* LIGAND DATABASE FILE (OPLS2005)
*
001     104   104    186    281     549
    1     0 S   NP   _N1_     1    29.31161    99.45570   -24.40615
    2     1 S   H    _HN1     2     1.02836    51.60525   171.27350
    3     1 S   H    _H1_     3     1.02777   118.74393   -98.01520
    4     1 S   H    _H2_     4     1.02957    55.54786    -4.63722
    5     1 S   CT   _CA1     5     1.50158   128.96097    84.69945
    6     5 S   HC   _HA1     6     1.09575   105.18958   115.98697
    7     5 S   CO3  _C1_     7     1.53762   112.30944    -4.17420
    8     7 S   O2Z  _O11     8     1.26372   114.98098   -44.21201
    9     7 S   O2Z  _O12     9     1.26224   114.92428   134.72228
   10     5 S   CT   _CB1    10     1.53080   107.40453  -126.12109
   11    10 S   HC   HB11    11     1.09835   109.28322   -50.15016
   12    10 S   HC   HB12    12     1.09815   110.44637    66.37542
   13    10 S   CT   _CG1    13     1.53060   112.73749  -171.18880
   14    13 S   HC   HG11    14     1.09586   110.57076   -65.73813
   15    13 S   HC   HG12    15     1.09660   109.86101    53.50490
   16    13 S   C    _CD1    16     1.51861   112.15037   173.86090
   17    16 S   O    _OE1    17     1.22782   123.21858     4.53959
   18    16 S   N    _N2_    18     1.38582   111.88494  -175.50516
   19    18 S   H    _HN2    19     1.01572   119.13980     3.52659
   20    18 S   CT1  _CA2    20     1.45799   122.65717   177.21217
   21    20 S   HC   _HA2    21     1.09741   108.81333    26.85695
   22    20 S   C    _C2_    22     1.52992   107.14549   -90.11097
   23    22 S   O    _O2_    23     1.22971   123.10928   -26.05513
   24    20 S   CT   _CB2    32     1.53166   112.47795   150.05586
   25    24 S   HC   HB21    33     1.09598   110.34930    54.43477
   26    24 S   HC   HB22    34     1.09435   109.76618   173.30514
   27    22 S   N    _N3_    24     1.38518   112.50954   156.66591
   28    27 S   H    _HN3    25     1.01654   120.34286    -2.23966
   29    24 S   S    _SG2    35     1.82558   111.34335   -66.38751
   30    27 S   CT   _CA3    26     1.45349   122.52697   178.43464
   31    30 S   HC   HA31    27     1.09567   107.83551   -55.18611
   32    30 S   HC   HA32    28     1.09559   107.59313    61.16353
   33    29 S   CT   _C12    36     1.84399    99.53296   179.25506
   34    33 S   HC   _H3_    37     1.09638   106.34684   -43.80660
   35    30 S   CO3  _C3_    29     1.52899   114.29523  -177.09364
   36    35 S   O2Z  _O31    30     1.26341   116.05334     0.05595
   37    35 S   O2Z  _O32    31     1.26436   114.41159  -179.97202
   38    33 S   CM   _C10    38     1.53099   110.24064    75.03446
   39    33 S   CT   _C13    99     1.53494   109.96220  -160.59049
   40    39 S   HC   _H14   100     1.09893   109.05868  -170.55269
   41    39 S   HC   _H15   101     1.09840   110.75147   -53.83571
   42    38 S   CM   _C9_    39     1.35067   118.80464  -110.71458
   43    42 S   HC   _H10    40     1.09004   117.82156     1.24080
   44    38 S   CT   _C11    95     1.51061   116.87616    70.59325
   45    44 S   HC   _H11    96     1.09422   111.11303   -48.65462
   46    44 S   HC   _H12    97     1.09211   113.48104  -167.98878
   47    44 S   HC   _H13    98     1.09466   110.23608    71.37409
   48    39 S   CO3  _C14   102     1.53412   116.35942    70.66724
   49    48 S   O2Z  _O34   103     1.26169   116.38843    25.54263
   50    48 S   O2Z  _O33   104     1.26480   114.25942  -155.61124
   51    42 S   CM   _C8_    41     1.44861   127.68552  -178.49195
   52    51 S   HC   _H9_    42     1.08494   118.17808     2.24044
   53    51 S   CM   _C7_    43     1.34361   122.66052  -178.09669
   54    53 S   HC   _H8_    44     1.08476   118.98149     0.24147
   55    53 S   CM   _C6_    45     1.45002   122.73117  -179.87028
   56    55 S   HC   _H7_    46     1.09077   114.00134     0.08847
   57    55 S   CM   _C5_    47     1.35072   127.69740  -179.88986
   58    57 S   CM   _C15    48     1.46766   118.21391  -179.97202
   59    58 S   HC   _H16    49     1.09021   115.32788    -0.09891
   60    57 S   CT   _C4_    91     1.50863   124.54633     0.05234
   61    60 S   HC   _H4_    92     1.09582   110.47992  -119.71857
   62    60 S   HC   _H5_    93     1.09177   113.86684     0.11191
   63    60 S   HC   _H6_    94     1.09583   110.48209   119.91417
   64    58 S   CM   _C16    50     1.34460   126.77276   179.88636
   65    64 S   HC   _H17    51     1.08298   119.81800     0.00000
   66    64 S   CM   _C17    52     1.45118   122.55364  -179.97202
   67    66 S   HC   _H18    53     1.09078   114.03793    -0.03426
   68    66 S   CM   _C18    54     1.35080   127.73976   179.96044
   69    68 S   CM   _C20    55     1.46727   118.16767  -179.98022
   70    69 S   HC   _H22    56     1.08864   115.25215     0.18238
   71    68 S   CT   _C19    87     1.50855   124.58166    -0.00000
   72    71 S   HC   _H19    88     1.09585   110.47435   119.75834
   73    71 S   HC   _H20    89     1.09587   110.47365  -119.86523
   74    71 S   HC   _H21    90     1.09172   113.89391    -0.05595
   75    69 S   CM   _C21    57     1.34545   126.75958   179.95154
   76    75 S   HC   _H23    58     1.08739   118.89722     0.36045
   77    75 S   CT   _C22    59     1.53091   126.63992   179.68721
   78    77 S   CT   _C27    60     1.58794   111.23814   111.59508
   79    77 S   OH   _O36    85     1.44313   107.41890    -6.13964
   80    79 S   HO   _H40    86     0.96983   109.24490   178.53580
   81    78 S   CT   _C26    61     1.55395   110.13222   174.18153
   82    81 S   HC   _H28    62     1.09788   110.07454  -174.30075
   83    81 S   HC   _H29    63     1.09757   110.11469    69.77697
   84    78 S   CT   _C28    77     1.54896   113.78754    52.10668
   85    84 S   HC   _H30    78     1.09495   111.82176   -62.54422
   86    84 S   HC   _H31    79     1.09705   110.62062   178.92735
   87    84 S   HC   _H32    80     1.09146   113.09028    59.51249
   88    78 S   CT   _C29    81     1.55185   110.75755   -67.61186
   89    88 S   HC   _H33    82     1.09505   111.61951    62.07433
   90    88 S   HC   _H34    83     1.09517   111.92458   -58.98874
   91    88 S   HC   _H35    84     1.09657   110.92604  -178.41699
   92    81 S   CT   _C25    64     1.52533   113.57212   -52.16015
   93    92 S   HC   _H26    65     1.09653   109.12849   176.59343
   94    92 S   HC   _H27    66     1.09576   110.25484   -67.13382
   95    92 S   CT   _C24    67     1.52546   111.98400    55.69272
   96    95 S   HC   _H24    68     1.09681   109.18366    67.56278
   97    95 S   HC   _H25    69     1.09773   107.77467  -177.06295
   98    77 S   CT   _C23    70     1.57563   110.13007  -122.34246
   99    98 S   CT   _C30    71     1.54045   112.47573    62.16272
  100    99 S   HC   _H36    72     1.09524   111.40386   -62.60340
  101    99 S   HC   _H37    73     1.09665   110.63587  -179.98022
  102    99 S   HC   _H38    74     1.09440   112.14836    59.49404
  103    98 S   OH   _O35    75     1.43351   109.93062   -56.71847
  104   103 S   HO   _H39    76     0.97247   108.25638   179.85065
  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
  15   7   2   1   1  13   7   4   3  10   4   4   2   1   1   2
   1   1   6   3   6   3   9   3   9  10   4   4   2   1   1   6
   3   9   3   9  11   4   4   2   1   1  12   4  25  20   8   1
  17   7   6   9   3   2   1   5   2   1   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    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    42    44    39    40    41    48  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    42    43    51    44    45    46    47    39    40    41    48    49    50  
   38    42    44    39    40    41    48  
   36    37  
   37  
    0  
   42    43    51    52    53    44    45    46    47    39    40    41    48  
   40    41    48    49    50    42    44  
   41    48    49    50  
   48    49    50  
   43    51    52    53    54    55    44    45    46    47  
   51    52    53    44  
   45    46    47    51  
   46    47  
   47  
    0  
   49    50  
   50  
    0  
   52    53    54    55    56    57  
   53    54    55  
   54    55    56    57    58    60  
   55    56    57  
   56    57    58    59    64    60    61    62    63  
   57    58    60  
   58    59    64    65    66    60    61    62    63  
   59    64    65    66    67    68    60    61    62    63  
   64    65    66    60  
   61    62    63    64  
   62    63  
   63  
    0  
   65    66    67    68    69    71  
   66    67    68  
   67    68    69    70    75    71    72    73    74  
   68    69    71  
   69    70    75    76    77    71    72    73    74  
   70    75    76    77    78    98    79    71    72    73    74  
   75    76    77    71  
   72    73    74    75  
   73    74  
   74  
    0  
   76    77    78    81    95    98    99   103    84    88    79    80  
   77    78    98    79  
   78    81    82    83    92    95    96    97    98    99   100   101   102   103   104    84    85    86    87    88    89    90    91    79    80  
   81    82    83    92    93    94    95    98    99   103    84    85    86    87    88    89    90    91    79    80  
   80    81    84    88    95    98    99   103  
   98  
   82    83    92    93    94    95    96    97    98    84    85    86    87    88    89    90    91  
   83    92    93    94    95    84    88  
   92    93    94    95    84    88  
   85    86    87    88    89    90    91    92    98  
   86    87    88  
   87    88  
   88  
   89    90    91    92    98  
   90    91  
   91  
    0  
   93    94    95    96    97    98    99   103  
   94    95    96    97    98  
   95    96    97    98  
   96    97    98    99   100   101   102   103   104  
   97    98    99   103  
   98    99   103  
   99   100   101   102   103   104  
  100   101   102   103   104  
  101   102   103  
  102   103  
  103  
  104  
    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   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   49   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   50   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   51   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   52   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   54   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   56   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   58   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   59   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   65   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   67   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   69   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   70   2.4200   0.0300   0.115000   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   76   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   77   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   78   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   79   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   80   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   81   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   99   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  100   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  101   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  102   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  103   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  104   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    39   268.000  1.529
   38    42   549.000  1.340
   38    44   317.000  1.510
   42    43   340.000  1.080
   42    51   380.000  1.444
   51    52   340.000  1.080
   51    53   549.000  1.340
   53    54   340.000  1.080
   53    55   380.000  1.444
   55    56   340.000  1.080
   55    57   549.000  1.340
   57    58   380.000  1.444
   57    60   317.000  1.510
   58    59   340.000  1.080
   58    64   549.000  1.340
   64    65   340.000  1.080
   64    66   380.000  1.444
   66    67   340.000  1.080
   66    68   549.000  1.340
   68    69   380.000  1.444
   68    71   317.000  1.510
   69    70   340.000  1.080
   69    75   549.000  1.340
   75    76   340.000  1.080
   75    77   317.000  1.510
   77    78   268.000  1.529
   77    98   268.000  1.529
   77    79   320.000  1.410
   78    81   268.000  1.529
   78    84   268.000  1.529
   78    88   268.000  1.529
   81    82   340.000  1.090
   81    83   340.000  1.090
   81    92   268.000  1.529
   92    93   340.000  1.090
   92    94   340.000  1.090
   92    95   268.000  1.529
   95    96   340.000  1.090
   95    97   340.000  1.090
   95    98   268.000  1.529
   98    99   268.000  1.529
   98   103   320.000  1.410
   99   100   340.000  1.090
   99   101   340.000  1.090
   99   102   340.000  1.090
  103   104   553.000  0.945
   84    85   340.000  1.090
   84    86   340.000  1.090
   84    87   340.000  1.090
   88    89   340.000  1.090
   88    90   340.000  1.090
   88    91   340.000  1.090
   79    80   553.000  0.945
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   340.000  1.090
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   340.000  1.090
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   340.000  1.090
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    48   317.000  1.522
   48    49   656.000  1.250
   48    50   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    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    39    75.00000  111.63000
   33    38    42    70.00000  124.00000
   33    38    44    65.00000  117.92700
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    48    70.00000  109.69300
   38    33    34    35.00000  109.50000
   38    42    43    35.00000  120.00000
   38    42    51    70.00000  123.01800
   38    44    45    35.00000  109.50000
   38    44    46    35.00000  109.50000
   38    44    47    35.00000  109.50000
   42    51    52    35.00000  120.00000
   42    51    53    70.00000  123.01800
   51    42    43    35.00000  120.00000
   51    53    54    35.00000  120.00000
   51    53    55    70.00000  123.01800
   53    51    52    35.00000  120.00000
   53    55    56    35.00000  120.00000
   53    55    57    70.00000  123.01800
   55    53    54    35.00000  120.00000
   55    57    58    70.00000  123.01800
   55    57    60    70.00000  124.00000
   57    55    56    35.00000  120.00000
   57    58    59    35.00000  120.00000
   57    58    64    70.00000  123.01800
   57    60    61    35.00000  109.50000
   57    60    62    35.00000  109.50000
   57    60    63    35.00000  109.50000
   58    64    65    35.00000  120.00000
   58    64    66    70.00000  123.01800
   64    58    59    35.00000  120.00000
   64    66    67    35.00000  120.00000
   64    66    68    70.00000  123.01800
   66    64    65    35.00000  120.00000
   66    68    69    70.00000  123.01800
   66    68    71    70.00000  124.00000
   68    66    67    35.00000  120.00000
   68    69    70    35.00000  120.00000
   68    69    75    70.00000  123.01800
   68    71    72    35.00000  109.50000
   68    71    73    35.00000  109.50000
   68    71    74    35.00000  109.50000
   69    75    76    35.00000  120.00000
   69    75    77    70.00000  124.00000
   75    69    70    35.00000  120.00000
   75    77    78    70.00000  112.02700
   75    77    98    70.00000  112.02700
   75    77    79    90.00000  110.39200
   77    75    76    35.00000  117.00000
   77    78    81    58.35000  112.70000
   77    78    84    58.35000  112.70000
   77    78    88    58.35000  112.70000
   77    98    95    58.35000  112.70000
   77    98    99    58.35000  112.70000
   77    98   103    50.00000  109.50000
   77    79    80    55.00000  108.50000
   78    81    82    37.50000  110.70000
   78    81    83    37.50000  110.70000
   78    81    92    58.35000  112.70000
   78    84    85    37.50000  110.70000
   78    84    86    37.50000  110.70000
   78    84    87    37.50000  110.70000
   78    88    89    37.50000  110.70000
   78    88    90    37.50000  110.70000
   78    88    91    37.50000  110.70000
   81    92    93    37.50000  110.70000
   81    92    94    37.50000  110.70000
   81    92    95    58.35000  112.70000
   83    81    82    33.00000  107.80000
   92    81    82    37.50000  110.70000
   92    81    83    37.50000  110.70000
   92    95    96    37.50000  110.70000
   92    95    97    37.50000  110.70000
   92    95    98    58.35000  112.70000
   94    92    93    33.00000  107.80000
   95    92    93    37.50000  110.70000
   95    92    94    37.50000  110.70000
   95    98    99    58.35000  112.70000
   95    98   103    50.00000  109.50000
   97    95    96    33.00000  107.80000
   98    77    78    58.35000  112.70000
   98    95    96    37.50000  110.70000
   98    95    97    37.50000  110.70000
   98    99   100    37.50000  110.70000
   98    99   101    37.50000  110.70000
   98    99   102    37.50000  110.70000
   98   103   104    55.00000  108.50000
  101    99   100    33.00000  107.80000
  102    99   100    33.00000  107.80000
  102    99   101    33.00000  107.80000
  103    98    99    50.00000  109.50000
   84    78    81    58.35000  112.70000
   86    84    85    33.00000  107.80000
   87    84    85    33.00000  107.80000
   87    84    86    33.00000  107.80000
   88    78    81    58.35000  112.70000
   88    78    84    58.35000  112.70000
   90    88    89    33.00000  107.80000
   91    88    89    33.00000  107.80000
   91    88    90    33.00000  107.80000
   79    77    78    50.00000  109.50000
   79    77    98    50.00000  109.50000
   71    68    69    70.00000  124.00000
   73    71    72    33.00000  107.80000
   74    71    72    33.00000  107.80000
   74    71    73    33.00000  107.80000
   60    57    58    70.00000  124.00000
   62    60    61    33.00000  107.80000
   63    60    61    33.00000  107.80000
   63    60    62    33.00000  107.80000
   44    38    42    70.00000  124.00000
   46    44    45    33.00000  107.80000
   47    44    45    33.00000  107.80000
   47    44    46    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.02700
   39    48    49    70.00000  117.00000
   39    48    50    70.00000  117.00000
   41    39    40    33.00000  107.80000
   48    39    40    35.00000  109.50000
   48    39    41    35.00000  109.50000
   50    48    49    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    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    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    42   0.42700  1.0 1.0
   29    33    38    42  -0.70350 -1.0 2.0
   29    33    38    42  -0.43150  1.0 3.0
   29    33    38    44   0.30250  1.0 1.0
   29    33    38    44  -0.14950 -1.0 2.0
   29    33    38    44   0.36900  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    48   0.56750  1.0 1.0
   29    33    39    48  -0.07550 -1.0 2.0
   29    33    39    48   0.20000  1.0 3.0
   33    38    42    43   7.00000 -1.0 2.0
   33    38    42    51   7.00000 -1.0 2.0
   33    38    44    45   0.34800  1.0 3.0
   33    38    44    46   0.34800  1.0 3.0
   33    38    44    47   0.34800  1.0 3.0
   33    39    48    49   0.41150 -1.0 2.0
   33    39    48    50   0.41150 -1.0 2.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    38    44   0.34800  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    48  -0.11250  1.0 3.0
   38    33    39    40   0.15000  1.0 3.0
   38    33    39    41   0.15000  1.0 3.0
   38    33    39    48  -0.98800  1.0 1.0
   38    33    39    48   0.48800 -1.0 2.0
   38    33    39    48   0.76800  1.0 3.0
   38    42    51    52  -0.18600  1.0 3.0
   38    42    51    53   0.28850  1.0 1.0
   38    42    51    53   2.61350 -1.0 2.0
   38    42    51    53   0.78400  1.0 3.0
   42    38    44    45   0.00000  1.0 1.0
   42    38    44    46   0.00000  1.0 1.0
   42    38    44    47   0.00000  1.0 1.0
   42    51    53    54   7.00000 -1.0 2.0
   42    51    53    55   7.00000 -1.0 2.0
   43    42    51    52   0.00000  1.0 1.0
   43    42    51    53  -0.18600  1.0 3.0
   51    53    55    56  -0.18600  1.0 3.0
   51    53    55    57   0.28850  1.0 1.0
   51    53    55    57   2.61350 -1.0 2.0
   51    53    55    57   0.78400  1.0 3.0
   52    51    53    54   7.00000 -1.0 2.0
   52    51    53    55   7.00000 -1.0 2.0
   53    55    57    58   7.00000 -1.0 2.0
   53    55    57    60   7.00000 -1.0 2.0
   54    53    55    56   0.00000  1.0 1.0
   54    53    55    57  -0.18600  1.0 3.0
   55    57    58    59  -0.18600  1.0 3.0
   55    57    58    64   0.28850  1.0 1.0
   55    57    58    64   2.61350 -1.0 2.0
   55    57    58    64   0.78400  1.0 3.0
   55    57    60    61   0.00000  1.0 1.0
   55    57    60    62   0.00000  1.0 1.0
   55    57    60    63   0.00000  1.0 1.0
   56    55    57    58   7.00000 -1.0 2.0
   56    55    57    60   7.00000 -1.0 2.0
   57    58    64    65   7.00000 -1.0 2.0
   57    58    64    66   7.00000 -1.0 2.0
   58    57    60    61   0.00000  1.0 1.0
   58    57    60    62   0.00000  1.0 1.0
   58    57    60    63   0.00000  1.0 1.0
   58    64    66    67  -0.18600  1.0 3.0
   58    64    66    68   0.28850  1.0 1.0
   58    64    66    68   2.61350 -1.0 2.0
   58    64    66    68   0.78400  1.0 3.0
   59    58    64    65   7.00000 -1.0 2.0
   59    58    64    66   7.00000 -1.0 2.0
   64    66    68    69   7.00000 -1.0 2.0
   64    66    68    71   7.00000 -1.0 2.0
   65    64    66    67   0.00000  1.0 1.0
   65    64    66    68  -0.18600  1.0 3.0
   66    68    69    70  -0.18600  1.0 3.0
   66    68    69    75   0.28850  1.0 1.0
   66    68    69    75   2.61350 -1.0 2.0
   66    68    69    75   0.78400  1.0 3.0
   66    68    71    72   0.00000  1.0 1.0
   66    68    71    73   0.00000  1.0 1.0
   66    68    71    74   0.00000  1.0 1.0
   67    66    68    69   7.00000 -1.0 2.0
   67    66    68    71   7.00000 -1.0 2.0
   68    69    75    76   7.00000 -1.0 2.0
   68    69    75    77   7.00000 -1.0 2.0
   69    68    71    72   0.00000  1.0 1.0
   69    68    71    73   0.00000  1.0 1.0
   69    68    71    74   0.00000  1.0 1.0
   69    75    77    78   0.09850  1.0 1.0
   69    75    77    78   0.15250 -1.0 2.0
   69    75    77    78  -0.50650  1.0 3.0
   69    75    77    98   0.09850  1.0 1.0
   69    75    77    98   0.15250 -1.0 2.0
   69    75    77    98  -0.50650  1.0 3.0
   69    75    77    79   0.67800  1.0 1.0
   69    75    77    79   0.47050 -1.0 2.0
   69    75    77    79  -0.62500  1.0 3.0
   70    69    75    76   7.00000 -1.0 2.0
   70    69    75    77   7.00000 -1.0 2.0
   75    77    78    81   0.34400  1.0 1.0
   75    77    78    81   0.09450 -1.0 2.0
   75    77    78    81   0.11100  1.0 3.0
   75    77    78    84   0.34400  1.0 1.0
   75    77    78    84   0.09450 -1.0 2.0
   75    77    78    84   0.11100  1.0 3.0
   75    77    78    88   0.34400  1.0 1.0
   75    77    78    88   0.09450 -1.0 2.0
   75    77    78    88   0.11100  1.0 3.0
   75    77    98    95   0.34400  1.0 1.0
   75    77    98    95   0.09450 -1.0 2.0
   75    77    98    95   0.11100  1.0 3.0
   75    77    98    99   0.34400  1.0 1.0
   75    77    98    99   0.09450 -1.0 2.0
   75    77    98    99   0.11100  1.0 3.0
   75    77    98   103   1.05650  1.0 1.0
   75    77    98   103   0.15600 -1.0 2.0
   75    77    98   103   0.53150  1.0 3.0
   75    77    79    80  -0.07800  1.0 1.0
   75    77    79    80  -0.21500 -1.0 2.0
   75    77    79    80  -0.03150  1.0 3.0
   76    75    77    78   0.00000  1.0 1.0
   76    75    77    98   0.00000  1.0 1.0
   76    75    77    79   0.00000  1.0 1.0
   77    78    81    82   0.15000  1.0 3.0
   77    78    81    83   0.15000  1.0 3.0
   77    78    81    92   0.56750  1.0 1.0
   77    78    81    92  -0.07550 -1.0 2.0
   77    78    81    92   0.20000  1.0 3.0
   77    78    84    85   0.15000  1.0 3.0
   77    78    84    86   0.15000  1.0 3.0
   77    78    84    87   0.15000  1.0 3.0
   77    78    88    89   0.15000  1.0 3.0
   77    78    88    90   0.15000  1.0 3.0
   77    78    88    91   0.15000  1.0 3.0
   77    98    99   100   0.15000  1.0 3.0
   77    98    99   101   0.15000  1.0 3.0
   77    98    99   102   0.15000  1.0 3.0
   77    98   103   104  -0.11600  1.0 1.0
   77    98   103   104  -0.09450 -1.0 2.0
   77    98   103   104   0.21250  1.0 3.0
   78    77    98    95   0.56750  1.0 1.0
   78    77    98    95  -0.07550 -1.0 2.0
   78    77    98    95   0.20000  1.0 3.0
   78    77    98    99   0.56750  1.0 1.0
   78    77    98    99  -0.07550 -1.0 2.0
   78    77    98    99   0.20000  1.0 3.0
   78    77    98   103   0.86500  1.0 1.0
   78    77    98   103  -0.17500 -1.0 2.0
   78    77    98   103   0.20800  1.0 3.0
   78    77    79    80  -0.11600  1.0 1.0
   78    77    79    80  -0.09450 -1.0 2.0
   78    77    79    80   0.21250  1.0 3.0
   78    81    92    93   0.15000  1.0 3.0
   78    81    92    94   0.15000  1.0 3.0
   78    81   -92    95   0.56750  1.0 1.0
   78    81   -92    95  -0.07550 -1.0 2.0
   78    81   -92    95   0.20000  1.0 3.0
   81    78    84    85   0.15000  1.0 3.0
   81    78    84    86   0.15000  1.0 3.0
   81    78    84    87   0.15000  1.0 3.0
   81    78    88    89   0.15000  1.0 3.0
   81    78    88    90   0.15000  1.0 3.0
   81    78    88    91   0.15000  1.0 3.0
   81    92    95    96   0.15000  1.0 3.0
   81    92    95    97   0.15000  1.0 3.0
   81    92    95    98   0.56750  1.0 1.0
   81    92    95    98  -0.07550 -1.0 2.0
   81    92    95    98   0.20000  1.0 3.0
   82    81    92    93   0.15000  1.0 3.0
   82    81    92    94   0.15000  1.0 3.0
   82    81    92    95   0.15000  1.0 3.0
   83    81    92    93   0.15000  1.0 3.0
   83    81    92    94   0.15000  1.0 3.0
   83    81    92    95   0.15000  1.0 3.0
   92    95   -98    77   0.56750  1.0 1.0
   92    95   -98    77  -0.07550 -1.0 2.0
   92    95   -98    77   0.20000  1.0 3.0
   92    95    98    99   0.56750  1.0 1.0
   92    95    98    99  -0.07550 -1.0 2.0
   92    95    98    99   0.20000  1.0 3.0
   92    95    98   103   0.86500  1.0 1.0
   92    95    98   103  -0.17500 -1.0 2.0
   92    95    98   103   0.20800  1.0 3.0
   93    92    95    96   0.15000  1.0 3.0
   93    92    95    97   0.15000  1.0 3.0
   93    92    95    98   0.15000  1.0 3.0
   94    92    95    96   0.15000  1.0 3.0
   94    92    95    97   0.15000  1.0 3.0
   94    92    95    98   0.15000  1.0 3.0
   95    98    99   100   0.15000  1.0 3.0
   95    98    99   101   0.15000  1.0 3.0
   95    98    99   102   0.15000  1.0 3.0
   95    98   103   104  -0.11600  1.0 1.0
   95    98   103   104  -0.09450 -1.0 2.0
   95    98   103   104   0.21250  1.0 3.0
   96    95    98    77   0.15000  1.0 3.0
   96    95    98    99   0.15000  1.0 3.0
   96    95    98   103   0.23400  1.0 3.0
   97    95    98    77   0.15000  1.0 3.0
   97    95    98    99   0.15000  1.0 3.0
   97    95    98   103   0.23400  1.0 3.0
   98    77   -78    81   0.56750  1.0 1.0
   98    77   -78    81  -0.07550 -1.0 2.0
   98    77   -78    81   0.20000  1.0 3.0
   98    77    78    84   0.56750  1.0 1.0
   98    77    78    84  -0.07550 -1.0 2.0
   98    77    78    84   0.20000  1.0 3.0
   98    77    78    88   0.56750  1.0 1.0
   98    77    78    88  -0.07550 -1.0 2.0
   98    77    78    88   0.20000  1.0 3.0
   98    77    79    80  -0.11600  1.0 1.0
   98    77    79    80  -0.09450 -1.0 2.0
   98    77    79    80   0.21250  1.0 3.0
   99    98   103   104  -0.11600  1.0 1.0
   99    98   103   104  -0.09450 -1.0 2.0
   99    98   103   104   0.21250  1.0 3.0
  103    98    99   100   0.23400  1.0 3.0
  103    98    99   101   0.23400  1.0 3.0
  103    98    99   102   0.23400  1.0 3.0
   84    78    81    82   0.15000  1.0 3.0
   84    78    81    83   0.15000  1.0 3.0
   84    78    81    92   0.56750  1.0 1.0
   84    78    81    92  -0.07550 -1.0 2.0
   84    78    81    92   0.20000  1.0 3.0
   84    78    88    89   0.15000  1.0 3.0
   84    78    88    90   0.15000  1.0 3.0
   84    78    88    91   0.15000  1.0 3.0
   88    78    81    82   0.15000  1.0 3.0
   88    78    81    83   0.15000  1.0 3.0
   88    78    81    92   0.56750  1.0 1.0
   88    78    81    92  -0.07550 -1.0 2.0
   88    78    81    92   0.20000  1.0 3.0
   88    78    84    85   0.15000  1.0 3.0
   88    78    84    86   0.15000  1.0 3.0
   88    78    84    87   0.15000  1.0 3.0
   79    77    78    81   0.86500  1.0 1.0
   79    77    78    81  -0.17500 -1.0 2.0
   79    77    78    81   0.20800  1.0 3.0
   79    77    78    84   0.86500  1.0 1.0
   79    77    78    84  -0.17500 -1.0 2.0
   79    77    78    84   0.20800  1.0 3.0
   79    77    78    88   0.86500  1.0 1.0
   79    77    78    88  -0.17500 -1.0 2.0
   79    77    78    88   0.20800  1.0 3.0
   79    77    98    95   0.86500  1.0 1.0
   79    77    98    95  -0.17500 -1.0 2.0
   79    77    98    95   0.20800  1.0 3.0
   79    77    98    99   0.86500  1.0 1.0
   79    77    98    99  -0.17500 -1.0 2.0
   79    77    98    99   0.20800  1.0 3.0
   79    77    98   103   3.75450  1.0 1.0
   71    68    69    70   0.00000  1.0 1.0
   71    68    69    75  -0.18600  1.0 3.0
   60    57    58    59   0.00000  1.0 1.0
   60    57    58    64  -0.18600  1.0 3.0
   44    38    42    43   7.00000 -1.0 2.0
   44    38    42    51   7.00000 -1.0 2.0
   39    33    38    42   0.09850  1.0 1.0
   39    33    38    42   0.15250 -1.0 2.0
   39    33    38    42  -0.50650  1.0 3.0
   39    33    38    44   0.46850  1.0 1.0
   39    33    38    44   0.08550 -1.0 2.0
   39    33    38    44   0.09800  1.0 3.0
   40    39    48    49   0.00000  1.0 1.0
   40    39    48    50   0.00000  1.0 1.0
   41    39    48    49   0.00000  1.0 1.0
   41    39    48    50   0.00000  1.0 1.0
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    44    38    42  15.00000 -1.0 2.0
   51    43    42    38  15.00000 -1.0 2.0
   42    52    51    53  15.00000 -1.0 2.0
   55    54    53    51  15.00000 -1.0 2.0
   53    56    55    57  15.00000 -1.0 2.0
   58    60    57    55  15.00000 -1.0 2.0
   57    59    58    64  15.00000 -1.0 2.0
   66    65    64    58  15.00000 -1.0 2.0
   64    67    66    68  15.00000 -1.0 2.0
   69    71    68    66  15.00000 -1.0 2.0
   68    70    69    75  15.00000 -1.0 2.0
   77    76    75    69  15.00000 -1.0 2.0
   49    39    48    50  10.50000 -1.0 2.0
END
