* LIGAND DATABASE FILE (OPLS2005)
*
001      87    90    172    286     524
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02073    94.81521    31.92896
    3     1 S   H    _H1_     3     1.02089    33.74493   148.78029
    4     1 S   H    _H2_     4     1.02173    85.25447   -76.49765
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08491   110.62044    58.69465
   26    24 S   HC   HB22    34     1.08584   110.00631   179.14591
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CT   _C21    36     1.86066    96.68777  -158.14854
   34    33 S   HC   _H6_    37     1.08378   106.02860    31.60754
   35    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   36    35 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   37    35 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   38    33 S   CM   _C20    38     1.51158   104.46602   -79.99311
   39    38 S   CM   _C19    39     1.33992   121.50396  -100.14128
   40    38 S   OH   _O34    86     1.38208   117.35773    78.48082
   41    40 S   HO   _H30    87     0.96061   109.47086     1.40333
   42    39 S   CM   _C18    40     1.44294   121.15092    -4.38570
   43    42 S   HC   _H26    41     1.07660   117.23056   166.18431
   44    39 S   OH   _O35    84     1.37877   121.65452   177.61460
   45    44 S   HO   _H31    85     0.96440   109.98981   178.03049
   46    42 S   CM   _C17    42     1.34655   121.55578   -13.48903
   47    46 S   CT   _C16    43     1.50573   119.60836  -161.18634
   48    47 S   HC   _H24    44     1.07795   110.28447  -136.23477
   49    47 S   HC   _H25    45     1.07922   111.98831   -15.31190
   50    47 S   CT   _C15    46     1.53043   107.70139   103.88060
   51    50 S   HC   _H22    47     1.10075   108.31315   175.14873
   52    50 S   HC   _H23    48     1.10228   109.37886   -69.61219
   53    50 S   CT   _C9_    49     1.54198   112.79591    53.02990
   54    53 S   HC   _H4_    50     1.10831   107.22303    69.05270
   55    53 S   CT   _C8_    51     1.57899   112.50562   -50.35123
   56    55 S   HC   _H3_    52     1.09036   105.72555   -63.58531
   57    55 S   CT   _C7_    53     1.55263   110.71852  -178.06386
   58    57 S   HC   _H12    54     1.08868   110.96669   -71.26802
   59    57 S   HC   _H13    55     1.09076   109.74198   170.12825
   60    33 S   CT   _C22    79     1.59517   115.67982   153.72412
   61    57 S   CT   _C6_    56     1.54200   113.07386    51.87892
   62    61 S   HC   _H10    57     1.09756   107.36886    68.00387
   63    61 S   HC   _H11    58     1.09736   109.59533  -176.91783
   64    60 S   CT   _C23    80     1.55294   110.01219   -32.67027
   65    64 S   HC   _H27    81     1.07983   108.51489   -57.58456
   66    64 S   HC   _H28    82     1.08026   108.46701  -177.57780
   67    64 S   HC   _H29    83     1.07967   108.50267    62.42933
   68    61 S   CT   _C5_    59     1.53651   112.21219   -53.79320
   69    53 S   CT   _C10    60     1.53469   111.71943  -172.71778
   70    69 S   HC   _H5_    61     1.10117   106.19953    66.04777
   71    68 S   CT   _C4_    75     1.55747   108.50879   -67.44369
   72    71 S   HC   _H7_    76     1.07890   108.37948  -179.97202
   73    71 S   HC   _H8_    77     1.07918   108.37147    59.97146
   74    71 S   HC   _H9_    78     1.07918   108.28051   -60.04078
   75    69 S   CT   _C11    62     1.52433   118.65355   -53.65886
   76    75 S   HC   _H14    63     1.09526   111.90249    79.26408
   77    75 S   HC   _H15    64     1.09480   111.57052   -41.25385
   78    75 S   CT   _C12    65     1.53990   104.61878  -160.43569
   79    78 S   HC   _H16    66     1.09627   109.98417   130.57852
   80    78 S   HC   _H17    67     1.09630   110.23955  -112.28611
   81    68 S   CT   _C13    68     1.56034   117.08318   168.33907
   82    81 S   CT   _C14    69     1.53514   115.39287   -35.10721
   83    82 S   HC   _H18    70     1.08589   109.44979    63.28649
   84    82 S   HC   _H19    71     1.08690   109.44905   -56.66966
   85    82 S   HC   _H20    72     1.08601   109.48435  -176.67333
   86    81 S   OH   _O33    73     1.42610   111.09599    86.33985
   87    86 S   HO   _H21    74     0.96923   106.52769   173.50792
  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   9   5   4   3
  18   7   2   1   1  11   9   4   1  11   4   2   1  15  11   6
   5  12   5   4  18   8  16   7  11   6   5   6  14   5   4   3
   2   1   1  19  14   6   8   3   2   1   8   5   4   9   4   3
   6   5   3   2   1   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    60    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    46    55    60    64    40  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    42    46    47    53    55    56    57    60    64    65    66    67    44    40    41  
   38    39    46    55    60    64    40  
   36    37  
   37  
    0  
   39    42    43    46    55    60    64    44    45    40    41  
   42    43    46    47    60    44    45    40    41  
   41    42    44    60  
    0  
   43    46    47    48    49    50    55    60    64    44    45  
   46    47    60    44  
   45    46  
    0  
   47    48    49    50    51    52    53    55    56    57    60    64    65    66    67  
   48    49    50    51    52    53    54    55    69    60    64  
   49    50    51    52    53    60  
   50    51    52    53    60  
   51    52    53    54    55    56    57    68    69    70    75    60  
   52    53    54    55    69  
   53    54    55    69  
   54    55    56    57    58    59    61    68    69    70    75    76    77    78    81    71    60    64  
   55    56    57    68    69    70    75    60  
   56    57    58    59    61    62    63    68    69    70    75    60    64    65    66    67  
   57    58    59    61    69    60    64  
   58    59    61    62    63    68    69    81    71    60    64  
   59    61    62    63    68    60  
   61    62    63    68    60  
   64    65    66    67    61    69  
   62    63    68    69    70    75    78    81    82    86    71    72    73    74  
   63    68    69    81    71  
   68    69    81    71  
   65    66    67  
   66    67  
   67  
    0  
   69    70    75    76    77    78    79    80    81    82    83    84    85    86    87    71    72    73    74  
   70    75    76    77    78    79    80    81    82    86    71    72    73    74  
   75    76    77    78    81    71  
   72    73    74    75    78    81    82    86  
   73    74    81  
   74    81  
   81  
   76    77    78    79    80    81    82    86  
   77    78    79    80    81  
   78    79    80    81  
   79    80    81    82    83    84    85    86    87  
   80    81    82    86  
   81    82    86  
   82    83    84    85    86    87  
   83    84    85    86    87  
   84    85    86  
   85    86  
   86  
   87  
    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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   40   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   41   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   42   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   43   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   44   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   45   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   46   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   47   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   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   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   61   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   69   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   78   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   82   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   87   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    60   268.000  1.529
   38    39   549.000  1.340
   38    40   510.000  1.338
   39    42   380.000  1.444
   39    44   510.000  1.338
   42    43   340.000  1.080
   42    46   549.000  1.340
   46    47   317.000  1.510
   46    60   317.000  1.510
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    50   268.000  1.529
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   268.000  1.529
   53    54   340.000  1.090
   53    55   268.000  1.529
   53    69   268.000  1.529
   55    56   340.000  1.090
   55    57   268.000  1.529
   55    60   268.000  1.529
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    61   268.000  1.529
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    68   268.000  1.529
   68    69   268.000  1.529
   68    81   268.000  1.529
   68    71   268.000  1.529
   69    70   340.000  1.090
   69    75   268.000  1.529
   75    76   340.000  1.090
   75    77   340.000  1.090
   75    78   268.000  1.529
   78    79   340.000  1.090
   78    80   340.000  1.090
   78    81   268.000  1.529
   81    82   268.000  1.529
   81    86   320.000  1.410
   82    83   340.000  1.090
   82    84   340.000  1.090
   82    85   340.000  1.090
   86    87   553.000  0.945
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   340.000  1.090
   60    64   268.000  1.529
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   340.000  1.090
   44    45   553.000  0.945
   40    41   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    60    75.00000  111.63000
   33    38    39    70.00000  124.00000
   33    38    40    90.00000  109.34000
   33    60    46    70.00000  112.02700
   33    60    55    58.35000  112.70000
   33    60    64    58.35000  112.70000
   38    33    34    35.00000  109.50000
   38    39    42    70.00000  123.01800
   38    39    44    80.00000  121.38400
   38    40    41    70.00000  107.45700
   39    42    43    35.00000  120.00000
   39    42    46    70.00000  123.01800
   39    44    45    70.00000  107.45700
   42    46    47    70.00000  124.00000
   42    46    60    70.00000  124.00000
   46    42    43    35.00000  120.00000
   46    47    48    35.00000  109.50000
   46    47    49    35.00000  109.50000
   46    47    50    70.00000  112.02700
   46    60    55    70.00000  112.02700
   46    60    64    70.00000  112.02700
   47    50    51    37.50000  110.70000
   47    50    52    37.50000  110.70000
   47    50    53    58.35000  112.70000
   49    47    48    33.00000  107.80000
   50    47    48    37.50000  110.70000
   50    47    49    37.50000  110.70000
   50    53    54    37.50000  110.70000
   50    53    55    58.35000  112.70000
   50    53    69    58.35000  112.70000
   52    50    51    33.00000  107.80000
   53    50    51    37.50000  110.70000
   53    50    52    37.50000  110.70000
   53    55    56    37.50000  110.70000
   53    55    57    58.35000  112.70000
   53    55    60    58.35000  112.70000
   53    69    68    58.35000  112.70000
   53    69    70    37.50000  110.70000
   53    69    75    58.35000  112.70000
   55    53    54    37.50000  110.70000
   55    57    58    37.50000  110.70000
   55    57    59    37.50000  110.70000
   55    57    61    58.35000  112.70000
   55    60    64    58.35000  112.70000
   57    55    56    37.50000  110.70000
   57    61    62    37.50000  110.70000
   57    61    63    37.50000  110.70000
   57    61    68    58.35000  112.70000
   59    57    58    33.00000  107.80000
   61    57    58    37.50000  110.70000
   61    57    59    37.50000  110.70000
   61    68    69    58.35000  112.70000
   61    68    81    58.35000  112.70000
   61    68    71    58.35000  112.70000
   63    61    62    33.00000  107.80000
   68    61    62    37.50000  110.70000
   68    61    63    37.50000  110.70000
   68    69    70    37.50000  110.70000
   68    69    75    58.35000  112.70000
   68    81    78    58.35000  112.70000
   68    81    82    58.35000  112.70000
   68    81    86    50.00000  109.50000
   68    71    72    37.50000  110.70000
   68    71    73    37.50000  110.70000
   68    71    74    37.50000  110.70000
   69    53    54    37.50000  110.70000
   69    53    55    58.35000  112.70000
   69    75    76    37.50000  110.70000
   69    75    77    37.50000  110.70000
   69    75    78    58.35000  112.70000
   75    69    70    37.50000  110.70000
   75    78    79    37.50000  110.70000
   75    78    80    37.50000  110.70000
   75    78    81    58.35000  112.70000
   77    75    76    33.00000  107.80000
   78    75    76    37.50000  110.70000
   78    75    77    37.50000  110.70000
   78    81    82    58.35000  112.70000
   78    81    86    50.00000  109.50000
   80    78    79    33.00000  107.80000
   81    68    69    58.35000  112.70000
   81    78    79    37.50000  110.70000
   81    78    80    37.50000  110.70000
   81    82    83    37.50000  110.70000
   81    82    84    37.50000  110.70000
   81    82    85    37.50000  110.70000
   81    86    87    55.00000  108.50000
   84    82    83    33.00000  107.80000
   85    82    83    33.00000  107.80000
   85    82    84    33.00000  107.80000
   86    81    82    50.00000  109.50000
   71    68    69    58.35000  112.70000
   71    68    81    58.35000  112.70000
   73    71    72    33.00000  107.80000
   74    71    72    33.00000  107.80000
   74    71    73    33.00000  107.80000
   60    33    34    37.50000  110.70000
   60    33    38    70.00000  112.02700
   60    46    47    65.00000  117.92700
   60    55    56    37.50000  110.70000
   60    55    57    58.35000  112.70000
   60    64    65    37.50000  110.70000
   60    64    66    37.50000  110.70000
   60    64    67    37.50000  110.70000
   66    64    65    33.00000  107.80000
   67    64    65    33.00000  107.80000
   67    64    66    33.00000  107.80000
   44    39    42    80.00000  121.38400
   40    38    39    80.00000  121.38400
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    60   0.01700  1.0 1.0
   24    29    33    60  -0.23550 -1.0 2.0
   24    29    33    60   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    38    39   0.42700  1.0 1.0
   29    33    38    39  -0.70350 -1.0 2.0
   29    33    38    39  -0.43150  1.0 3.0
   29    33    38    40   0.09700  1.0 1.0
   29    33    38    40   0.15600 -1.0 2.0
   29    33    38    40  -0.50800  1.0 3.0
   29    33    60    46   0.56750  1.0 1.0
   29    33    60    46  -0.07550 -1.0 2.0
   29    33    60    46   0.20000  1.0 3.0
   29    33    60    55   0.44750  1.0 1.0
   29    33    60    55  -0.17800 -1.0 2.0
   29    33    60    55   0.20200  1.0 3.0
   29    33    60    64   0.44750  1.0 1.0
   29    33    60    64  -0.17800 -1.0 2.0
   29    33    60    64   0.20200  1.0 3.0
   33    38    39    42   7.00000 -1.0 2.0
   33    38    39    44   7.00000 -1.0 2.0
   33    38    40    41   2.00000 -1.0 2.0
   33    60    64    65   0.15000  1.0 3.0
   33    60    64    66   0.15000  1.0 3.0
   33    60    64    67   0.15000  1.0 3.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    60    46   0.15000  1.0 3.0
   34    33    60    55   0.15000  1.0 3.0
   34    33    60    64   0.15000  1.0 3.0
   38    33    60    46   0.31000  1.0 1.0
   38    33    60    46   0.14700 -1.0 2.0
   38    33    60    46   0.07550  1.0 3.0
   38    33    60    55   0.34400  1.0 1.0
   38    33    60    55   0.09450 -1.0 2.0
   38    33    60    55   0.11100  1.0 3.0
   38    33    60    64   0.34400  1.0 1.0
   38    33    60    64   0.09450 -1.0 2.0
   38    33    60    64   0.11100  1.0 3.0
   38    39    42    43  -0.18600  1.0 3.0
   38    39   -42    46   0.28850  1.0 1.0
   38    39   -42    46   2.61350 -1.0 2.0
   38    39   -42    46   0.78400  1.0 3.0
   38    39    44    45  -0.66100  1.0 1.0
   38    39    44    45   1.20850 -1.0 2.0
   38    39    44    45  -0.36000  1.0 3.0
   39    38    40    41  -0.66100  1.0 1.0
   39    38    40    41   1.20850 -1.0 2.0
   39    38    40    41  -0.36000  1.0 3.0
   39    42    46    47   7.00000 -1.0 2.0
   39    42    46    60   7.00000 -1.0 2.0
   42    39    44    45  -0.66100  1.0 1.0
   42    39    44    45   1.20850 -1.0 2.0
   42    39    44    45  -0.36000  1.0 3.0
   42    46    47    48   0.00000  1.0 1.0
   42    46    47    49   0.00000  1.0 1.0
   42    46    47    50   0.09850  1.0 1.0
   42    46    47    50   0.15250 -1.0 2.0
   42    46    47    50  -0.50650  1.0 3.0
   42    46   -60    33   0.09850  1.0 1.0
   42    46   -60    33   0.15250 -1.0 2.0
   42    46   -60    33  -0.50650  1.0 3.0
   42    46    60    55   0.09850  1.0 1.0
   42    46    60    55   0.15250 -1.0 2.0
   42    46    60    55  -0.50650  1.0 3.0
   42    46    60    64   0.09850  1.0 1.0
   42    46    60    64   0.15250 -1.0 2.0
   42    46    60    64  -0.50650  1.0 3.0
   43    42    46    47   7.00000 -1.0 2.0
   43    42    46    60   7.00000 -1.0 2.0
   46    47    50    51   0.15000  1.0 3.0
   46    47    50    52   0.15000  1.0 3.0
   46    47    50    53   0.34400  1.0 1.0
   46    47    50    53   0.09450 -1.0 2.0
   46    47    50    53   0.11100  1.0 3.0
   46    60    64    65   0.15000  1.0 3.0
   46    60    64    66   0.15000  1.0 3.0
   46    60    64    67   0.15000  1.0 3.0
   47    46    60    33   0.46850  1.0 1.0
   47    46    60    33   0.08550 -1.0 2.0
   47    46    60    33   0.09800  1.0 3.0
   47    46    60    55   0.46850  1.0 1.0
   47    46    60    55   0.08550 -1.0 2.0
   47    46    60    55   0.09800  1.0 3.0
   47    46    60    64   0.46850  1.0 1.0
   47    46    60    64   0.08550 -1.0 2.0
   47    46    60    64   0.09800  1.0 3.0
   47    50    53    54   0.15000  1.0 3.0
   47    50   -53    55   0.56750  1.0 1.0
   47    50   -53    55  -0.07550 -1.0 2.0
   47    50   -53    55   0.20000  1.0 3.0
   47    50    53    69   0.56750  1.0 1.0
   47    50    53    69  -0.07550 -1.0 2.0
   47    50    53    69   0.20000  1.0 3.0
   48    47    50    51   0.15000  1.0 3.0
   48    47    50    52   0.15000  1.0 3.0
   48    47    50    53   0.15000  1.0 3.0
   49    47    50    51   0.15000  1.0 3.0
   49    47    50    52   0.15000  1.0 3.0
   49    47    50    53   0.15000  1.0 3.0
   50    53    55    56   0.15000  1.0 3.0
   50    53    55    57   0.56750  1.0 1.0
   50    53    55    57  -0.07550 -1.0 2.0
   50    53    55    57   0.20000  1.0 3.0
   50    53    55    60   0.56750  1.0 1.0
   50    53    55    60  -0.07550 -1.0 2.0
   50    53    55    60   0.20000  1.0 3.0
   50    53    69    68   0.56750  1.0 1.0
   50    53    69    68  -0.07550 -1.0 2.0
   50    53    69    68   0.20000  1.0 3.0
   50    53    69    70   0.15000  1.0 3.0
   50    53    69    75   0.56750  1.0 1.0
   50    53    69    75  -0.07550 -1.0 2.0
   50    53    69    75   0.20000  1.0 3.0
   51    50    53    54   0.15000  1.0 3.0
   51    50    53    55   0.15000  1.0 3.0
   51    50    53    69   0.15000  1.0 3.0
   52    50    53    54   0.15000  1.0 3.0
   52    50    53    55   0.15000  1.0 3.0
   52    50    53    69   0.15000  1.0 3.0
   53    55    57    58   0.15000  1.0 3.0
   53    55    57    59   0.15000  1.0 3.0
   53    55    57    61   0.56750  1.0 1.0
   53    55    57    61  -0.07550 -1.0 2.0
   53    55    57    61   0.20000  1.0 3.0
   53    55    60    33   0.56750  1.0 1.0
   53    55    60    33  -0.07550 -1.0 2.0
   53    55    60    33   0.20000  1.0 3.0
   53    55   -60    46   0.34400  1.0 1.0
   53    55   -60    46   0.09450 -1.0 2.0
   53    55   -60    46   0.11100  1.0 3.0
   53    55    60    64   0.56750  1.0 1.0
   53    55    60    64  -0.07550 -1.0 2.0
   53    55    60    64   0.20000  1.0 3.0
   53    69    75    76   0.15000  1.0 3.0
   53    69    75    77   0.15000  1.0 3.0
   53    69    75    78   0.56750  1.0 1.0
   53    69    75    78  -0.07550 -1.0 2.0
   53    69    75    78   0.20000  1.0 3.0
   54    53    55    56   0.15000  1.0 3.0
   54    53    55    57   0.15000  1.0 3.0
   54    53    55    60   0.15000  1.0 3.0
   54    53    69    68   0.15000  1.0 3.0
   54    53    69    70   0.15000  1.0 3.0
   54    53    69    75   0.15000  1.0 3.0
   55    53    69    68   0.56750  1.0 1.0
   55    53    69    68  -0.07550 -1.0 2.0
   55    53    69    68   0.20000  1.0 3.0
   55    53    69    70   0.15000  1.0 3.0
   55    53    69    75   0.56750  1.0 1.0
   55    53    69    75  -0.07550 -1.0 2.0
   55    53    69    75   0.20000  1.0 3.0
   55    57    61    62   0.15000  1.0 3.0
   55    57    61    63   0.15000  1.0 3.0
   55    57   -61    68   0.56750  1.0 1.0
   55    57   -61    68  -0.07550 -1.0 2.0
   55    57   -61    68   0.20000  1.0 3.0
   55    60    64    65   0.15000  1.0 3.0
   55    60    64    66   0.15000  1.0 3.0
   55    60    64    67   0.15000  1.0 3.0
   56    55    57    58   0.15000  1.0 3.0
   56    55    57    59   0.15000  1.0 3.0
   56    55    57    61   0.15000  1.0 3.0
   56    55    60    33   0.15000  1.0 3.0
   56    55    60    46   0.15000  1.0 3.0
   56    55    60    64   0.15000  1.0 3.0
   57    55    60    33   0.56750  1.0 1.0
   57    55    60    33  -0.07550 -1.0 2.0
   57    55    60    33   0.20000  1.0 3.0
   57    55    60    46   0.34400  1.0 1.0
   57    55    60    46   0.09450 -1.0 2.0
   57    55    60    46   0.11100  1.0 3.0
   57    55    60    64   0.56750  1.0 1.0
   57    55    60    64  -0.07550 -1.0 2.0
   57    55    60    64   0.20000  1.0 3.0
   57    61    68    69   0.56750  1.0 1.0
   57    61    68    69  -0.07550 -1.0 2.0
   57    61    68    69   0.20000  1.0 3.0
   57    61    68    81   0.56750  1.0 1.0
   57    61    68    81  -0.07550 -1.0 2.0
   57    61    68    81   0.20000  1.0 3.0
   57    61    68    71   0.56750  1.0 1.0
   57    61    68    71  -0.07550 -1.0 2.0
   57    61    68    71   0.20000  1.0 3.0
   58    57    61    62   0.15000  1.0 3.0
   58    57    61    63   0.15000  1.0 3.0
   58    57    61    68   0.15000  1.0 3.0
   59    57    61    62   0.15000  1.0 3.0
   59    57    61    63   0.15000  1.0 3.0
   59    57    61    68   0.15000  1.0 3.0
   61    68   -69    53   0.56750  1.0 1.0
   61    68   -69    53  -0.07550 -1.0 2.0
   61    68   -69    53   0.20000  1.0 3.0
   61    68    69    70   0.15000  1.0 3.0
   61    68    69    75   0.56750  1.0 1.0
   61    68    69    75  -0.07550 -1.0 2.0
   61    68    69    75   0.20000  1.0 3.0
   61    68    81    78   0.56750  1.0 1.0
   61    68    81    78  -0.07550 -1.0 2.0
   61    68    81    78   0.20000  1.0 3.0
   61    68    81    82   0.56750  1.0 1.0
   61    68    81    82  -0.07550 -1.0 2.0
   61    68    81    82   0.20000  1.0 3.0
   61    68    81    86   0.86500  1.0 1.0
   61    68    81    86  -0.17500 -1.0 2.0
   61    68    81    86   0.20800  1.0 3.0
   61    68    71    72   0.15000  1.0 3.0
   61    68    71    73   0.15000  1.0 3.0
   61    68    71    74   0.15000  1.0 3.0
   62    61    68    69   0.15000  1.0 3.0
   62    61    68    81   0.15000  1.0 3.0
   62    61    68    71   0.15000  1.0 3.0
   63    61    68    69   0.15000  1.0 3.0
   63    61    68    81   0.15000  1.0 3.0
   63    61    68    71   0.15000  1.0 3.0
   68    69    75    76   0.15000  1.0 3.0
   68    69    75    77   0.15000  1.0 3.0
   68    69   -75    78   0.56750  1.0 1.0
   68    69   -75    78  -0.07550 -1.0 2.0
   68    69   -75    78   0.20000  1.0 3.0
   68    81    82    83   0.15000  1.0 3.0
   68    81    82    84   0.15000  1.0 3.0
   68    81    82    85   0.15000  1.0 3.0
   68    81    86    87  -0.11600  1.0 1.0
   68    81    86    87  -0.09450 -1.0 2.0
   68    81    86    87   0.21250  1.0 3.0
   69    53    55    56   0.15000  1.0 3.0
   69    53   -55    57   0.56750  1.0 1.0
   69    53   -55    57  -0.07550 -1.0 2.0
   69    53   -55    57   0.20000  1.0 3.0
   69    53    55    60   0.56750  1.0 1.0
   69    53    55    60  -0.07550 -1.0 2.0
   69    53    55    60   0.20000  1.0 3.0
   69    68   -81    78   0.56750  1.0 1.0
   69    68   -81    78  -0.07550 -1.0 2.0
   69    68   -81    78   0.20000  1.0 3.0
   69    68    81    82   0.56750  1.0 1.0
   69    68    81    82  -0.07550 -1.0 2.0
   69    68    81    82   0.20000  1.0 3.0
   69    68    81    86   0.86500  1.0 1.0
   69    68    81    86  -0.17500 -1.0 2.0
   69    68    81    86   0.20800  1.0 3.0
   69    68    71    72   0.15000  1.0 3.0
   69    68    71    73   0.15000  1.0 3.0
   69    68    71    74   0.15000  1.0 3.0
   69    75    78    79   0.15000  1.0 3.0
   69    75    78    80   0.15000  1.0 3.0
   69    75   -78    81   0.56750  1.0 1.0
   69    75   -78    81  -0.07550 -1.0 2.0
   69    75   -78    81   0.20000  1.0 3.0
   70    69    75    76   0.15000  1.0 3.0
   70    69    75    77   0.15000  1.0 3.0
   70    69    75    78   0.15000  1.0 3.0
   75    78   -81    68   0.56750  1.0 1.0
   75    78   -81    68  -0.07550 -1.0 2.0
   75    78   -81    68   0.20000  1.0 3.0
   75    78    81    82   0.56750  1.0 1.0
   75    78    81    82  -0.07550 -1.0 2.0
   75    78    81    82   0.20000  1.0 3.0
   75    78    81    86   0.86500  1.0 1.0
   75    78    81    86  -0.17500 -1.0 2.0
   75    78    81    86   0.20800  1.0 3.0
   76    75    78    79   0.15000  1.0 3.0
   76    75    78    80   0.15000  1.0 3.0
   76    75    78    81   0.15000  1.0 3.0
   77    75    78    79   0.15000  1.0 3.0
   77    75    78    80   0.15000  1.0 3.0
   77    75    78    81   0.15000  1.0 3.0
   78    81    82    83   0.15000  1.0 3.0
   78    81    82    84   0.15000  1.0 3.0
   78    81    82    85   0.15000  1.0 3.0
   78    81    86    87  -0.11600  1.0 1.0
   78    81    86    87  -0.09450 -1.0 2.0
   78    81    86    87   0.21250  1.0 3.0
   79    78    81    68   0.15000  1.0 3.0
   79    78    81    82   0.15000  1.0 3.0
   79    78    81    86   0.23400  1.0 3.0
   80    78    81    68   0.15000  1.0 3.0
   80    78    81    82   0.15000  1.0 3.0
   80    78    81    86   0.23400  1.0 3.0
   81    68    69    53   0.56750  1.0 1.0
   81    68    69    53  -0.07550 -1.0 2.0
   81    68    69    53   0.20000  1.0 3.0
   81    68    69    70   0.15000  1.0 3.0
   81    68   -69    75   0.56750  1.0 1.0
   81    68   -69    75  -0.07550 -1.0 2.0
   81    68   -69    75   0.20000  1.0 3.0
   81    68    71    72   0.15000  1.0 3.0
   81    68    71    73   0.15000  1.0 3.0
   81    68    71    74   0.15000  1.0 3.0
   82    81    86    87  -0.11600  1.0 1.0
   82    81    86    87  -0.09450 -1.0 2.0
   82    81    86    87   0.21250  1.0 3.0
   86    81    82    83   0.23400  1.0 3.0
   86    81    82    84   0.23400  1.0 3.0
   86    81    82    85   0.23400  1.0 3.0
   71    68    69    53   0.56750  1.0 1.0
   71    68    69    53  -0.07550 -1.0 2.0
   71    68    69    53   0.20000  1.0 3.0
   71    68    69    70   0.15000  1.0 3.0
   71    68    69    75   0.56750  1.0 1.0
   71    68    69    75  -0.07550 -1.0 2.0
   71    68    69    75   0.20000  1.0 3.0
   71    68    81    78   0.56750  1.0 1.0
   71    68    81    78  -0.07550 -1.0 2.0
   71    68    81    78   0.20000  1.0 3.0
   71    68    81    82   0.56750  1.0 1.0
   71    68    81    82  -0.07550 -1.0 2.0
   71    68    81    82   0.20000  1.0 3.0
   71    68    81    86   0.86500  1.0 1.0
   71    68    81    86  -0.17500 -1.0 2.0
   71    68    81    86   0.20800  1.0 3.0
   60    33   -38    39   0.09850  1.0 1.0
   60    33   -38    39   0.15250 -1.0 2.0
   60    33   -38    39  -0.50650  1.0 3.0
   60    33    38    40   0.09700  1.0 1.0
   60    33    38    40   0.15600 -1.0 2.0
   60    33    38    40  -0.50800  1.0 3.0
   60    46    47    48   0.34800  1.0 3.0
   60    46    47    49   0.34800  1.0 3.0
   60    46   -47    50   0.46850  1.0 1.0
   60    46   -47    50   0.08550 -1.0 2.0
   60    46   -47    50   0.09800  1.0 3.0
   60    55    57    58   0.15000  1.0 3.0
   60    55    57    59   0.15000  1.0 3.0
   60    55    57    61   0.56750  1.0 1.0
   60    55    57    61  -0.07550 -1.0 2.0
   60    55    57    61   0.20000  1.0 3.0
   44    39    42    43   0.00000  1.0 1.0
   44    39    42    46   0.50950  1.0 1.0
   44    39    42    46   0.56650 -1.0 2.0
   44    39    42    46   0.34050  1.0 3.0
   40    38    39    42   7.00000 -1.0 2.0
   40    38    39    44   7.00000 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   33    40    38    39   1.10000 -1.0 2.0
   42    44    39    38   1.10000 -1.0 2.0
   39    43    42    46   1.10000 -1.0 2.0
   47    60    46    42   1.10000 -1.0 2.0
END
