* LIGAND DATABASE FILE (OPLS2005)
*
001     104   105    189    287     558
    1     0 S   NP   _N1_     1    28.19600    94.81126   -24.43566
    2     1 S   H    _HN1     2     1.02775   109.89664   -93.26529
    3     1 S   H    _H1_     3     1.02945    80.56239    12.96507
    4     1 S   H    _H2_     4     1.02822    27.85841   175.87531
    5     1 S   CT   _CA1     5     1.50228   129.62476   121.64350
    6     5 S   HC   _HA1     6     1.09572   105.13652    83.48598
    7     5 S   CO3  _C1_     7     1.53820   111.94645   -36.63506
    8     7 S   O2Z  _O11     8     1.26412   114.96544   -48.29970
    9     7 S   O2Z  _O12     9     1.26197   114.97803   130.01092
   10     5 S   CT   _CB1    10     1.53050   107.29724  -158.60453
   11    10 S   HC   HB11    11     1.09846   109.49053   -47.30727
   12    10 S   HC   HB12    12     1.09803   110.49249    69.32113
   13    10 S   CT   _CG1    13     1.53046   112.60529  -168.08552
   14    13 S   HC   HG11    14     1.09571   110.76755   -64.73836
   15    13 S   HC   HG12    15     1.09612   109.56439    54.50657
   16    13 S   C    _CD1    16     1.51902   111.82770   174.91204
   17    16 S   O    _OE1    17     1.22822   122.96480    11.40809
   18    16 S   N    _N2_    18     1.38541   112.09785  -169.01947
   19    18 S   H    _HN2    19     1.02048   118.99639     2.48939
   20    18 S   CT1  _CA2    20     1.46096   123.29953   178.64088
   21    20 S   HC   _HA2    21     1.09720   109.19501    -1.35306
   22    20 S   C    _C2_    22     1.53711   109.63577  -117.18834
   23    22 S   O    _O2_    23     1.23138   121.73539  -156.10531
   24    20 S   CT   _CB2    32     1.53514   111.84838   120.50952
   25    24 S   HC   HB21    33     1.09313   108.95365    60.16236
   26    24 S   HC   HB22    34     1.09417   109.69269   178.27444
   27    22 S   N    _N3_    24     1.38307   114.16275    31.12207
   28    27 S   H    _HN3    25     1.01493   118.84466    -3.29289
   29    24 S   S    _SG2    35     1.83122   111.84113   -61.79472
   30    27 S   CT   _CA3    26     1.45383   123.54323   175.60127
   31    30 S   HC   HA31    27     1.09531   109.19419    25.77046
   32    30 S   HC   HA32    28     1.09505   107.15246   142.63933
   33    29 S   CT   _C19    36     1.86888   101.86216   171.48726
   34    30 S   CO3  _C3_    29     1.52897   113.02669   -97.72459
   35    34 S   O2Z  _O31    30     1.26424   115.38507   -49.11046
   36    34 S   O2Z  _O32    31     1.26368   115.06199   131.80859
   37    33 S   CM   _C18    37     1.52727   106.85317  -179.18171
   38    37 S   HC   _H27    38     1.09115   114.94078   -46.40686
   39    33 S   CM   _C21    76     1.52766   111.40288   -53.07539
   40    39 S   HC   _H31    77     1.09179   113.59851   127.14782
   41    33 S   CT   _C20   101     1.54321   107.46356    66.72801
   42    41 S   HC   _H28   102     1.09590   112.44420   -67.49289
   43    41 S   HC   _H29   103     1.09735   112.17044    54.30316
   44    41 S   HC   _H30   104     1.09821   110.83523   173.57624
   45    37 S   CM   _C17    39     1.34507   127.52977   135.50094
   46    45 S   HC   _H26    40     1.08286   119.34425    -0.41684
   47    39 S   CMA  _C22    78     1.35987   130.27053   -52.15703
   48    47 S   OM   _O33    79     1.26560   126.86675    -4.66153
   49    45 S   CM   _C16    41     1.44998   122.72509   179.24515
   50    49 S   HC   _H25    42     1.09056   114.05356    -0.47313
   51    47 S   OS   _O34    80     1.41743   111.91121   178.52276
   52    49 S   CM   _C15    43     1.35052   127.63152   179.44257
   53    51 S   CO   _C23    81     1.44556   112.26011   -82.79210
   54    53 S   HC   _H3_    82     1.09864   109.06140    53.16580
   55    52 S   CM   _C14    44     1.46599   118.21110   179.92598
   56    55 S   HC   _H24    45     1.09021   115.67531     0.31898
   57    52 S   CT   _C29    72     1.50850   124.60874    -0.20367
   58    57 S   HC   _H35    73     1.09588   110.46361  -119.99226
   59    57 S   HC   _H36    74     1.09176   113.90370    -0.20367
   60    57 S   HC   _H37    75     1.09582   110.46186   119.69356
   61    53 S   CT   _C24    83     1.53376   106.97547   171.41954
   62    61 S   HC   _H4_    84     1.09674   110.00627    54.22804
   63    55 S   CM   _C13    46     1.34441   126.70491  -179.92338
   64    63 S   HC   _H23    47     1.08575   121.26768    -1.03628
   65    61 S   CT   _C25    85     1.53077   111.12247   176.23386
   66    65 S   HC   _H5_    86     1.09693   110.20631    74.32749
   67    61 S   OH   _O40    99     1.43041   110.09056   -62.62923
   68    67 S   HO   _H34   100     0.97226   108.01587   -59.73006
   69    63 S   CM   _C6_    48     1.46178   123.43623  -179.08315
   70    65 S   CT   _C26    87     1.53171   111.87173   -48.43782
   71    70 S   HC   _H6_    88     1.09732   109.14522   -74.05342
   72    65 S   OH   _O39    97     1.43123   109.34706  -170.07592
   73    72 S   HO   _H33    98     0.97231   107.92702    62.23409
   74    69 S   CM   _C5_    49     1.35598   121.79760   -68.33713
   75    70 S   CT   _C27    89     1.52911   110.74795    48.60886
   76    75 S   HC   _H7_    90     1.09912   110.41108    65.57398
   77    70 S   OH   _O38    95     1.42820   108.04697   169.19371
   78    77 S   HO   _H32    96     0.97491   106.63580   176.63652
   79    74 S   CT   _C10    50     1.51304   122.54273   176.71419
   80    79 S   HC   _H15    51     1.09761   108.19714   109.21377
   81    79 S   HC   _H16    52     1.09695   109.74490  -134.51468
   82    74 S   CT   _C4_    68     1.51054   124.78234    -4.21821
   83    82 S   HC   _H8_    69     1.09486   110.04693   110.55796
   84    82 S   HC   _H9_    70     1.09290   113.73738   -10.96047
   85    82 S   HC   _H10    71     1.09571   109.98071  -130.20807
   86    53 S   OS   _O35    91     1.43006   112.16000   -68.82206
   87    75 S   CO3  _C28    92     1.54241   114.47413  -174.83768
   88    87 S   O2Z  _O37    93     1.26351   116.26286    -1.06386
   89    87 S   O2Z  _O36    94     1.26529   114.74124  -179.56479
   90    79 S   CT   _C9_    53     1.52274   114.43064   -12.67540
   91    90 S   HC   _H13    54     1.09617   109.50906   164.56939
   92    90 S   HC   _H14    55     1.09609   110.03316   -78.69972
   93    90 S   CT   _C8_    56     1.52009   110.30841    43.39728
   94    93 S   HC   _H11    57     1.09904   108.43500    61.44675
   95    93 S   HC   _H12    58     1.09739   109.35706   176.82091
   96    69 S   CT   _C7_    59     1.54348   115.54225   111.33746
   97    96 S   CT   _C11    60     1.54579   109.20494   -71.89970
   98    97 S   HC   _H17    61     1.09615   111.09786  -174.79180
   99    97 S   HC   _H18    62     1.09622   111.59997    65.83445
  100    97 S   HC   _H19    63     1.09549   111.89547   -54.39267
  101    96 S   CT   _C12    64     1.54675   112.38013    48.15004
  102   101 S   HC   _H20    65     1.09656   110.95052   174.09837
  103   101 S   HC   _H21    66     1.09626   111.23458    54.28963
  104   101 S   HC   _H22    67     1.09578   112.11242   -66.57723
  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  11   5   4   3
  14   2   1   1  13   5  10   4   5   2   1   1   6   3   6   2
   9   3   8   9  13   6  10   4   4   2   1   1  12   7   9   3
  13   7   4   1  21  11   7   3   1  14   7   5   3   1  13   6
   5   5   2   1   1   3   2   1   1   8   5   4  11   4   3   8
   7   3   2   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    39    41    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    45    39    40    47    41    42    43    44  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    45    46    49    39    40    47    48    51    41    42    43    44  
   35    36  
   36  
    0  
   38    45    46    49    50    52    39    40    47    41    42    43    44  
   45    46    49    39    41  
   40    47    48    51    53    41    42    43    44    45  
   47    48    51    41  
   42    43    44    45    47  
   43    44  
   44  
    0  
   46    49    50    52    55    57  
   49    50    52  
   48    51    53    54    61    86  
   51    53  
   50    52    55    56    63    57    58    59    60  
   52    55    57  
   53    54    61    62    65    75    86    67  
   55    56    63    64    69    57    58    59    60  
   54    61    62    65    66    70    75    76    86    87    72    67    68  
   61    62    65    75    86    67  
   56    63    64    69    74    96    57    58    59    60  
   63    64    69    57  
   58    59    60    63  
   59    60  
   60  
    0  
   62    65    66    70    71    75    86    77    72    73    67    68  
   65    66    70    86    72    67    68  
   64    69    74    79    93    96    97   101    82  
   69    74    96  
   66    70    71    75    76    86    87    77    78    72    73    67    68  
   70    71    75    77    72    73    67  
   68    70    72    86  
    0  
   74    79    80    81    90    93    94    95    96    97    98    99   100   101   102   103   104    82    83    84    85  
   71    75    76    86    87    88    89    77    78    72    73  
   75    76    86    87    77    78    72  
   73    75    77  
    0  
   79    80    81    90    91    92    93    96    97   101    82    83    84    85  
   76    86    87    88    89    77    78  
   86    87    88    89    77  
   78    86    87  
    0  
   80    81    90    91    92    93    94    95    96    82    83    84    85  
   81    90    91    92    93    82  
   90    91    92    93    82  
   83    84    85    90    96  
   84    85  
   85  
    0  
   87    88    89  
   88    89  
   89  
    0  
   91    92    93    94    95    96    97   101  
   92    93    94    95    96  
   93    94    95    96  
   94    95    96    97    98    99   100   101   102   103   104  
   95    96    97   101  
   96    97   101  
   97    98    99   100   101   102   103   104  
   98    99   100   101   102   103   104  
   99   100   101  
  100   101  
  101  
  102   103   104  
  103   104  
  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   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5500   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   46   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   48   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   49   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   50   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   51   2.8500   0.1400  -0.685000   1.7660   1.5600   0.020110767  -0.896042159
   52   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   53   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.100000   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   64   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   68   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   69   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   70   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   73   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   74   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   75   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   76   2.5000   0.0300   0.030000   1.3810   1.2100   0.008598240   0.268726247
   77   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   78   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   79   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   87   3.7500   0.1050   0.600000   2.1120   1.8750   0.001000000  -0.126889456
   88   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   89   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   90   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   94   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   97   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   98   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  100   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  101   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  102   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  103   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  104   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    39   317.000  1.510
   33    41   268.000  1.529
   37    38   340.000  1.080
   37    45   549.000  1.340
   45    46   340.000  1.080
   45    49   380.000  1.444
   49    50   340.000  1.080
   49    52   549.000  1.340
   52    55   380.000  1.444
   52    57   317.000  1.510
   55    56   340.000  1.080
   55    63   549.000  1.340
   63    64   340.000  1.080
   63    69   380.000  1.444
   69    74   549.000  1.340
   69    96   317.000  1.510
   74    79   317.000  1.510
   74    82   317.000  1.510
   79    80   340.000  1.090
   79    81   340.000  1.090
   79    90   268.000  1.529
   90    91   340.000  1.090
   90    92   340.000  1.090
   90    93   268.000  1.529
   93    94   340.000  1.090
   93    95   340.000  1.090
   93    96   268.000  1.529
   96    97   268.000  1.529
   96   101   268.000  1.529
   97    98   340.000  1.090
   97    99   340.000  1.090
   97   100   340.000  1.090
  101   102   340.000  1.090
  101   103   340.000  1.090
  101   104   340.000  1.090
   82    83   340.000  1.090
   82    84   340.000  1.090
   82    85   340.000  1.090
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   340.000  1.090
   39    40   340.000  1.080
   39    47   465.000  1.376
   47    48   745.000  1.250
   47    51   440.000  1.360
   51    53   320.000  1.380
   53    54   340.000  1.090
   53    61   250.000  1.527
   53    86   320.000  1.380
   61    62   340.000  1.090
   61    65   268.000  1.529
   61    67   320.000  1.410
   65    66   340.000  1.090
   65    70   268.000  1.529
   65    72   320.000  1.410
   70    71   340.000  1.090
   70    75   268.000  1.529
   70    77   320.000  1.410
   75    76   340.000  1.090
   75    86   320.000  1.410
   75    87   317.000  1.522
   87    88   656.000  1.250
   87    89   656.000  1.250
   77    78   553.000  0.945
   72    73   553.000  0.945
   67    68   553.000  0.945
   41    42   340.000  1.090
   41    43   340.000  1.090
   41    44   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    39    75.00000  112.20000
   29    33    41    75.00000  111.63000
   33    37    38    35.00000  117.00000
   33    37    45    70.00000  124.00000
   33    39    40    35.00000  117.00000
   33    39    47    70.00000  124.00000
   33    41    42    37.50000  110.70000
   33    41    43    37.50000  110.70000
   33    41    44    37.50000  110.70000
   37    45    46    35.00000  120.00000
   37    45    49    70.00000  123.01800
   45    37    38    35.00000  120.00000
   45    49    50    35.00000  120.00000
   45    49    52    70.00000  123.01800
   49    45    46    35.00000  120.00000
   49    52    55    70.00000  123.01800
   49    52    57    70.00000  124.00000
   52    49    50    35.00000  120.00000
   52    55    56    35.00000  120.00000
   52    55    63    70.00000  123.01800
   52    57    58    35.00000  109.50000
   52    57    59    35.00000  109.50000
   52    57    60    35.00000  109.50000
   55    63    64    35.00000  120.00000
   55    63    69    70.00000  123.01800
   63    55    56    35.00000  120.00000
   63    69    74    70.00000  123.01800
   63    69    96    70.00000  124.00000
   69    63    64    35.00000  120.00000
   69    74    79    70.00000  124.00000
   69    74    82    70.00000  124.00000
   69    96    93    70.00000  112.02700
   69    96    97    70.00000  112.02700
   69    96   101    70.00000  112.02700
   74    79    80    35.00000  109.50000
   74    79    81    35.00000  109.50000
   74    79    90    70.00000  112.02700
   74    82    83    35.00000  109.50000
   74    82    84    35.00000  109.50000
   74    82    85    35.00000  109.50000
   79    90    91    37.50000  110.70000
   79    90    92    37.50000  110.70000
   79    90    93    58.35000  112.70000
   81    79    80    33.00000  107.80000
   90    79    80    37.50000  110.70000
   90    79    81    37.50000  110.70000
   90    93    94    37.50000  110.70000
   90    93    95    37.50000  110.70000
   90    93    96    58.35000  112.70000
   92    90    91    33.00000  107.80000
   93    90    91    37.50000  110.70000
   93    90    92    37.50000  110.70000
   93    96    97    58.35000  112.70000
   93    96   101    58.35000  112.70000
   95    93    94    33.00000  107.80000
   96    69    74    70.00000  124.00000
   96    93    94    37.50000  110.70000
   96    93    95    37.50000  110.70000
   96    97    98    37.50000  110.70000
   96    97    99    37.50000  110.70000
   96    97   100    37.50000  110.70000
   96   101   102    37.50000  110.70000
   96   101   103    37.50000  110.70000
   96   101   104    37.50000  110.70000
   99    97    98    33.00000  107.80000
  100    97    98    33.00000  107.80000
  100    97    99    33.00000  107.80000
  101    96    97    58.35000  112.70000
  103   101   102    33.00000  107.80000
  104   101   102    33.00000  107.80000
  104   101   103    33.00000  107.80000
   82    74    79    65.00000  117.92700
   84    82    83    33.00000  107.80000
   85    82    83    33.00000  107.80000
   85    82    84    33.00000  107.80000
   57    52    55    70.00000  124.00000
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    33.00000  107.80000
   39    33    37    70.00000  110.12100
   39    47    48    65.00000  137.10300
   39    47    51    80.00000  120.01400
   47    39    40    40.00000  120.50800
   47    51    53    85.00000  113.97000
   51    47    48    65.00000  121.00000
   51    53    54    35.00000  109.50000
   51    53    61    90.00000  108.56700
   51    53    86    92.60000  111.55000
   53    61    62    45.00000  108.72000
   53    61    65    75.00000  109.43000
   53    61    67    90.00000  111.58700
   53    86    75    60.00000  109.50000
   61    53    54    45.00000  112.01100
   61    65    66    37.50000  110.70000
   61    65    70    58.35000  112.70000
   61    65    72    50.00000  109.50000
   61    67    68    55.00000  108.50000
   65    61    62    37.50000  110.70000
   65    70    71    37.50000  110.70000
   65    70    75    58.35000  112.70000
   65    70    77    50.00000  109.50000
   65    72    73    55.00000  108.50000
   70    65    66    37.50000  110.70000
   70    75    76    37.50000  110.70000
   70    75    86    50.00000  109.50000
   70    75    87    70.00000  109.69300
   70    77    78    55.00000  108.50000
   75    70    71    37.50000  110.70000
   75    87    88    70.00000  117.00000
   75    87    89    70.00000  117.00000
   86    53    54    35.00000  109.50000
   86    53    61    90.00000  108.56700
   86    75    76    35.00000  109.50000
   87    75    76    35.00000  109.50000
   87    75    86    85.00000  109.63000
   89    87    88    80.00000  126.00000
   77    70    71    35.00000  109.50000
   77    70    75    50.00000  109.50000
   72    65    66    35.00000  109.50000
   72    65    70    50.00000  109.50000
   67    61    62    35.00000  109.50000
   67    61    65    50.00000  109.50000
   41    33    37    70.00000  112.02700
   41    33    39    70.00000  112.02700
   43    41    42    33.00000  107.80000
   44    41    42    33.00000  107.80000
   44    41    43    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    39  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  1.0 3.0
   24    29    33    41   0.01700  1.0 1.0
   24    29    33    41  -0.23550 -1.0 2.0
   24    29    33    41   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.00000  1.0 1.0
   29    33    37    45   0.42700  1.0 1.0
   29    33    37    45  -0.70350 -1.0 2.0
   29    33    37    45  -0.43150  1.0 3.0
   29    33    39    40   0.00000  1.0 1.0
   29    33    39    47   0.42700  1.0 1.0
   29    33    39    47  -0.70350 -1.0 2.0
   29    33    39    47  -0.43150  1.0 3.0
   29    33    41    42   0.15000  1.0 3.0
   29    33    41    43   0.15000  1.0 3.0
   29    33    41    44   0.15000  1.0 3.0
   33    37    45    46   7.00000 -1.0 2.0
   33    37    45    49   7.00000 -1.0 2.0
   33    39    47    48   7.00000 -1.0 2.0
   33    39    47    51   7.00000 -1.0 2.0
   37    33    39    40   0.00000  1.0 1.0
   37    33    39    47  -0.28300  1.0 1.0
   37    33    39    47   0.26700 -1.0 2.0
   37    33    39    47  -0.63300  1.0 3.0
   37    33    41    42   0.15000  1.0 3.0
   37    33    41    43   0.15000  1.0 3.0
   37    33    41    44   0.15000  1.0 3.0
   37    45    49    50  -0.18600  1.0 3.0
   37    45    49    52   0.28850  1.0 1.0
   37    45    49    52   2.61350 -1.0 2.0
   37    45    49    52   0.78400  1.0 3.0
   38    37    45    46   7.00000 -1.0 2.0
   38    37    45    49   7.00000 -1.0 2.0
   45    49    52    55   7.00000 -1.0 2.0
   45    49    52    57   7.00000 -1.0 2.0
   46    45    49    50   0.00000  1.0 1.0
   46    45    49    52  -0.18600  1.0 3.0
   49    52    55    56  -0.18600  1.0 3.0
   49    52    55    63   0.28850  1.0 1.0
   49    52    55    63   2.61350 -1.0 2.0
   49    52    55    63   0.78400  1.0 3.0
   49    52    57    58   0.00000  1.0 1.0
   49    52    57    59   0.00000  1.0 1.0
   49    52    57    60   0.00000  1.0 1.0
   50    49    52    55   7.00000 -1.0 2.0
   50    49    52    57   7.00000 -1.0 2.0
   52    55    63    64   7.00000 -1.0 2.0
   52    55    63    69   7.00000 -1.0 2.0
   55    52    57    58   0.00000  1.0 1.0
   55    52    57    59   0.00000  1.0 1.0
   55    52    57    60   0.00000  1.0 1.0
   55    63    69    74   0.28850  1.0 1.0
   55    63    69    74   2.61350 -1.0 2.0
   55    63    69    74   0.78400  1.0 3.0
   55    63    69    96  -0.18600  1.0 3.0
   56    55    63    64   7.00000 -1.0 2.0
   56    55    63    69   7.00000 -1.0 2.0
   63    69    74    79   7.00000 -1.0 2.0
   63    69    74    82   7.00000 -1.0 2.0
   63    69    96    93   0.98200  1.0 1.0
   63    69    96    93  -0.11900 -1.0 2.0
   63    69    96    93   0.24250  1.0 3.0
   63    69    96    97   0.98200  1.0 1.0
   63    69    96    97  -0.11900 -1.0 2.0
   63    69    96    97   0.24250  1.0 3.0
   63    69    96   101   0.98200  1.0 1.0
   63    69    96   101  -0.11900 -1.0 2.0
   63    69    96   101   0.24250  1.0 3.0
   64    63    69    74  -0.18600  1.0 3.0
   64    63    69    96   0.00000  1.0 1.0
   69    74    79    80   0.00000  1.0 1.0
   69    74    79    81   0.00000  1.0 1.0
   69    74    79    90   0.09850  1.0 1.0
   69    74    79    90   0.15250 -1.0 2.0
   69    74    79    90  -0.50650  1.0 3.0
   69    74    82    83   0.00000  1.0 1.0
   69    74    82    84   0.00000  1.0 1.0
   69    74    82    85   0.00000  1.0 1.0
   69    96    97    98   0.15000  1.0 3.0
   69    96    97    99   0.15000  1.0 3.0
   69    96    97   100   0.15000  1.0 3.0
   69    96   101   102   0.15000  1.0 3.0
   69    96   101   103   0.15000  1.0 3.0
   69    96   101   104   0.15000  1.0 3.0
   74    69    96    93   0.09850  1.0 1.0
   74    69    96    93   0.15250 -1.0 2.0
   74    69    96    93  -0.50650  1.0 3.0
   74    69    96    97   0.09850  1.0 1.0
   74    69    96    97   0.15250 -1.0 2.0
   74    69    96    97  -0.50650  1.0 3.0
   74    69    96   101   0.09850  1.0 1.0
   74    69    96   101   0.15250 -1.0 2.0
   74    69    96   101  -0.50650  1.0 3.0
   74    79    90    91   0.15000  1.0 3.0
   74    79    90    92   0.15000  1.0 3.0
   74    79   -90    93   0.34400  1.0 1.0
   74    79   -90    93   0.09450 -1.0 2.0
   74    79   -90    93   0.11100  1.0 3.0
   79    74    82    83   0.34800  1.0 3.0
   79    74    82    84   0.34800  1.0 3.0
   79    74    82    85   0.34800  1.0 3.0
   79    90    93    94   0.15000  1.0 3.0
   79    90    93    95   0.15000  1.0 3.0
   79    90    93    96   0.56750  1.0 1.0
   79    90    93    96  -0.07550 -1.0 2.0
   79    90    93    96   0.20000  1.0 3.0
   80    79    90    91   0.15000  1.0 3.0
   80    79    90    92   0.15000  1.0 3.0
   80    79    90    93   0.15000  1.0 3.0
   81    79    90    91   0.15000  1.0 3.0
   81    79    90    92   0.15000  1.0 3.0
   81    79    90    93   0.15000  1.0 3.0
   90    93   -96    69   0.34400  1.0 1.0
   90    93   -96    69   0.09450 -1.0 2.0
   90    93   -96    69   0.11100  1.0 3.0
   90    93    96    97   0.56750  1.0 1.0
   90    93    96    97  -0.07550 -1.0 2.0
   90    93    96    97   0.20000  1.0 3.0
   90    93    96   101   0.56750  1.0 1.0
   90    93    96   101  -0.07550 -1.0 2.0
   90    93    96   101   0.20000  1.0 3.0
   91    90    93    94   0.15000  1.0 3.0
   91    90    93    95   0.15000  1.0 3.0
   91    90    93    96   0.15000  1.0 3.0
   92    90    93    94   0.15000  1.0 3.0
   92    90    93    95   0.15000  1.0 3.0
   92    90    93    96   0.15000  1.0 3.0
   93    96    97    98   0.15000  1.0 3.0
   93    96    97    99   0.15000  1.0 3.0
   93    96    97   100   0.15000  1.0 3.0
   93    96   101   102   0.15000  1.0 3.0
   93    96   101   103   0.15000  1.0 3.0
   93    96   101   104   0.15000  1.0 3.0
   94    93    96    69   0.15000  1.0 3.0
   94    93    96    97   0.15000  1.0 3.0
   94    93    96   101   0.15000  1.0 3.0
   95    93    96    69   0.15000  1.0 3.0
   95    93    96    97   0.15000  1.0 3.0
   95    93    96   101   0.15000  1.0 3.0
   96    69   -74    79   7.00000 -1.0 2.0
   96    69    74    82   7.00000 -1.0 2.0
   97    96   101   102   0.15000  1.0 3.0
   97    96   101   103   0.15000  1.0 3.0
   97    96   101   104   0.15000  1.0 3.0
  101    96    97    98   0.15000  1.0 3.0
  101    96    97    99   0.15000  1.0 3.0
  101    96    97   100   0.15000  1.0 3.0
   82    74    79    80   0.34800  1.0 3.0
   82    74    79    81   0.34800  1.0 3.0
   82    74    79    90   0.46850  1.0 1.0
   82    74    79    90   0.08550 -1.0 2.0
   82    74    79    90   0.09800  1.0 3.0
   57    52    55    56   0.00000  1.0 1.0
   57    52    55    63  -0.18600  1.0 3.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    45  -0.28300  1.0 1.0
   39    33    37    45   0.26700 -1.0 2.0
   39    33    37    45  -0.63300  1.0 3.0
   39    33    41    42   0.15000  1.0 3.0
   39    33    41    43   0.15000  1.0 3.0
   39    33    41    44   0.15000  1.0 3.0
   39    47    51    53  -2.26850  1.0 1.0
   39    47    51    53   3.39050 -1.0 2.0
   40    39    47    48   7.00000 -1.0 2.0
   40    39    47    51   7.00000 -1.0 2.0
   47    51    53    54   0.08050  1.0 3.0
   47    51    53    61  -0.46850  1.0 1.0
   47    51    53    61   0.09300 -1.0 2.0
   47    51    53    61  -0.12850  1.0 3.0
   47    51    53    86  -0.48150  1.0 1.0
   47    51    53    86   0.09250 -1.0 2.0
   47    51    53    86  -0.12850  1.0 3.0
   48    47    51    53   2.00000 -1.0 2.0
   51    53    61    62   0.23400  1.0 3.0
   51    53    61    65   0.62750  1.0 1.0
   51    53    61    65  -0.30950 -1.0 2.0
   51    53    61    65   0.27300  1.0 3.0
   51    53    61    67   3.69350  1.0 1.0
   51    53    61    67  -1.82950 -1.0 2.0
   51    53    86    75  -0.81800  1.0 1.0
   53    61    65    66   0.15000  1.0 3.0
   53    61    65    70   3.97050  1.0 1.0
   53    61    65    72   0.86500  1.0 1.0
   53    61    65    72  -0.17500 -1.0 2.0
   53    61    65    72   0.20800  1.0 3.0
   53    61    67    68  -0.11600  1.0 1.0
   53    61    67    68  -0.09450 -1.0 2.0
   53    61    67    68   0.21250  1.0 3.0
   54    53    61    62   0.15000  1.0 3.0
   54    53    61    65   0.15000  1.0 3.0
   54    53    61    67   0.23400  1.0 3.0
   54    53    86    75   0.37050  1.0 3.0
   61    53    86    75   0.06250  1.0 1.0
   61    53    86    75  -0.01100 -1.0 2.0
   61    53    86    75   0.28050  1.0 3.0
   61    65    70    71   0.15000  1.0 3.0
   61    65   -70    75   0.56750  1.0 1.0
   61    65   -70    75  -0.07550 -1.0 2.0
   61    65   -70    75   0.20000  1.0 3.0
   61    65    70    77   0.86500  1.0 1.0
   61    65    70    77  -0.17500 -1.0 2.0
   61    65    70    77   0.20800  1.0 3.0
   61    65    72    73  -0.11600  1.0 1.0
   61    65    72    73  -0.09450 -1.0 2.0
   61    65    72    73   0.21250  1.0 3.0
   62    61    65    66   0.15000  1.0 3.0
   62    61    65    70   0.15000  1.0 3.0
   62    61    65    72   0.23400  1.0 3.0
   62    61    67    68   0.19450  1.0 3.0
   65    61    67    68  -0.11600  1.0 1.0
   65    61    67    68  -0.09450 -1.0 2.0
   65    61    67    68   0.21250  1.0 3.0
   65    70    75    76   0.15000  1.0 3.0
   65    70    75    86   0.62750  1.0 1.0
   65    70    75    86  -0.30950 -1.0 2.0
   65    70    75    86   0.27300  1.0 3.0
   65    70    75    87  -1.63150  1.0 1.0
   65    70    75    87  -0.43550 -1.0 2.0
   65    70    75    87   0.24500  1.0 3.0
   65    70    77    78  -0.11600  1.0 1.0
   65    70    77    78  -0.09450 -1.0 2.0
   65    70    77    78   0.21250  1.0 3.0
   66    65    70    71   0.15000  1.0 3.0
   66    65    70    75   0.15000  1.0 3.0
   66    65    70    77   0.23400  1.0 3.0
   66    65    72    73   0.19450  1.0 3.0
   70    65    72    73  -0.11600  1.0 1.0
   70    65    72    73  -0.09450 -1.0 2.0
   70    65    72    73   0.21250  1.0 3.0
   70    75   -86    53   0.06250  1.0 1.0
   70    75   -86    53  -0.01100 -1.0 2.0
   70    75   -86    53   0.28050  1.0 3.0
   70    75    87    88   0.41150 -1.0 2.0
   70    75    87    89   0.41150 -1.0 2.0
   71    70    75    76   0.15000  1.0 3.0
   71    70    75    86   0.23400  1.0 3.0
   71    70    75    87  -0.11250  1.0 3.0
   71    70    77    78   0.19450  1.0 3.0
   75    70    77    78  -0.11600  1.0 1.0
   75    70    77    78  -0.09450 -1.0 2.0
   75    70    77    78   0.21250  1.0 3.0
   76    75    86    53   0.37050  1.0 3.0
   76    75    87    88   0.00000  1.0 1.0
   76    75    87    89   0.00000  1.0 1.0
   86    53    61    62   0.23400  1.0 3.0
   86    53   -61    65   0.62750  1.0 1.0
   86    53   -61    65  -0.30950 -1.0 2.0
   86    53   -61    65   0.27300  1.0 3.0
   86    53    61    67   3.69350  1.0 1.0
   86    53    61    67  -1.82950 -1.0 2.0
   86    75    87    88   0.30150 -1.0 2.0
   86    75    87    89   0.30150 -1.0 2.0
   87    75    86    53  -1.11000  1.0 1.0
   87    75    86    53   0.50250 -1.0 2.0
   87    75    86    53   0.47450  1.0 3.0
   77    70    75    76   0.23400  1.0 3.0
   77    70    75    86   3.69350  1.0 1.0
   77    70    75    86  -1.82950 -1.0 2.0
   77    70    75    87  -5.33000  1.0 1.0
   77    70    75    87  -0.54250 -1.0 2.0
   77    70    75    87  -0.07300  1.0 3.0
   72    65    70    71   0.23400  1.0 3.0
   72    65    70    75   0.86500  1.0 1.0
   72    65    70    75  -0.17500 -1.0 2.0
   72    65    70    75   0.20800  1.0 3.0
   72    65    70    77   3.75450  1.0 1.0
   67    61    65    66   0.23400  1.0 3.0
   67    61    65    70   0.86500  1.0 1.0
   67    61    65    70  -0.17500 -1.0 2.0
   67    61    65    70   0.20800  1.0 3.0
   67    61    65    72   3.75450  1.0 1.0
   41    33    37    38   0.00000  1.0 1.0
   41    33    37    45   0.09850  1.0 1.0
   41    33    37    45   0.15250 -1.0 2.0
   41    33    37    45  -0.50650  1.0 3.0
   41    33    39    40   0.00000  1.0 1.0
   41    33    39    47   0.09850  1.0 1.0
   41    33    39    47   0.15250 -1.0 2.0
   41    33    39    47  -0.50650  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   33    38    37    45  15.00000 -1.0 2.0
   49    46    45    37  15.00000 -1.0 2.0
   45    50    49    52  15.00000 -1.0 2.0
   55    57    52    49  15.00000 -1.0 2.0
   52    56    55    63  15.00000 -1.0 2.0
   69    64    63    55  15.00000 -1.0 2.0
   63    96    69    74   1.10000 -1.0 2.0
   79    82    74    69   1.10000 -1.0 2.0
   33    40    39    47  15.00000 -1.0 2.0
   48    51    47    39  15.00000 -1.0 2.0
   88    75    87    89  10.50000 -1.0 2.0
END
