* LIGAND DATABASE FILE (OPLS2005)
*
001     103   105    181    277     531
    1     0 S   NP   _N1_     1    28.47042    96.44237   -19.34023
    2     1 S   H    _HN1     2     1.02834    42.74356   166.54827
    3     1 S   H    _H1_     3     1.02779    83.32798   -67.79531
    4     1 S   H    _H2_     4     1.02954    82.82214    41.74505
    5     1 S   CT   _CA1     5     1.50186   153.43299   163.87174
    6     5 S   HC   _HA1     6     1.09600   105.06263    60.89518
    7     5 S   CO3  _C1_     7     1.53671   112.41953   -58.79426
    8     7 S   O2Z  _O11     8     1.26329   114.94020   -42.10816
    9     7 S   O2Z  _O12     9     1.26234   114.88019   136.48992
   10     5 S   CT   _CB1    10     1.53092   107.35446   178.40603
   11    10 S   HC   HB11    11     1.09809   108.70469   -52.49378
   12    10 S   HC   HB12    12     1.09758   110.66432    63.81357
   13    10 S   CT   _CG1    13     1.53004   112.79196  -173.75952
   14    13 S   HC   HG11    14     1.09483   110.46295   -72.05723
   15    13 S   HC   HG12    15     1.09613   109.64497    46.93752
   16    13 S   C    _CD1    16     1.51879   112.64019   166.18212
   17    16 S   O    _OE1    17     1.22738   123.20599    -3.33278
   18    16 S   N    _N2_    18     1.38601   111.78575   178.60380
   19    18 S   H    _HN2    19     1.01748   118.93314    -4.55135
   20    18 S   CT1  _CA2    20     1.46230   123.25636   171.71191
   21    20 S   HC   _HA2    21     1.09732   109.57629   -10.48890
   22    20 S   C    _C2_    22     1.53441   106.92020  -125.72693
   23    22 S   O    _O2_    23     1.22973   122.62528  -137.81120
   24    20 S   CT   _CB2    32     1.52989   112.34458   112.52082
   25    24 S   HC   HB21    33     1.09422   109.81911    55.15222
   26    24 S   HC   HB22    34     1.09376   110.06491   172.61632
   27    22 S   N    _N3_    24     1.38623   113.12487    48.52652
   28    27 S   H    _HN3    25     1.01517   118.93133     0.51738
   29    24 S   S    _SG2    35     1.82875   112.43837   -68.92320
   30    27 S   CT   _CA3    26     1.45406   123.11951   174.99211
   31    30 S   HC   HA31    27     1.09549   108.76628    31.43624
   32    30 S   HC   HA32    28     1.09478   107.11903   148.43268
   33    29 S   CT   _C17    36     1.84248    99.60244   137.51747
   34    33 S   HC   _H3_    37     1.09181   105.54549    42.92996
   35    30 S   CO3  _C3_    29     1.53002   113.90964   -91.50721
   36    35 S   O2Z  _O31    30     1.26330   115.95057   -28.88282
   37    35 S   O2Z  _O32    31     1.26423   114.58983   151.88129
   38    33 S   CA   _C18    38     1.52081   111.00575   -74.25258
   39    33 S   CM   _C16    75     1.51135   108.83843   160.58183
   40    39 S   HC   _H20    76     1.09207   115.05254    69.22433
   41    38 S   CA   _C19    39     1.40149   119.39970   114.90400
   42    41 S   HA   _H21    40     1.08749   120.48244     3.05582
   43    39 S   CMA  _C15    77     1.35516   128.79189  -111.00595
   44    43 S   OM   _O43    78     1.26330   128.27922  -178.39843
   45    41 S   CA   _C20    41     1.39336   120.70760  -175.39062
   46    45 S   HA   _H22    42     1.08529   118.52144   179.58222
   47    43 S   CT   _C14    79     1.52603   120.61421     0.55673
   48    47 S   HC   _H18    80     1.09647   110.43575   -42.82317
   49    47 S   HC   _H19    81     1.10008   113.02428  -159.22823
   50    45 S   CA   _C21    43     1.39670   120.03681    -0.04846
   51    47 S   CO4  _C13    82     1.52795   111.15798    80.44830
   52    51 S   O    _O35    83     1.22981   122.38174    57.35888
   53    50 S   CA   _C22    44     1.40223   120.26761    -3.28348
   54    50 S   OS   _O37    52     1.37369   122.44681   177.97175
   55    51 S   CM   _C12    84     1.49311   116.47780  -122.96697
   56    55 S   HC   _H17    85     1.08351   117.31569    -9.87773
   57    38 S   CA   _C23    45     1.40749   121.91099   -63.00379
   58    57 S   HA   _H23    46     1.08615   118.37644    -2.43968
   59    53 S   OS   _O36    47     1.37141   115.98100  -177.80634
   60    54 S   CO   _C25    53     1.44177   114.49372   -45.99335
   61    60 S   HC   _H4_    54     1.09798   108.44474    72.74079
   62    55 S   CM   _C11    86     1.34063   120.01880   166.73249
   63    62 S   HC   _H16    87     1.08776   120.22743     0.64801
   64    59 S   CT   _C24    48     1.42194   117.22639   176.09345
   65    64 S   HC   _H24    49     1.09413   107.81051  -176.44769
   66    64 S   HC   _H25    50     1.09461   111.03510    65.80452
   67    64 S   HC   _H26    51     1.09509   111.26203   -58.69249
   68    60 S   CT   _C26    55     1.53509   107.07505  -169.50686
   69    68 S   HC   _H5_    56     1.09592   110.02513    53.12130
   70    62 S   CA   _C7_    88     1.47220   124.24684  -176.44587
   71    68 S   CT   _C27    57     1.53181   111.35932   175.42170
   72    71 S   HC   _H6_    58     1.09670   110.12387    75.00661
   73    68 S   OH   _O42    73     1.43063   109.92173   -63.38075
   74    73 S   HO   _H32    74     0.97209   108.23986   -61.78802
   75    70 S   CA   _C8_    89     1.40355   122.77661   -31.97211
   76    75 S   HA   _H13    90     1.08735   120.96310     0.23407
   77    71 S   CT   _C28    59     1.53203   111.90564   -47.78707
   78    77 S   HC   _H7_    60     1.09629   109.10186   -73.01300
   79    71 S   OH   _O41    71     1.43000   109.50816  -169.31592
   80    79 S   HO   _H31    72     0.97309   107.84991    60.11156
   81    75 S   CA   _C9_    91     1.39851   120.78927  -179.00810
   82    81 S   HA   _H14    92     1.08627   119.29763   179.68041
   83    77 S   CT   _C29    61     1.53175   110.87228    48.44960
   84    83 S   HC   _H8_    62     1.09826   111.04665    64.76685
   85    77 S   OH   _O40    69     1.42691   109.68357   170.34231
   86    85 S   HO   _H30    70     0.97242   108.18049   -57.43421
   87    81 S   CA   _C10    93     1.39245   119.81313     0.16786
   88    60 S   OS   _O38    63     1.43202   112.04659   -49.40934
   89    83 S   CT   _C30    64     1.53005   111.45750  -174.61377
   90    89 S   HC   _H27    65     1.09396   111.05660    66.06459
   91    89 S   HC   _H28    66     1.09417   111.30834   -55.97514
   92    87 S   CA   _C5_    94     1.39300   120.01274    -0.49968
   93    87 S   OH   _O34   102     1.36653   120.55798   179.16796
   94    93 S   HO   _H15   103     0.97199   108.76576     1.99125
   95    89 S   OH   _O39    67     1.42527   109.29677  -175.11553
   96    95 S   HO   _H29    68     0.97315   106.95774   176.20274
   97    70 S   CA   _C6_    95     1.40319   118.48271   149.88280
   98    97 S   HA   _H12    96     1.08811   120.46728    -0.73701
   99    92 S   OS   _O33    97     1.37059   120.77264   178.01367
  100    99 S   CT   _C4_    98     1.42864   110.01262    90.73147
  101   100 S   HC   _H9_    99     1.09404   107.84444  -179.17386
  102   100 S   HC   _H10   100     1.09556   111.08867    62.63399
  103   100 S   HC   _H11   101     1.09519   111.28939   -60.88038
  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   8   5   4   3
  13   6   2   1   1  12   9   3   8   4   7   4   7   3   7   4
   3  10   6   3   9  10   6   3   3   1   4  13   6   8   3   3
   2   1   1  12   7   9  13   7   4   1   8   4  12   7   3   1
   7   3   9   6   3   1   7   4   4   3   2   9   3   1   1   1
   3   1   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    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    41    57    39    40    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    45    53    57    58    39    40    43    44    47  
   38    41    57    39    40    43  
   36    37  
   37  
    0  
   41    42    45    46    50    53    57    58    59    39    40    43  
   40    43    44    47    48    49    51    41    57  
   43    44    47  
   42    45    46    50    53    57    58    54  
   45    46    50    57  
   44    47    48    49    51    52    55  
   47    48    49    51  
   46    50    53    57    59    54    60  
   50    53    54  
   48    49    51    52    55    56    62  
   49    51    52    55  
   51    52    55  
   53    57    58    59    64    54    60    61    68    88  
   52    55    56    62    63    70  
   55    56    62  
   57    58    59    64    65    66    67    54    60  
   60    61    68    69    71    83    88    73    57    59  
   56    62    63    70    75    97  
   62    63    70  
   58    59    64  
   59  
   64    65    66    67  
   61    68    69    71    72    77    83    84    88    89    79    73    74  
   68    69    71    83    88    73  
   63    70    75    76    81    92    97    98  
   70    75    97  
   65    66    67  
   66    67  
   67  
    0  
   69    71    72    77    78    83    88    85    79    80    73    74  
   71    72    77    88    79    73    74  
   75    76    81    82    87    92    97    98    99  
   72    77    78    83    84    88    89    85    86    79    80    73    74  
   77    78    83    85    79    80    73  
   74    77    79    88  
    0  
   76    81    82    87    92    97    98    93  
   81    82    87    97  
   78    83    84    88    89    90    91    95    85    86    79    80  
   83    84    88    89    85    86    79  
   80    83    85  
    0  
   82    87    92    97    99    93    94  
   87    92    93  
   84    88    89    90    91    95    96    85    86  
   88    89    90    91    95    85  
   86    88    89  
    0  
   92    97    98    99   100    93    94  
   89    90    91    95  
   90    91    95    96  
   91    95    96  
   95    96  
   97    98    99   100   101   102   103    93    94  
   94    97    99  
    0  
   96  
    0  
   98    99   100  
   99  
  100   101   102   103  
  101   102   103  
  102   103  
  103  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.222500   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   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   40   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   42   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   43   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   44   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   51   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   52   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   53   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   54   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   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   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   60   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   63   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   71   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   74   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   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   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   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   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   84   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   85   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   86   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   87   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   88   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   89   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   93   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   94   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   95   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   96   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   97   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   98   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   99   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
  100   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
  101   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  102   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  103   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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   317.000  1.510
   38    41   469.000  1.400
   38    57   469.000  1.400
   41    42   367.000  1.080
   41    45   469.000  1.400
   45    46   367.000  1.080
   45    50   469.000  1.400
   50    53   469.000  1.400
   50    54   450.000  1.364
   53    57   469.000  1.400
   53    59   450.000  1.364
   57    58   367.000  1.080
   59    64   320.000  1.410
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   340.000  1.090
   54    60   320.000  1.380
   60    61   340.000  1.090
   60    68   250.000  1.527
   60    88   320.000  1.380
   68    69   340.000  1.090
   68    71   268.000  1.529
   68    73   320.000  1.410
   71    72   340.000  1.090
   71    77   268.000  1.529
   71    79   320.000  1.410
   77    78   340.000  1.090
   77    83   268.000  1.529
   77    85   320.000  1.410
   83    84   340.000  1.090
   83    88   320.000  1.410
   83    89   268.000  1.529
   89    90   340.000  1.090
   89    91   340.000  1.090
   89    95   320.000  1.410
   95    96   553.000  0.945
   85    86   553.000  0.945
   79    80   553.000  0.945
   73    74   553.000  0.945
   39    40   340.000  1.080
   39    43   465.000  1.376
   43    44   745.000  1.250
   43    47   270.000  1.512
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    51   317.000  1.522
   51    52   570.000  1.229
   51    55   320.000  1.462
   55    56   340.000  1.080
   55    62   549.000  1.340
   62    63   340.000  1.080
   62    70   320.000  1.460
   70    75   469.000  1.400
   70    97   469.000  1.400
   75    76   367.000  1.080
   75    81   469.000  1.400
   81    82   367.000  1.080
   81    87   469.000  1.400
   87    92   469.000  1.400
   87    93   450.000  1.364
   92    97   469.000  1.400
   92    99   450.000  1.364
   97    98   367.000  1.080
   99   100   320.000  1.410
  100   101   340.000  1.090
  100   102   340.000  1.090
  100   103   340.000  1.090
   93    94   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    80.00000  109.48900
   29    33    39    75.00000  112.20000
   33    38    41    70.00000  120.00000
   33    38    57    70.00000  120.00000
   33    39    40    35.00000  117.00000
   33    39    43    70.00000  124.00000
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    45    63.00000  120.00000
   38    57    53    63.00000  120.00000
   38    57    58    35.00000  120.00000
   41    45    46    35.00000  120.00000
   41    45    50    63.00000  120.00000
   45    41    42    35.00000  120.00000
   45    50    53    63.00000  120.00000
   45    50    54    70.00000  120.00000
   50    45    46    35.00000  120.00000
   50    53    57    63.00000  120.00000
   50    53    59    70.00000  120.00000
   50    54    60   100.00000  112.36700
   53    57    58    35.00000  120.00000
   53    59    64    75.00000  111.00000
   57    38    41    63.00000  120.00000
   59    53    57    70.00000  120.00000
   59    64    65    35.00000  109.50000
   59    64    66    35.00000  109.50000
   59    64    67    35.00000  109.50000
   66    64    65    33.00000  107.80000
   67    64    65    33.00000  107.80000
   67    64    66    33.00000  107.80000
   54    50    53    70.00000  120.00000
   54    60    61    35.00000  109.50000
   54    60    68    90.00000  108.56700
   54    60    88    92.60000  111.55000
   60    68    69    45.00000  108.72000
   60    68    71    75.00000  109.43000
   60    68    73    90.00000  111.58700
   60    88    83    60.00000  109.50000
   68    60    61    45.00000  112.01100
   68    71    72    37.50000  110.70000
   68    71    77    58.35000  112.70000
   68    71    79    50.00000  109.50000
   68    73    74    55.00000  108.50000
   71    68    69    37.50000  110.70000
   71    77    78    37.50000  110.70000
   71    77    83    58.35000  112.70000
   71    77    85    50.00000  109.50000
   71    79    80    55.00000  108.50000
   77    71    72    37.50000  110.70000
   77    83    84    37.50000  110.70000
   77    83    88    50.00000  109.50000
   77    83    89    58.35000  112.70000
   77    85    86    55.00000  108.50000
   83    77    78    37.50000  110.70000
   83    89    90    37.50000  110.70000
   83    89    91    37.50000  110.70000
   83    89    95    50.00000  109.50000
   88    60    61    35.00000  109.50000
   88    60    68    90.00000  108.56700
   88    83    84    35.00000  109.50000
   89    83    84    37.50000  110.70000
   89    83    88    50.00000  109.50000
   89    95    96    55.00000  108.50000
   91    89    90    33.00000  107.80000
   95    89    90    35.00000  109.50000
   95    89    91    35.00000  109.50000
   85    77    78    35.00000  109.50000
   85    77    83    50.00000  109.50000
   79    71    72    35.00000  109.50000
   79    71    77    50.00000  109.50000
   73    68    69    35.00000  109.50000
   73    68    71    50.00000  109.50000
   39    33    34    35.00000  109.50000
   39    33    38    70.00000  112.99600
   39    43    44    65.00000  137.10300
   39    43    47    65.00000  122.18000
   43    39    40    40.00000  120.50800
   43    47    48    45.00000  110.52000
   43    47    49    45.00000  110.52000
   43    47    51    70.00000  109.06800
   47    43    44    85.00000  112.85300
   47    51    52    80.00000  120.40000
   47    51    55    65.00000  118.62400
   49    47    48    33.00000  107.80000
   51    47    48    35.00000  109.50000
   51    47    49    35.00000  109.50000
   51    55    56    40.00000  117.72500
   51    55    62    65.00000  118.96000
   55    51    52    80.00000  123.72100
   55    62    63    35.00000  120.00000
   55    62    70    60.00000  123.20500
   62    55    56    35.00000  120.00000
   62    70    75    60.00000  120.93500
   62    70    97    60.00000  120.93500
   70    62    63    40.00000  117.26300
   70    75    76    35.00000  120.00000
   70    75    81    63.00000  120.00000
   70    97    92    63.00000  120.00000
   70    97    98    35.00000  120.00000
   75    81    82    35.00000  120.00000
   75    81    87    63.00000  120.00000
   81    75    76    35.00000  120.00000
   81    87    92    63.00000  120.00000
   81    87    93    70.00000  120.00000
   87    81    82    35.00000  120.00000
   87    92    97    63.00000  120.00000
   87    92    99    70.00000  120.00000
   87    93    94    35.00000  113.00000
   92    97    98    35.00000  120.00000
   92    99   100    75.00000  111.00000
   97    70    75    63.00000  120.00000
   99    92    97    70.00000  120.00000
   99   100   101    35.00000  109.50000
   99   100   102    35.00000  109.50000
   99   100   103    35.00000  109.50000
  102   100   101    33.00000  107.80000
  103   100   101    33.00000  107.80000
  103   100   102    33.00000  107.80000
   93    87    92    70.00000  120.00000
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  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  1.0 3.0
   24    29    33    39  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   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    38    41  -0.16000  1.0 1.0
   29    33    38    41  -0.03200 -1.0 2.0
   29    33    38    41   0.04500  1.0 3.0
   29    33    38    57  -0.16000  1.0 1.0
   29    33    38    57  -0.03200 -1.0 2.0
   29    33    38    57   0.04500  1.0 3.0
   29    33    39    40   0.00000  1.0 1.0
   29    33    39    43   0.42700  1.0 1.0
   29    33    39    43  -0.70350 -1.0 2.0
   29    33    39    43  -0.43150  1.0 3.0
   33    38    41    42   3.62500 -1.0 2.0
   33    38    41    45   3.62500 -1.0 2.0
   33    38    57    53   3.62500 -1.0 2.0
   33    38    57    58   3.62500 -1.0 2.0
   33    39    43    44   7.00000 -1.0 2.0
   33    39    43    47   7.00000 -1.0 2.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    57   0.00000  1.0 1.0
   34    33    39    40   0.33100  1.0 3.0
   34    33    39    43   0.00000  1.0 1.0
   38    33    39    40   0.00000  1.0 1.0
   38    33    39    43   1.44450  1.0 1.0
   38    33    39    43   0.06600 -1.0 2.0
   38    33    39    43   0.29250  1.0 3.0
   38    41    45    46   3.62500 -1.0 2.0
   38    41    45    50   3.62500 -1.0 2.0
   41    38    57    53   3.62500 -1.0 2.0
   41    38    57    58   3.62500 -1.0 2.0
   41    45   -50    53   3.62500 -1.0 2.0
   41    45    50    54   3.62500 -1.0 2.0
   42    41    45    46   3.62500 -1.0 2.0
   42    41    45    50   3.62500 -1.0 2.0
   45    50    53    57   3.62500 -1.0 2.0
   45    50    53    59   3.62500 -1.0 2.0
   45    50    54    60   1.63200 -1.0 2.0
   46    45    50    53   3.62500 -1.0 2.0
   46    45    50    54   3.62500 -1.0 2.0
   50    53   -57    38   3.62500 -1.0 2.0
   50    53    57    58   3.62500 -1.0 2.0
   50    53    59    64   1.63200 -1.0 2.0
   50    54    60    61   0.08050  1.0 3.0
   50    54    60    68  -0.32850  1.0 1.0
   50    54    60    68  -0.35800 -1.0 2.0
   50    54    60    68   0.33950  1.0 3.0
   50    54    60    88  -0.25600  1.0 1.0
   50    54    60    88  -0.40050 -1.0 2.0
   50    54    60    88   0.34700  1.0 3.0
   53    50    54    60   1.63200 -1.0 2.0
   53    59    64    65   0.08050  1.0 3.0
   53    59    64    66   0.08050  1.0 3.0
   53    59    64    67   0.08050  1.0 3.0
   57    38    41    42   3.62500 -1.0 2.0
   57    38   -41    45   3.62500 -1.0 2.0
   57    53    59    64   1.63200 -1.0 2.0
   59    53    57    38   3.62500 -1.0 2.0
   59    53    57    58   3.62500 -1.0 2.0
   54    50    53    57   3.62500 -1.0 2.0
   54    50    53    59   3.62500 -1.0 2.0
   54    60    68    69   0.23400  1.0 3.0
   54    60    68    71   0.62750  1.0 1.0
   54    60    68    71  -0.30950 -1.0 2.0
   54    60    68    71   0.27300  1.0 3.0
   54    60    68    73   3.69350  1.0 1.0
   54    60    68    73  -1.82950 -1.0 2.0
   54    60    88    83  -0.81800  1.0 1.0
   60    68    71    72   0.15000  1.0 3.0
   60    68    71    77   3.97050  1.0 1.0
   60    68    71    79   0.86500  1.0 1.0
   60    68    71    79  -0.17500 -1.0 2.0
   60    68    71    79   0.20800  1.0 3.0
   60    68    73    74  -0.11600  1.0 1.0
   60    68    73    74  -0.09450 -1.0 2.0
   60    68    73    74   0.21250  1.0 3.0
   61    60    68    69   0.15000  1.0 3.0
   61    60    68    71   0.15000  1.0 3.0
   61    60    68    73   0.23400  1.0 3.0
   61    60    88    83   0.37050  1.0 3.0
   68    60    88    83   0.06250  1.0 1.0
   68    60    88    83  -0.01100 -1.0 2.0
   68    60    88    83   0.28050  1.0 3.0
   68    71    77    78   0.15000  1.0 3.0
   68    71   -77    83   0.56750  1.0 1.0
   68    71   -77    83  -0.07550 -1.0 2.0
   68    71   -77    83   0.20000  1.0 3.0
   68    71    77    85   0.86500  1.0 1.0
   68    71    77    85  -0.17500 -1.0 2.0
   68    71    77    85   0.20800  1.0 3.0
   68    71    79    80  -0.11600  1.0 1.0
   68    71    79    80  -0.09450 -1.0 2.0
   68    71    79    80   0.21250  1.0 3.0
   69    68    71    72   0.15000  1.0 3.0
   69    68    71    77   0.15000  1.0 3.0
   69    68    71    79   0.23400  1.0 3.0
   69    68    73    74   0.19450  1.0 3.0
   71    68    73    74  -0.11600  1.0 1.0
   71    68    73    74  -0.09450 -1.0 2.0
   71    68    73    74   0.21250  1.0 3.0
   71    77    83    84   0.15000  1.0 3.0
   71    77    83    88   0.62750  1.0 1.0
   71    77    83    88  -0.30950 -1.0 2.0
   71    77    83    88   0.27300  1.0 3.0
   71    77    83    89   0.56750  1.0 1.0
   71    77    83    89  -0.07550 -1.0 2.0
   71    77    83    89   0.20000  1.0 3.0
   71    77    85    86  -0.11600  1.0 1.0
   71    77    85    86  -0.09450 -1.0 2.0
   71    77    85    86   0.21250  1.0 3.0
   72    71    77    78   0.15000  1.0 3.0
   72    71    77    83   0.15000  1.0 3.0
   72    71    77    85   0.23400  1.0 3.0
   72    71    79    80   0.19450  1.0 3.0
   77    71    79    80  -0.11600  1.0 1.0
   77    71    79    80  -0.09450 -1.0 2.0
   77    71    79    80   0.21250  1.0 3.0
   77    83   -88    60   0.06250  1.0 1.0
   77    83   -88    60  -0.01100 -1.0 2.0
   77    83   -88    60   0.28050  1.0 3.0
   77    83    89    90   0.15000  1.0 3.0
   77    83    89    91   0.15000  1.0 3.0
   77    83    89    95   0.86500  1.0 1.0
   77    83    89    95  -0.17500 -1.0 2.0
   77    83    89    95   0.20800  1.0 3.0
   78    77    83    84   0.15000  1.0 3.0
   78    77    83    88   0.23400  1.0 3.0
   78    77    83    89   0.15000  1.0 3.0
   78    77    85    86   0.19450  1.0 3.0
   83    77    85    86  -0.11600  1.0 1.0
   83    77    85    86  -0.09450 -1.0 2.0
   83    77    85    86   0.21250  1.0 3.0
   83    89    95    96  -0.11600  1.0 1.0
   83    89    95    96  -0.09450 -1.0 2.0
   83    89    95    96   0.21250  1.0 3.0
   84    83    88    60   0.37050  1.0 3.0
   84    83    89    90   0.15000  1.0 3.0
   84    83    89    91   0.15000  1.0 3.0
   84    83    89    95   0.23400  1.0 3.0
   88    60    68    69   0.23400  1.0 3.0
   88    60   -68    71   0.62750  1.0 1.0
   88    60   -68    71  -0.30950 -1.0 2.0
   88    60   -68    71   0.27300  1.0 3.0
   88    60    68    73   3.69350  1.0 1.0
   88    60    68    73  -1.82950 -1.0 2.0
   88    83    89    90   0.23400  1.0 3.0
   88    83    89    91   0.23400  1.0 3.0
   88    83    89    95   3.69350  1.0 1.0
   88    83    89    95  -1.82950 -1.0 2.0
   89    83    88    60   0.06250  1.0 1.0
   89    83    88    60  -0.01100 -1.0 2.0
   89    83    88    60   0.28050  1.0 3.0
   90    89    95    96   0.19450  1.0 3.0
   91    89    95    96   0.19450  1.0 3.0
   85    77    83    84   0.23400  1.0 3.0
   85    77    83    88   3.69350  1.0 1.0
   85    77    83    88  -1.82950 -1.0 2.0
   85    77    83    89   0.86500  1.0 1.0
   85    77    83    89  -0.17500 -1.0 2.0
   85    77    83    89   0.20800  1.0 3.0
   79    71    77    78   0.23400  1.0 3.0
   79    71    77    83   0.86500  1.0 1.0
   79    71    77    83  -0.17500 -1.0 2.0
   79    71    77    83   0.20800  1.0 3.0
   79    71    77    85   3.75450  1.0 1.0
   73    68    71    72   0.23400  1.0 3.0
   73    68    71    77   0.86500  1.0 1.0
   73    68    71    77  -0.17500 -1.0 2.0
   73    68    71    77   0.20800  1.0 3.0
   73    68    71    79   3.75450  1.0 1.0
   39    33    38    41   0.18050 -1.0 2.0
   39    33    38    57   0.18050 -1.0 2.0
   39    43    47    48   0.00000  1.0 1.0
   39    43    47    49   0.00000  1.0 1.0
   39    43    47    51  -0.51250  1.0 1.0
   39    43    47    51  -0.88800 -1.0 2.0
   39    43    47    51   0.08850  1.0 3.0
   40    39    43    44   7.00000 -1.0 2.0
   40    39    43    47   7.00000 -1.0 2.0
   43    47    51    52   0.30150 -1.0 2.0
   43    47    51    55   0.65300  1.0 1.0
   43    47    51    55  -0.03850 -1.0 2.0
   43    47    51    55   0.33900  1.0 3.0
   44    43    47    48   0.00000  1.0 1.0
   44    43    47    49   0.00000  1.0 1.0
   44    43    47    51   0.09700  1.0 1.0
   44    43    47    51   0.15600 -1.0 2.0
   44    43    47    51  -0.50800  1.0 3.0
   47    51    55    56   0.04550  1.0 1.0
   47    51    55    56   0.83000 -1.0 2.0
   47    51    55    56  -0.04000  1.0 3.0
   47    51    55    62  -0.33500  1.0 1.0
   47    51    55    62   1.06600 -1.0 2.0
   47    51    55    62  -0.14000  1.0 3.0
   48    47    51    52   0.00000  1.0 1.0
   48    47    51    55   0.00000  1.0 1.0
   49    47    51    52   0.00000  1.0 1.0
   49    47    51    55   0.00000  1.0 1.0
   51    55    62    63   7.00000 -1.0 2.0
   51    55    62    70   7.00000 -1.0 2.0
   52    51    55    56   0.00000  1.0 1.0
   52    51    55    62   1.00000 -1.0 2.0
   55    62    70    75   0.15800  1.0 1.0
   55    62    70    75   1.85350 -1.0 2.0
   55    62    70    75  -0.48700  1.0 3.0
   55    62    70    97   0.15800  1.0 1.0
   55    62    70    97   1.85350 -1.0 2.0
   55    62    70    97  -0.48700  1.0 3.0
   56    55    62    63   7.00000 -1.0 2.0
   56    55    62    70   7.00000 -1.0 2.0
   62    70    75    76   3.62500 -1.0 2.0
   62    70    75    81   3.62500 -1.0 2.0
   62    70    97    92   3.62500 -1.0 2.0
   62    70    97    98   3.62500 -1.0 2.0
   63    62    70    75   0.56550  1.0 3.0
   63    62    70    97   0.56550  1.0 3.0
   70    75    81    82   3.62500 -1.0 2.0
   70    75    81    87   3.62500 -1.0 2.0
   75    70    97    92   3.62500 -1.0 2.0
   75    70    97    98   3.62500 -1.0 2.0
   75    81   -87    92   3.62500 -1.0 2.0
   75    81    87    93   3.62500 -1.0 2.0
   76    75    81    82   3.62500 -1.0 2.0
   76    75    81    87   3.62500 -1.0 2.0
   81    87    92    97   3.62500 -1.0 2.0
   81    87    92    99   3.62500 -1.0 2.0
   81    87    93    94   0.84100 -1.0 2.0
   82    81    87    92   3.62500 -1.0 2.0
   82    81    87    93   3.62500 -1.0 2.0
   87    92   -97    70   3.62500 -1.0 2.0
   87    92    97    98   3.62500 -1.0 2.0
   87    92    99   100   1.63200 -1.0 2.0
   92    87    93    94   0.84100 -1.0 2.0
   92    99   100   101   0.08050  1.0 3.0
   92    99   100   102   0.08050  1.0 3.0
   92    99   100   103   0.08050  1.0 3.0
   97    70    75    76   3.62500 -1.0 2.0
   97    70   -75    81   3.62500 -1.0 2.0
   97    92    99   100   1.63200 -1.0 2.0
   99    92    97    70   3.62500 -1.0 2.0
   99    92    97    98   3.62500 -1.0 2.0
   93    87    92    97   3.62500 -1.0 2.0
   93    87    92    99   3.62500 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   41    57    38    33   4.00000 -1.0 2.0
   45    42    41    38   1.10000 -1.0 2.0
   50    46    45    41   1.10000 -1.0 2.0
   53    54    50    45   4.00000 -1.0 2.0
   57    59    53    50   4.00000 -1.0 2.0
   53    58    57    38   1.10000 -1.0 2.0
   33    40    39    43  15.00000 -1.0 2.0
   47    44    43    39  15.00000 -1.0 2.0
   47    55    51    52  10.50000 -1.0 2.0
   51    56    55    62  15.00000 -1.0 2.0
   70    63    62    55  15.00000 -1.0 2.0
   75    97    70    62   4.00000 -1.0 2.0
   81    76    75    70   1.10000 -1.0 2.0
   87    82    81    75   1.10000 -1.0 2.0
   92    93    87    81   4.00000 -1.0 2.0
   97    99    92    87   4.00000 -1.0 2.0
   92    98    97    70   1.10000 -1.0 2.0
END
