* LIGAND DATABASE FILE (OPLS2005)
*
001      94   101    181    318     534
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02046    96.51553    28.61897
    3     1 S   H    _H1_     3     1.02113    34.57461   142.39643
    4     1 S   H    _H2_     4     1.02135    83.12070   -79.55889
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08611   110.49349    58.84143
   26    24 S   HC   HB22    34     1.08575   109.90351   179.01802
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CT   _C19    36     1.80778    98.51994   161.82895
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   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   CM   _C20    37     1.50887   110.75232    59.99143
   38    37 S   HC   _H14    38     1.08135   124.45406   -64.95075
   39    33 S   C    _C32    60     1.53927   109.38822   170.80247
   40    39 S   O    _O36    61     1.22306   125.97430    61.96010
   41    33 S   CM   _C14    65     1.48882   111.20858   -67.09638
   42    37 S   CM   _C21    39     1.33250   109.88742   116.41905
   43    41 S   CM   _C13    66     1.33906   129.53722   125.60467
   44    43 S   HC   _H11    67     1.08232   123.60640     1.14278
   45    41 S   C    _C15    90     1.48098   123.35381   -52.90658
   46    45 S   O    _O33    91     1.22040   124.40131     1.84334
   47    42 S   C5N  _C22    40     1.39661   130.69915   178.33493
   48    43 S   CT   _C12    68     1.49225   113.43806   179.24282
   49    48 S   HC   _H3_    69     1.09543   110.74644  -112.40334
   50    47 S   CT4  _C23    41     1.37676   124.74977  -170.62856
   51    47 S   NA   _N6_    52     1.36166   126.05421    10.05586
   52    51 S   H    _H19    53     1.01102   126.13919    -0.44543
   53    48 S   C5N  _C11    70     1.48631   118.66677   118.15993
   54    50 S   C56B _C24    42     1.42010   107.31740  -179.22469
   55    50 S   CTH  _C30    54     1.49812   120.36907     2.02796
   56    55 S   HC   _H20    55     1.09798   107.45686    96.70947
   57    55 S   HC   _H21    56     1.09597   110.55064  -146.64370
   58    53 S   CT4  _C10    71     1.38262   125.99626  -127.03787
   59    53 S   NA   _N4_    82     1.36595   125.53321    55.72620
   60    59 S   H    _H10    83     1.01038   125.39785    -1.51064
   61    54 S   CA   _C25    43     1.40882   134.48114  -179.77272
   62    61 S   HA   _H15    44     1.08567   120.85699    -0.14265
   63    55 S   CT1  _C31    57     1.55514   111.60688   -21.97640
   64    63 S   HC   _H5_    58     1.09586   110.04014   155.13633
   65    58 S   C56B _C8_    72     1.42192   107.40976  -178.48573
   66    58 S   CTH  _C17    84     1.49917   122.27138     2.52538
   67    66 S   HC   _H12    85     1.09799   107.52922   105.38390
   68    66 S   HC   _H13    86     1.09626   110.32280  -137.79513
   69    61 S   CA   _C26    45     1.39999   119.20919   179.92598
   70    69 S   HA   _H16    46     1.08688   119.47235   179.94405
   71    42 S   N    _N7_    59     1.37283   111.52041    -0.03426
   72    63 S   CO3  _C33    62     1.52267   105.95389   -90.27061
   73    72 S   O2Z  _O38    63     1.26251   115.26625    62.91039
   74    72 S   O2Z  _O37    64     1.26309   114.79670  -117.10594
   75    65 S   CA   _C9_    73     1.40987   134.36392  -179.39413
   76    75 S   HA   _H9_    74     1.08592   120.80371     0.02798
   77    66 S   CT1  _C16    87     1.54503   111.65980   -13.79183
   78    77 S   HC   _H4_    88     1.09535   109.31660   156.81901
   79    69 S   CA   _C27    47     1.39303   120.82964    -0.06256
   80    79 S   HA   _H17    48     1.08722   119.50246  -179.97202
   81    75 S   CA   _C4_    75     1.39922   119.27082  -179.95154
   82    81 S   HA   _H6_    76     1.08781   119.50975   179.97202
   83    48 S   N    _N5_    89     1.46069   100.43601     1.98386
   84    77 S   CO3  _C18    92     1.51930   108.83764   -86.70661
   85    84 S   O2Z  _O35    93     1.26098   115.32221    61.98054
   86    84 S   O2Z  _O34    94     1.26321   114.73002  -117.98458
   87    79 S   CA   _C28    49     1.39785   121.05396    -0.08847
   88    87 S   HA   _H18    50     1.08488   120.86445  -179.86878
   89    81 S   CA   _C5_    77     1.39288   120.81603    -0.01978
   90    89 S   HA   _H7_    78     1.08741   119.57539   180.00000
   91    54 S   C56A _C29    51     1.40289   106.74325    -0.02798
   92    89 S   CA   _C6_    79     1.39720   121.01766    -0.00000
   93    92 S   HA   _H8_    80     1.08508   120.92737  -180.00000
   94    65 S   C56A _C7_    81     1.39897   106.97421     0.54032
  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  10   5   4   3
  15   2   1   1  12   5  11   4  11  11  10   5   9   3  12  12
   5  15   9   3  12  12  10   5   4  15   9   3   7   4   5   4
  12  10   5   4   6   3   3   2   1   1   7   4   5   4   4   3
   6   3   3   2   1   1   2   1   4   3   1   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    39    41    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    42    71    39    40    41    43    45  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    42    47    63    71    39    40    41    43    44    48    83    45    46  
   35    36  
   36  
    0  
   38    42    47    50    51    63    71    39    40    41    43    45  
   42    47    71    39    41  
   40    72    41    43    45    42    47    55    63    64    71  
   41    42    63    71  
   43    44    48    49    53    77    83    45    46    42    71  
   47    50    54    91    51    52    55    63    64    71    72  
   44    48    49    53    58    59    77    83    45    46  
   48    49    53    83    45  
   46    84    48    49    53    66    77    78    83  
   48    77    83  
   50    54    61    87    91    51    52    55    56    57    63    71  
   49    53    58    65    94    59    60    66    77    78    83    84  
   53    58    59    77    83  
   54    61    62    69    87    91    51    52    55    56    57    63    64    71    72  
   52    55    71    54    61    79    87    88    91  
   54    87    91  
   58    65    75    92    94    59    60    66    67    68    77    83  
   61    62    69    70    79    87    88    91    55    56    57    63  
   56    57    63    64    71    72    73    74    61    91  
   57    63    64    71    72  
   63    64    71    72  
   65    75    76    81    92    94    59    60    66    67    68    77    78    83    84  
   60    66    83    65    75    89    92    93    94  
   65    92    94  
   62    69    70    79    80    87    91  
   69    70    79    91  
   64    71    72    73    74  
   71    72    73    74  
   75    76    81    82    89    92    93    94    66    67    68    77  
   67    68    77    78    83    84    85    86    75    94  
   68    77    78    83    84  
   77    78    83    84  
   70    79    80    87    88    91  
   79    80    87  
   72    73    74  
   73    74  
   74  
    0  
   76    81    82    89    90    92    94  
   81    82    89    94  
   78    83    84    85    86  
   83    84    85    86  
   80    87    88    91  
   87    88    91  
   82    89    90    92    93    94  
   89    90    92  
   84    85    86  
   85    86  
   86  
    0  
   88    91  
   91  
   90    92    93    94  
   92    93    94  
    0  
   93    94  
   94  
    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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   40   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   41   3.5500   0.0760  -0.056700   2.0020   1.7750   0.023028004  -0.852763146
   42   3.5500   0.0760  -0.073200   2.0020   1.7750   0.023028004  -0.852763146
   43   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   44   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   45   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   47   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5000   0.0660   0.125000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   50   3.5500   0.0700   0.075000   2.5000   1.7750   0.001000000  -0.843144165
   51   3.2500   0.1700  -0.570000   1.8650   1.6500   0.001000000  -0.511443539
   52   0.5000   0.0300   0.420000   0.9960   0.8600   0.030040813  -0.651083722
   53   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   54   3.5500   0.0700  -0.055000   2.5000   1.7750   0.001000000  -0.843144165
   55   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5500   0.0700   0.075000   2.5000   1.7750   0.001000000  -0.843144165
   59   3.2500   0.1700  -0.570000   1.8650   1.6500   0.001000000  -0.511443539
   60   0.5000   0.0300   0.420000   0.9960   0.8600   0.030040813  -0.651083722
   61   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   63   3.5000   0.0660  -0.090000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   65   3.5500   0.0700  -0.055000   2.5000   1.7750   0.001000000  -0.843144165
   66   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   70   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   71   3.2500   0.1700   0.003200   1.8100   1.6000   0.054801302  -1.445846770
   72   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   73   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   74   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   75   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   76   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   77   3.5000   0.0660  -0.090000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   79   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   80   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   81   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   82   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   83   3.2500   0.1700  -0.140000   1.8100   1.6000   0.054801302  -1.445846770
   84   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   85   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   86   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   87   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   88   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   89   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   90   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   91   3.5500   0.0700   0.130000   2.5000   1.7750   0.001000000  -0.843144165
   92   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   93   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   94   3.5500   0.0700   0.130000   2.5000   1.7750   0.001000000  -0.843144165
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  1.510
   33    39   317.000  1.522
   33    41   317.000  1.510
   37    38   340.000  1.080
   37    42   549.000  1.340
   42    47   320.000  1.460
   42    71   400.000  1.384
   47    50   546.000  1.352
   47    51   427.000  1.381
   50    54   388.000  1.459
   50    55   317.000  1.495
   54    61   469.000  1.404
   54    91   447.000  1.419
   61    62   367.000  1.080
   61    69   469.000  1.400
   69    70   367.000  1.080
   69    79   469.000  1.400
   79    80   367.000  1.080
   79    87   469.000  1.400
   87    88   367.000  1.080
   87    91   469.000  1.400
   91    51   428.000  1.380
   51    52   434.000  1.010
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    63   268.000  1.529
   63    64   340.000  1.090
   63    71   337.000  1.449
   63    72   317.000  1.522
   71    39   490.000  1.335
   39    40   570.000  1.229
   72    73   656.000  1.250
   72    74   656.000  1.250
   41    43   549.000  1.340
   41    45   410.000  1.444
   43    44   340.000  1.080
   43    48   317.000  1.510
   48    49   340.000  1.090
   48    53   317.000  1.510
   48    83   337.000  1.449
   53    58   546.000  1.352
   53    59   427.000  1.381
   58    65   388.000  1.459
   58    66   317.000  1.495
   65    75   469.000  1.404
   65    94   447.000  1.419
   75    76   367.000  1.080
   75    81   469.000  1.400
   81    82   367.000  1.080
   81    89   469.000  1.400
   89    90   367.000  1.080
   89    92   469.000  1.400
   92    93   367.000  1.080
   92    94   469.000  1.400
   94    59   428.000  1.380
   59    60   434.000  1.010
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    77   268.000  1.529
   77    78   340.000  1.090
   77    83   337.000  1.449
   77    84   317.000  1.522
   83    45   490.000  1.335
   45    46   570.000  1.229
   84    85   656.000  1.250
   84    86   656.000  1.250
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  112.20000
   29    33    39    70.00000  112.33000
   29    33    41    75.00000  112.20000
   33    37    38    35.00000  117.00000
   33    37    42    70.00000  124.00000
   33    39    71    70.00000  116.60000
   33    39    40    80.00000  120.40000
   33    41    43    70.00000  124.00000
   33    41    45    70.00000  119.70000
   37    42    47    60.00000  123.20500
   37    42    71    75.00000  120.83300
   42    37    38    35.00000  120.00000
   42    47    50    60.00000  120.93500
   42    47    51    70.00000  118.40000
   42    71    63    70.00000  119.94800
   42    71    39    70.00000  120.89900
   47    50    54    85.00000  106.40000
   47    50    55    70.00000  125.00000
   47    51    91    70.00000  111.60000
   47    51    52    35.00000  120.00000
   50    54    61    85.00000  134.90000
   50    54    91    85.00000  108.80000
   50    55    56    35.00000  109.50000
   50    55    57    35.00000  109.50000
   50    55    63    63.00000  115.60000
   54    61    62    35.00000  120.00000
   54    61    69    63.00000  120.00000
   54    91    87    85.00000  122.70000
   54    91    51    70.00000  104.40000
   61    69    70    35.00000  120.00000
   61    69    79    63.00000  120.00000
   69    61    62    35.00000  120.00000
   69    79    80    35.00000  120.00000
   69    79    87    63.00000  120.00000
   79    69    70    35.00000  120.00000
   79    87    88    35.00000  120.00000
   79    87    91    85.00000  120.00000
   87    79    80    35.00000  120.00000
   87    91    51    70.00000  132.80000
   91    54    61    85.00000  116.20000
   91    87    88    35.00000  120.00000
   91    51    52    35.00000  123.10000
   51    47    50    70.00000  108.70000
   55    50    54    70.00000  128.60000
   55    63    64    37.50000  110.70000
   55    63    71    80.00000  109.70000
   55    63    72    63.00000  111.10000
   57    55    56    33.00000  107.80000
   63    55    56    37.50000  110.70000
   63    55    57    37.50000  110.70000
   63    71    39    50.00000  121.90000
   63    72    73    70.00000  117.00000
   63    72    74    70.00000  117.00000
   71    42    47    70.00000  114.23000
   71    63    64    35.00000  109.50000
   71    39    40    80.00000  122.90000
   39    33    37    70.00000  115.00700
   72    63    64    35.00000  109.50000
   72    63    71    63.00000  110.10000
   74    72    73    80.00000  126.00000
   41    33    37    70.00000  110.12100
   41    33    39    70.00000  115.00700
   41    43    44    35.00000  120.00000
   41    43    48    70.00000  124.00000
   41    45    83    80.00000  111.56200
   41    45    46    80.00000  125.30000
   43    48    49    35.00000  109.50000
   43    48    53    70.00000  112.99600
   43    48    83    75.00000  110.78400
   48    43    44    35.00000  117.00000
   48    53    58    60.00000  130.00000
   48    53    59    60.00000  130.00000
   48    83    77    70.00000  118.74000
   48    83    45    50.00000  121.90000
   53    48    49    35.00000  109.50000
   53    58    65    85.00000  106.40000
   53    58    66    70.00000  125.00000
   53    59    94    70.00000  111.60000
   53    59    60    35.00000  120.00000
   58    65    75    85.00000  134.90000
   58    65    94    85.00000  108.80000
   58    66    67    35.00000  109.50000
   58    66    68    35.00000  109.50000
   58    66    77    63.00000  115.60000
   65    75    76    35.00000  120.00000
   65    75    81    63.00000  120.00000
   65    94    92    85.00000  122.70000
   65    94    59    70.00000  104.40000
   75    81    82    35.00000  120.00000
   75    81    89    63.00000  120.00000
   81    75    76    35.00000  120.00000
   81    89    90    35.00000  120.00000
   81    89    92    63.00000  120.00000
   89    81    82    35.00000  120.00000
   89    92    93    35.00000  120.00000
   89    92    94    85.00000  120.00000
   92    89    90    35.00000  120.00000
   92    94    59    70.00000  132.80000
   94    65    75    85.00000  116.20000
   94    92    93    35.00000  120.00000
   94    59    60    35.00000  123.10000
   59    53    58    70.00000  108.70000
   66    58    65    70.00000  128.60000
   66    77    78    37.50000  110.70000
   66    77    83    80.00000  109.70000
   66    77    84    63.00000  111.10000
   68    66    67    33.00000  107.80000
   77    66    67    37.50000  110.70000
   77    66    68    37.50000  110.70000
   77    83    45    50.00000  121.90000
   77    84    85    70.00000  117.00000
   77    84    86    70.00000  117.00000
   83    48    49    35.00000  109.50000
   83    48    53    75.00000  111.96400
   83    77    78    35.00000  109.50000
   83    45    46    80.00000  122.90000
   45    41    43    70.00000  118.70000
   84    77    78    35.00000  109.50000
   84    77    83    63.00000  110.10000
   86    84    85    80.00000  126.00000
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  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  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
   24    29    33    41  -0.62250  1.0 1.0
   24    29    33    41  -0.38450 -1.0 2.0
   24    29    33    41   0.81900  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   0.00000  1.0 1.0
   29    33    37    42   0.42700  1.0 1.0
   29    33    37    42  -0.70350 -1.0 2.0
   29    33    37    42  -0.43150  1.0 3.0
   29    33    39    71   0.00000  1.0 1.0
   29    33    39    40   0.30150 -1.0 2.0
   29    33    41    43   0.42700  1.0 1.0
   29    33    41    43  -0.70350 -1.0 2.0
   29    33    41    43  -0.43150  1.0 3.0
   29    33    41    45   0.09700  1.0 1.0
   29    33    41    45   0.15600 -1.0 2.0
   29    33    41    45  -0.50800  1.0 3.0
   33    37    42    47   7.00000 -1.0 2.0
   33    37   -42    71   7.00000 -1.0 2.0
   33    41    43    44   7.00000 -1.0 2.0
   33    41    43    48   7.00000 -1.0 2.0
   33    41    45    83   1.59650  1.0 1.0
   33    41    45    83   0.42750 -1.0 2.0
   33    41    45    83  -0.48350  1.0 3.0
   33    41    45    46  -0.64400  1.0 1.0
   33    41    45    46   0.26850 -1.0 2.0
   37    33   -39    71   0.00000  1.0 1.0
   37    33    39    40   0.30150 -1.0 2.0
   37    33    41    43  -0.28300  1.0 1.0
   37    33    41    43   0.26700 -1.0 2.0
   37    33    41    43  -0.63300  1.0 3.0
   37    33    41    45   0.09700  1.0 1.0
   37    33    41    45   0.15600 -1.0 2.0
   37    33    41    45  -0.50800  1.0 3.0
   37    42    47    50   0.15800  1.0 1.0
   37    42    47    50   1.85350 -1.0 2.0
   37    42    47    50  -0.48700  1.0 3.0
   37    42    47    51   0.11450  1.0 1.0
   37    42    47    51   1.85100 -1.0 2.0
   37    42    47    51  -0.49050  1.0 3.0
   37    42    71    63  -0.88150  1.0 1.0
   37    42    71    63   2.95600 -1.0 2.0
   37    42   -71    39  -0.18900  1.0 1.0
   37    42   -71    39   1.70900 -1.0 2.0
   38    37    42    47   7.00000 -1.0 2.0
   38    37    42    71   7.00000 -1.0 2.0
   42    47    50    54   3.62500 -1.0 2.0
   42    47    50    55   3.62500 -1.0 2.0
   42    47    51    91   3.62500 -1.0 2.0
   42    47    51    52   2.00000 -1.0 2.0
   42    71   -39    33   0.67100  1.0 1.0
   42    71   -39    33   1.42150 -1.0 2.0
   42    71   -39    33   0.18700  1.0 3.0
   42    71    39    40   2.67200 -1.0 2.0
   47    42    71    63   1.00000 -1.0 2.0
   47    42    71    39  -0.56400  1.0 1.0
   47    42    71    39   0.77500 -1.0 2.0
   47    42    71    39   0.18700  1.0 3.0
   47    50    54    61   1.67500 -1.0 2.0
   47    50   -54    91   1.67500 -1.0 2.0
   47    50    55    56  -0.24000  1.0 3.0
   47    50    55    57  -0.24000  1.0 3.0
   47    50   -55    63  -0.35700  1.0 1.0
   50    47   -51    91   1.50000 -1.0 2.0
   50    47    51    52   1.50000 -1.0 2.0
   50    54    61    62   3.50000 -1.0 2.0
   50    54    61    69   3.50000 -1.0 2.0
   50    54    91    87   3.00000 -1.0 2.0
   50    54   -91    51   3.00000 -1.0 2.0
   50    55    63    64   0.23100  1.0 3.0
   50    55    63    71   0.42250  1.0 1.0
   50    55    63    71  -0.48100 -1.0 2.0
   50    55    63    71   0.35650  1.0 3.0
   50    55    63    72  -0.84850  1.0 1.0
   50    55    63    72  -0.22800 -1.0 2.0
   50    55    63    72   0.29250  1.0 3.0
   54    50    55    56   0.00000  1.0 1.0
   54    50    55    57   0.00000  1.0 1.0
   54    50    55    63   0.00000  1.0 1.0
   54    61    69    70   3.62500 -1.0 2.0
   54    61    69    79   3.62500 -1.0 2.0
   54    91   -51    47   1.52500 -1.0 2.0
   54    91    51    52   1.52500 -1.0 2.0
   61    54    91    87   3.00000 -1.0 2.0
   61    54    91    51   3.00000 -1.0 2.0
   61    69    79    80   3.62500 -1.0 2.0
   61    69   -79    87   3.62500 -1.0 2.0
   62    61    69    70   3.62500 -1.0 2.0
   62    61    69    79   3.62500 -1.0 2.0
   69    79    87    88   3.62500 -1.0 2.0
   69    79    87    91   3.62500 -1.0 2.0
   70    69    79    80   3.62500 -1.0 2.0
   70    69    79    87   3.62500 -1.0 2.0
   79    87   -91    54   3.62500 -1.0 2.0
   79    87    91    51   3.62500 -1.0 2.0
   80    79    87    88   3.62500 -1.0 2.0
   80    79    87    91   3.62500 -1.0 2.0
   87    91    51    47   1.52500 -1.0 2.0
   87    91    51    52   1.52500 -1.0 2.0
   88    87    91    54   3.62500 -1.0 2.0
   88    87    91    51   3.62500 -1.0 2.0
   91    54    61    62   3.50000 -1.0 2.0
   91    54   -61    69   3.50000 -1.0 2.0
   51    47   -50    54   6.52500 -1.0 2.0
   51    47    50    55   6.52500 -1.0 2.0
   55    50    54    61   1.67500 -1.0 2.0
   55    50    54    91   1.67500 -1.0 2.0
   55    63   -71    42  -0.05900 -1.0 2.0
   55    63    71    39   0.25950  1.0 1.0
   55    63    71    39   0.43850 -1.0 2.0
   55    63    71    39   2.61650  1.0 3.0
   55    63    72    73   0.00000  1.0 1.0
   55    63    72    74   0.00000  1.0 1.0
   56    55    63    64   0.15000  1.0 3.0
   56    55    63    71   0.23200  1.0 3.0
   56    55    63    72  -0.03800  1.0 3.0
   57    55    63    64   0.15000  1.0 3.0
   57    55    63    71   0.23200  1.0 3.0
   57    55    63    72  -0.03800  1.0 3.0
   63    71    39    33   1.15000  1.0 1.0
   63    71    39    33   3.04450 -1.0 2.0
   63    71    39    40   3.04450 -1.0 2.0
   64    63    71    42   0.00000  1.0 1.0
   64    63    71    39   0.00000  1.0 1.0
   64    63    72    73   0.00000  1.0 1.0
   64    63    72    74   0.00000  1.0 1.0
   71    42   -47    50  -0.01750  1.0 1.0
   71    42   -47    50  -0.32000 -1.0 2.0
   71    42   -47    50   0.00600  1.0 3.0
   71    42    47    51  -0.01750  1.0 1.0
   71    42    47    51  -0.32000 -1.0 2.0
   71    42    47    51   0.00600  1.0 3.0
   71    63    72    73   0.00000  1.0 1.0
   71    63    72    74   0.00000  1.0 1.0
   39    33    37    38   0.00000  1.0 1.0
   39    33   -37    42  -0.51250  1.0 1.0
   39    33   -37    42  -0.88800 -1.0 2.0
   39    33   -37    42   0.08850  1.0 3.0
   39    33    41    43  -0.51250  1.0 1.0
   39    33    41    43  -0.88800 -1.0 2.0
   39    33    41    43   0.08850  1.0 3.0
   39    33    41    45   0.09700  1.0 1.0
   39    33    41    45   0.15600 -1.0 2.0
   39    33    41    45  -0.50800  1.0 3.0
   72    63    71    42   0.17850 -1.0 2.0
   72    63    71    39  -0.29800  1.0 1.0
   72    63    71    39   0.13950 -1.0 2.0
   72    63    71    39  -2.45650  1.0 3.0
   41    33    37    38   0.00000  1.0 1.0
   41    33    37    42  -0.28300  1.0 1.0
   41    33    37    42   0.26700 -1.0 2.0
   41    33    37    42  -0.63300  1.0 3.0
   41    33    39    71   0.00000  1.0 1.0
   41    33    39    40   0.30150 -1.0 2.0
   41    43    48    49   0.00000  1.0 1.0
   41    43    48    53   1.44450  1.0 1.0
   41    43    48    53   0.06600 -1.0 2.0
   41    43    48    53   0.29250  1.0 3.0
   41    43   -48    83   0.62150  1.0 1.0
   41    43   -48    83   0.42850 -1.0 2.0
   41    43   -48    83  -0.68200  1.0 3.0
   43    41   -45    83   0.49500  1.0 1.0
   43    41   -45    83   1.31600 -1.0 2.0
   43    41   -45    83  -0.02300  1.0 3.0
   43    41    45    46   1.00000 -1.0 2.0
   43    48    53    58   0.18050 -1.0 2.0
   43    48    53    59   0.04300 -1.0 2.0
   43    48    83    77   0.17850 -1.0 2.0
   43    48   -83    45  -0.19250  1.0 1.0
   43    48   -83    45  -0.00500 -1.0 2.0
   43    48   -83    45   0.17000  1.0 3.0
   44    43    48    49   0.33100  1.0 3.0
   44    43    48    53   0.00000  1.0 1.0
   44    43    48    83   0.00000  1.0 1.0
   48    53    58    65   3.62500 -1.0 2.0
   48    53    58    66   3.62500 -1.0 2.0
   48    53    59    94   3.62500 -1.0 2.0
   48    53    59    60   2.00000 -1.0 2.0
   48    83   -45    41   1.49850  1.0 1.0
   48    83   -45    41   1.53950 -1.0 2.0
   48    83    45    46   3.04450 -1.0 2.0
   49    48    53    58   0.00000  1.0 1.0
   49    48    53    59   0.00000  1.0 1.0
   49    48    83    77   0.00000  1.0 1.0
   49    48    83    45   0.00000  1.0 1.0
   53    48    83    77   0.17850 -1.0 2.0
   53    48    83    45  -0.69800  1.0 1.0
   53    48    83    45  -0.21350 -1.0 2.0
   53    58    65    75   1.67500 -1.0 2.0
   53    58   -65    94   1.67500 -1.0 2.0
   53    58    66    67  -0.24000  1.0 3.0
   53    58    66    68  -0.24000  1.0 3.0
   53    58   -66    77  -0.35700  1.0 1.0
   58    53   -59    94   1.50000 -1.0 2.0
   58    53    59    60   1.50000 -1.0 2.0
   58    65    75    76   3.50000 -1.0 2.0
   58    65    75    81   3.50000 -1.0 2.0
   58    65    94    92   3.00000 -1.0 2.0
   58    65   -94    59   3.00000 -1.0 2.0
   58    66    77    78   0.23100  1.0 3.0
   58    66    77    83   0.42250  1.0 1.0
   58    66    77    83  -0.48100 -1.0 2.0
   58    66    77    83   0.35650  1.0 3.0
   58    66    77    84  -0.84850  1.0 1.0
   58    66    77    84  -0.22800 -1.0 2.0
   58    66    77    84   0.29250  1.0 3.0
   65    58    66    67   0.00000  1.0 1.0
   65    58    66    68   0.00000  1.0 1.0
   65    58    66    77   0.00000  1.0 1.0
   65    75    81    82   3.62500 -1.0 2.0
   65    75    81    89   3.62500 -1.0 2.0
   65    94   -59    53   1.52500 -1.0 2.0
   65    94    59    60   1.52500 -1.0 2.0
   75    65    94    92   3.00000 -1.0 2.0
   75    65    94    59   3.00000 -1.0 2.0
   75    81    89    90   3.62500 -1.0 2.0
   75    81   -89    92   3.62500 -1.0 2.0
   76    75    81    82   3.62500 -1.0 2.0
   76    75    81    89   3.62500 -1.0 2.0
   81    89    92    93   3.62500 -1.0 2.0
   81    89    92    94   3.62500 -1.0 2.0
   82    81    89    90   3.62500 -1.0 2.0
   82    81    89    92   3.62500 -1.0 2.0
   89    92   -94    65   3.62500 -1.0 2.0
   89    92    94    59   3.62500 -1.0 2.0
   90    89    92    93   3.62500 -1.0 2.0
   90    89    92    94   3.62500 -1.0 2.0
   92    94    59    53   1.52500 -1.0 2.0
   92    94    59    60   1.52500 -1.0 2.0
   93    92    94    65   3.62500 -1.0 2.0
   93    92    94    59   3.62500 -1.0 2.0
   94    65    75    76   3.50000 -1.0 2.0
   94    65   -75    81   3.50000 -1.0 2.0
   59    53   -58    65   6.52500 -1.0 2.0
   59    53    58    66   6.52500 -1.0 2.0
   66    58    65    75   1.67500 -1.0 2.0
   66    58    65    94   1.67500 -1.0 2.0
   66    77   -83    48  -0.05900 -1.0 2.0
   66    77    83    45   0.25950  1.0 1.0
   66    77    83    45   0.43850 -1.0 2.0
   66    77    83    45   2.61650  1.0 3.0
   66    77    84    85   0.00000  1.0 1.0
   66    77    84    86   0.00000  1.0 1.0
   67    66    77    78   0.15000  1.0 3.0
   67    66    77    83   0.23200  1.0 3.0
   67    66    77    84  -0.03800  1.0 3.0
   68    66    77    78   0.15000  1.0 3.0
   68    66    77    83   0.23200  1.0 3.0
   68    66    77    84  -0.03800  1.0 3.0
   77    83    45    41   1.49850  1.0 1.0
   77    83    45    41   1.53950 -1.0 2.0
   77    83    45    46   3.04450 -1.0 2.0
   78    77    83    48   0.00000  1.0 1.0
   78    77    83    45   0.00000  1.0 1.0
   78    77    84    85   0.00000  1.0 1.0
   78    77    84    86   0.00000  1.0 1.0
   83    48   -53    58  -0.24500  1.0 1.0
   83    48   -53    58   0.48300 -1.0 2.0
   83    48   -53    58   0.08900  1.0 3.0
   83    48    53    59   0.04300 -1.0 2.0
   83    77    84    85   0.00000  1.0 1.0
   83    77    84    86   0.00000  1.0 1.0
   45    41    43    44   7.00000 -1.0 2.0
   45    41   -43    48   7.00000 -1.0 2.0
   84    77    83    48   0.17850 -1.0 2.0
   84    77    83    45  -0.29800  1.0 1.0
   84    77    83    45   0.13950 -1.0 2.0
   84    77    83    45  -2.45650  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
   33    38    37    42   1.10000 -1.0 2.0
   47    71    42    37   1.10000 -1.0 2.0
   50    51    47    42   4.00000 -1.0 2.0
   54    55    50    47   4.00000 -1.0 2.0
   61    91    54    50   4.00000 -1.0 2.0
   69    62    61    54   1.10000 -1.0 2.0
   79    70    69    61   1.10000 -1.0 2.0
   87    80    79    69   1.10000 -1.0 2.0
   91    88    87    79   1.10000 -1.0 2.0
   87    51    91    54   4.00000 -1.0 2.0
   52    47    51    91   1.00000 -1.0 2.0
   63    39    71    42   1.00000 -1.0 2.0
   33    71    39    40  10.50000 -1.0 2.0
   73    63    72    74  10.50000 -1.0 2.0
   33    45    41    43   1.10000 -1.0 2.0
   48    44    43    41   1.10000 -1.0 2.0
   58    59    53    48   4.00000 -1.0 2.0
   65    66    58    53   4.00000 -1.0 2.0
   75    94    65    58   4.00000 -1.0 2.0
   81    76    75    65   1.10000 -1.0 2.0
   89    82    81    75   1.10000 -1.0 2.0
   92    90    89    81   1.10000 -1.0 2.0
   94    93    92    89   1.10000 -1.0 2.0
   92    59    94    65   4.00000 -1.0 2.0
   60    53    59    94   1.00000 -1.0 2.0
   77    45    83    48   1.00000 -1.0 2.0
   41    83    45    46  10.50000 -1.0 2.0
   85    77    84    86  10.50000 -1.0 2.0
END
