  1.0 3.0
   53    51    52    57  -0.95700  1.0 1.0
   53    51    52    57  -0.18200 -1.0 2.0
   53    51    52    57   0.29450  1.0 3.0
   53    51    52    59   0.56750  1.0 1.0
   53    51    52    59  -0.07550 -1.0 2.0
   53    51    52    59   0.20000  1.0 3.0
   53    51    52    61   0.44750  1.0 1.0
   53    51    52    61  -0.17800 -1.0 2.0
   53    51    52    61   0.20200  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   37    45    43    44  10.50000 -1.0 2.0
   52    62    57    58  10.50000 -1.0 2.0
   70    77    71    72  10.50000 -1.0 2.0
END
